Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jyo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ALA 32.A O no hydrogen 2.893 N/A LEU 5.A N ASN 63.A OD1 no hydrogen 2.842 N/A LEU 6.A N VAL 34.A O no hydrogen 2.864 N/A GLY 7.A N GLY 64.A O no hydrogen 3.289 N/A LEU 8.A N ARG 36.A O no hydrogen 2.935 N/A ILE 9.A N ASN 66.A O no hydrogen 2.951 N/A GLY 10.A N ILE 38.A O no hydrogen 3.247 N/A GLN 11.A NE2 TYR 71.A OH no hydrogen 3.271 N/A GLY 12.A N ASP 39.A OD1 no hydrogen 2.901 N/A LEU 13.A N ASP 39.A OD2 no hydrogen 2.846 N/A SER 16.A N LEU 13.A O no hydrogen 3.020 N/A ARG 17.A NH1 PHE 279.A O no hydrogen 3.059 N/A THR 18.A N SER 16.A OG no hydrogen 3.143 N/A MET 21.A N ARG 17.A O no hydrogen 3.198 N/A HIS 22.A N THR 18.A O no hydrogen 3.184 N/A GLU 23.A N PRO 19.A O no hydrogen 2.903 N/A ALA 24.A N ALA 20.A O no hydrogen 2.986 N/A GLU 25.A N MET 21.A O no hydrogen 3.087 N/A GLY 26.A N HIS 22.A O no hydrogen 3.008 N/A LEU 27.A N GLU 23.A O no hydrogen 3.176 N/A ALA 28.A N ALA 24.A O no hydrogen 2.901 N/A GLN 29.A N GLU 25.A O no hydrogen 3.090 N/A GLN 29.A N GLY 26.A O no hydrogen 3.028 N/A GLN 29.A NE2 GLU 25.A OE2 no hydrogen 2.893 N/A GLN 29.A NE2 GLU 269.A O no hydrogen 2.940 N/A GLY 30.A N LEU 27.A O no hydrogen 2.911 N/A ARG 31.A N.A GLY 26.A O no hydrogen 2.940 N/A ARG 31.A N.B GLY 26.A O no hydrogen 2.923 N/A ARG 31.A NE.A ASP 2.A O no hydrogen 2.662 N/A ARG 31.A NH1.B ASP 2.A O no hydrogen 3.006 N/A ARG 31.A NH2.A ASP 2.A O no hydrogen 3.016 N/A THR 33.A OG1 ARG 31.A O.A no hydrogen 2.558 N/A THR 33.A OG1 ARG 31.A O.B no hydrogen 3.120 N/A VAL 34.A N ILE 4.A O no hydrogen 2.944 N/A TYR 35.A N GLU 23.A OE2 no hydrogen 2.874 N/A ARG 36.A N LEU 6.A O no hydrogen 2.945 N/A ARG 37.A NE LEU 13.A O no hydrogen 2.883 N/A ARG 37.A NH2 SER 16.A O no hydrogen 3.091 N/A ILE 38.A N LEU 8.A O no hydrogen 2.758 N/A THR 40.A N GLY 10.A O no hydrogen 2.976 N/A THR 40.A OG1 GLY 10.A O no hydrogen 3.413 N/A THR 40.A OG1 TYR 71.A OH no hydrogen 2.757 N/A LEU 41.A N ASP 39.A OD1 no hydrogen 2.864 N/A GLY 42.A N ASP 39.A O no hydrogen 2.919 N/A SER 46.A OG.A THR 40.A O no hydrogen 3.154 N/A SER 46.A OG.A GLY 42.A O no hydrogen 2.634 N/A SER 46.A OG.B GLY 42.A O no hydrogen 3.437 N/A GLN 48.A N ALA 45.A O no hydrogen 3.323 N/A LYS 51.A NZ.A ASP 55.A OD2 no hydrogen 2.678 N/A LYS 51.A NZ.B ASP 55.A OD2 no hydrogen 2.953 N/A THR 52.A N ASP 49.A O.B no hydrogen 2.849 N/A THR 52.A N ASP 49.A OD1.B no hydrogen 2.762 N/A THR 52.A OG1 ASP 49.A OD1.B no hydrogen 2.538 N/A LEU 