Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1o5k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N HIS 1.A O no hydrogen 2.724 N/A ARG 4.A NE ASP 203.A OD2 no hydrogen 3.016 N/A ARG 4.A NH2 GLY 202.A O no hydrogen 3.562 N/A ARG 4.A NH2 ASP 203.A OD2 no hydrogen 3.311 N/A GLY 5.A N ASP 203.A O no hydrogen 2.887 N/A GLY 7.A N VAL 205.A O no hydrogen 2.884 N/A THR 8.A N ALA 38.A O no hydrogen 2.986 N/A THR 8.A OG1 GLN 31.A OE1 no hydrogen 2.564 N/A THR 8.A OG1 SER 210.A OG no hydrogen 2.628 N/A ALA 9.A N SER 207.A O no hydrogen 2.825 N/A ILE 10.A N ILE 40.A O no hydrogen 2.966 N/A VAL 11.A N ASN 211.A OD1 no hydrogen 3.264 N/A THR 12.A OG1 GLY 46.A O no hydrogen 2.687 N/A LYS 15.A N GLU 18.A O no hydrogen 2.791 N/A ASN 16.A N GLU 268.A OE2 no hydrogen 2.738 N/A GLY 17.A N GLU 268.A OE1 no hydrogen 2.760 N/A GLU 18.A N LYS 15.A O no hydrogen 2.889 N/A ASP 20.A N PRO 13.A O no hydrogen 2.927 N/A SER 23.A N ASP 20.A OD1 no hydrogen 3.096 N/A SER 23.A OG ASP 20.A OD1 no hydrogen 3.500 N/A SER 23.A OG ASP 20.A OD2 no hydrogen 2.767 N/A SER 23.A OG PHE 264.A O no hydrogen 3.259 N/A TYR 24.A N ASP 20.A O no hydrogen 3.035 N/A TYR 24.A OH THR 63.A OG1 no hydrogen 2.625 N/A GLU 25.A N LEU 21.A O no hydrogen 2.883 N/A ARG 26.A N GLU 22.A O no hydrogen 3.314 N/A ARG 26.A NH2 PHE 264.A O no hydrogen 3.161 N/A LEU 27.A N SER 23.A O no hydrogen 3.139 N/A VAL 28.A N TYR 24.A O no hydrogen 2.856 N/A ARG 29.A N GLU 25.A O no hydrogen 2.946 N/A ARG 29.A NE GLU 25.A OE1 no hydrogen 3.006 N/A ARG 29.A NH2 GLU 25.A OE1 no hydrogen 2.586 N/A TYR 30.A N ARG 26.A O no hydrogen 3.108 N/A TYR 30.A OH VAL 212.A O no hydrogen 2.595 N/A GLN 31.A N LEU 27.A O no hydrogen 3.058 N/A GLN 31.A NE2 SER 210.A O no hydrogen 2.883 N/A LEU 32.A N VAL 28.A O no hydrogen 2.994 N/A GLU 33.A N ARG 29.A O no hydrogen 2.874 N/A ASN 34.A N GLN 31.A O no hydrogen 3.207 N/A ASN 34.A ND2 TYR 30.A O no hydrogen 2.800 N/A GLY 35.A N LEU 32.A O no hydrogen 3.397 N/A VAL 36.A N GLN 31.A O no hydrogen 3.386 N/A ASN 37.A N VAL 6.A O no hydrogen 2.744 N/A ASN 37.A ND2 ARG 4.A O no hydrogen 2.957 N/A LEU 39.A N PRO 72.A O no hydrogen 3.014 N/A ILE 40.A N THR 8.A O no hydrogen 2.855 N/A VAL 41.A N ILE 74.A O no hydrogen 2.837 N/A THR 45.A OG1 ASN 251.A OD1 no hydrogen 2.877 N/A GLY 46.A N GLY 43.A O no hydrogen 2.962 N/A GLU 47.A N THR 44.A O no hydrogen 3.000 N/A SER 48.A N GLY 43.A O no hydrogen 3.296 N/A SER 48.A OG GLY 43.A O no hydrogen 3.531 N/A THR 50.A N GLU 47.A O no hydrogen 2.931 N/A THR 