Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5hkp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 6.A N LEU 2.A O no hydrogen 3.026 N/A LYS 7.A N THR 3.A O no hydrogen 2.667 N/A LYS 8.A N GLY 4.A O no hydrogen 3.343 N/A LYS 8.A NZ GLU 5.A OE2 no hydrogen 3.037 N/A LYS 8.A NZ HIS 35.A O no hydrogen 3.356 N/A LYS 8.A NZ SER 37.A OG no hydrogen 3.000 N/A ASP 9.A N GLU 5.A O no hydrogen 3.301 N/A GLU 10.A N TYR 6.A O no hydrogen 3.094 N/A GLU 10.A N LYS 7.A O no hydrogen 3.088 N/A LEU 11.A N LYS 7.A O no hydrogen 2.902 N/A LEU 12.A N LYS 8.A O no hydrogen 2.881 N/A GLU 13.A N ASP 9.A O no hydrogen 3.061 N/A ALA 14.A N GLU 10.A O no hydrogen 2.919 N/A ALA 15.A N LEU 11.A O no hydrogen 2.886 N/A ARG 16.A N LEU 12.A O no hydrogen 2.904 N/A ARG 16.A NE TYR 51.A OH no hydrogen 3.027 N/A ARG 16.A NH2 TYR 51.A OH no hydrogen 3.233 N/A SER 17.A N GLU 13.A O no hydrogen 2.988 N/A SER 17.A OG GLU 13.A O no hydrogen 2.918 N/A SER 17.A OG ALA 14.A O no hydrogen 3.398 N/A GLY 18.A N ALA 15.A O no hydrogen 3.306 N/A ASN 19.A N ALA 14.A O no hydrogen 2.877 N/A LYS 22.A N ASN 19.A OD1 no hydrogen 3.359 N/A LYS 22.A NZ GLU 10.A O no hydrogen 3.544 N/A LYS 22.A NZ GLU 10.A OE1 no hydrogen 3.520 N/A LEU 23.A N ASN 19.A O no hydrogen 2.929 N/A MET 24.A N GLU 20.A O no hydrogen 3.126 N/A ALA 25.A N GLU 21.A O no hydrogen 3.079 N/A ALA 25.A N LYS 22.A O no hydrogen 3.275 N/A LEU 26.A N LYS 22.A O no hydrogen 3.097 N/A LEU 26.A N LEU 23.A O no hydrogen 3.025 N/A THR 28.A N ASN 31.A OD1 no hydrogen 2.862 N/A THR 28.A OG1 ASN 31.A OD1 no hydrogen 3.464 N/A LEU 30.A N THR 28.A OG1 no hydrogen 3.017 N/A ASN 31.A N THR 28.A O no hydrogen 3.301 N/A ASN 31.A ND2 LEU 26.A O no hydrogen 2.711 N/A ASN 33.A ND2 GLY 64.A O no hydrogen 3.290 N/A CYS 34.A N ASN 31.A O no hydrogen 3.122 N/A CYS 34.A SG ASN 31.A O no hydrogen 3.169 N/A HIS 35.A ND1 LYS 41.A O no hydrogen 2.955 N/A ALA 36.A N SER 42.A O no hydrogen 2.804 N/A SER 37.A OG GLU 5.A OE1 no hydrogen 2.944 N/A ARG 40.A NE ASP 71.A OD2 no hydrogen 2.873 N/A ARG 40.A NH2 ASP 71.A OD1 no hydrogen 3.340 N/A ARG 40.A NH2 ASP 71.A OD2 no hydrogen 3.208 N/A LYS 41.A N ASP 38.A O no hydrogen 3.293 N/A HIS 46.A N THR 43.A OG1 no hydrogen 3.335 N/A HIS 46.A NE2 ALA 69.A O no hydrogen 2.995 N/A LEU 47.A N THR 43.A O no hydrogen 3.196 N/A ALA 48.A N PRO 44.A O no hydrogen 2.788 N/A ALA 49.A N LEU 45.A O no hydrogen 2.949 N/A GLY 50.A N HIS 46.A O no hydrogen 2.900 N/A TYR 51.A N LEU 47.A O no hydrogen 2.913 N/A