Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mml_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N CYS 66.A O no hydrogen 2.892 N/A LEU 4.A N LEU 148.A O no hydrogen 2.785 N/A GLU 5.A N ARG 64.A O no hydrogen 2.733 N/A VAL 6.A N ASP 146.A O no hydrogen 2.748 N/A LEU 7.A N SER 62.A O no hydrogen 2.798 N/A ARG 8.A N SER 62.A O no hydrogen 3.457 N/A ARG 8.A NE GLY 60.A O no hydrogen 3.311 N/A THR 9.A OG1 GLY 10.A O no hydrogen 2.837 N/A LEU 14.A N GLU 55.A O no hydrogen 2.910 N/A GLU 16.A N THR 53.A O no hydrogen 2.976 N/A ASP 17.A N SER 131.A OG no hydrogen 2.901 N/A GLY 19.A N ASP 17.A OD1 no hydrogen 2.916 N/A ARG 20.A N ARG 29.A O no hydrogen 2.654 N/A ARG 20.A NE VAL 126.A O no hydrogen 2.912 N/A ARG 20.A NH1 SER 131.A O no hydrogen 3.089 N/A ARG 20.A NH2 VAL 126.A O no hydrogen 2.909 N/A ARG 20.A NH2 SER 129.A O no hydrogen 3.023 N/A ARG 20.A NH2 SER 131.A O no hydrogen 2.704 N/A VAL 27.A N LEU 23.A O no hydrogen 3.269 N/A THR 28.A OG1 HIS 247.A O no hydrogen 2.668 N/A ARG 29.A NE LEU 18.A O no hydrogen 2.837 N/A ARG 29.A NH2 LEU 18.A O no hydrogen 3.202 N/A SER 30.A OG TYR 132.A O no hydrogen 3.294 N/A SER 30.A OG ASP 246.A OD1 no hydrogen 2.619 N/A ALA 32.A N ASP 17.A O no hydrogen 2.827 N/A ALA 33.A N GLU 55.A OE2 no hydrogen 2.778 N/A ASP 34.A N TYR 114.A OH no hydrogen 2.950 N/A ARG 35.A N ASP 265.A OD1 no hydrogen 2.994 N/A ARG 36.A N ASP 265.A OD2 no hydrogen 3.319 N/A ARG 36.A NH1 GLU 261.A O no hydrogen 3.500 N/A ARG 36.A NH1 GLU 261.A OE2 no hydrogen 3.550 N/A ARG 36.A NH1 ASP 265.A OD2 no hydrogen 3.057 N/A ARG 36.A NH2 GLU 261.A OE1 no hydrogen 3.256 N/A SER 37.A N ASP 34.A OD1 no hydrogen 3.161 N/A SER 37.A OG ASP 34.A OD2 no hydrogen 2.696 N/A HIS 38.A N ASP 34.A O no hydrogen 3.212 N/A HIS 38.A ND1 THR 53.A OG1 no hydrogen 2.779 N/A THR 39.A N ARG 35.A O no hydrogen 2.911 N/A THR 39.A OG1 ARG 35.A O no hydrogen 3.414 N/A THR 39.A OG1 ARG 36.A O no hydrogen 3.197 N/A LEU 40.A N ARG 36.A O no hydrogen 2.879 N/A ALA 41.A N SER 37.A O no hydrogen 2.828 N/A ASN 42.A N HIS 38.A O no hydrogen 3.176 N/A ASN 42.A ND2 GLY 49.A O no hydrogen 3.503 N/A ASN 42.A ND2 SER 51.A O no hydrogen 2.758 N/A ARG 43.A N THR 39.A O no hydrogen 2.929 N/A ARG 43.A NE GLN 162.A OE1 no hydrogen 2.713 N/A LEU 44.A N LEU 40.A O no hydrogen 2.988 N/A VAL 45.A N ASN 42.A O no hydrogen 3.248 N/A ALA 46.A N ARG 43.A O no hydrogen 2.917 N/A ASN 47.A N ASN 42.A O no hydrogen 2.794 N/A ASN 47.A ND2 ASN 42.A OD1 no hydrogen 2.928 N/A ASN 47.A ND2 VAL 117.A O no hydrogen 2.864 N/A SER 51.A N PRO 48.A O no hydrogen 3.212 N/A SER 51.A OG PRO 48.A O no hydrogen 3.201 N/A THR 53.A N GLU 16.A O no hydrogen 2.889 N/A THR 53.A OG1 HIS 38.A ND1 no hydrogen 2.779 N/A ILE 54.A N LEU 115.A O no hydrogen 2.933 N/A GLU 55.A N LEU 14.A O no hydrogen 2.764 N/A VAL 56.A N SER 113.A O no hydrogen 2.805 N/A THR 57.A N LEU 12.A O no hydrogen 3.007 N/A THR 57.A OG1 LEU 12.A O no hydrogen 2.961 N/A PHE 58.A N LEU 111.A O no hydrogen 2.850 N/A GLY 60.A N LEU 104.A O no hydrogen 3.247 N/A GLY 60.A N GLY 105.A O no