Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2psh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ PRO 175.A O no hydrogen 3.123 N/A LYS 2.A NZ SER 176.A O no hydrogen 2.948 N/A LYS 2.A NZ ILE 178.A O no hydrogen 2.731 N/A GLU 7.A N ASP 5.A OD1 no hydrogen 2.995 N/A GLN 8.A N ASP 5.A O no hydrogen 3.150 N/A GLN 8.A NE2 HIS 60.A NE2 no hydrogen 3.334 N/A GLN 8.A NE2 GLU 186.A OE2 no hydrogen 2.883 N/A ARG 9.A NE GLU 183.A OE1 no hydrogen 3.371 N/A ARG 9.A NH1 GLU 185.A OE2 no hydrogen 3.485 N/A ARG 9.A NH2 GLU 183.A OE1 no hydrogen 3.187 N/A ARG 9.A NH2 GLU 185.A OE1 no hydrogen 2.856 N/A ARG 9.A NH2 GLU 185.A OE2 no hydrogen 3.346 N/A LYS 10.A NZ GLU 7.A OE1 no hydrogen 2.565 N/A ARG 11.A N GLN 8.A O no hydrogen 3.181 N/A ARG 11.A NE GLN 8.A OE1 no hydrogen 3.084 N/A ARG 11.A NH1 ASP 281.A OD1 no hydrogen 3.326 N/A ARG 11.A NH1 ASP 281.A OD2 no hydrogen 3.068 N/A ARG 11.A NH2 ASP 281.A OD2 no hydrogen 3.223 N/A MET 12.A N ARG 9.A O no hydrogen 3.302 N/A THR 14.A N GLN 17.A OE1 no hydrogen 2.906 N/A THR 14.A OG1 GLN 17.A OE1 no hydrogen 3.428 N/A GLN 17.A N THR 14.A OG1 no hydrogen 3.184 N/A TRP 18.A N THR 14.A O no hydrogen 2.981 N/A TRP 18.A NE1 SER 55.A OG no hydrogen 2.935 N/A TRP 19.A N GLY 15.A O no hydrogen 2.811 N/A ALA 20.A N PRO 16.A O no hydrogen 3.087 N/A ARG 21.A N TRP 18.A O no hydrogen 2.916 N/A ARG 21.A NH2 TYR 35.A OH no hydrogen 3.257 N/A CYS 22.A N TRP 19.A O no hydrogen 3.378 N/A CYS 22.A SG TRP 18.A O no hydrogen 3.491 N/A CYS 22.A SG ASN 33.A OD1 no hydrogen 3.647 N/A ALA 23.A N TYR 34.A O no hydrogen 2.833 N/A MET 25.A N ILE 32.A O no hydrogen 3.039 N/A VAL 27.A N SER 30.A O no hydrogen 2.890 N/A SER 30.A N VAL 27.A O no hydrogen 2.831 N/A SER 30.A OG LYS 84.A O no hydrogen 2.823 N/A ILE 32.A N MET 25.A O no hydrogen 2.932 N/A ASN 33.A N SER 82.A OG no hydrogen 2.753 N/A TYR 34.A N ALA 23.A O no hydrogen 2.998 N/A TYR 35.A N ILE 73.A O no hydrogen 2.828 N/A TYR 35.A OH GLU 66.A OE2 no hydrogen 2.493 N/A SER 37.A N CYS 71.A O no hydrogen 2.899 N/A GLU 38.A N ASP 36.A OD1 no hydrogen 2.873 N/A LYS 39.A N SER 37.A O no hydrogen 2.715 N/A GLU 42.A N GLU 42.A OE1 no hydrogen 2.889 N/A ASN 43.A N HIS 40.A O no hydrogen 3.352 N/A VAL 45.A N ARG 70.A O no hydrogen 2.772 N/A ILE 46.A N ILE 113.A O no hydrogen 2.732 N/A PHE 47.A N ILE 72.A O no hydrogen 3.006 N/A LEU 48.A N VAL 115.A O no hydrogen 