Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2psd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ PRO 184.A O no hydrogen 3.190 N/A LYS 1.A NZ ILE 187.A O no hydrogen 2.735 N/A GLU 6.A N ASP 4.A OD1 no hydrogen 3.100 N/A GLN 7.A N ASP 4.A O no hydrogen 2.974 N/A GLN 7.A NE2 HIS 59.A NE2 no hydrogen 3.358 N/A GLN 7.A NE2 GLU 195.A OE2 no hydrogen 3.023 N/A ARG 8.A NH1 GLU 192.A OE1 no hydrogen 3.078 N/A ARG 8.A NH1 GLU 194.A OE1 no hydrogen 2.868 N/A ARG 8.A NH2 GLU 194.A OE2 no hydrogen 2.899 N/A ARG 10.A N GLN 7.A O no hydrogen 3.001 N/A ARG 10.A NH1 ASP 290.A OD2 no hydrogen 2.969 N/A ARG 10.A NH2 ASP 290.A OD2 no hydrogen 3.259 N/A MET 11.A N ARG 8.A O no hydrogen 3.323 N/A THR 13.A N GLN 16.A OE1 no hydrogen 2.855 N/A GLN 16.A N THR 13.A OG1 no hydrogen 3.238 N/A TRP 17.A N THR 13.A O no hydrogen 2.974 N/A TRP 17.A NE1 SER 54.A OG no hydrogen 2.922 N/A TRP 18.A N GLY 14.A O no hydrogen 2.768 N/A ALA 19.A N PRO 15.A O no hydrogen 3.026 N/A ARG 20.A N TRP 17.A O no hydrogen 2.928 N/A ARG 20.A NH2 TYR 34.A OH no hydrogen 3.151 N/A CYS 21.A N TRP 18.A O no hydrogen 3.165 N/A CYS 21.A SG TRP 17.A O no hydrogen 3.499 N/A LYS 22.A N TYR 33.A O no hydrogen 2.839 N/A GLN 23.A NE2 ASN 32.A OD1 no hydrogen 2.917 N/A MET 24.A N.A ILE 31.A O no hydrogen 2.914 N/A MET 24.A N.B ILE 31.A O no hydrogen 2.910 N/A VAL 26.A N SER 29.A O no hydrogen 2.933 N/A SER 29.A N VAL 26.A O no hydrogen 2.859 N/A SER 29.A OG LYS 83.A O no hydrogen 2.652 N/A ILE 31.A N MET 24.A O.A no hydrogen 2.934 N/A ILE 31.A N MET 24.A O.B no hydrogen 2.859 N/A ASN 32.A N SER 81.A OG no hydrogen 2.897 N/A ASN 32.A ND2 ASP 74.A OD2 no hydrogen 2.797 N/A TYR 33.A N LYS 22.A O no hydrogen 2.909 N/A TYR 34.A N ILE 72.A O no hydrogen 2.898 N/A TYR 34.A OH GLU 65.A OE2 no hydrogen 2.503 N/A SER 36.A N CYS 70.A O no hydrogen 2.852 N/A GLU 37.A N ASP 35.A OD1 no hydrogen 2.928 N/A LYS 38.A N SER 36.A O no hydrogen 2.736 N/A HIS 39.A ND1 GLU 65.A O no hydrogen 3.243 N/A GLU 41.A N GLU 41.A OE1 no hydrogen 2.837 N/A ASN 42.A N HIS 39.A O no hydrogen 3.417 N/A VAL 44.A N ARG 69.A O no hydrogen 2.794 N/A ILE 45.A N ILE 112.A O no hydrogen 2.818 N/A PHE 46.A N ILE 71.A O no hydrogen 2.986 N/A LEU 47.A N VAL 114.A O no hydrogen 2.799 N/A HIS 48.A ND1 GLY 49.A O no hydrogen 2.817 N/A ASN 50.A N ASP 117.A OD2 no hydrogen 2.947 N/A ASN 50.A ND2 THR 213.A O no hydrogen 3.091 N/A THR 52.A OG1 GLY 49.A O no hydrogen 3.325 N/A SER 54.A N ASP 74.A OD1 no hydrogen 