Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mfj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 7.A N THR 10.A OG1 no hydrogen 2.910 N/A GLU 9.A N ASP 7.A OD1 no hydrogen 2.708 N/A THR 10.A N ASP 7.A OD1 no hydrogen 3.135 N/A THR 10.A OG1 ASP 7.A O no hydrogen 3.138 N/A VAL 11.A N ASP 7.A O no hydrogen 2.856 N/A ARG 12.A N PRO 8.A O no hydrogen 3.028 N/A ARG 12.A NE GLU 9.A OE1 no hydrogen 2.894 N/A ARG 12.A NH1 LEU 17.A O no hydrogen 2.975 N/A ARG 12.A NH2 GLU 9.A OE2 no hydrogen 3.337 N/A ILE 13.A N GLU 9.A O no hydrogen 2.938 N/A ILE 13.A N THR 10.A O no hydrogen 2.906 N/A ALA 14.A N THR 10.A O no hydrogen 2.683 N/A LEU 15.A N VAL 11.A O no hydrogen 3.119 N/A LEU 17.A N ARG 12.A O no hydrogen 3.091 N/A LEU 17.A N LEU 15.A O no hydrogen 2.563 N/A THR 21.A OG1 GLU 18.A O no hydrogen 2.572 N/A ALA 22.A N GLU 19.A O no hydrogen 3.064 N/A LEU 25.A N THR 21.A O no hydrogen 2.999 N/A THR 26.A N ALA 22.A O no hydrogen 2.912 N/A THR 26.A OG1 ALA 22.A O no hydrogen 2.928 N/A GLU 27.A N ALA 23.A O no hydrogen 2.893 N/A LEU 28.A N TRP 24.A O no hydrogen 2.918 N/A ASP 29.A N LEU 25.A O no hydrogen 2.740 N/A GLU 30.A N THR 26.A O no hydrogen 2.857 N/A LEU 31.A N GLU 27.A O no hydrogen 3.032 N/A ARG 39.A NH2 GLU 45.A OE2 no hydrogen 3.228 N/A ARG 42.A NH2 ALA 67.A O no hydrogen 3.416 N/A ARG 42.A NH2 PRO 68.A O no hydrogen 2.147 N/A ARG 47.A N GLY 43.A O no hydrogen 2.979 N/A ARG 47.A NH2 GLU 57.A OE1 no hydrogen 2.640 N/A ASP 48.A N GLU 44.A O no hydrogen 2.798 N/A LEU 49.A N GLU 45.A O no hydrogen 3.186 N/A LEU 50.A N ALA 46.A O no hydrogen 2.907 N/A ARG 51.A N ARG 47.A O no hydrogen 3.093 N/A ARG 51.A NE GLU 57.A OE2 no hydrogen 2.968 N/A ARG 51.A NH2 GLU 57.A OE1 no hydrogen 2.829 N/A ARG 51.A NH2 GLU 57.A OE2 no hydrogen 3.411 N/A ARG 52.A N ASP 48.A O no hydrogen 2.744 N/A LEU 53.A N LEU 49.A O no hydrogen 2.824 N/A GLU 54.A N ARG 51.A O no hydrogen 2.899 N/A VAL 55.A N LEU 50.A O no hydrogen 2.996 N/A ALA 60.A N PRO 56.A O no hydrogen 2.961 N/A GLU 61.A N GLU 57.A O no hydrogen 2.884 N/A GLU 62.A N LEU 58.A O no hydrogen 3.207 N/A ILE 63.A N ASP 59.A O no hydrogen 2.772 N/A VAL 64.A N ALA 60.A O no hydrogen 3.057 N/A ALA 65.A N GLU 61.A O no hydrogen 3.081 N/A ALA 66.A N GLU 62.A O no hydrogen 2.950 N/A ALA 67.A N VAL 64.A O no hydrogen 3.272 N/A ASP 69.A N ASP 73.A OD1 no hydrogen 2.469 N/A ASP 71.A N ASP 69.A OD2 no hydrogen 2.969 N/A ARG 72.A N ASP 69.A OD2 no hydrogen 3.095 N/A ASP 73.A N ASP 69.A O no hydrogen 2.757 N/A TRP 77.A N ASP 73.A O no hydrogen 2.994 N/A TRP 78.A