ASN 52.A N ALA 49.A O no hydrogen 3.230 N/A ARG 53.A N ALA 48.A O no hydrogen 2.762 N/A ARG 53.A NE ARG 16.A O no hydrogen 2.766 N/A ARG 53.A NH2 ARG 16.A O no hydrogen 3.075 N/A VAL 57.A N ARG 53.A O no hydrogen 2.877 N/A GLN 58.A N VAL 54.A O no hydrogen 2.989 N/A LEU 59.A N ARG 55.A O no hydrogen 3.010 N/A LEU 60.A N ILE 56.A O no hydrogen 2.945 N/A LEU 61.A N VAL 57.A O no hydrogen 3.001 N/A GLN 62.A N GLN 58.A O no hydrogen 2.902 N/A HIS 63.A N LEU 59.A O no hydrogen 2.830 N/A HIS 63.A N LEU 60.A O no hydrogen 3.119 N/A GLY 64.A N LEU 61.A O no hydrogen 3.240 N/A ALA 65.A N LEU 60.A O no hydrogen 2.839 N/A ASP 66.A N ASN 33.A OD1 no hydrogen 2.745 N/A HIS 68.A N ASP 66.A OD1 no hydrogen 2.727 N/A ALA 69.A N ASP 66.A O no hydrogen 3.269 N/A ASP 71.A N LEU 75.A O no hydrogen 2.898 N/A LYS 72.A N ARG 40.A O no hydrogen 2.745 N/A GLY 73.A N ASP 71.A OD1 no hydrogen 2.756 N/A GLY 74.A N ASP 71.A O no hydrogen 2.881 N/A LEU 75.A N ASP 71.A OD1 no hydrogen 3.098 N/A VAL 76.A N HIS 79.A ND1 no hydrogen 3.160 N/A HIS 79.A N VAL 76.A O no hydrogen 2.853 N/A HIS 79.A NE2 PHE 108.A O no hydrogen 2.868 N/A ASN 80.A ND2 VAL 76.A O no hydrogen 3.181 N/A ALA 81.A N PRO 77.A O no hydrogen 3.030 N/A CYS 82.A N LEU 78.A O no hydrogen 2.960 N/A CYS 82.A SG LEU 78.A O no hydrogen 3.158 N/A SER 83.A N HIS 79.A O no hydrogen 2.794 N/A SER 83.A OG GLU 113.A OE1 no hydrogen 2.864 N/A TYR 84.A N ASN 80.A O no hydrogen 3.274 N/A GLY 85.A N CYS 82.A O no hydrogen 3.126 N/A HIS 86.A N ALA 81.A O no hydrogen 2.852 N/A HIS 86.A NE2 GLY 50.A O no hydrogen 2.846 N/A THR 90.A N HIS 86.A O no hydrogen 2.911 N/A THR 90.A OG1 HIS 86.A O no hydrogen 2.804 N/A GLU 91.A N TYR 87.A O no hydrogen 2.931 N/A LEU 92.A N GLU 88.A O no hydrogen 3.005 N/A LEU 93.A N VAL 89.A O no hydrogen 2.893 N/A LEU 94.A N THR 90.A O no hydrogen 2.953 N/A LYS 95.A N GLU 91.A O no hydrogen 2.904 N/A HIS 96.A N LEU 92.A O no hydrogen 3.049 N/A GLY 97.A N LEU 94.A O no hydrogen 2.930 N/A ALA 98.A N LEU 93.A O no hydrogen 3.171 N/A ASN 101.A ND2 GLY 130.A O no hydrogen 3.248 N/A ALA 102.A N CYS 99.A O no hydrogen 3.040 N/A ASP 104.A N PHE 108.A O no hydrogen 3.005 N/A LEU 105.A N GLY 73.A O no hydrogen 3.070 N/A TRP 106.A N ASP 104.A OD1 no hydrogen 2.792 N/A GLN 107.A N ASP 104.A O no hydrogen 2.983 N/A PHE 108.A N ASP 104.A OD1 no hydrogen 2.902 N/A THR 109.A N HIS 112.A ND1 no hydrogen 3.180 N/A THR 109.A OG1 HIS 112.A ND1 no hydrogen 2.875 N/A HIS 112.A N THR 109.A OG1 no hydrogen 3.106 