2.758 N/A SER 54.A OG ASP 74.A OD1 no hydrogen 2.578 N/A TYR 55.A N SER 53.A OG no hydrogen 3.354 N/A TYR 55.A OH ILE 12.A O no hydrogen 2.597 N/A LEU 56.A N SER 53.A O no hydrogen 3.016 N/A TRP 57.A N SER 54.A O no hydrogen 2.962 N/A ARG 58.A N TYR 55.A O no hydrogen 3.159 N/A ARG 58.A NH1 TYR 55.A O no hydrogen 2.879 N/A ARG 58.A NH1 GLU 286.A OE2 no hydrogen 2.860 N/A ARG 58.A NH2 GLU 195.A OE2 no hydrogen 2.984 N/A ARG 58.A NH2 GLU 286.A OE1 no hydrogen 3.021 N/A ARG 58.A NH2 GLU 286.A OE2 no hydrogen 3.340 N/A VAL 60.A N TRP 57.A O no hydrogen 2.987 N/A VAL 61.A N TRP 57.A O no hydrogen 3.014 N/A HIS 63.A N VAL 60.A O no hydrogen 3.201 N/A HIS 63.A NE2 ASP 290.A OD1 no hydrogen 2.812 N/A ILE 64.A N VAL 61.A O no hydrogen 2.931 N/A GLU 65.A N VAL 61.A O no hydrogen 3.158 N/A VAL 67.A N ILE 64.A O no hydrogen 2.963 N/A ALA 68.A N ILE 64.A O no hydrogen 3.378 N/A ARG 69.A N HIS 39.A O no hydrogen 3.088 N/A ARG 69.A NE ASP 35.A OD1 no hydrogen 2.914 N/A ARG 69.A NE ASP 35.A OD2 no hydrogen 3.379 N/A ARG 69.A NH1 LEU 105.A O no hydrogen 2.890 N/A ARG 69.A NH1 ASN 106.A O no hydrogen 3.545 N/A ARG 69.A NH2 ASP 35.A OD2 no hydrogen 2.844 N/A ARG 69.A NH2 LEU 105.A O no hydrogen 3.043 N/A CYS 70.A N SER 36.A OG no hydrogen 2.845 N/A CYS 70.A SG ALA 68.A O no hydrogen 3.499 N/A ILE 71.A N VAL 44.A O no hydrogen 2.927 N/A ILE 72.A N TYR 34.A O no hydrogen 2.763 N/A ASP 74.A N ASN 32.A O no hydrogen 2.882 N/A LEU 75.A N HIS 48.A NE2 no hydrogen 2.980 N/A GLY 77.A N GLY 82.A O no hydrogen 2.846 N/A MET 78.A N LEU 75.A O no hydrogen 2.920 N/A LYS 80.A N ASP 74.A OD2 no hydrogen 2.810 N/A SER 81.A N MET 78.A O no hydrogen 3.061 N/A SER 81.A OG ASP 74.A O no hydrogen 2.612 N/A GLY 82.A N PHE 30.A O no hydrogen 2.854 N/A SER 84.A N TYR 89.A OH no hydrogen 2.926 N/A SER 84.A OG SER 88.A O no hydrogen 2.881 N/A GLY 85.A N TYR 97.A OH no hydrogen 2.897 N/A GLY 87.A N SER 84.A O no hydrogen 3.113 N/A SER 88.A N ASN 86.A OD1 no hydrogen 3.105 N/A SER 88.A OG ASP 93.A OD2 no hydrogen 2.530 N/A ARG 90.A N ASP 93.A OD2 no hydrogen 2.904 N/A ARG 90.A NE GLU 219.A OE2 no hydrogen 2.916 N/A ARG 90.A NH1 ASP 229.A OD2 no hydrogen 2.912 N/A ARG 90.A NH2 GLU 219.A OE1 no hydrogen 3.490 N/A ARG 90.A NH2 GLU 219.A OE2 no hydrogen 3.020 N/A ARG 90.A NH2 ASP 229.A OD1 no hydrogen 3.032 N/A ARG 90.A NH2 ASP 229.A OD2 no hydrogen 3.353 N/A LEU 91.A N GLU 219.A OE1 no hydrogen 2.815 N/A HIS 94.A N ARG 90.A O no hydrogen 3.043 N/A TYR 95.A N LEU 