50.A OG1 GLU 47.A O no hydrogen 3.201 N/A VAL 51.A N SER 48.A O no hydrogen 3.503 N/A ASN 52.A N GLU 55.A OE1 no hydrogen 2.935 N/A GLU 55.A N ASN 52.A OD1 no hydrogen 2.877 N/A ARG 56.A N ASN 52.A O no hydrogen 2.962 N/A ARG 56.A NH2 GLY 76.A O no hydrogen 2.793 N/A GLU 57.A N GLU 53.A O no hydrogen 3.137 N/A LYS 58.A N ASP 54.A O no hydrogen 3.166 N/A LEU 59.A N GLU 55.A O no hydrogen 2.912 N/A VAL 60.A N ARG 56.A O no hydrogen 2.800 N/A SER 61.A N GLU 57.A O no hydrogen 2.939 N/A SER 61.A OG GLU 57.A O no hydrogen 3.040 N/A ARG 62.A N LYS 58.A O no hydrogen 2.953 N/A ARG 62.A NH1 GLU 65.A OE2 no hydrogen 2.721 N/A ARG 62.A NH2 GLU 25.A OE2 no hydrogen 2.904 N/A THR 63.A N LEU 59.A O no hydrogen 3.028 N/A THR 63.A OG1 TYR 24.A OH no hydrogen 2.625 N/A THR 63.A OG1 LEU 59.A O no hydrogen 2.712 N/A LEU 64.A N VAL 60.A O no hydrogen 3.024 N/A GLU 65.A N SER 61.A O no hydrogen 2.992 N/A ILE 66.A N ARG 62.A O no hydrogen 3.011 N/A VAL 67.A N THR 63.A O no hydrogen 3.048 N/A ASP 68.A N LEU 64.A O no hydrogen 3.326 N/A LYS 70.A N VAL 67.A O no hydrogen 2.957 N/A VAL 73.A N ASN 98.A OD1 no hydrogen 2.705 N/A ILE 74.A N LEU 39.A O no hydrogen 2.804 N/A VAL 75.A N GLY 99.A O no hydrogen 3.053 N/A GLY 76.A N VAL 41.A O no hydrogen 2.813 N/A ALA 77.A N LEU 101.A O no hydrogen 2.939 N/A THR 79.A N THR 85.A OG1 no hydrogen 2.910 N/A THR 79.A OG1 SER 81.A O no hydrogen 3.323 N/A THR 79.A OG1 THR 85.A OG1 no hydrogen 3.281 N/A ASN 80.A ND2 TYR 106.A O no hydrogen 2.959 N/A SER 81.A N THR 79.A OG1 no hydrogen 3.260 N/A THR 82.A OG1 HIS 118.A ND1 no hydrogen 2.743 N/A LYS 84.A N SER 81.A OG no hydrogen 3.184 N/A LYS 84.A NZ GLU 53.A OE2 no hydrogen 2.940 N/A THR 85.A N SER 81.A O no hydrogen 2.923 N/A THR 85.A OG1 THR 79.A OG1 no hydrogen 3.281 N/A THR 85.A OG1 SER 81.A O no hydrogen 2.838 N/A LEU 86.A N THR 82.A O no hydrogen 3.035 N/A LYS 87.A N GLU 83.A O no hydrogen 3.223 N/A LEU 88.A N LYS 84.A O no hydrogen 3.069 N/A VAL 89.A N THR 85.A O no hydrogen 2.896 N/A LYS 90.A N LEU 86.A O no hydrogen 2.811 N/A GLN 91.A N LYS 87.A O no hydrogen 3.012 N/A GLN 91.A NE2 GLU 53.A OE2 no hydrogen 3.188 N/A ALA 92.A N LEU 88.A O no hydrogen 3.004 N/A GLU 93.A N VAL 89.A O no hydrogen 2.876 N/A LYS 94.A N LYS 90.A O no hydrogen 2.862 N/A LEU 95.A N GLN 91.A O no hydrogen 3.002 N/A GLY 96.A N GLU 93.A O no hydrogen 2.898 N/A ALA 97.A N ALA 92.A O no hydrogen 3.049 N/A ASN 98.A N VAL 73.A O no hydrogen 2.795 N/A VAL 100.A N GLY 129.A O no hydrogen 2.892 N/A LEU 101.A N VAL 75.A O