N PRO 74.A O no hydrogen 3.139 N/A TRP 78.A N ALA 75.A O no hydrogen 2.858 N/A LEU 79.A N ALA 75.A O no hydrogen 3.078 N/A LEU 80.A N LEU 76.A O no hydrogen 2.766 N/A GLU 81.A N TRP 77.A O no hydrogen 3.291 N/A ARG 82.A N TRP 78.A O no hydrogen 3.276 N/A ARG 82.A NH1 TRP 78.A O no hydrogen 2.746 N/A ARG 82.A NH1 GLU 81.A OE2 no hydrogen 2.897 N/A THR 83.A N LEU 79.A O no hydrogen 2.812 N/A THR 83.A OG1 LEU 79.A O no hydrogen 2.754 N/A HIS 84.A N LEU 80.A O no hydrogen 2.895 N/A HIS 85.A N GLU 81.A O no hydrogen 2.965 N/A ALA 86.A N ARG 82.A O no hydrogen 2.897 N/A ILE 87.A N HIS 84.A O no hydrogen 3.015 N/A VAL 88.A N HIS 84.A O no hydrogen 2.969 N/A ARG 89.A N HIS 85.A O no hydrogen 2.924 N/A ARG 89.A NE ALA 86.A O no hydrogen 3.486 N/A ARG 89.A NH2 GLU 27.A OE2 no hydrogen 2.992 N/A HIS 90.A N ILE 87.A O no hydrogen 3.005 N/A MET 91.A N VAL 88.A O no hydrogen 2.871 N/A GLY 92.A N ARG 175.A O no hydrogen 2.679 N/A ASP 93.A N HIS 90.A O no hydrogen 3.148 N/A ARG 95.A N ASP 93.A OD1 no hydrogen 2.804 N/A ALA 96.A N ASP 93.A OD1 no hydrogen 3.281 N/A ARG 99.A NH2 GLU 27.A OE1 no hydrogen 3.064 N/A TYR 106.A OH HIS 155.A NE2 no hydrogen 2.698 N/A GLY 108.A N PRO 105.A O no hydrogen 3.397 N/A ARG 113.A NH1 GLY 162.A O no hydrogen 2.899 N/A TYR 114.A N ALA 110.A O no hydrogen 3.069 N/A TYR 114.A OH GLU 62.A OE1 no hydrogen 3.169 N/A PHE 115.A N ALA 112.A O no hydrogen 3.234 N/A HIS 116.A NE2 PRO 102.A O no hydrogen 2.741 N/A TYR 118.A N TYR 114.A O no hydrogen 3.056 N/A TYR 118.A OH ILE 63.A O no hydrogen 2.521 N/A VAL 119.A N PHE 115.A O no hydrogen 3.016 N/A PHE 120.A N HIS 116.A O no hydrogen 2.907 N/A LEU 121.A N VAL 117.A O no hydrogen 2.864 N/A ALA 122.A N TYR 118.A O no hydrogen 2.782 N/A THR 123.A N PHE 120.A O no hydrogen 2.841 N/A THR 123.A OG1 VAL 119.A O no hydrogen 2.757 N/A VAL 127.A N THR 123.A O no hydrogen 3.254 N/A ARG 128.A N VAL 124.A O no hydrogen 3.218 N/A ARG 129.A N PRO 125.A O no hydrogen 3.088 N/A PHE 130.A N ALA 126.A O no hydrogen 3.057 N/A HIS 131.A N VAL 127.A O no hydrogen 2.830 N/A ALA 132.A N ARG 128.A O no hydrogen 3.149 N/A GLU 133.A N ARG 129.A O no hydrogen 3.072 N/A ARG 134.A N PHE 130.A O no hydrogen 3.025 N/A ARG 134.A NH1 HIS 228.A O no hydrogen 2.692 N/A GLY 135.A N ALA 132.A O no hydrogen 3.168 N/A ILE 136.A N HIS 131.A O no hydrogen 2.914 N/A VAL 140.A N PRO 137.A O no hydrogen 2.960 N/A GLY 141.A N PRO 137.A O no hydrogen 3.048 N/A TRP 142.A N ASP 138.A O no hydrogen 2.782 N/A GLU 143.A N GLU 139.A O no hydrogen 3.113 N/A THR 144.A N VAL 140.A O