2.724 N/A HIS 49.A ND1 GLY 50.A O no hydrogen 2.825 N/A ASN 51.A N ASP 118.A OD2 no hydrogen 2.735 N/A ASN 51.A ND2 THR 204.A O no hydrogen 3.316 N/A THR 53.A OG1 GLY 50.A O no hydrogen 3.313 N/A SER 55.A N ASP 75.A OD1 no hydrogen 2.837 N/A SER 55.A OG ASP 75.A OD1 no hydrogen 2.599 N/A TYR 56.A N SER 54.A OG no hydrogen 3.234 N/A TYR 56.A OH ILE 13.A O no hydrogen 2.634 N/A LEU 57.A N SER 54.A O no hydrogen 3.085 N/A TRP 58.A N SER 55.A O no hydrogen 3.057 N/A ARG 59.A N TYR 56.A O no hydrogen 3.041 N/A ARG 59.A NH1 TYR 56.A O no hydrogen 3.055 N/A ARG 59.A NH1 GLU 277.A OE2 no hydrogen 2.763 N/A ARG 59.A NH2 GLU 186.A OE2 no hydrogen 2.929 N/A ARG 59.A NH2 GLU 277.A OE1 no hydrogen 2.988 N/A ARG 59.A NH2 GLU 277.A OE2 no hydrogen 3.368 N/A VAL 61.A N TRP 58.A O no hydrogen 3.002 N/A VAL 62.A N TRP 58.A O no hydrogen 3.076 N/A HIS 64.A N VAL 61.A O no hydrogen 3.217 N/A HIS 64.A NE2 ASP 281.A OD1 no hydrogen 2.811 N/A ILE 65.A N VAL 62.A O no hydrogen 2.925 N/A GLU 66.A N VAL 62.A O no hydrogen 3.106 N/A VAL 68.A N ILE 65.A O no hydrogen 2.825 N/A ARG 70.A N HIS 40.A O no hydrogen 3.113 N/A ARG 70.A NE ASP 36.A OD1 no hydrogen 2.968 N/A ARG 70.A NE ASP 36.A OD2 no hydrogen 3.352 N/A ARG 70.A NH1 LEU 106.A O no hydrogen 2.886 N/A ARG 70.A NH2 ASP 36.A OD2 no hydrogen 2.879 N/A ARG 70.A NH2 LEU 106.A O no hydrogen 3.188 N/A CYS 71.A N SER 37.A OG no hydrogen 2.760 N/A CYS 71.A SG ALA 69.A O no hydrogen 3.575 N/A ILE 72.A N VAL 45.A O no hydrogen 2.921 N/A ILE 73.A N TYR 35.A O no hydrogen 2.742 N/A ASP 75.A N ASN 33.A O no hydrogen 2.793 N/A LEU 76.A N HIS 49.A NE2 no hydrogen 3.093 N/A GLY 78.A N GLY 83.A O no hydrogen 2.840 N/A MET 79.A N LEU 76.A O no hydrogen 2.882 N/A LYS 81.A N ASP 75.A OD2 no hydrogen 2.835 N/A SER 82.A N MET 79.A O no hydrogen 3.147 N/A SER 82.A OG ASN 33.A O no hydrogen 3.500 N/A SER 82.A OG ASP 75.A O no hydrogen 2.660 N/A GLY 83.A N PHE 31.A O no hydrogen 2.900 N/A SER 85.A N TYR 90.A OH no hydrogen 2.838 N/A SER 85.A OG ASN 87.A OD1 no hydrogen 2.890 N/A SER 85.A OG SER 89.A O no hydrogen 2.862 N/A GLY 86.A N TYR 98.A OH no hydrogen 2.871 N/A GLY 88.A N SER 85.A O no hydrogen 2.933 N/A SER 89.A N ASN 87.A OD1 no hydrogen 2.976 N/A SER 89.A OG ASP 94.A OD2 no hydrogen 2.726 N/A ARG 91.A N ASP 94.A OD2 no hydrogen 2.936 N/A ARG 91.A NE GLU 210.A OE2 no hydrogen 2.997 N/A ARG 91.A NH1 ASP 220.A