no hydrogen 2.852 N/A VAL 102.A N VAL 131.A O no hydrogen 2.815 N/A THR 104.A N TYR 133.A O no hydrogen 3.026 N/A TYR 107.A N THR 139.A O no hydrogen 3.035 N/A ASN 108.A N TYR 106.A O no hydrogen 2.925 N/A ASN 108.A ND2 ASN 80.A O no hydrogen 2.892 N/A GLN 112.A NE2 ASN 142.A O no hydrogen 2.908 N/A GLY 114.A N THR 111.A OG1 no hydrogen 3.116 N/A LEU 115.A N THR 111.A O no hydrogen 2.891 N/A TYR 116.A N GLN 112.A O no hydrogen 3.017 N/A TYR 116.A OH ASP 154.A OD2 no hydrogen 2.683 N/A GLN 117.A N GLU 113.A O no hydrogen 2.847 N/A GLN 117.A NE2.A GLU 113.A OE2 no hydrogen 3.205 N/A GLN 117.A NE2.B GLU 113.A OE2 no hydrogen 2.825 N/A HIS 118.A N GLY 114.A O no hydrogen 2.846 N/A HIS 118.A ND1 THR 82.A OG1 no hydrogen 2.743 N/A TYR 119.A N LEU 115.A O no hydrogen 3.133 N/A TYR 119.A OH VAL 102.A O no hydrogen 2.722 N/A LYS 120.A N TYR 116.A O no hydrogen 2.858 N/A LYS 120.A NZ.A GLN 117.A OE1.A no hydrogen 2.369 N/A LYS 120.A NZ.B GLU 124.A OE1 no hydrogen 3.521 N/A LYS 120.A NZ.B GLU 124.A OE2 no hydrogen 2.545 N/A TYR 121.A N GLN 117.A O no hydrogen 2.912 N/A ILE 122.A N HIS 118.A O no hydrogen 3.219 N/A SER 123.A N TYR 119.A O no hydrogen 2.819 N/A GLU 124.A N LYS 120.A O no hydrogen 2.926 N/A ARG 125.A N ILE 122.A O no hydrogen 2.937 N/A ARG 125.A NH1 TYR 121.A O no hydrogen 3.063 N/A ARG 125.A NH1 GLU 124.A OE1 no hydrogen 3.338 N/A THR 126.A OG1 GLU 93.A OE2 no hydrogen 2.917 N/A ASP 127.A N GLU 93.A OE1 no hydrogen 3.170 N/A LEU 128.A N THR 126.A OG1 no hydrogen 2.991 N/A ILE 130.A N ASN 157.A O no hydrogen 2.921 N/A VAL 131.A N VAL 100.A O no hydrogen 2.755 N/A VAL 132.A N GLY 160.A O no hydrogen 2.995 N/A TYR 133.A N VAL 102.A O no hydrogen 3.142 N/A ASN 134.A ND2 ASN 142.A OD1 no hydrogen 2.904 N/A ASN 134.A ND2 GLU 162.A OE2 no hydrogen 2.765 N/A ARG 138.A N VAL 135.A O no hydrogen 2.954 N/A ARG 138.A NH1 ASN 251.A O no hydrogen 2.931 N/A THR 139.A N VAL 135.A O no hydrogen 3.085 N/A THR 139.A OG1 VAL 135.A O no hydrogen 3.219 N/A THR 139.A OG1 VAL 141.A O no hydrogen 2.879 N/A GLY 140.A N PRO 136.A O no hydrogen 2.988 N/A VAL 141.A N THR 139.A OG1 no hydrogen 3.112 N/A ASN 142.A ND2 GLN 169.A OE1 no hydrogen 3.009 N/A VAL 143.A N ASN 134.A OD1 no hydrogen 2.877 N/A LEU 144.A N GLN 112.A OE1 no hydrogen 3.041 N/A THR 147.A OG1 GLN 112.A OE1 no hydrogen 2.692 N/A ALA 148.A N LEU 144.A O no hydrogen 2.938 N/A ALA 149.A N PRO 145.A O no hydrogen 2.862 N/A ARG 150.A N GLU 146.A O no hydrogen 3.015 N/A ARG 150.A NH1 GLU 113.A OE1 no hydrogen 2.752 N/A