no hydrogen 2.896 N/A THR 144.A OG1 VAL 140.A O no hydrogen 2.674 N/A LEU 145.A N GLY 141.A O no hydrogen 3.172 N/A THR 146.A N TRP 142.A O no hydrogen 2.969 N/A THR 146.A OG1 TRP 142.A O no hydrogen 3.483 N/A GLN 147.A NE2 GLU 150.A OE1 no hydrogen 3.364 N/A LEU 148.A N LEU 145.A O no hydrogen 3.027 N/A GLY 149.A N THR 146.A O no hydrogen 3.000 N/A LEU 151.A N GLN 147.A O no hydrogen 2.870 N/A VAL 152.A N LEU 148.A O no hydrogen 2.827 N/A ALA 153.A N GLY 149.A O no hydrogen 2.892 N/A ILE 154.A N GLU 150.A O no hydrogen 2.816 N/A HIS 155.A N LEU 151.A O no hydrogen 3.028 N/A HIS 155.A ND1 GLN 161.A O no hydrogen 2.955 N/A HIS 155.A NE2 TYR 106.A OH no hydrogen 2.698 N/A ARG 156.A N VAL 152.A O no hydrogen 3.142 N/A ARG 156.A NE ASP 59.A OD1 no hydrogen 3.364 N/A ARG 156.A NE ASP 59.A OD2 no hydrogen 2.856 N/A ARG 156.A NH2 GLU 62.A OE1 no hydrogen 3.305 N/A ARG 157.A N ALA 153.A O no hydrogen 2.916 N/A ARG 157.A NH2 GLU 285.A OE2 no hydrogen 3.157 N/A LYS 158.A N ILE 154.A O no hydrogen 2.795 N/A TYR 159.A N HIS 155.A O no hydrogen 2.972 N/A ASN 165.A ND2 TYR 159.A OH no hydrogen 3.020 N/A GLN 167.A N GLN 167.A OE1 no hydrogen 2.745 N/A GLN 167.A NE2 GLY 101.A O no hydrogen 2.925 N/A TRP 169.A NE1 GLN 147.A OE1 no hydrogen 2.953 N/A THR 170.A N MET 166.A O no hydrogen 3.221 N/A THR 170.A OG1 GLN 167.A O no hydrogen 3.070 N/A THR 171.A N TRP 168.A O no hydrogen 3.392 N/A THR 171.A OG1 TRP 168.A O no hydrogen 2.504 N/A TYR 172.A N TRP 169.A O no hydrogen 2.968 N/A HIS 173.A N HIS 173.A ND1 no hydrogen 2.816 N/A HIS 173.A NE2 GLN 147.A OE1 no hydrogen 2.710 N/A LEU 174.A N THR 170.A O no hydrogen 2.876 N/A ARG 175.A N THR 171.A O no hydrogen 2.764 N/A ARG 175.A NE THR 171.A O no hydrogen 3.053 N/A ARG 175.A NH1 ASP 93.A O no hydrogen 3.339 N/A ARG 175.A NH1 ALA 96.A O no hydrogen 2.779 N/A ARG 175.A NH2 THR 171.A OG1 no hydrogen 3.152 N/A GLY 176.A N HIS 173.A O no hydrogen 3.253 N/A ILE 177.A N TYR 172.A O no hydrogen 3.350 N/A TYR 179.A N PHE 186.A O no hydrogen 2.890 N/A TYR 179.A OH GLY 176.A O no hydrogen 2.599 N/A ARG 180.A N THR 144.A OG1 no hydrogen 3.058 N/A ARG 180.A NE GLY 182.A O no hydrogen 2.924 N/A ARG 180.A NH1 GLU 204.A OE1 no hydrogen 2.953 N/A ARG 180.A NH2 GLU 204.A OE1 no hydrogen 3.012 N/A LEU 181.A N LEU 184.A O no hydrogen 2.924 N/A ARG 183.A NE PRO 208.A O no hydrogen 3.433 N/A ARG 183.A NH1 ARG 183.A O no hydrogen 2.818 N/A ARG 183.A NH1 PRO 203.A O no hydrogen 2.762 N/A ARG 183.A NH2 PRO 203.A O no hydrogen 3.131 N/A ARG 183.A NH2 TRP 205.A O no hydrogen 3.397 N/A