Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3psp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N ASP 11.A OD1 no hydrogen 2.527 N/A LYS 2.A N TYR 10.A O no hydrogen 3.324 N/A LYS 2.A NZ ASP 11.A O no hydrogen 3.076 N/A ILE 3.A N TYR 10.A O no hydrogen 3.025 N/A PHE 5.A N LYS 8.A O no hydrogen 2.772 N/A LYS 8.A N PHE 5.A O no hydrogen 3.301 N/A TYR 10.A N ILE 3.A O no hydrogen 2.763 N/A ASP 11.A N ASN 30.A OD1 no hydrogen 3.042 N/A TYR 12.A N ILE 29.A O no hydrogen 2.959 N/A PHE 14.A N LEU 27.A O no hydrogen 2.836 N/A VAL 16.A N LEU 25.A O no hydrogen 2.816 N/A LYS 22.A N GLU 19.A O no hydrogen 2.945 N/A LYS 22.A NZ GLU 19.A OE1 no hydrogen 2.835 N/A LEU 25.A N VAL 16.A O no hydrogen 2.913 N/A LYS 26.A NZ ASP 15.A OD1 no hydrogen 2.757 N/A LEU 27.A N PHE 14.A O no hydrogen 2.662 N/A ILE 29.A N TYR 12.A O no hydrogen 2.861 N/A ASN 30.A N ASP 33.A OD2 no hydrogen 3.072 N/A VAL 31.A N ASP 11.A OD2 no hydrogen 3.048 N/A ASP 33.A N ASN 30.A O no hydrogen 2.716 N/A TYR 36.A N ASN 34.A OD1 no hydrogen 3.032 N/A THR 37.A N ASN 34.A OD1 no hydrogen 3.330 N/A ALA 38.A N ASN 34.A O no hydrogen 3.096 N/A ALA 39.A N PRO 35.A O no hydrogen 2.807 N/A ASP 40.A N TYR 36.A O no hydrogen 2.937 N/A ASN 41.A N THR 37.A O no hydrogen 2.958 N/A PHE 42.A N ALA 38.A O no hydrogen 2.986 N/A LEU 43.A N ALA 39.A O no hydrogen 2.850 N/A ALA 44.A N ASP 40.A O no hydrogen 3.033 N/A ARG 45.A N ASN 41.A O no hydrogen 2.628 N/A ARG 45.A NE GLU 6.A OE1 no hydrogen 2.972 N/A ARG 45.A NH1 GLU 6.A OE2 no hydrogen 2.724 N/A ARG 45.A NH2 ARG 45.A O no hydrogen 3.108 N/A TYR 46.A N PHE 42.A O no hydrogen 3.168 N/A TYR 46.A OH LYS 26.A O no hydrogen 2.731 N/A GLU 47.A N ALA 44.A O no hydrogen 3.090 N/A LEU 48.A N LEU 43.A O no hydrogen 2.779 N/A SER 51.A OG ASP 83.A OD2 no hydrogen 2.969 N/A TYR 52.A N PRO 49.A O no hydrogen 3.160 N/A TYR 52.A OH THR 84.A OG1 no hydrogen 2.547 N/A ARG 53.A N MET 50.A O no hydrogen 3.103 N/A ARG 53.A NE ASP 40.A OD1 no hydrogen 2.981 N/A ARG 53.A NH2 ASP 40.A OD2 no hydrogen 3.197 N/A VAL 56.A N TYR 52.A O no hydrogen 3.017 N/A VAL 57.A N ARG 53.A O no hydrogen 3.123 N/A GLN 58.A N ASP 54.A O no hydrogen 2.905 N/A PHE 59.A N GLN 55.A O no hydrogen 3.048 N/A ILE 60.A N VAL 56.A O no hydrogen 2.814 N/A LEU 61.A N VAL 57.A O no hydrogen 2.905 N/A LYS 62.A N GLN 58.A O no hydrogen 2.887 N/A ASN 63.A N PHE 59.A O no hydrogen 3.131 N/A ASN 63.A N ILE 60.A O no hydrogen 3.049 N/A THR 64.A