53.A N ASP 49.A O.A no hydrogen 3.181 N/A LEU 53.A N ASP 49.A O.B no hydrogen 3.227 N/A LEU 54.A N LEU 50.A O no hydrogen 2.875 N/A ASP 55.A N LYS 51.A O.A no hydrogen 3.031 N/A ASP 55.A N LYS 51.A O.B no hydrogen 2.815 N/A ALA 56.A N THR 52.A O no hydrogen 2.921 N/A ALA 57.A N LEU 53.A O no hydrogen 3.124 N/A LEU 58.A N LEU 54.A O no hydrogen 3.128 N/A TYR 59.A N ASP 55.A O no hydrogen 2.968 N/A LEU 60.A N.A ALA 56.A O no hydrogen 3.019 N/A LEU 60.A N.B ALA 56.A O no hydrogen 2.962 N/A PHE 62.A N ALA 57.A O no hydrogen 3.025 N/A ASN 63.A N LEU 5.A O no hydrogen 2.729 N/A LEU 65.A N VAL 95.A O no hydrogen 2.865 N/A ASN 66.A N GLY 7.A O no hydrogen 2.745 N/A ASN 66.A ND2 TYR 35.A OH no hydrogen 2.709 N/A ILE 67.A N ASN 93.A O no hydrogen 2.920 N/A THR 68.A N.A ILE 9.A O no hydrogen 2.950 N/A THR 68.A N.B ILE 9.A O no hydrogen 2.933 N/A TYR 71.A N THR 68.A O.A no hydrogen 2.991 N/A TYR 71.A N THR 68.A O.B no hydrogen 2.787 N/A TYR 71.A OH THR 40.A OG1 no hydrogen 2.757 N/A LYS 72.A NZ ASP 109.A OD2 no hydrogen 2.801 N/A VAL 75.A N TYR 71.A O no hydrogen 3.005 N/A LEU 76.A N GLN 73.A O no hydrogen 3.206 N/A LEU 78.A N VAL 75.A O no hydrogen 2.965 N/A LEU 79.A N LEU 76.A O no hydrogen 3.134 N/A ASP 80.A N THR 103.A OG1 no hydrogen 2.965 N/A GLU 81.A N.A THR 103.A O no hydrogen 3.007 N/A GLU 81.A N.B THR 103.A O no hydrogen 2.985 N/A SER 83.A N GLY 105.A O no hydrogen 2.845 N/A ALA 86.A N SER 83.A OG no hydrogen 3.085 N/A THR 87.A N SER 83.A O no hydrogen 2.875 N/A THR 87.A OG1 VAL 82.A O no hydrogen 3.247 N/A THR 87.A OG1 SER 83.A O no hydrogen 2.738 N/A GLN 88.A N GLU 84.A O.A no hydrogen 2.921 N/A GLN 88.A N GLU 84.A O.B no hydrogen 2.977 N/A GLN 88.A NE2 GLU 84.A OE1.A no hydrogen 3.012 N/A GLN 88.A NE2 GLU 84.A OE2.B no hydrogen 2.870 N/A LEU 89.A N GLN 85.A O no hydrogen 2.940 N/A GLY 90.A N ALA 86.A O no hydrogen 2.853 N/A ALA 91.A N ALA 86.A O no hydrogen 3.206 N/A VAL 92.A N LYS 72.A O no hydrogen 2.885 N/A ASN 93.A N HIS 106.A O no hydrogen 3.109 N/A ASN 93.A ND2 THR 108.A OG1 no hydrogen 3.025 N/A THR 94.A N HIS 106.A O no hydrogen 3.199 N/A THR 94.A OG1 ASN 66.A OD1 no hydrogen 3.037 N/A THR 94.A OG1 ASN 93.A OD1 no hydrogen 2.887 N/A THR 94.A OG1 THR 108.A OG1 no hydrogen 3.332 N/A VAL 95.A N LEU 65.A O no hydrogen 2.733 N/A VAL 96.A N THR 104.A O no hydrogen 2.876 N/A ILE 97.A N ASN 63.A O no hydrogen 3.068 N/A ASP 98.A N HIS 102.A O no hydrogen 3.008 N/A THR 100.A N ASP 98.A OD1 no hydrogen 3.035 N/A THR 100.A OG1 ASP 98.A OD1 no hydrogen 3.349 N/A GLY 