LEU 184.A N SER 217.A OG no hydrogen 3.107 N/A GLN 185.A N HIS 201.A O no hydrogen 2.879 N/A GLN 185.A NE2 GLN 147.A OE1 no hydrogen 3.191 N/A PHE 186.A N TYR 179.A O no hydrogen 2.791 N/A SER 187.A N GLY 199.A O no hydrogen 2.933 N/A SER 187.A OG GLY 199.A O no hydrogen 3.543 N/A SER 187.A OG HIS 201.A NE2 no hydrogen 2.780 N/A LEU 188.A N ILE 177.A O no hydrogen 3.252 N/A ALA 189.A N HIS 197.A O no hydrogen 3.150 N/A GLY 191.A N THR 195.A O no hydrogen 2.861 N/A GLY 194.A N GLY 191.A O no hydrogen 3.163 N/A THR 195.A N ASP 193.A OD1 no hydrogen 2.871 N/A HIS 197.A N ALA 189.A O no hydrogen 2.729 N/A HIS 197.A ND1 THR 195.A O no hydrogen 3.279 N/A LEU 198.A N VAL 236.A O no hydrogen 3.158 N/A GLY 199.A N SER 187.A O no hydrogen 2.921 N/A LEU 200.A N TRP 238.A O no hydrogen 3.227 N/A HIS 201.A N GLN 185.A O no hydrogen 3.006 N/A HIS 201.A NE2 SER 187.A OG no hydrogen 2.780 N/A GLU 204.A N GLU 150.A OE1 no hydrogen 2.791 N/A TYR 214.A N LEU 210.A O no hydrogen 2.770 N/A ASP 215.A N PRO 211.A O no hydrogen 2.788 N/A GLU 216.A N LYS 212.A O no hydrogen 2.932 N/A SER 217.A N ALA 213.A O no hydrogen 3.074 N/A SER 217.A OG LEU 181.A O no hydrogen 2.544 N/A LEU 218.A N TYR 214.A O no hydrogen 3.114 N/A HIS 219.A N ASP 215.A O no hydrogen 2.917 N/A HIS 219.A ND1 ASP 215.A O no hydrogen 3.073 N/A ARG 220.A N SER 217.A O no hydrogen 2.846 N/A ALA 221.A N SER 217.A O no hydrogen 3.091 N/A ARG 222.A NE PRO 328.A OXT no hydrogen 2.866 N/A ARG 222.A NH2 PRO 328.A O no hydrogen 2.823 N/A PHE 224.A N ARG 220.A O no hydrogen 3.069 N/A PHE 225.A N ALA 221.A O no hydrogen 3.026 N/A ASP 226.A N ARG 222.A O no hydrogen 2.807 N/A ARG 227.A N PRO 223.A O no hydrogen 2.804 N/A HIS 228.A N PHE 224.A O no hydrogen 3.066 N/A HIS 228.A ND1 ARG 134.A O no hydrogen 2.702 N/A PHE 229.A N PHE 225.A O no hydrogen 2.873 N/A HIS 232.A NE2 ALA 189.A O no hydrogen 2.772 N/A ALA 237.A N VAL 325.A O no hydrogen 2.889 N/A TRP 238.A N LEU 198.A O no hydrogen 2.830 N/A GLY 239.A N GLY 323.A O no hydrogen 3.116 N/A SER 240.A OG THR 322.A OG1 no hydrogen 2.914 N/A SER 241.A N ARG 321.A O no hydrogen 3.156 N/A MET 243.A N SER 241.A OG no hydrogen 2.919 N/A ASP 245.A N TRP 242.A O no hydrogen 2.966 N/A GLN 247.A N ASP 245.A OD1 no hydrogen 2.806 N/A LEU 248.A N ASP 245.A O no hydrogen 3.138 N/A GLU 249.A N PRO 246.A O no hydrogen 2.678 N/A GLU 250.A N GLN 247.A O no hydrogen 2.894 N/A TYR 251.A N LEU 248.A O no hydrogen 2.919 N/A LEU 252.A N LEU 248.A O no hydrogen 3.019 N/A SER 256.A N THR 253.A O no hydrogen 3.144 N/A ILE 259.A