hydrogen 2.937 N/A SER 62.A N ARG 8.A O no hydrogen 2.822 N/A ALA 63.A N ILE 102.A O no hydrogen 2.918 N/A ARG 64.A N GLU 5.A O no hydrogen 2.818 N/A ARG 64.A NH1 GLY 99.A O no hydrogen 3.226 N/A VAL 65.A N GLN 100.A O no hydrogen 3.017 N/A CYS 66.A N THR 3.A O no hydrogen 3.012 N/A CYS 66.A SG ARG 64.A O no hydrogen 3.643 N/A GLY 67.A N ASP 98.A OD1 no hydrogen 2.886 N/A VAL 70.A N VAL 96.A O no hydrogen 2.891 N/A ILE 72.A N HIS 94.A O no hydrogen 2.724 N/A ALA 73.A N ALA 116.A O no hydrogen 3.138 N/A THR 75.A N TYR 114.A O no hydrogen 2.988 N/A THR 75.A OG1 SER 37.A O no hydrogen 2.609 N/A ALA 77.A N ARG 112.A O no hydrogen 2.883 N/A ASP 80.A N ASP 78.A OD1 no hydrogen 3.129 N/A ALA 82.A N SER 103.A O no hydrogen 2.867 N/A VAL 83.A N ILE 86.A O no hydrogen 2.930 N/A ASN 84.A N VAL 101.A O no hydrogen 2.952 N/A ILE 86.A N VAL 83.A O no hydrogen 2.927 N/A PHE 88.A N PRO 81.A O no hydrogen 2.976 N/A THR 90.A OG1 ASP 78.A OD1 no hydrogen 2.924 N/A ASN 91.A N VAL 74.A O no hydrogen 2.689 N/A SER 92.A OG PHE 88.A O no hydrogen 3.370 N/A SER 92.A OG GLY 89.A O no hydrogen 3.115 N/A HIS 94.A N ILE 72.A O no hydrogen 2.696 N/A HIS 95.A NE2 GLU 159.A OE2 no hydrogen 3.049 N/A VAL 96.A N VAL 70.A O no hydrogen 2.822 N/A HIS 97.A N GLN 100.A OE1 no hydrogen 2.944 N/A HIS 97.A ND1 ASP 69.A OD2 no hydrogen 2.828 N/A ASP 98.A N ASP 69.A OD1 no hydrogen 3.327 N/A GLY 99.A N VAL 65.A O no hydrogen 2.723 N/A GLN 100.A N HIS 97.A O no hydrogen 3.023 N/A VAL 101.A N ASN 84.A OD1 no hydrogen 2.809 N/A ILE 102.A N ALA 63.A O no hydrogen 2.804 N/A SER 103.A N ALA 82.A O no hydrogen 2.818 N/A LEU 104.A N PHE 61.A O no hydrogen 2.743 N/A GLY 105.A N THR 79.A O no hydrogen 2.789 N/A SER 109.A OG ILE 168.A O no hydrogen 3.125 N/A LEU 111.A N GLN 269.A OE1 no hydrogen 2.783 N/A ARG 112.A N GLN 269.A OE1 no hydrogen 2.957 N/A ARG 112.A NH1 GLY 268.A O no hydrogen 2.903 N/A SER 113.A N VAL 56.A O no hydrogen 2.950 N/A SER 113.A OG ALA 77.A O no hydrogen 2.687 N/A TYR 114.A N THR 75.A O no hydrogen 2.819 N/A TYR 114.A OH GLU 55.A OE2 no hydrogen 2.520 N/A LEU 115.A N ILE 54.A O no hydrogen 2.859 N/A ALA 116.A N ALA 73.A O no hydrogen 2.900 N/A ARG 118.A N ALA 71.A O no hydrogen 2.794 N/A ARG 118.A NH2 GLU 156.A O no hydrogen 3.263 N/A GLY 119.A N ASN 47.A OD1 no hydrogen 2.846 N/A GLY 120.A N VAL 117.A O no hydrogen 2.816 N/A ILE 121.A N ALA 52.A O no hydrogen 3.260 N/A ASP 122.A N PRO 149.A O no hydrogen 2.807 N/A VAL 126.A N SER 129.A O no hydrogen 2.796 N/A SER 129.A N VAL 126.A O no hydrogen 3.199 N/A SER 129.A OG ASP 17.A OD1 no hydrogen 2.685 N/A SER 129.A OG ASP 17.A OD2 no hydrogen 3.530 N/A ARG 130.A N ASP 17.A OD2 no hydrogen 2.865 N/A ARG 130.A NE VAL 123.A O no hydrogen 2.732 N/A SER 131.A N SER 129.A OG no hydrogen 3.034 N/A SER 131.A OG GLU 16.A OE1 no hydrogen 3.207 N/A SER 131.A OG ASP 17.A OD1 no hydrogen 2.609 N/A SER 131.A OG SER 129.A OG no hydrogen 3.379 N/A TYR 132.A N VAL 15.A O no hydrogen 3.121 N/A ASP 133.A N ILE 137.A O no hydrogen 2.728 N/A VAL 134.A N ASP 246.A OD2 no hydrogen 3.131 N/A