N LEU 61.A O no hydrogen 3.245 N/A THR 64.A OG1 ILE 60.A O no hydrogen 3.424 N/A LYS 67.A N ASP 315.A OD1 no hydrogen 3.123 N/A LYS 67.A NZ ASP 311.A OD1 no hydrogen 3.127 N/A LYS 67.A NZ ASP 311.A OD2 no hydrogen 3.556 N/A VAL 68.A N ASP 315.A OD2 no hydrogen 2.633 N/A LEU 69.A N ASP 315.A OD2 no hydrogen 2.992 N/A LEU 75.A N ASN 230.A OD1 no hydrogen 2.855 N/A MET 77.A N ASN 180.A OD1 no hydrogen 2.808 N/A TYR 80.A OH LEU 111.A O no hydrogen 2.879 N/A ASN 81.A ND2 SER 51.A OG no hydrogen 3.175 N/A THR 84.A N ASN 81.A OD1 no hydrogen 3.069 N/A THR 84.A OG1 GLU 19.A OE2 no hydrogen 2.697 N/A THR 84.A OG1 TYR 52.A OH no hydrogen 2.547 N/A ILE 85.A N ASN 81.A O no hydrogen 3.068 N/A PHE 86.A N PRO 82.A O no hydrogen 2.857 N/A ASN 87.A N ASP 83.A O no hydrogen 2.774 N/A GLY 88.A N THR 84.A O no hydrogen 3.037 N/A ILE 89.A N ILE 85.A O no hydrogen 2.982 N/A VAL 90.A N PHE 86.A O no hydrogen 2.836 N/A LYS 91.A N ASN 87.A O no hydrogen 2.790 N/A ILE 92.A N GLY 88.A O no hydrogen 3.003 N/A ASN 93.A N ILE 89.A O no hydrogen 2.787 N/A ASN 93.A ND2 PHE 99.A O no hydrogen 3.045 N/A SER 94.A N LYS 91.A O no hydrogen 2.877 N/A SER 94.A OG LYS 91.A O no hydrogen 2.568 N/A ASN 95.A N ILE 92.A O no hydrogen 3.001 N/A LYS 97.A N ASN 93.A O no hydrogen 3.226 N/A THR 98.A N ASN 93.A OD1 no hydrogen 2.812 N/A PHE 99.A N ASN 93.A OD1 no hydrogen 3.263 N/A LEU 104.A N ASP 100.A O no hydrogen 2.944 N/A ALA 105.A N ASP 101.A O no hydrogen 3.270 N/A GLN 106.A N GLU 102.A O no hydrogen 3.034 N/A GLN 106.A N ILE 103.A O no hydrogen 2.790 N/A GLN 106.A NE2 GLU 102.A OE1 no hydrogen 3.543 N/A ILE 107.A N ILE 103.A O no hydrogen 3.164 N/A GLY 108.A N LEU 104.A O no hydrogen 2.892 N/A GLY 109.A N ALA 105.A O no hydrogen 3.386 N/A ALA 110.A N GLN 106.A O no hydrogen 2.656 N/A LEU 111.A N ILE 107.A O no hydrogen 2.696 N/A HIS 112.A N GLY 109.A O no hydrogen 3.299 N/A ASP 113.A N ALA 110.A O no hydrogen 2.983 N/A GLU 116.A N ASP 113.A OD1 no hydrogen 3.138 N/A SER 117.A N ILE 114.A O no hydrogen 2.956 N/A LEU 121.A N SER 117.A O no hydrogen 2.946 N/A LEU 122.A N TRP 118.A O no hydrogen 2.760 N/A SER 123.A N GLU 119.A O no hydrogen 3.056 N/A SER 123.A OG GLU 119.A O no hydrogen 3.413 N/A SER 123.A OG LEU 120.A O no hydrogen 2.515 N/A PHE 124.A N LEU 120.A O no hydrogen 3.015 N/A ALA 125.A N LEU 121.A O no hydrogen 2.789 N/A ASN 126.A N LEU 122.A O no hydrogen 2.822 N/A THR 127.A N SER 123.A O no hydrogen 2.874 N/A THR 127.A