101.A N ASP 98.A O no hydrogen 3.315 N/A HIS 102.A N ASP 98.A OD1 no hydrogen 3.124 N/A THR 103.A N ASP 80.A OD2 no hydrogen 2.958 N/A THR 103.A OG1 ASP 80.A OD2 no hydrogen 3.341 N/A THR 104.A N VAL 96.A O no hydrogen 3.014 N/A GLY 105.A N GLU 81.A O.A no hydrogen 2.714 N/A GLY 105.A N GLU 81.A O.B no hydrogen 2.984 N/A HIS 106.A N THR 94.A O no hydrogen 2.771 N/A ASN 107.A ND2 ALA 91.A O no hydrogen 2.951 N/A THR 108.A N ASN 93.A OD1 no hydrogen 2.754 N/A THR 108.A OG1 ASN 93.A OD1 no hydrogen 3.320 N/A THR 108.A OG1 THR 94.A OG1 no hydrogen 3.332 N/A THR 108.A OG1 GLN 257.A O no hydrogen 2.892 N/A VAL 110.A N ASN 107.A OD1 no hydrogen 2.910 N/A SER 111.A N ASN 107.A O no hydrogen 3.512 N/A SER 111.A OG THR 108.A O no hydrogen 3.556 N/A SER 111.A OG ASP 260.A OD2 no hydrogen 2.717 N/A GLY 112.A N THR 108.A O no hydrogen 2.793 N/A PHE 113.A N ASP 109.A O no hydrogen 3.021 N/A GLY 114.A N VAL 110.A O no hydrogen 3.118 N/A ARG 115.A N SER 111.A O no hydrogen 2.864 N/A ARG 115.A NH1 GLU 118.A OE1 no hydrogen 3.040 N/A GLY 116.A N GLY 112.A O no hydrogen 2.967 N/A MET 117.A N.A PHE 113.A O no hydrogen 3.021 N/A MET 117.A N.B PHE 113.A O no hydrogen 2.991 N/A GLU 118.A N GLY 114.A O no hydrogen 3.147 N/A GLU 119.A N ARG 115.A O no hydrogen 2.937 N/A GLY 120.A N GLY 116.A O no hydrogen 2.787 N/A LEU 121.A N MET 117.A O.A no hydrogen 2.998 N/A LEU 121.A N MET 117.A O.B no hydrogen 2.777 N/A ALA 124.A N LEU 121.A O no hydrogen 3.180 N/A LYS 125.A NZ ASP 127.A OD2 no hydrogen 2.959 N/A LYS 125.A NZ ASP 195.A OD1 no hydrogen 2.847 N/A LYS 125.A NZ ASP 195.A OD2 no hydrogen 3.014 N/A SER 128.A N ASP 195.A OD2 no hydrogen 2.906 N/A VAL 129.A N LYS 152.A O.A no hydrogen 3.041 N/A VAL 129.A N LYS 152.A O.B no hydrogen 2.899 N/A VAL 130.A N GLY 196.A O no hydrogen 2.976 N/A GLN 131.A N GLN 154.A O no hydrogen 2.870 N/A GLN 131.A NE2 GLY 133.A O no hydrogen 2.933 N/A GLN 131.A NE2 GLY 138.A O no hydrogen 2.965 N/A VAL 132.A N VAL 198.A O no hydrogen 2.922 N/A GLY 133.A N ALA 156.A O no hydrogen 2.740 N/A ALA 134.A N ASP 157.A OD1 no hydrogen 2.779 N/A ASN 139.A N GLY 135.A O no hydrogen 2.886 N/A ASN 139.A N GLY 136.A O no hydrogen 3.101 N/A ASN 139.A ND2 GLY 135.A O no hydrogen 2.754 N/A VAL 141.A N VAL 137.A O no hydrogen 2.977 N/A ALA 142.A N GLY 138.A O no hydrogen 2.954 N/A TYR 143.A N ASN 139.A O no hydrogen 3.182 N/A ALA 144.A N ALA 140.A O no hydrogen 2.976 N/A LEU 145.A N VAL 141.A O no hydrogen 2.879 N/A VAL 146.A N ALA 142.A O no hydrogen 3.135 N/A THR 147.A N TYR 143.A