N/A HIS 112.A ND1 THR 109.A OG1 no hydrogen 2.875 N/A HIS 112.A NE2 LYS 141.A O no hydrogen 2.715 N/A GLU 113.A N THR 109.A O no hydrogen 3.190 N/A ALA 114.A N PRO 110.A O no hydrogen 2.961 N/A ALA 115.A N LEU 111.A O no hydrogen 2.832 N/A SER 116.A N HIS 112.A O no hydrogen 2.989 N/A SER 116.A OG HIS 112.A O no hydrogen 2.842 N/A SER 116.A OG GLU 113.A O no hydrogen 3.082 N/A LYS 117.A N GLU 113.A O no hydrogen 3.243 N/A LYS 117.A NZ SER 83.A O no hydrogen 3.498 N/A LYS 117.A NZ SER 83.A OG no hydrogen 2.693 N/A ASN 118.A N ALA 115.A O no hydrogen 3.126 N/A ARG 119.A N ALA 114.A O no hydrogen 2.884 N/A ARG 119.A NE SER 83.A O no hydrogen 3.123 N/A ARG 119.A NH2 SER 83.A O no hydrogen 2.828 N/A CYS 123.A N ARG 119.A O no hydrogen 2.830 N/A CYS 123.A SG ARG 119.A O no hydrogen 3.279 N/A SER 124.A N VAL 120.A O no hydrogen 3.083 N/A SER 124.A OG VAL 120.A O no hydrogen 3.475 N/A SER 124.A OG GLU 159.A OE1 no hydrogen 2.673 N/A SER 124.A OG GLU 159.A OE2 no hydrogen 3.319 N/A LEU 125.A N GLU 121.A O no hydrogen 2.993 N/A LEU 126.A N VAL 122.A O no hydrogen 2.879 N/A LEU 127.A N CYS 123.A O no hydrogen 2.888 N/A SER 128.A N SER 124.A O no hydrogen 3.042 N/A SER 128.A OG LEU 125.A O no hydrogen 2.476 N/A HIS 129.A N LEU 125.A O no hydrogen 3.336 N/A HIS 129.A N LEU 126.A O no hydrogen 3.124 N/A GLY 130.A N LEU 127.A O no hydrogen 2.944 N/A ALA 131.A N LEU 126.A O no hydrogen 2.978 N/A ASP 132.A N ASN 101.A OD1 no hydrogen 3.024 N/A THR 134.A N ASP 132.A OD1 no hydrogen 2.770 N/A THR 134.A OG1 ASP 132.A OD1 no hydrogen 2.622 N/A THR 134.A OG1 ASP 132.A OD2 no hydrogen 3.378 N/A ASN 137.A N LYS 141.A O no hydrogen 3.001 N/A CYS 138.A N TRP 106.A O no hydrogen 2.943 N/A CYS 138.A SG TRP 106.A O no hydrogen 3.298 N/A HIS 139.A N ASN 137.A OD1 no hydrogen 2.804 N/A GLY 140.A N ASN 137.A O no hydrogen 3.074 N/A LYS 141.A N ASN 137.A OD1 no hydrogen 3.081 N/A SER 142.A N ASP 145.A OD2 no hydrogen 2.982 N/A VAL 144.A N PRO 133.A O no hydrogen 3.481 N/A ASP 145.A N SER 142.A OG no hydrogen 3.120 N/A MET 146.A N SER 142.A O no hydrogen 3.234 N/A MET 146.A N ALA 143.A O no hydrogen 3.105 N/A ALA 147.A N ALA 143.A O no hydrogen 2.922 N/A GLU 151.A N GLU 151.A OE1 no hydrogen 2.892 N/A LEU 152.A N THR 149.A OG1 no hydrogen 3.108 N/A ARG 153.A N THR 149.A O no hydrogen 3.030 N/A ARG 153.A NH1 ALA 147.A O no hydrogen 3.166 N/A GLU 154.A N PRO 150.A O no hydrogen 2.833 N/A ARG 155.A N GLU 151.A O no hydrogen 2.986 N/A ARG 155.A NE SER 124.A OG no