N SER 256.A OG no hydrogen 3.098 N/A GLN 260.A N SER 256.A O no hydrogen 2.948 N/A GLN 260.A NE2 ASP 255.A O no hydrogen 2.814 N/A LEU 261.A N ASN 257.A O no hydrogen 3.249 N/A ALA 262.A N ILE 258.A O no hydrogen 2.896 N/A ARG 263.A N ILE 259.A O no hydrogen 2.983 N/A ARG 263.A NH2 GLU 249.A OE1 no hydrogen 2.968 N/A PHE 264.A N LEU 261.A O no hydrogen 3.120 N/A TRP 265.A N ALA 262.A O no hydrogen 2.792 N/A TRP 265.A NE1 TYR 214.A OH no hydrogen 2.984 N/A THR 266.A N PHE 324.A O no hydrogen 2.829 N/A THR 268.A N THR 322.A O no hydrogen 3.076 N/A ASP 278.A N ASN 276.A OD1 no hydrogen 2.672 N/A GLY 279.A N TRP 318.A O no hydrogen 2.785 N/A ASP 280.A N ALA 277.A O no hydrogen 2.895 N/A ILE 283.A N GLY 279.A O no hydrogen 2.997 N/A LEU 284.A N ASP 280.A O no hydrogen 3.199 N/A GLU 285.A N SER 281.A O no hydrogen 3.040 N/A PHE 286.A N SER 282.A O no hydrogen 3.000 N/A VAL 287.A N ILE 283.A O no hydrogen 2.974 N/A PHE 288.A N LEU 284.A O no hydrogen 3.170 N/A TYR 290.A OH GLN 293.A O no hydrogen 2.920 N/A ASP 296.A N ASP 296.A OD1 no hydrogen 2.645 N/A GLU 297.A N PRO 294.A O no hydrogen 3.134 N/A LEU 298.A N LEU 295.A O no hydrogen 3.174 N/A ARG 301.A N GLU 305.A OE1 no hydrogen 2.965 N/A ARG 301.A NH1 GLU 305.A OE1 no hydrogen 2.794 N/A GLU 305.A N SER 302.A OG no hydrogen 2.869 N/A ARG 306.A N SER 302.A O no hydrogen 2.843 N/A ALA 307.A N SER 303.A O no hydrogen 2.834 N/A VAL 308.A N LEU 304.A O no hydrogen 2.905 N/A ALA 310.A N ARG 306.A O no hydrogen 3.110 N/A HIS 311.A N ALA 307.A O no hydrogen 3.405 N/A LYS 313.A N ILE 309.A O no hydrogen 3.100 N/A ALA 314.A N ALA 310.A O no hydrogen 3.049 N/A GLY 315.A N LEU 312.A O no hydrogen 2.991 N/A ARG 316.A N HIS 311.A O no hydrogen 3.048 N/A ARG 316.A NH1 GLU 250.A OE1 no hydrogen 2.877 N/A ARG 316.A NH2 GLU 250.A OE1 no hydrogen 2.925 N/A ARG 316.A NH2 GLU 250.A OE2 no hydrogen 3.085 N/A TRP 318.A N ASP 280.A OD1 no hydrogen 2.793 N/A TRP 318.A NE1 VAL 308.A O no hydrogen 3.298 N/A HIS 319.A N ASP 245.A OD2 no hydrogen 3.031 N/A ARG 321.A N SER 241.A O no hydrogen 3.213 N/A ARG 321.A NE ASP 269.A OD1 no hydrogen 2.621 N/A ARG 321.A NE ASP 269.A OD2 no hydrogen 3.165 N/A ARG 321.A NH2 ASP 269.A O no hydrogen 2.978 N/A ARG 321.A NH2 ASP 269.A OD1 no hydrogen 2.779 N/A THR 322.A N ASP 269.A OD2 no hydrogen 3.077 N/A THR 322.A OG1 SER 240.A OG no hydrogen 2.914 N/A GLY 323.A N GLY 239.A O no hydrogen 3.198 N/A PHE 324.A N THR 266.A O no hydrogen 3.105 N/A VAL 325.A N ALA 237.A O no hydrogen 2.954 N/A LEU 327.A N ARG 235.A O no hydrogen 2.716 N/A