O no hydrogen 3.140 N/A THR 147.A OG1 TYR 143.A O no hydrogen 2.851 N/A THR 147.A OG1 ALA 144.A O no hydrogen 3.276 N/A HIS 148.A N LEU 145.A O no hydrogen 3.169 N/A HIS 148.A ND1 ALA 144.A O no hydrogen 2.901 N/A VAL 150.A N LEU 145.A O no hydrogen 3.151 N/A GLN 151.A N.A LEU 126.A O no hydrogen 3.204 N/A GLN 151.A N.B LEU 126.A O no hydrogen 3.140 N/A LYS 152.A N.A ASP 127.A O no hydrogen 3.130 N/A LYS 152.A NZ.B SER 128.A OG no hydrogen 3.062 N/A LEU 153.A N ALA 178.A O no hydrogen 2.903 N/A GLN 154.A N VAL 129.A O no hydrogen 2.905 N/A VAL 155.A N VAL 180.A O no hydrogen 2.927 N/A ALA 156.A N GLN 131.A O no hydrogen 2.938 N/A ASP 159.A N ASP 157.A OD2 no hydrogen 2.811 N/A SER 161.A N.A ASP 159.A OD1 no hydrogen 2.742 N/A SER 161.A OG.A ASP 159.A OD1 no hydrogen 2.567 N/A SER 161.A OG.A ASP 159.A OD2 no hydrogen 3.133 N/A ARG 162.A N ASP 159.A O no hydrogen 3.085 N/A ALA 163.A N ASP 159.A O no hydrogen 3.438 N/A GLN 164.A N.A THR 160.A O.A no hydrogen 3.093 N/A GLN 164.A N.A THR 160.A O.B no hydrogen 2.930 N/A GLN 164.A N.B THR 160.A O.A no hydrogen 3.052 N/A GLN 164.A N.B THR 160.A O.B no hydrogen 2.915 N/A GLN 164.A NE2.A ASP 168.A OD1 no hydrogen 2.781 N/A ALA 165.A N SER 161.A O.A no hydrogen 3.093 N/A ALA 165.A N SER 161.A O.B no hydrogen 2.844 N/A LEU 166.A N.A ARG 162.A O no hydrogen 3.010 N/A LEU 166.A N.B ARG 162.A O no hydrogen 3.050 N/A ALA 167.A N ALA 163.A O no hydrogen 2.980 N/A ASP 168.A N GLN 164.A O.A no hydrogen 2.905 N/A ASP 168.A N GLN 164.A O.B no hydrogen 3.117 N/A VAL 169.A N.A ALA 165.A O no hydrogen 3.070 N/A VAL 169.A N.B ALA 165.A O no hydrogen 3.107 N/A ILE 170.A N LEU 166.A O.A no hydrogen 2.929 N/A ILE 170.A N LEU 166.A O.B no hydrogen 2.922 N/A ASN 171.A N ALA 167.A O no hydrogen 2.910 N/A ASN 171.A ND2 VAL 179.A O no hydrogen 2.987 N/A ASN 172.A N ASP 168.A O no hydrogen 3.089 N/A ALA 173.A N VAL 169.A O.A no hydrogen 2.970 N/A ALA 173.A N VAL 169.A O.B no hydrogen 3.034 N/A VAL 174.A N ILE 170.A O no hydrogen 2.926 N/A GLY 175.A N ASN 171.A O no hydrogen 2.828 N/A ARG 176.A N ASN 171.A O no hydrogen 3.290 N/A ARG 176.A NH1 GLN 151.A O.A no hydrogen 2.848 N/A ARG 176.A NH1 GLN 151.A O.B no hydrogen 3.070 N/A ARG 176.A NH2 VAL 146.A O no hydrogen 3.131 N/A ARG 176.A NH2 VAL 150.A O no hydrogen 2.830 N/A ALA 178.A N ARG 176.A O no hydrogen 2.945 N/A VAL 179.A N ASN 171.A OD1 no hydrogen 2.826 N/A VAL 180.A N LEU 153.A O no hydrogen 2.882 N/A VAL 182.A N.A VAL 155.A O no hydrogen 2.966 N/A VAL 182.A N.B VAL 155.A O no hydrogen 2.952 