hydrogen 2.918 N/A ARG 155.A NH2 SER 124.A OG no hydrogen 2.957 N/A LEU 156.A N LEU 152.A O no hydrogen 2.913 N/A THR 157.A N ARG 153.A O no hydrogen 3.229 N/A THR 157.A OG1 ARG 153.A O no hydrogen 3.204 N/A TYR 158.A N GLU 154.A O no hydrogen 2.895 N/A GLU 159.A N ARG 155.A O no hydrogen 2.805 N/A PHE 160.A N LEU 156.A O no hydrogen 2.961 N/A LYS 161.A N THR 157.A O no hydrogen 3.011 N/A GLY 162.A N TYR 158.A O no hydrogen 2.879 N/A HIS 163.A N GLU 159.A O no hydrogen 2.890 N/A SER 164.A N PHE 160.A O no hydrogen 2.946 N/A SER 164.A OG PHE 160.A O no hydrogen 2.697 N/A LEU 165.A N LYS 161.A O no hydrogen 2.894 N/A LEU 166.A N GLY 162.A O no hydrogen 2.956 N/A GLN 167.A N HIS 163.A O no hydrogen 2.948 N/A ALA 168.A N SER 164.A O no hydrogen 2.991 N/A ALA 169.A N LEU 165.A O no hydrogen 2.876 N/A ARG 170.A N LEU 166.A O no hydrogen 2.939 N/A GLU 171.A N GLN 167.A O no hydrogen 2.981 N/A ALA 172.A N ALA 169.A O no hydrogen 3.096 N/A ASP 173.A N ALA 168.A O no hydrogen 3.012 N/A LYS 176.A N ASP 173.A OD1 no hydrogen 3.073 N/A VAL 177.A N ASP 173.A O no hydrogen 2.882 N/A LYS 178.A N LEU 174.A O no hydrogen 2.901 N/A LYS 179.A N ALA 175.A O no hydrogen 3.028 N/A THR 180.A N LYS 176.A O no hydrogen 3.144 N/A LEU 181.A N VAL 177.A O no hydrogen 3.248 N/A LEU 181.A N LYS 178.A O no hydrogen 3.187 N/A ALA 182.A N LYS 179.A O no hydrogen 3.040 N/A GLU 184.A N LEU 181.A O no hydrogen 3.237 N/A ASN 187.A ND2 GLY 220.A O no hydrogen 3.127 N/A PHE 188.A N ILE 185.A O no hydrogen 2.973 N/A LYS 189.A NZ HIS 194.A O no hydrogen 3.238 N/A LYS 189.A NZ GLU 225.A OE2 no hydrogen 2.914 N/A LYS 189.A NZ LYS 226.A O no hydrogen 3.347 N/A GLN 190.A N GLU 195.A O no hydrogen 2.828 N/A GLN 190.A NE2 GLN 192.A OE1 no hydrogen 3.218 N/A GLN 192.A N GLN 190.A OE1 no hydrogen 2.706 N/A SER 193.A N GLN 190.A OE1 no hydrogen 3.047 N/A HIS 194.A N GLN 190.A O no hydrogen 2.740 N/A GLU 195.A N SER 193.A OG no hydrogen 3.047 N/A THR 196.A N HIS 199.A ND1 no hydrogen 3.251 N/A THR 196.A OG1 HIS 199.A ND1 no hydrogen 3.228 N/A HIS 199.A ND1 THR 196.A OG1 no hydrogen 3.228 N/A HIS 199.A NE2 MET 231.A O no hydrogen 2.840 N/A CYS 200.A N THR 196.A O no hydrogen 3.169 N/A CYS 200.A SG THR 196.A O no hydrogen 3.687 N/A ALA 201.A N ALA 197.A O no hydrogen 2.867 N/A VAL 202.A N LEU 198.A O no hydrogen 3.063 N/A ALA 203.A N HIS 199.A O no hydrogen 3.276 N/A SER 204.A N ALA 201.A O no hydrogen 3.122 N/A HIS 206.A N SER 204.A OG no hydrogen 2.966 N/A ARG 209.A NE ASP 244.A OD1 no