OG1 SER 123.A O no hydrogen 3.323 N/A ILE 128.A N PHE 124.A O no hydrogen 2.892 N/A ARG 129.A N ALA 125.A O no hydrogen 2.746 N/A ARG 129.A NH1 GLU 161.A OE1 no hydrogen 2.500 N/A SER 130.A N ASN 126.A O no hydrogen 2.583 N/A SER 130.A OG ASN 126.A O no hydrogen 2.500 N/A ASN 131.A N ILE 128.A O no hydrogen 3.375 N/A ASN 131.A ND2 THR 127.A O no hydrogen 2.976 N/A TRP 132.A N ILE 128.A O no hydrogen 2.888 N/A TRP 132.A NE1 THR 98.A OG1 no hydrogen 3.093 N/A LYS 135.A NZ ARG 129.A O no hydrogen 2.458 N/A LYS 135.A NZ GLU 161.A OE2 no hydrogen 3.426 N/A TYR 139.A N LYS 135.A O no hydrogen 3.225 N/A TYR 139.A OH GLU 161.A OE1 no hydrogen 2.882 N/A ASP 140.A N THR 136.A O no hydrogen 2.857 N/A ILE 141.A N PRO 137.A O no hydrogen 2.776 N/A VAL 142.A N ALA 138.A O no hydrogen 2.958 N/A ARG 143.A N TYR 139.A O no hydrogen 2.942 N/A ARG 143.A NE ASP 140.A OD1 no hydrogen 2.770 N/A ARG 143.A NH1 MET 77.A O no hydrogen 2.863 N/A ARG 143.A NH1 ASN 79.A O no hydrogen 2.992 N/A ARG 143.A NH2 ASN 79.A O no hydrogen 2.699 N/A ARG 143.A NH2 ASP 140.A OD1 no hydrogen 2.969 N/A LEU 144.A N ASP 140.A O no hydrogen 3.340 N/A LEU 144.A N ILE 141.A O no hydrogen 3.026 N/A ILE 145.A N ILE 141.A O no hydrogen 3.226 N/A ILE 145.A N VAL 142.A O no hydrogen 3.288 N/A VAL 146.A N VAL 142.A O no hydrogen 2.946 N/A LYS 147.A NZ GLU 78.A OE1 no hydrogen 3.083 N/A LYS 147.A NZ GLU 78.A OE2 no hydrogen 2.651 N/A LYS 147.A NZ ASP 115.A OD1 no hydrogen 3.568 N/A LYS 148.A N ILE 145.A O no hydrogen 2.663 N/A LYS 148.A NZ ASP 115.A OD2 no hydrogen 3.397 N/A LEU 149.A N VAL 146.A O no hydrogen 3.181 N/A TYR 151.A N ASP 154.A OD2 no hydrogen 3.354 N/A ASP 154.A N TYR 151.A O no hydrogen 2.942 N/A ILE 155.A N SER 152.A O no hydrogen 3.094 N/A LYS 156.A N SER 153.A O no hydrogen 3.260 N/A TYR 158.A N ILE 155.A O no hydrogen 2.990 N/A ILE 159.A N ILE 155.A O no hydrogen 3.156 N/A GLU 160.A N LYS 156.A O no hydrogen 3.092 N/A GLU 161.A N ASP 157.A O no hydrogen 2.978 N/A GLY 162.A N TYR 158.A O no hydrogen 2.684 N/A LEU 163.A N ILE 159.A O no hydrogen 3.033 N/A ASN 165.A ND2 GLU 161.A O no hydrogen 2.960 N/A ASN 167.A N ASN 165.A OD1 no hydrogen 2.796 N/A THR 169.A N ASN 167.A OD1 no hydrogen 3.083 N/A THR 171.A N ASN 167.A O no hydrogen 3.076 N/A THR 171.A OG1 GLY 162.A O no hydrogen 3.348 N/A THR 171.A OG1 LEU 163.A O no hydrogen 3.105 N/A THR 171.A OG1 ASN 165.A O no hydrogen 2.881 N/A THR 171.A OG1 ASN 167.A O no hydrogen 