OD2 no hydrogen 2.884 N/A ARG 91.A NH2 GLU 210.A OE2 no hydrogen 3.023 N/A ARG 91.A NH2 ASP 220.A OD1 no hydrogen 2.894 N/A ARG 91.A NH2 ASP 220.A OD2 no hydrogen 3.479 N/A LEU 92.A N GLU 210.A OE1 no hydrogen 2.678 N/A HIS 95.A N ARG 91.A O no hydrogen 3.128 N/A TYR 96.A N LEU 92.A O no hydrogen 2.955 N/A TYR 96.A OH GLU 130.A OE1 no hydrogen 2.703 N/A LYS 97.A N LEU 93.A O no hydrogen 2.973 N/A TYR 98.A N ASP 94.A O no hydrogen 3.320 N/A TYR 98.A OH ASP 29.A OD1 no hydrogen 2.483 N/A LEU 99.A N HIS 95.A O no hydrogen 2.933 N/A THR 100.A N TYR 96.A O no hydrogen 2.886 N/A THR 100.A OG1 TYR 96.A O no hydrogen 2.816 N/A THR 100.A OG1 LYS 97.A O no hydrogen 3.137 N/A ALA 101.A N LYS 97.A O no hydrogen 3.251 N/A TRP 102.A N TYR 98.A O no hydrogen 2.966 N/A PHE 103.A N LEU 99.A O no hydrogen 2.960 N/A GLU 104.A N THR 100.A O no hydrogen 3.271 N/A LEU 105.A N TRP 102.A O no hydrogen 2.910 N/A LEU 106.A N PHE 103.A O no hydrogen 3.158 N/A LYS 110.A NZ ASP 133.A O no hydrogen 2.594 N/A LYS 111.A NZ ASP 133.A O no hydrogen 2.715 N/A ILE 112.A N ARG 134.A O no hydrogen 2.809 N/A ILE 113.A N ALA 44.A O no hydrogen 2.872 N/A PHE 114.A N ALA 137.A O no hydrogen 3.104 N/A VAL 115.A N ILE 46.A O no hydrogen 2.911 N/A GLY 116.A N VAL 139.A O no hydrogen 2.964 N/A HIS 117.A N LEU 48.A O no hydrogen 3.137 N/A ASP 118.A N MET 141.A O no hydrogen 3.437 N/A ASP 118.A N GLU 142.A O no hydrogen 3.080 N/A ALA 121.A N ASP 118.A O no hydrogen 2.958 N/A LEU 123.A N TRP 119.A O no hydrogen 3.067 N/A ALA 124.A N GLY 120.A O no hydrogen 3.111 N/A PHE 125.A N ALA 121.A O no hydrogen 2.772 N/A HIS 126.A N ALA 122.A O no hydrogen 2.847 N/A TYR 127.A N LEU 123.A O no hydrogen 2.931 N/A ALA 128.A N ALA 124.A O no hydrogen 2.908 N/A TYR 129.A N PHE 125.A O no hydrogen 3.028 N/A GLU 130.A N HIS 126.A O no hydrogen 3.147 N/A GLU 130.A N TYR 127.A O no hydrogen 3.129 N/A HIS 131.A N ALA 128.A O no hydrogen 3.144 N/A HIS 131.A ND1 TYR 127.A O no hydrogen 2.815 N/A GLN 132.A NE2 TYR 129.A O no hydrogen 2.944 N/A ARG 134.A N HIS 131.A O no hydrogen 2.966 N/A ARG 134.A NE LYS 110.A O no hydrogen 2.678 N/A ARG 134.A NH2 PRO 109.A O no hydrogen 2.927 N/A LYS 136.A N ILE 112.A O no hydrogen 2.826 N/A LYS 136.A NZ ASN 43.A OD1 no hydrogen 2.705 N/A LYS 136.A NZ GLU 298.A OE1 no hydrogen 2.611 N/A ILE 138.A N PRO 239.A O no hydrogen 3.139 N/A VAL 139.A N PHE 114.A O