91.A O no hydrogen 2.878 N/A TYR 95.A OH GLU 129.A OE1 no hydrogen 2.645 N/A LYS 96.A N LEU 92.A O no hydrogen 2.957 N/A TYR 97.A N ASP 93.A O no hydrogen 3.326 N/A TYR 97.A OH ASP 28.A OD1 no hydrogen 2.588 N/A LEU 98.A N HIS 94.A O no hydrogen 2.889 N/A THR 99.A N TYR 95.A O no hydrogen 2.891 N/A THR 99.A OG1 TYR 95.A O no hydrogen 2.841 N/A THR 99.A OG1 LYS 96.A O no hydrogen 3.216 N/A ALA 100.A N LYS 96.A O no hydrogen 3.185 N/A TRP 101.A N TYR 97.A O no hydrogen 2.932 N/A PHE 102.A N LEU 98.A O no hydrogen 2.935 N/A GLU 103.A N THR 99.A O no hydrogen 3.358 N/A LEU 104.A N TRP 101.A O no hydrogen 2.953 N/A LEU 105.A N PHE 102.A O no hydrogen 3.176 N/A LYS 109.A NZ ASP 132.A O no hydrogen 2.657 N/A LYS 109.A NZ ASP 132.A OD2 no hydrogen 3.477 N/A LYS 110.A NZ ASP 132.A O no hydrogen 3.268 N/A ILE 111.A N ARG 133.A O no hydrogen 2.866 N/A ILE 112.A N ALA 43.A O no hydrogen 2.881 N/A PHE 113.A N ALA 136.A O no hydrogen 3.082 N/A VAL 114.A N ILE 45.A O no hydrogen 2.836 N/A GLY 115.A N VAL 138.A O no hydrogen 2.822 N/A HIS 116.A N LEU 47.A O no hydrogen 3.075 N/A HIS 116.A NE2 HIS 282.A O no hydrogen 2.838 N/A ASP 117.A N MET 140.A O no hydrogen 3.324 N/A GLY 119.A N HIS 116.A O no hydrogen 2.861 N/A ALA 120.A N ASP 117.A O no hydrogen 2.956 N/A ALA 121.A N ASP 117.A O no hydrogen 3.462 N/A LEU 122.A N TRP 118.A O no hydrogen 3.031 N/A ALA 123.A N GLY 119.A O no hydrogen 3.107 N/A PHE 124.A N ALA 120.A O no hydrogen 2.845 N/A HIS 125.A N ALA 121.A O no hydrogen 2.950 N/A TYR 126.A N LEU 122.A O no hydrogen 2.894 N/A ALA 127.A N ALA 123.A O no hydrogen 2.883 N/A TYR 128.A N PHE 124.A O no hydrogen 2.945 N/A GLU 129.A N HIS 125.A O no hydrogen 3.070 N/A HIS 130.A N ALA 127.A O no hydrogen 3.105 N/A HIS 130.A ND1 TYR 126.A O no hydrogen 2.697 N/A GLN 131.A NE2 TYR 128.A O no hydrogen 2.978 N/A ARG 133.A N HIS 130.A O no hydrogen 2.981 N/A ARG 133.A NE LYS 109.A O no hydrogen 2.680 N/A ARG 133.A NH2 PRO 108.A O no hydrogen 2.917 N/A LYS 135.A N ILE 111.A O no hydrogen 2.804 N/A ILE 137.A N PRO 248.A O no hydrogen 3.109 N/A VAL 138.A N PHE 113.A O no hydrogen 2.770 N/A HIS 139.A N LEU 250.A O no hydrogen 2.841 N/A MET 140.A N GLY 115.A O no hydrogen 3.179 N/A VAL 146.A N ASP 145.A OD1 no hydrogen 2.744 N/A ILE 147.A N PRO 221.A O no hydrogen 2.883 N/A ASP 151.A N SER 149.A OG no hydrogen 3.110 N/A TRP 153.A N TRP 150.A O no hydrogen 2.998 N/A ILE 156.A N PRO 154.A O no hydrogen 2.845 N/A ILE 160.A N ILE 156.A O no