3.347 N/A MET 172.A N ILE 168.A O no hydrogen 2.826 N/A LEU 173.A N THR 169.A O no hydrogen 2.922 N/A THR 174.A N LEU 170.A O no hydrogen 2.897 N/A THR 174.A OG1 LEU 170.A O no hydrogen 2.649 N/A VAL 175.A N THR 171.A O no hydrogen 2.838 N/A ARG 176.A N MET 172.A O no hydrogen 3.095 N/A ARG 176.A NH1 ASP 20.A OD1 no hydrogen 3.479 N/A ARG 176.A NH1 ASP 20.A OD2 no hydrogen 2.908 N/A ARG 176.A NH2 ASP 20.A OD1 no hydrogen 3.019 N/A ILE 177.A N LEU 173.A O no hydrogen 3.016 N/A LEU 178.A N THR 174.A O no hydrogen 3.018 N/A VAL 179.A N VAL 175.A O no hydrogen 2.791 N/A ASN 180.A N ARG 176.A O no hydrogen 3.058 N/A ASN 180.A ND2 MET 77.A O no hydrogen 3.052 N/A ASN 180.A ND2 ARG 143.A O no hydrogen 2.828 N/A CYS 181.A N ILE 177.A O no hydrogen 2.944 N/A CYS 181.A SG ILE 177.A O no hydrogen 3.447 N/A PHE 182.A N VAL 179.A O no hydrogen 3.275 N/A ASN 183.A N ASN 180.A O no hydrogen 2.923 N/A ASN 184.A N CYS 181.A O no hydrogen 2.890 N/A ASN 184.A ND2 VAL 146.A O no hydrogen 2.863 N/A ASN 184.A ND2 LEU 149.A O no hydrogen 2.751 N/A ASN 186.A N ASN 184.A OD1 no hydrogen 2.922 N/A TRP 187.A N ASN 184.A OD1 no hydrogen 3.024 N/A TRP 187.A NE1 LEU 149.A O no hydrogen 2.961 N/A GLY 188.A N ASN 184.A O no hydrogen 3.152 N/A LEU 191.A N TRP 187.A O no hydrogen 3.113 N/A LEU 192.A N GLY 188.A O no hydrogen 3.054 N/A GLU 193.A N VAL 189.A O no hydrogen 2.875 N/A SER 194.A N LEU 191.A O no hydrogen 3.108 N/A SER 194.A OG LEU 191.A O no hydrogen 2.789 N/A ASN 195.A ND2 ASP 241.A OD2 no hydrogen 3.545 N/A ASN 195.A ND2 GLU 243.A OE1 no hydrogen 3.155 N/A VAL 197.A N SER 194.A O no hydrogen 2.667 N/A TYR 198.A N SER 194.A O no hydrogen 3.136 N/A TYR 198.A OH ASP 241.A OD2 no hydrogen 2.830 N/A LYS 199.A N ASN 195.A O no hydrogen 2.985 N/A SER 200.A N VAL 197.A O no hydrogen 3.171 N/A SER 200.A OG GLN 196.A O no hydrogen 3.336 N/A SER 200.A OG VAL 197.A O no hydrogen 3.505 N/A ILE 201.A N VAL 197.A O no hydrogen 2.828 N/A THR 204.A N SER 200.A O no hydrogen 2.935 N/A THR 204.A OG1 SER 200.A O no hydrogen 2.893 N/A ILE 205.A N ILE 201.A O no hydrogen 2.881 N/A THR 207.A N ILE 205.A O no hydrogen 2.680 N/A SER 213.A N GLN 216.A OE1 no hydrogen 2.939 N/A GLN 216.A N SER 213.A OG no hydrogen 3.301 N/A SER 217.A N SER 213.A O no hydrogen 3.297 N/A SER 217.A OG SER 213.A O no hydrogen 3.559 N/A GLN 218.A N ALA 214.A O no hydrogen 2.978 N/A ASN 219.A N LYS 215.A O no hydrogen 2.874 N/A ASN 219.A ND2 GLY 21.A O no hydrogen 