ILE 151.A N THR 147.A O no hydrogen 3.043 N/A ALA 152.A N ALA 148.A O no hydrogen 2.910 N/A ALA 153.A N ALA 149.A O no hydrogen 2.885 N/A ASP 154.A N ARG 150.A O no hydrogen 2.909 N/A ASP 154.A N ILE 151.A O no hydrogen 3.275 N/A LEU 155.A N ILE 151.A O no hydrogen 2.883 N/A LYS 156.A NZ ALA 153.A O no hydrogen 2.813 N/A ASN 157.A ND2 THR 126.A O no hydrogen 2.805 N/A VAL 158.A N LEU 155.A O no hydrogen 2.999 N/A VAL 159.A N ILE 130.A O no hydrogen 2.915 N/A ILE 161.A N MET 185.A O no hydrogen 2.856 N/A ALA 163.A N ASN 134.A O no hydrogen 2.773 N/A ASN 164.A N GLU 162.A OE2 no hydrogen 2.873 N/A ASN 164.A ND2 ASN 142.A OD1 no hydrogen 3.053 N/A ASP 166.A N ASN 164.A OD1 no hydrogen 2.871 N/A ASP 168.A N ASP 166.A OD1 no hydrogen 2.979 N/A GLN 169.A NE2 VAL 143.A O no hydrogen 2.750 N/A GLN 169.A NE2 GLU 162.A OE1 no hydrogen 2.982 N/A ILE 170.A N ASP 166.A O no hydrogen 2.929 N/A ASP 171.A N ILE 167.A O no hydrogen 2.817 N/A ARG 172.A N ASP 168.A O no hydrogen 3.073 N/A THR 173.A N GLN 169.A O no hydrogen 2.843 N/A THR 173.A OG1 GLU 162.A OE1 no hydrogen 2.935 N/A THR 173.A OG1 GLN 169.A O no hydrogen 3.105 N/A VAL 174.A N ILE 170.A O no hydrogen 3.096 N/A SER 175.A N ASP 171.A O no hydrogen 3.029 N/A LEU 176.A N ARG 172.A O no hydrogen 2.762 N/A THR 177.A N THR 173.A O no hydrogen 3.105 N/A THR 177.A OG1 THR 173.A O no hydrogen 2.698 N/A THR 177.A OG1 VAL 174.A O no hydrogen 3.545 N/A LYS 178.A N VAL 174.A O no hydrogen 3.283 N/A LYS 178.A NZ PHE 184.A O no hydrogen 2.629 N/A LYS 178.A NZ ASP 203.A OD1 no hydrogen 2.693 N/A GLN 179.A N SER 175.A O no hydrogen 3.064 N/A GLN 179.A NE2 SER 175.A O no hydrogen 3.609 N/A GLN 179.A NE2 SER 175.A OG no hydrogen 3.021 N/A ALA 180.A N LEU 176.A O no hydrogen 3.076 N/A ARG 181.A N THR 177.A O no hydrogen 2.807 N/A ARG 181.A NE ASP 183.A OD2 no hydrogen 3.107 N/A ARG 181.A NH1 ALA 152.A O no hydrogen 2.901 N/A ARG 181.A NH1 LEU 155.A O no hydrogen 3.048 N/A ARG 181.A NH1 VAL 158.A O no hydrogen 2.878 N/A ARG 181.A NH2 VAL 158.A O no hydrogen 2.757 N/A PHE 184.A N ARG 181.A O no hydrogen 2.959 N/A MET 185.A N VAL 159.A O no hydrogen 2.999 N/A VAL 186.A N ASP 203.A OD1 no hydrogen 2.948 N/A TRP 187.A N ILE 161.A O no hydrogen 2.927 N/A TRP 187.A NE1 PHE 3.A O no hydrogen 2.982 N/A SER 188.A N GLY 204.A O no hydrogen 2.823 N/A SER 188.A OG ASN 190.A O no hydrogen 2.669 N/A GLY 189.A N GLU 162.A O no hydrogen 2.922 N/A ASN 190.A N SER 188.A OG no hydrogen 3.018 N/A ASN 190.A ND2 ALA 163.A O no hydrogen 2.968 N/A ARG 