hydrogen 2.834 N/A ALA 161.A N GLU 157.A O no hydrogen 2.958 N/A LEU 162.A N GLU 158.A O no hydrogen 2.851 N/A ILE 163.A N ASP 159.A O no hydrogen 2.803 N/A LYS 164.A N ILE 160.A O no hydrogen 2.863 N/A LYS 164.A NZ GLY 225.A O no hydrogen 3.025 N/A SER 165.A N ALA 161.A O no hydrogen 3.224 N/A SER 165.A N LEU 162.A O no hydrogen 3.058 N/A SER 165.A OG LEU 162.A O no hydrogen 2.645 N/A GLU 167.A N SER 165.A OG no hydrogen 3.143 N/A GLY 168.A N SER 165.A O no hydrogen 2.930 N/A GLU 169.A N GLU 166.A O no hydrogen 3.258 N/A MET 171.A N GLU 167.A O no hydrogen 2.911 N/A VAL 172.A N GLY 168.A O no hydrogen 2.960 N/A LEU 173.A N GLU 169.A O no hydrogen 2.757 N/A GLU 174.A N GLU 169.A O no hydrogen 3.262 N/A ASN 175.A N LYS 170.A O no hydrogen 2.931 N/A ASN 176.A N VAL 172.A O no hydrogen 2.900 N/A PHE 177.A N MET 171.A O no hydrogen 2.973 N/A VAL 179.A N ASN 176.A O no hydrogen 3.059 N/A GLU 180.A N ASN 176.A O no hydrogen 2.893 N/A THR 181.A N PHE 177.A O no hydrogen 2.986 N/A VAL 182.A N PHE 177.A O no hydrogen 2.984 N/A LEU 183.A N PHE 178.A O no hydrogen 2.920 N/A SER 185.A N.A THR 181.A O no hydrogen 3.347 N/A SER 185.A N.B THR 181.A O no hydrogen 3.346 N/A SER 185.A OG.B THR 181.A O no hydrogen 3.189 N/A SER 185.A OG.B VAL 182.A O no hydrogen 2.703 N/A LYS 186.A N VAL 182.A O no hydrogen 2.995 N/A LYS 186.A N LEU 183.A O no hydrogen 3.254 N/A LYS 186.A NZ SER 185.A OG.A no hydrogen 2.830 N/A LYS 186.A NZ SER 185.A OG.B no hydrogen 3.036 N/A ILE 187.A N PRO 184.A O no hydrogen 3.406 N/A MET 188.A N ASP 287.A OD2 no hydrogen 2.781 N/A ARG 189.A N ASP 287.A OD1 no hydrogen 2.994 N/A ARG 189.A NE GLU 286.A O no hydrogen 2.789 N/A ARG 189.A NH1 GLU 195.A OE1 no hydrogen 2.807 N/A ARG 189.A NH2 GLU 195.A OE1 no hydrogen 3.318 N/A ARG 189.A NH2 GLU 195.A OE2 no hydrogen 3.211 N/A ARG 189.A NH2 GLU 286.A OE1 no hydrogen 2.810 N/A LYS 190.A N VAL 2.A O no hydrogen 2.988 N/A GLU 192.A N GLU 195.A OE1 no hydrogen 2.864 N/A GLU 194.A N GLU 194.A OE1 no hydrogen 2.716 N/A PHE 196.A N GLU 192.A O no hydrogen 3.052 N/A ALA 197.A N PRO 193.A O no hydrogen 2.963 N/A ALA 198.A N GLU 194.A O no hydrogen 3.163 N/A ALA 198.A N GLU 195.A O no hydrogen 3.178 N/A TYR 199.A N GLU 195.A O no hydrogen 3.429 N/A TYR 199.A OH GLU 286.A OE2 no hydrogen 2.585 N/A LEU 200.A N PHE 196.A O no hydrogen 2.886 N/A GLU 201.A N ALA 197.A O no hydrogen 2.935 N/A PHE 203.A N LEU 200.A O no hydrogen 2.800 N/A LYS 204.A N GLU 201.A O no hydrogen 3.270 N/A LYS 