2.946 N/A LEU 220.A N GLN 216.A O no hydrogen 3.134 N/A ALA 221.A N SER 217.A O no hydrogen 3.072 N/A ILE 222.A N GLN 218.A O no hydrogen 3.051 N/A ALA 223.A N ASN 219.A O no hydrogen 3.142 N/A VAL 224.A N LEU 220.A O no hydrogen 2.713 N/A SER 225.A N ALA 221.A O no hydrogen 2.887 N/A SER 225.A OG ALA 221.A O no hydrogen 2.868 N/A SER 225.A OG ILE 222.A O no hydrogen 3.341 N/A THR 226.A N ILE 222.A O no hydrogen 3.101 N/A THR 226.A OG1 ILE 222.A O no hydrogen 2.632 N/A LEU 227.A N ALA 223.A O no hydrogen 3.027 N/A ILE 228.A N VAL 224.A O no hydrogen 2.853 N/A PHE 229.A N SER 225.A O no hydrogen 2.865 N/A ASN 230.A N THR 226.A O no hydrogen 2.918 N/A ASN 230.A ND2 LEU 75.A O no hydrogen 2.889 N/A ASN 230.A ND2 VAL 179.A O no hydrogen 3.349 N/A TYR 231.A N LEU 227.A O no hydrogen 2.912 N/A TYR 231.A OH LEU 192.A O no hydrogen 2.517 N/A SER 232.A N ILE 228.A O no hydrogen 2.908 N/A SER 232.A OG PHE 229.A O no hydrogen 2.653 N/A SER 232.A OG ASN 278.A OD1 no hydrogen 3.045 N/A ALA 233.A N PHE 229.A O no hydrogen 2.887 N/A LEU 234.A N ASN 230.A O no hydrogen 2.882 N/A VAL 235.A N TYR 231.A O no hydrogen 3.088 N/A THR 236.A N SER 232.A O no hydrogen 3.225 N/A THR 236.A OG1 ALA 233.A O no hydrogen 2.587 N/A LYS 237.A N LEU 234.A O no hydrogen 2.916 N/A LYS 237.A NZ TYR 74.A OH no hydrogen 3.532 N/A GLY 238.A N VAL 235.A O no hydrogen 3.083 N/A SER 240.A OG GLU 193.A OE1 no hydrogen 3.033 N/A LEU 244.A N ASP 241.A O no hydrogen 3.043 N/A ILE 247.A N GLU 243.A O no hydrogen 3.374 N/A VAL 248.A N LEU 244.A O no hydrogen 2.866 N/A ALA 249.A N LEU 245.A O no hydrogen 2.612 N/A ASP 250.A N PRO 246.A O no hydrogen 2.848 N/A ALA 251.A N ILE 247.A O no hydrogen 2.979 N/A ILE 252.A N VAL 248.A O no hydrogen 3.015 N/A ASN 253.A N ALA 249.A O no hydrogen 2.645 N/A THR 254.A N ASP 250.A O no hydrogen 2.799 N/A THR 254.A OG1 ASP 250.A O no hydrogen 3.179 N/A LYS 255.A N ALA 251.A O no hydrogen 2.920 N/A TYR 256.A N ALA 251.A O no hydrogen 2.882 N/A GLY 257.A N ILE 252.A O no hydrogen 2.864 N/A LEU 259.A N TYR 256.A O no hydrogen 3.079 N/A GLU 261.A N GLU 261.A OE1 no hydrogen 2.987 N/A TYR 262.A N LEU 259.A O no hydrogen 2.817 N/A GLN 263.A N LEU 259.A O no hydrogen 3.014 N/A GLU 264.A N GLU 260.A O no hydrogen 2.792 N/A CYS 265.A N TYR 262.A O no hydrogen 3.414 N/A ALA 269.A N CYS 265.A O no hydrogen 2.885 N/A TYR 270.A N GLU 266.A O no hydrogen 2.835 N/A ARG 271.A N GLU 267.A O no hydrogen 3.211 N/A ARG 