193.A N ASN 190.A O no hydrogen 2.973 N/A ARG 193.A NE PRO 165.A O no hydrogen 2.727 N/A THR 194.A N ASP 191.A O no hydrogen 3.204 N/A THR 194.A OG1 ASN 190.A O no hydrogen 3.406 N/A THR 194.A OG1 ASP 191.A O no hydrogen 3.038 N/A LEU 197.A N ARG 193.A O no hydrogen 2.826 N/A LEU 198.A N THR 194.A O no hydrogen 2.761 N/A CYS 199.A N PHE 195.A O no hydrogen 3.017 N/A CYS 199.A SG PHE 195.A O no hydrogen 3.418 N/A ALA 200.A N TYR 196.A O no hydrogen 2.886 N/A GLY 201.A N LEU 198.A O no hydrogen 2.886 N/A GLY 202.A N LEU 197.A O no hydrogen 2.973 N/A ASP 203.A N VAL 186.A O no hydrogen 2.753 N/A VAL 205.A N GLY 5.A O no hydrogen 2.895 N/A ILE 206.A N SER 188.A O no hydrogen 2.862 N/A SER 207.A N GLY 7.A O no hydrogen 2.777 N/A SER 207.A OG ASP 191.A OD1 no hydrogen 2.506 N/A SER 207.A OG ASP 191.A OD2 no hydrogen 3.523 N/A SER 207.A OG SER 210.A OG no hydrogen 3.264 N/A VAL 208.A N ASP 191.A OD2 no hydrogen 3.011 N/A VAL 209.A N ASP 191.A OD2 no hydrogen 2.893 N/A SER 210.A N SER 207.A OG no hydrogen 2.900 N/A SER 210.A OG THR 8.A OG1 no hydrogen 2.628 N/A SER 210.A OG SER 207.A O no hydrogen 3.531 N/A ASN 211.A N VAL 208.A O no hydrogen 2.942 N/A ASN 211.A ND2 ALA 9.A O no hydrogen 2.880 N/A ASN 211.A ND2 VAL 208.A O no hydrogen 2.954 N/A VAL 212.A N VAL 209.A O no hydrogen 3.035 N/A ALA 213.A N VAL 209.A O no hydrogen 2.898 N/A MET 217.A N ALA 213.A O no hydrogen 3.142 N/A VAL 218.A N PRO 214.A O no hydrogen 2.947 N/A GLU 219.A N LYS 215.A O no hydrogen 2.885 N/A LEU 220.A N GLN 216.A O no hydrogen 2.977 N/A CYS 221.A N MET 217.A O no hydrogen 3.340 N/A CYS 221.A SG MET 217.A O no hydrogen 3.767 N/A ALA 222.A N VAL 218.A O no hydrogen 2.896 N/A GLU 223.A N GLU 219.A O no hydrogen 2.932 N/A TYR 224.A N LEU 220.A O no hydrogen 3.433 N/A PHE 225.A N CYS 221.A O no hydrogen 2.854 N/A SER 226.A N.A ALA 222.A O no hydrogen 2.932 N/A SER 226.A N.B ALA 222.A O no hydrogen 2.935 N/A SER 226.A OG.A ALA 222.A O no hydrogen 2.887 N/A SER 226.A OG.B ALA 222.A O no hydrogen 3.503 N/A SER 226.A OG.B GLU 223.A O no hydrogen 2.852 N/A GLY 227.A N TYR 224.A O no hydrogen 2.892 N/A ASN 228.A N GLU 223.A O no hydrogen 2.862 N/A ASN 228.A ND2 GLU 223.A OE1 no hydrogen 2.997 N/A SER 232.A N ASN 228.A O no hydrogen 2.949 N/A SER 232.A OG LEU 220.A O no hydrogen 2.747 N/A ARG 233.A N LEU 229.A O no hydrogen 2.873 N/A GLU 234.A N GLU 230.A O no hydrogen 2.994 N/A VAL 235.A N LYS 231.A O no hydrogen 3.066 N/A HIS 236.A N SER 232.A O no hydrogen 3.013 N/A ARG 237.A N ARG 233.A O