206.A NZ GLU 174.A O no hydrogen 3.027 N/A GLY 207.A N LEU 173.A O no hydrogen 2.908 N/A ARG 210.A N GLY 207.A O no hydrogen 3.001 N/A ARG 210.A NE PHE 203.A O no hydrogen 2.853 N/A ARG 210.A NH1 LEU 173.A O no hydrogen 3.054 N/A ARG 210.A NH1 GLU 174.A O no hydrogen 3.177 N/A ARG 210.A NH2 PHE 203.A O no hydrogen 3.085 N/A ARG 211.A N GLU 208.A O no hydrogen 2.855 N/A ARG 211.A NE GLU 208.A OE2 no hydrogen 2.873 N/A ARG 211.A NH1 GLU 169.A OE2 no hydrogen 3.080 N/A ARG 211.A NH2 GLU 208.A OE1 no hydrogen 3.018 N/A ARG 211.A NH2 GLU 208.A OE2 no hydrogen 3.566 N/A THR 213.A N ARG 210.A O no hydrogen 2.945 N/A THR 213.A OG1 ARG 210.A O no hydrogen 2.887 N/A LEU 214.A N ARG 211.A O no hydrogen 2.905 N/A SER 215.A N ARG 211.A O no hydrogen 2.856 N/A SER 215.A OG ARG 211.A O no hydrogen 3.341 N/A TRP 216.A N PRO 212.A O no hydrogen 3.163 N/A ARG 218.A NE ILE 163.A O no hydrogen 2.857 N/A ARG 218.A NH1 GLU 169.A OE2 no hydrogen 2.883 N/A ARG 218.A NH2 ILE 163.A O no hydrogen 3.089 N/A ARG 218.A NH2 SER 165.A O no hydrogen 2.838 N/A ARG 218.A NH2 GLU 169.A OE1 no hydrogen 2.821 N/A ARG 218.A NH2 GLU 169.A OE2 no hydrogen 3.390 N/A GLU 219.A N TRP 216.A O no hydrogen 2.943 N/A ILE 220.A N PRO 217.A O no hydrogen 3.036 N/A LEU 222.A N ILE 220.A O no hydrogen 2.845 N/A VAL 223.A N ILE 147.A O no hydrogen 3.024 N/A GLY 226.A N LEU 222.A O no hydrogen 2.821 N/A VAL 230.A N LYS 227.A O no hydrogen 3.128 N/A VAL 231.A N LYS 227.A O no hydrogen 3.075 N/A GLN 232.A N PRO 228.A O no hydrogen 2.990 N/A ILE 233.A N ASP 229.A O no hydrogen 3.033 N/A VAL 234.A N VAL 230.A O no hydrogen 2.892 N/A ARG 235.A N VAL 231.A O no hydrogen 2.891 N/A ASN 236.A N GLN 232.A O no hydrogen 2.892 N/A TYR 237.A N ILE 233.A O no hydrogen 3.017 N/A TYR 237.A OH VAL 143.A O no hydrogen 2.740 N/A ASN 238.A N VAL 234.A O no hydrogen 2.773 N/A ASN 238.A ND2 VAL 144.A O no hydrogen 2.871 N/A ALA 239.A N ARG 235.A O no hydrogen 3.036 N/A TYR 240.A N ASN 236.A O no hydrogen 3.171 N/A LEU 241.A N TYR 237.A O no hydrogen 2.862 N/A ARG 242.A N ASN 238.A O no hydrogen 2.988 N/A ARG 242.A NE ASN 238.A OD1 no hydrogen 2.766 N/A ARG 242.A NH2 ASP 145.A OD2 no hydrogen 3.068 N/A ALA 243.A N ALA 239.A O no hydrogen 3.275 N/A ALA 243.A N TYR 240.A O no hydrogen 3.144 N/A SER 244.A N LEU 241.A O no hydrogen 3.216 N/A SER 244.A OG LEU 241.A O no hydrogen 2.699 N/A ASP 245.A N ALA 243.A O no hydrogen 2.904 N/A LEU 247.A N SER 244.A O no hydrogen 3.137 N/A LYS 249.A N ASN 