no hydrogen 2.832 N/A HIS 140.A N LEU 241.A O no hydrogen 2.963 N/A MET 141.A N GLY 116.A O no hydrogen 3.239 N/A VAL 147.A N ASP 146.A OD1 no hydrogen 2.759 N/A ILE 148.A N PRO 212.A O no hydrogen 2.840 N/A SER 156.A N LEU 153.A O no hydrogen 3.007 N/A SER 156.A OG LEU 153.A O no hydrogen 2.553 N/A GLU 158.A N SER 156.A OG no hydrogen 3.221 N/A GLY 159.A N SER 156.A O no hydrogen 3.084 N/A LYS 161.A N GLU 157.A O no hydrogen 3.195 N/A LYS 161.A NZ GLU 165.A OE1 no hydrogen 3.015 N/A MET 162.A N GLU 158.A O no hydrogen 2.510 N/A VAL 163.A N GLY 159.A O no hydrogen 2.923 N/A LEU 164.A N GLU 160.A O no hydrogen 2.741 N/A GLU 165.A N LYS 161.A O no hydrogen 3.266 N/A ASN 166.A N LYS 161.A O no hydrogen 2.977 N/A ASN 167.A N VAL 163.A O no hydrogen 2.852 N/A ASN 167.A ND2 GLU 171.A OE2 no hydrogen 2.924 N/A PHE 168.A N MET 162.A O no hydrogen 2.963 N/A VAL 170.A N ASN 167.A O no hydrogen 3.152 N/A GLU 171.A N ASN 167.A O no hydrogen 2.857 N/A THR 172.A N PHE 168.A O no hydrogen 2.907 N/A VAL 173.A N PHE 168.A O no hydrogen 2.889 N/A LEU 174.A N PHE 169.A O no hydrogen 2.962 N/A SER 176.A OG VAL 173.A O no hydrogen 2.672 N/A LYS 177.A N VAL 173.A O no hydrogen 3.163 N/A LYS 177.A N LEU 174.A O no hydrogen 2.996 N/A LYS 177.A NZ SER 176.A OG no hydrogen 2.892 N/A ILE 178.A N PRO 175.A O no hydrogen 3.373 N/A MET 179.A N ASP 278.A OD2 no hydrogen 2.894 N/A ARG 180.A N ASP 278.A OD1 no hydrogen 2.985 N/A ARG 180.A NH1 GLU 186.A OE2 no hydrogen 3.552 N/A ARG 180.A NH2 GLU 186.A OE1 no hydrogen 2.495 N/A ARG 180.A NH2 GLU 186.A OE2 no hydrogen 3.438 N/A LYS 181.A N VAL 3.A O no hydrogen 3.128 N/A GLU 183.A N GLU 186.A OE1 no hydrogen 2.953 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.635 N/A GLU 186.A N GLU 183.A O no hydrogen 3.014 N/A PHE 187.A N GLU 183.A O no hydrogen 3.114 N/A ALA 188.A N PRO 184.A O no hydrogen 3.075 N/A ALA 189.A N GLU 185.A O no hydrogen 3.165 N/A ALA 189.A N GLU 186.A O no hydrogen 3.178 N/A TYR 190.A OH GLU 277.A OE2 no hydrogen 2.548 N/A LEU 191.A N PHE 187.A O no hydrogen 2.938 N/A GLU 192.A N ALA 188.A O no hydrogen 2.881 N/A PHE 194.A N LEU 191.A O no hydrogen 2.802 N/A LYS 195.A N GLU 192.A O no hydrogen 3.271 N/A GLY 198.A N LEU 164.A O no hydrogen 2.891 N/A ARG 201.A N GLY 198.A O no hydrogen 2.982 N/A ARG 201.A NE PHE 194.A O no hydrogen 3.052 N/A ARG 201.A NH1 LEU 164.A O no hydrogen 3.033 