no hydrogen 2.806 N/A LYS 238.A N GLU 234.A O no hydrogen 2.917 N/A LEU 239.A N VAL 235.A O no hydrogen 3.043 N/A ARG 240.A N ARG 237.A O no hydrogen 3.284 N/A MET 243.A N LEU 239.A O no hydrogen 2.831 N/A LYS 244.A N ARG 240.A O no hydrogen 2.895 N/A LYS 244.A NZ ASP 192.A OD2 no hydrogen 2.655 N/A ALA 245.A N PRO 241.A O no hydrogen 2.885 N/A LEU 246.A N LEU 242.A O no hydrogen 3.089 N/A PHE 247.A N LYS 244.A O no hydrogen 3.036 N/A VAL 248.A N ALA 245.A O no hydrogen 3.378 N/A ILE 253.A N THR 250.A O no hydrogen 2.816 N/A LYS 256.A N PRO 252.A O no hydrogen 3.074 N/A LYS 256.A NZ THR 12.A O no hydrogen 2.717 N/A LYS 256.A NZ GLU 47.A OE1 no hydrogen 2.672 N/A LYS 256.A NZ GLU 268.A O no hydrogen 2.958 N/A ALA 257.A N ILE 253.A O no hydrogen 3.262 N/A ALA 258.A N PRO 254.A O no hydrogen 2.887 N/A LEU 259.A N VAL 255.A O no hydrogen 2.823 N/A ASN 260.A N LYS 256.A O no hydrogen 2.957 N/A ASN 260.A ND2 ILE 265.A O no hydrogen 2.780 N/A LEU 261.A N ALA 257.A O no hydrogen 2.965 N/A MET 262.A N ALA 258.A O no hydrogen 3.000 N/A GLY 263.A N ASN 260.A O no hydrogen 2.906 N/A PHE 264.A N LEU 259.A O no hydrogen 2.925 N/A ARG 270.A N GLU 47.A OE2 no hydrogen 3.063 N/A ARG 270.A NE GLY 17.A O no hydrogen 3.203 N/A ARG 270.A NH1 THR 50.A O no hydrogen 2.760 N/A ARG 270.A NH1 GLU 55.A OE1 no hydrogen 2.862 N/A ARG 270.A NH1 GLU 55.A OE2 no hydrogen 3.497 N/A ARG 270.A NH2 GLY 17.A O no hydrogen 2.737 N/A ARG 270.A NH2 GLU 55.A OE2 no hydrogen 2.851 N/A LEU 273.A N ARG 270.A O no hydrogen 2.844 N/A SER 277.A N GLU 249.A OE2 no hydrogen 2.888 N/A SER 277.A OG GLU 249.A OE2 no hydrogen 3.308 N/A SER 277.A OG THR 280.A OG1 no hydrogen 3.165 N/A THR 280.A N SER 277.A OG no hydrogen 3.135 N/A THR 280.A OG1 GLU 249.A OE2 no hydrogen 2.654 N/A THR 280.A OG1 SER 277.A OG no hydrogen 3.165 N/A VAL 281.A N SER 277.A O no hydrogen 3.049 N/A GLU 282.A N GLU 278.A O no hydrogen 2.924 N/A LEU 283.A N LYS 279.A O no hydrogen 3.076 N/A LEU 284.A N THR 280.A O no hydrogen 2.838 N/A ARG 285.A N VAL 281.A O no hydrogen 2.830 N/A ASN 286.A N GLU 282.A O no hydrogen 3.178 N/A VAL 287.A N LEU 283.A O no hydrogen 2.918 N/A LEU 288.A N LEU 284.A O no hydrogen 2.688 N/A LYS 289.A N ARG 285.A O no hydrogen 2.998 N/A LYS 289.A NZ ASN 286.A OD1 no hydrogen 3.127 N/A GLU 290.A N ASN 286.A O no hydrogen 2.874 N/A SER 291.A N VAL 287.A O no hydrogen 2.977 N/A SER 291.A OG VAL 287.A O no hydrogen 2.629 N/A GLY 292.A N LYS 289.A O no hydrogen 3.116 N/A LEU 293.A N LEU 288.A O no hydrogen 2.908 N/A