hydrogen 3.065 N/A ARG 209.A NH1 ASP 244.A OD1 no hydrogen 3.381 N/A ARG 209.A NH2 SER 204.A O no hydrogen 2.776 N/A LYS 210.A NZ GLU 214.A OE1 no hydrogen 3.192 N/A GLN 211.A N GLN 211.A OE1 no hydrogen 2.922 N/A VAL 212.A N LYS 208.A O no hydrogen 2.895 N/A ALA 213.A N ARG 209.A O no hydrogen 2.903 N/A GLU 214.A N LYS 210.A O no hydrogen 3.019 N/A LEU 215.A N GLN 211.A O no hydrogen 2.946 N/A LEU 216.A N VAL 212.A O no hydrogen 2.954 N/A LEU 217.A N ALA 213.A O no hydrogen 3.058 N/A ARG 218.A N GLU 214.A O no hydrogen 2.781 N/A LYS 219.A N LEU 215.A O no hydrogen 3.005 N/A GLY 220.A N LEU 217.A O no hydrogen 3.238 N/A ALA 221.A N LEU 216.A O no hydrogen 2.784 N/A ASN 222.A N ASN 187.A OD1 no hydrogen 3.098 N/A ASN 222.A ND2 GLU 225.A OE1 no hydrogen 2.722 N/A GLU 225.A N ASN 222.A O no hydrogen 3.185 N/A ASN 227.A N MET 231.A O no hydrogen 2.875 N/A ASN 227.A ND2 GLU 195.A OE2 no hydrogen 3.470 N/A LYS 228.A N SER 193.A O no hydrogen 2.863 N/A ASP 229.A N ASN 227.A OD1 no hydrogen 2.881 N/A PHE 230.A N ASN 227.A O no hydrogen 2.737 N/A MET 231.A N ASN 227.A OD1 no hydrogen 2.982 N/A HIS 235.A N THR 232.A OG1 no hydrogen 3.356 N/A VAL 236.A N THR 232.A O no hydrogen 3.257 N/A ALA 237.A N PRO 233.A O no hydrogen 2.819 N/A ALA 238.A N LEU 234.A O no hydrogen 2.832 N/A GLU 239.A N HIS 235.A O no hydrogen 3.174 N/A ARG 240.A N ALA 237.A O no hydrogen 3.256 N/A ARG 240.A NH1 VAL 236.A O no hydrogen 3.091 N/A ARG 240.A NH1 GLU 239.A OE1 no hydrogen 2.567 N/A ALA 241.A N ALA 238.A O no hydrogen 2.974 N/A HIS 242.A N ALA 237.A O no hydrogen 2.945 N/A HIS 242.A ND1 VAL 202.A O no hydrogen 2.725 N/A VAL 245.A N ASP 244.A OD1 no hydrogen 2.731 N/A MET 246.A N HIS 242.A O no hydrogen 3.237 N/A GLU 247.A N ASN 243.A O no hydrogen 3.248 N/A LEU 249.A N VAL 245.A O no hydrogen 2.891 N/A HIS 250.A N MET 246.A O no hydrogen 2.923 N/A LYS 251.A N GLU 247.A O no hydrogen 2.938 N/A HIS 252.A N VAL 248.A O no hydrogen 3.061 N/A HIS 252.A ND1 VAL 248.A O no hydrogen 3.104 N/A GLY 253.A N HIS 250.A O no hydrogen 3.059 N/A ALA 254.A N LEU 249.A O no hydrogen 2.891 N/A ALA 258.A N LYS 255.A O no hydrogen 3.189 N/A ASP 260.A N GLN 264.A O no hydrogen 2.766 N/A SER 261.A N ASP 229.A O no hydrogen 3.050 N/A SER 261.A OG ASP 229.A O no hydrogen 3.523 N/A LEU 262.A N ASP 260.A OD1 no hydrogen 2.733 N/A GLY 263.A N ASP 260.A O no hydrogen 3.058 N/A GLN 264.A N ASP 260.A OD1 no hydrogen 2.893 N/A THR 265.A N HIS 268.A ND1 no hydrogen 3.164 N/A THR 265.A OG1 