272.A O no hydrogen 2.804 N/A LYS 249.A NZ SER 244.A O no hydrogen 2.934 N/A LYS 249.A NZ SER 244.A OG no hydrogen 2.786 N/A LYS 249.A NZ LEU 247.A O no hydrogen 2.772 N/A LYS 249.A NZ PRO 271.A O no hydrogen 2.777 N/A LEU 250.A N ILE 137.A O no hydrogen 2.942 N/A PHE 251.A N GLU 274.A O no hydrogen 2.808 N/A ILE 252.A N HIS 139.A O no hydrogen 2.991 N/A GLU 253.A N VAL 276.A O no hydrogen 2.864 N/A SER 254.A N SER 260.A OG no hydrogen 3.121 N/A SER 254.A OG LEU 281.A O no hydrogen 2.701 N/A ASP 255.A N VAL 278.A O no hydrogen 2.851 N/A GLY 257.A N GLY 280.A O no hydrogen 2.843 N/A PHE 258.A N GLU 141.A OE2 no hydrogen 3.012 N/A PHE 259.A N GLU 141.A OE1 no hydrogen 2.970 N/A SER 260.A N GLU 141.A OE2 no hydrogen 2.931 N/A SER 260.A OG GLU 141.A OE2 no hydrogen 2.565 N/A ILE 263.A N PHE 259.A O no hydrogen 3.139 N/A ILE 263.A N SER 260.A O no hydrogen 3.172 N/A VAL 264.A N SER 260.A O no hydrogen 2.906 N/A ALA 267.A N ILE 263.A O no hydrogen 2.785 N/A LYS 268.A N VAL 264.A O no hydrogen 2.910 N/A LYS 269.A N GLY 266.A O no hydrogen 3.007 N/A PHE 270.A N ALA 267.A O no hydrogen 3.132 N/A ASN 272.A ND2 ASP 245.A O no hydrogen 3.044 N/A THR 273.A OG1 PHE 270.A O no hydrogen 2.831 N/A GLU 274.A N LYS 249.A O no hydrogen 2.911 N/A VAL 276.A N PHE 251.A O no hydrogen 3.127 N/A VAL 278.A N GLU 253.A O no hydrogen 2.968 N/A GLY 280.A N ASP 255.A O no hydrogen 2.897 N/A PHE 283.A N LYS 186.A O no hydrogen 3.141 N/A GLN 285.A N GLN 285.A OE1 no hydrogen 2.726 N/A GLU 286.A N PHE 283.A O no hydrogen 2.969 N/A ASP 287.A N LEU 284.A O no hydrogen 3.000 N/A ALA 288.A N LEU 284.A O no hydrogen 2.956 N/A MET 292.A N.A ALA 288.A O no hydrogen 2.971 N/A MET 292.A N.B ALA 288.A O no hydrogen 2.956 N/A GLY 293.A N PRO 289.A O no hydrogen 2.839 N/A LYS 294.A N ASP 290.A O no hydrogen 2.919 N/A TYR 295.A N GLU 291.A O no hydrogen 3.039 N/A ILE 296.A N MET 292.A O.A no hydrogen 2.942 N/A ILE 296.A N MET 292.A O.B no hydrogen 2.869 N/A LYS 297.A N GLY 293.A O no hydrogen 2.845 N/A SER 298.A N LYS 294.A O no hydrogen 2.992 N/A SER 298.A OG LYS 294.A O no hydrogen 3.047 N/A PHE 299.A N TYR 295.A O no hydrogen 3.121 N/A VAL 300.A N ILE 296.A O no hydrogen 2.849 N/A GLU 301.A N LYS 297.A O no hydrogen 2.842 N/A ARG 302.A N SER 298.A O no hydrogen 3.093 N/A ARG 302.A NH2 GLU 274.A OE1 no hydrogen 2.758 N/A VAL 303.A N PHE 299.A O no hydrogen 3.050 N/A LEU 304.A N VAL 300.A O no hydrogen 2.980 N/A LYS 305.A N GLU 301.A O no hydrogen 3.296 N/A