271.A NE THR 226.A OG1 no hydrogen 3.026 N/A ARG 271.A NH1 GLU 267.A O no hydrogen 2.900 N/A ARG 271.A NH1 GLU 267.A OE1 no hydrogen 2.697 N/A LEU 272.A N ALA 268.A O no hydrogen 3.103 N/A THR 273.A N ALA 269.A O no hydrogen 2.922 N/A THR 273.A OG1 ALA 269.A O no hydrogen 2.727 N/A VAL 274.A N TYR 270.A O no hydrogen 2.999 N/A ALA 275.A N ARG 271.A O no hydrogen 2.900 N/A TYR 276.A N LEU 272.A O no hydrogen 2.841 N/A GLY 277.A N THR 273.A O no hydrogen 2.940 N/A ASN 278.A N VAL 274.A O no hydrogen 2.780 N/A LEU 279.A N ALA 275.A O no hydrogen 3.089 N/A ALA 280.A N TYR 276.A O no hydrogen 2.828 N/A THR 281.A N GLY 277.A O no hydrogen 3.225 N/A THR 281.A N ASN 278.A O no hydrogen 3.175 N/A THR 281.A OG1 ASN 278.A O no hydrogen 2.620 N/A VAL 282.A N LEU 279.A O no hydrogen 3.093 N/A GLU 283.A N LEU 279.A O no hydrogen 2.977 N/A ARG 287.A N GLU 283.A O no hydrogen 3.081 N/A GLN 288.A N PRO 284.A O no hydrogen 2.952 N/A PHE 289.A N THR 285.A O no hydrogen 2.957 N/A ALA 290.A N ARG 287.A O no hydrogen 3.154 N/A SER 292.A N PHE 289.A O no hydrogen 2.857 N/A VAL 293.A N ALA 290.A O no hydrogen 3.290 N/A TRP 295.A NE1 ASN 253.A OD1 no hydrogen 2.880 N/A ALA 297.A N VAL 293.A O no hydrogen 3.045 N/A ASN 298.A N THR 294.A O no hydrogen 2.862 N/A ILE 299.A N TRP 295.A O no hydrogen 3.149 N/A LYS 300.A N LEU 296.A O no hydrogen 2.887 N/A ARG 301.A N ALA 297.A O no hydrogen 3.093 N/A ARG 301.A NH2 ASN 298.A OD1 no hydrogen 2.841 N/A SER 302.A N ASN 298.A O no hydrogen 2.933 N/A SER 302.A OG ASN 298.A O no hydrogen 3.439 N/A TYR 303.A N ILE 299.A O no hydrogen 2.783 N/A GLY 304.A N LYS 300.A O no hydrogen 2.691 N/A VAL 306.A N TYR 303.A O no hydrogen 2.950 N/A ARG 308.A NH1 GLU 267.A OE1 no hydrogen 2.983 N/A ARG 308.A NH1 GLU 267.A OE2 no hydrogen 3.399 N/A ARG 308.A NH2 GLU 266.A OE2 no hydrogen 3.147 N/A ARG 308.A NH2 GLU 267.A OE2 no hydrogen 2.918 N/A LYS 310.A N VAL 306.A O no hydrogen 2.689 N/A LYS 310.A NZ ASP 314.A OD1 no hydrogen 3.537 N/A ASP 311.A N PRO 307.A O no hydrogen 2.944 N/A ILE 312.A N PHE 309.A O no hydrogen 2.869 N/A PHE 313.A N PHE 309.A O no hydrogen 3.016 N/A ASP 314.A N LYS 310.A O no hydrogen 2.810 N/A ASP 315.A N ASP 311.A O no hydrogen 3.230 N/A LEU 316.A N ILE 312.A O no hydrogen 2.820 N/A LEU 316.A N PHE 313.A O no hydrogen 2.952 N/A SER 317.A N ASP 314.A O no hydrogen 3.267 N/A SER 317.A OG PHE 313.A O no hydrogen 3.529 N/A SER 317.A OG ASP 314.A O no hydrogen 2.977 N/A