HIS 268.A ND1 no hydrogen 3.407 N/A HIS 268.A N THR 265.A OG1 no hydrogen 3.116 N/A HIS 268.A NE2 PHE 297.A O no hydrogen 2.761 N/A ARG 269.A N THR 265.A O no hydrogen 3.273 N/A ARG 269.A NE GLU 239.A OE2 no hydrogen 3.207 N/A ARG 269.A NH1 ASP 260.A OD2 no hydrogen 2.581 N/A ARG 269.A NH2 GLU 239.A OE2 no hydrogen 3.003 N/A ALA 270.A N ALA 266.A O no hydrogen 2.859 N/A ALA 271.A N LEU 267.A O no hydrogen 2.868 N/A LEU 272.A N HIS 268.A O no hydrogen 2.942 N/A ALA 273.A N ARG 269.A O no hydrogen 3.152 N/A GLY 274.A N ALA 271.A O no hydrogen 3.004 N/A HIS 275.A N ALA 270.A O no hydrogen 3.102 N/A HIS 275.A NE2 GLU 239.A O no hydrogen 2.811 N/A THR 278.A OG1 ASN 243.A OD1 no hydrogen 2.616 N/A CYS 279.A N HIS 275.A O no hydrogen 3.090 N/A CYS 279.A SG HIS 275.A O no hydrogen 3.357 N/A ARG 280.A N LEU 276.A O no hydrogen 3.057 N/A ARG 280.A NH1 GLN 277.A OE1 no hydrogen 2.926 N/A LEU 281.A N GLN 277.A O no hydrogen 2.885 N/A LEU 282.A N THR 278.A O no hydrogen 2.897 N/A LEU 283.A N CYS 279.A O no hydrogen 2.911 N/A SER 284.A N ARG 280.A O no hydrogen 2.969 N/A SER 284.A OG LEU 281.A O no hydrogen 2.744 N/A TYR 285.A N LEU 281.A O no hydrogen 2.809 N/A GLY 286.A N LEU 283.A O no hydrogen 2.914 N/A SER 287.A N LEU 282.A O no hydrogen 2.963 N/A SER 287.A OG LEU 282.A O no hydrogen 3.004 N/A SER 290.A N ASP 288.A OD1 no hydrogen 2.898 N/A SER 290.A OG ASP 288.A OD1 no hydrogen 2.685 N/A SER 290.A OG ASP 288.A OD2 no hydrogen 3.440 N/A ILE 291.A N ASP 288.A O no hydrogen 3.441 N/A SER 293.A N PHE 297.A O no hydrogen 2.865 N/A SER 293.A OG PHE 297.A O no hydrogen 3.468 N/A LEU 294.A N LEU 262.A O no hydrogen 2.959 N/A GLN 295.A N SER 293.A OG no hydrogen 3.305 N/A GLY 296.A N SER 293.A O no hydrogen 2.886 N/A PHE 297.A N SER 293.A OG no hydrogen 3.223 N/A THR 298.A N GLN 301.A OE1 no hydrogen 2.754 N/A GLN 301.A N THR 298.A O no hydrogen 3.053 N/A GLN 301.A N THR 298.A OG1 no hydrogen 3.193 N/A MET 302.A N ALA 299.A O no hydrogen 2.996 N/A GLY 303.A N ALA 300.A O no hydrogen 3.382 N/A VAL 307.A N ASN 304.A OD1 no hydrogen 2.757 N/A GLN 308.A N ASN 304.A O no hydrogen 2.896 N/A GLN 308.A NE2 GLY 303.A O no hydrogen 2.928 N/A GLN 309.A N GLU 305.A O no hydrogen 2.959 N/A ILE 310.A N ALA 306.A O no hydrogen 2.977 N/A LEU 311.A N VAL 307.A O no hydrogen 2.876 N/A SER 312.A N GLN 308.A O no hydrogen 2.999 N/A SER 312.A N GLN 309.A O no hydrogen 3.316 N/A SER 312.A OG GLN 308.A O no hydrogen 3.234 N/A SER 312.A OG GLN 309.A O no hydrogen 2.935 N/A