N/A ILE 187.A N ALA 184.A O no hydrogen 3.084 N/A GLU 188.A N GLU 188.A OE1 no hydrogen 2.786 N/A ASP 189.A N GLY 186.A O no hydrogen 3.347 N/A ILE 191.A N ILE 187.A O no hydrogen 2.937 N/A ALA 192.A N GLU 188.A O no hydrogen 2.914 N/A ALA 193.A N VAL 190.A O no hydrogen 3.305 N/A ALA 194.A N ILE 191.A O no hydrogen 3.007 N/A ASP 195.A N SER 128.A O no hydrogen 2.778 N/A VAL 197.A N TRP 223.A O no hydrogen 3.114 N/A VAL 198.A N VAL 130.A O no hydrogen 2.917 N/A ASN 199.A N GLY 225.A O no hydrogen 2.881 N/A ASN 199.A ND2 THR 201.A O no hydrogen 3.065 N/A ASN 199.A ND2 MET 203.A O no hydrogen 3.391 N/A ASN 199.A ND2 ASP 226.A OD1 no hydrogen 2.749 N/A ALA 200.A N VAL 132.A O no hydrogen 2.715 N/A THR 201.A N ASN 199.A OD1 no hydrogen 3.294 N/A THR 201.A OG1 ASN 199.A OD1 no hydrogen 2.733 N/A MET 203.A N THR 201.A OG1 no hydrogen 3.005 N/A GLY 204.A N HIS 208.A O no hydrogen 2.790 N/A MET 205.A N PRO 202.A O no hydrogen 3.133 N/A HIS 208.A N MET 205.A O no hydrogen 2.822 N/A THR 211.A OG1 PHE 213.A O no hydrogen 2.778 N/A ASP 214.A N GLU 188.A OE2 no hydrogen 2.860 N/A SER 216.A N ASP 214.A OD1 no hydrogen 2.894 N/A SER 216.A OG ASP 214.A OD1 no hydrogen 2.728 N/A CYS 217.A N ASP 214.A O no hydrogen 3.169 N/A CYS 217.A SG ASP 214.A O no hydrogen 3.374 N/A LEU 218.A N VAL 215.A O no hydrogen 3.113 N/A THR 219.A N HIS 222.A ND1 no hydrogen 3.142 N/A THR 219.A OG1 HIS 222.A ND1 no hydrogen 2.853 N/A LYS 220.A NZ ASP 221.A OD1 no hydrogen 3.287 N/A LYS 220.A NZ ASP 221.A OD2 no hydrogen 3.400 N/A ASP 221.A N THR 219.A OG1 no hydrogen 3.227 N/A HIS 222.A N THR 219.A O no hydrogen 3.044 N/A HIS 222.A ND1 THR 219.A OG1 no hydrogen 2.853 N/A HIS 222.A NE2 ILE 191.A O no hydrogen 2.793 N/A TRP 223.A N ASP 195.A O no hydrogen 3.249 N/A TRP 223.A NE1 LYS 125.A O no hydrogen 2.875 N/A VAL 224.A N GLU 246.A O no hydrogen 3.042 N/A GLY 225.A N VAL 197.A O no hydrogen 2.866 N/A ASP 226.A N LEU 248.A O no hydrogen 3.007 N/A VAL 227.A N ASN 199.A O no hydrogen 2.970 N/A VAL 228.A N ASP 226.A OD1 no hydrogen 3.041 N/A THR 234.A OG1 ASP 226.A OD2 no hydrogen 2.741 N/A LEU 237.A N THR 234.A OG1 no hydrogen 3.149 N/A LYS 238.A N THR 234.A O no hydrogen 2.830 N/A ALA 239.A N GLU 235.A O no hydrogen 2.989 N/A ALA 240.A N LEU 236.A O no hydrogen 3.036 N/A ARG 241.A N LEU 237.A O no hydrogen 2.893 N/A ARG 241.A NE THR 247.A OG1 no hydrogen 3.017 N/A ARG 241.A NH1 GLU 233.A OE2.A no hydrogen 2.916 N/A ARG 241.A NH1 GLU 233.A OE2.B no hydrogen 3.297 N/A ARG 241.A NH2 THR 247.A OG1 no hydrogen 