N/A ARG 201.A NH1 GLU 165.A O no hydrogen 3.050 N/A ARG 201.A NH2 PHE 194.A O no hydrogen 3.358 N/A ARG 201.A NH2 LYS 195.A O no hydrogen 3.345 N/A ARG 202.A N GLU 199.A O no hydrogen 2.922 N/A ARG 202.A NE GLU 199.A OE2 no hydrogen 2.814 N/A ARG 202.A NH1 GLU 160.A OE2 no hydrogen 3.149 N/A ARG 202.A NH2 GLU 160.A OE1 no hydrogen 2.961 N/A ARG 202.A NH2 GLU 199.A OE1 no hydrogen 3.265 N/A THR 204.A N ARG 201.A O no hydrogen 3.002 N/A THR 204.A OG1 ARG 201.A O no hydrogen 2.774 N/A LEU 205.A N ARG 202.A O no hydrogen 2.900 N/A SER 206.A N ARG 202.A O no hydrogen 2.858 N/A SER 206.A OG ARG 202.A O no hydrogen 3.221 N/A TRP 207.A N PRO 203.A O no hydrogen 3.085 N/A ARG 209.A N LEU 205.A O no hydrogen 3.390 N/A ARG 209.A NE ILE 154.A O no hydrogen 2.985 N/A ARG 209.A NH1 GLU 160.A OE2 no hydrogen 3.285 N/A ARG 209.A NH2 ILE 154.A O no hydrogen 3.059 N/A GLU 210.A N SER 206.A O no hydrogen 3.260 N/A GLU 210.A N TRP 207.A O no hydrogen 2.939 N/A ILE 211.A N PRO 208.A O no hydrogen 3.133 N/A LEU 213.A N ILE 211.A O no hydrogen 2.888 N/A VAL 214.A N ILE 148.A O no hydrogen 2.987 N/A GLY 217.A N LEU 213.A O no hydrogen 2.769 N/A LYS 218.A NZ GLU 210.A OE2 no hydrogen 3.230 N/A VAL 222.A N LYS 218.A O no hydrogen 2.969 N/A GLN 223.A N PRO 219.A O no hydrogen 3.036 N/A GLN 223.A NE2 ASN 227.A OD1 no hydrogen 2.949 N/A ILE 224.A N ASP 220.A O no hydrogen 3.071 N/A VAL 225.A N VAL 221.A O no hydrogen 2.959 N/A ARG 226.A N VAL 222.A O no hydrogen 2.932 N/A ASN 227.A N GLN 223.A O no hydrogen 2.900 N/A TYR 228.A N ILE 224.A O no hydrogen 3.047 N/A TYR 228.A OH VAL 144.A O no hydrogen 2.675 N/A ASN 229.A N VAL 225.A O no hydrogen 2.902 N/A ASN 229.A ND2 VAL 145.A O no hydrogen 2.796 N/A ALA 230.A N ARG 226.A O no hydrogen 3.057 N/A TYR 231.A N ASN 227.A O no hydrogen 3.186 N/A LEU 232.A N TYR 228.A O no hydrogen 2.828 N/A ARG 233.A N ASN 229.A O no hydrogen 2.904 N/A ARG 233.A NE ASN 229.A O no hydrogen 3.574 N/A ALA 234.A N TYR 231.A O no hydrogen 3.036 N/A SER 235.A N LEU 232.A O no hydrogen 3.183 N/A SER 235.A OG LEU 232.A O no hydrogen 2.598 N/A LEU 238.A N SER 235.A O no hydrogen 3.050 N/A LYS 240.A N ASN 263.A O no hydrogen 2.778 N/A LYS 240.A NZ SER 235.A O no hydrogen 2.925 N/A LYS 240.A NZ SER 235.A OG no hydrogen 2.799 N/A LYS 240.A NZ LEU 238.A O no hydrogen 2.651 N/A LYS 240.A NZ PRO 262.A O no hydrogen 2.843 N/A LEU 241.A N ILE 138.A O no hydrogen 3.024 N/A PHE 242.A N ALA 265.A O no hydrogen 2.890 N/A ILE 243.A N HIS 140.A O no hydrogen 3.017 N/A GLU 244.A N VAL 267.A O no hydrogen 2.829 N/A SER 245.A OG LEU 272.A O no hydrogen 2.790 N/A ASP 246.A N VAL 269.A O no hydrogen 2.839 N/A GLY 248.A N GLY 271.A O no hydrogen 2.936 N/A PHE 249.A N SER 251.A OG no hydrogen 3.095 N/A SER 251.A OG GLU 142.A OE1 no hydrogen 3.462 N/A SER 251.A OG GLU 142.A OE2 no hydrogen 2.467 N/A SER 251.A OG PHE 249.A O no hydrogen 3.022 N/A VAL 255.A N SER 251.A O no hydrogen 3.252 N/A GLU 256.A N ASN 252.A O no hydrogen 3.084 N/A GLY 257.A N ALA 253.A O no hydrogen 3.189 N/A ALA 258.A N ILE 254.A O no hydrogen 2.871 N/A LYS 259.A N VAL 255.A O no hydrogen 3.076 N/A LYS 260.A N GLY 257.A O no hydrogen 3.027 N/A LYS 260.A NZ ASP 146.A OD2 no hydrogen 3.565 N/A PHE 261.A N ALA 258.A O no hydrogen 3.213 N/A ASN 263.A ND2 ASP 236.A O no hydrogen 2.920 N/A THR 264.A OG1 PHE 261.A O no hydrogen 2.812 N/A ALA 265.A N LYS 240.A O no hydrogen 2.874 N/A VAL 267.A N PHE 242.A O no hydrogen 3.083 N/A VAL 269.A N GLU 244.A O no hydrogen 2.899 N/A GLY 271.A N ASP 246.A O no hydrogen 3.085 N/A HIS 273.A N LYS 177.A O no hydrogen 3.293 N/A HIS 273.A ND1 GLU 142.A OE1 no hydrogen 2.852 N/A PHE 274.A N LYS 177.A O no hydrogen 3.293 N/A GLN 276.A N GLN 276.A OE1 no hydrogen 2.793 N/A GLU 277.A N PHE 274.A O no hydrogen 2.924 N/A ASP 278.A N LEU 275.A O no hydrogen 2.982 N/A ALA 279.A N LEU 275.A O no hydrogen 2.861 N/A GLU 282.A N GLU 282.A OE1 no hydrogen 2.735 N/A MET 283.A N ALA 279.A O no hydrogen 2.922 N/A GLY 284.A N PRO 280.A O no hydrogen 2.791 N/A LYS 285.A N ASP 281.A O no hydrogen 2.975 N/A TYR 286.A N GLU 282.A O no hydrogen 3.107 N/A ILE 287.A N MET 283.A O no hydrogen 2.901 N/A LYS 288.A N GLY 284.A O no hydrogen 2.863 N/A SER 289.A N LYS 285.A O no hydrogen 3.056 N/A SER 289.A OG LYS 285.A O no hydrogen 3.353 N/A SER 289.A OG TYR 286.A O no hydrogen 2.933 N/A PHE 290.A N TYR 286.A O no hydrogen 3.048 N/A VAL 291.A N ILE 287.A O no hydrogen 2.943 N/A GLU 292.A N LYS 288.A O no hydrogen 2.908 N/A ARG 293.A N SER 289.A O no hydrogen 2.902 N/A VAL 294.A N PHE 290.A O no hydrogen 2.857 N/A LEU 295.A N VAL 291.A O no hydrogen 2.969 N/A LYS 296.A N GLU 292.A O no hydrogen 3.032 N/A ASN 297.A N ARG 293.A O no hydrogen 2.958 N/A GLU 298.A N VAL 294.A O no hydrogen 3.243 N/A