3.034 N/A ALA 242.A N LYS 238.A O no hydrogen 2.950 N/A LEU 243.A N ALA 240.A O no hydrogen 3.075 N/A GLY 244.A N ARG 241.A O no hydrogen 3.014 N/A CYS 245.A N ALA 240.A O no hydrogen 3.071 N/A CYS 245.A SG THR 219.A O no hydrogen 3.187 N/A CYS 245.A SG LYS 220.A O no hydrogen 4.029 N/A CYS 245.A SG ALA 240.A O no hydrogen 3.348 N/A LEU 248.A N VAL 224.A O no hydrogen 2.909 N/A THR 251.A N ASP 249.A OD1 no hydrogen 2.793 N/A THR 251.A OG1 ASP 249.A OD1 no hydrogen 2.661 N/A ARG 252.A N ASP 249.A O no hydrogen 3.335 N/A ARG 252.A NH1 GLU 119.A OE1 no hydrogen 2.793 N/A ALA 254.A N GLY 250.A O no hydrogen 3.347 N/A ILE 255.A N THR 251.A O no hydrogen 2.940 N/A HIS 256.A N ARG 252.A O no hydrogen 2.968 N/A HIS 256.A NE2 GLU 119.A OE2 no hydrogen 3.049 N/A GLN 257.A N MET 253.A O.A no hydrogen 2.820 N/A GLN 257.A N MET 253.A O.B no hydrogen 3.032 N/A GLN 257.A NE2 ALA 254.A O no hydrogen 3.354 N/A ALA 258.A N ILE 255.A O no hydrogen 3.042 N/A VAL 259.A N ILE 255.A O no hydrogen 2.898 N/A ASP 260.A N HIS 256.A O no hydrogen 2.915 N/A ALA 261.A N GLN 257.A O no hydrogen 3.020 N/A PHE 262.A N ALA 258.A O no hydrogen 2.845 N/A ARG 263.A N VAL 259.A O no hydrogen 3.070 N/A ARG 263.A NE GLU 269.A OE1 no hydrogen 2.869 N/A ARG 263.A NH1 ASP 260.A OD1 no hydrogen 2.975 N/A ARG 263.A NH2 GLU 269.A OE2 no hydrogen 3.072 N/A LEU 264.A N ASP 260.A O no hydrogen 3.096 N/A PHE 265.A N ALA 261.A O no hydrogen 2.815 N/A THR 266.A N PHE 262.A O no hydrogen 3.081 N/A THR 266.A OG1 PHE 262.A O no hydrogen 2.815 N/A GLY 267.A N ARG 263.A O no hydrogen 2.919 N/A LEU 268.A N THR 266.A OG1 no hydrogen 2.959 N/A ASP 271.A N GLU 25.A OE2 no hydrogen 2.877 N/A SER 273.A OG ASP 271.A OD1 no hydrogen 2.573 N/A ARG 274.A N ASP 271.A OD1 no hydrogen 2.902 N/A ARG 274.A NE GLU 25.A OE1 no hydrogen 2.898 N/A ARG 274.A NH2 GLU 25.A OE1 no hydrogen 3.456 N/A ARG 274.A NH2 GLU 25.A OE2 no hydrogen 2.948 N/A MET 275.A N ASP 271.A O no hydrogen 3.192 N/A ARG 276.A N VAL 272.A O no hydrogen 2.852 N/A ARG 276.A NH1 GLU 119.A OE1 no hydrogen 2.937 N/A ARG 276.A NH2 GLU 119.A OE2 no hydrogen 3.106 N/A GLU 277.A N SER 273.A O no hydrogen 2.942 N/A THR 278.A N ARG 274.A O no hydrogen 3.007 N/A THR 278.A OG1 ARG 274.A O no hydrogen 3.236 N/A PHE 279.A N MET 275.A O no hydrogen 3.041 N/A LEU 280.A N ARG 276.A O no hydrogen 3.068 N/A SER 281.A N GLU 277.A O no hydrogen 3.009 N/A SER 281.A N THR 278.A O no hydrogen 3.134 N/A SER 281.A OG THR 278.A O no hydrogen 2.712 N/A LEU 282.A N PHE 279.A O no hydrogen 3.322 N/A