LEU 142.A N ALA 13.A O no hydrogen 2.889 N/A ARG 143.A N ASP 146.A OD2 no hydrogen 2.786 N/A ARG 143.A NH1 LEU 142.A O no hydrogen 3.144 N/A GLY 145.A N VAL 6.A O no hydrogen 2.804 N/A ASP 146.A N ARG 143.A O no hydrogen 3.120 N/A LEU 148.A N LEU 4.A O no hydrogen 2.784 N/A VAL 150.A N THR 2.A O no hydrogen 2.903 N/A GLY 151.A N GLY 120.A O no hydrogen 2.950 N/A HIS 153.A ND1 GLY 151.A O no hydrogen 3.136 N/A THR 154.A OG1 GLU 156.A OE1 no hydrogen 3.120 N/A VAL 173.A N THR 275.A O no hydrogen 2.887 N/A LEU 175.A N ARG 277.A O no hydrogen 2.841 N/A GLN 176.A N ASP 263.A OD2 no hydrogen 2.927 N/A VAL 177.A N HIS 279.A O no hydrogen 2.741 N/A VAL 178.A N VAL 258.A O no hydrogen 2.784 N/A GLY 180.A N ILE 256.A O no hydrogen 2.786 N/A ARG 182.A N VAL 255.A O no hydrogen 2.852 N/A ARG 182.A NE GLU 225.A OE1 no hydrogen 3.308 N/A ARG 182.A NH2 GLU 225.A OE1 no hydrogen 2.739 N/A TRP 185.A N ARG 182.A O no hydrogen 3.044 N/A PHE 186.A N ASP 183.A O no hydrogen 3.261 N/A VAL 187.A N GLU 214.A O no hydrogen 2.989 N/A ILE 191.A N ASP 188.A O no hydrogen 3.082 N/A LEU 192.A N PRO 189.A O no hydrogen 2.884 N/A VAL 193.A N ASP 190.A O no hydrogen 3.009 N/A ARG 194.A N ILE 191.A O no hydrogen 3.150 N/A ARG 194.A NH2 ASP 188.A OD2 no hydrogen 3.100 N/A THR 195.A OG1 ILE 191.A O no hydrogen 2.536 N/A TRP 197.A N VAL 276.A O no hydrogen 3.014 N/A TRP 197.A NE1 LEU 192.A O no hydrogen 3.008 N/A LEU 198.A N VAL 210.A O no hydrogen 2.925 N/A VAL 199.A N GLN 274.A O no hydrogen 3.108 N/A THR 200.A N ARG 208.A O no hydrogen 3.048 N/A ARG 202.A N THR 200.A OG1 no hydrogen 3.116 N/A SER 203.A N THR 200.A O no hydrogen 3.231 N/A SER 203.A OG THR 200.A O no hydrogen 2.819 N/A ASP 204.A N GLY 207.A O no hydrogen 3.109 N/A ARG 205.A NE ASP 246.A OD2 no hydrogen 2.751 N/A ARG 205.A NH1 GLY 31.A O no hydrogen 2.825 N/A ARG 205.A NH1 GLU 55.A OE1 no hydrogen 2.795 N/A ARG 205.A NH2 GLY 31.A O no hydrogen 2.821 N/A ARG 205.A NH2 ASP 246.A OD1 no hydrogen 2.967 N/A ARG 205.A NH2 ASP 246.A OD2 no hydrogen 2.966 N/A VAL 206.A N ASP 204.A OD1 no hydrogen 2.879 N/A GLY 207.A N ASP 204.A OD1 no hydrogen 3.138 N/A ARG 208.A N SER 203.A OG no hydrogen 2.988 N/A ARG 208.A NE GLY 207.A O no hydrogen 3.086 N/A ARG 208.A NH2 ASP 204.A OD1 no hydrogen 2.745 N/A ARG 208.A NH2 GLY 207.A O no hydrogen 3.285 N/A LEU 209.A N PRO 240.A O no hydrogen 2.968 N/A VAL 210.A N LEU 198.A O no hydrogen 2.893 N/A LEU 213.A N GLY 238.A O no hydrogen 2.967 N/A TYR 215.A OH VAL 234.A O no hydrogen 2.558 N/A ARG 216.A N TRP 185.A O no hydrogen 2.877 N/A ARG 220.A N ASN 217.A O no hydrogen 3.076 N/A GLU 225.A N GLY 251.A O no hydrogen 2.926 N/A ALA 227.A N VAL 249.A O no hydrogen 3.060 N/A THR 228.A OG1 ARG 229.A O no hydrogen 3.219 N/A ARG 229.A NH1 ALA 33.A O no hydrogen 2.941 N/A ARG 229.A NH2 ASP 265.A OD1 no hydrogen 2.664 N/A GLY 230.A N LEU 243.A O no hydrogen 2.745 N/A ALA 231.A N THR 228.A O no hydrogen 3.194 N/A ILE 232.A N GLY 257.A O no hydrogen 2.744 N/A GLN 233.A N VAL 241.A O no hydrogen 2.897 N/A VAL 234.A N PRO 254.A O no hydrogen 2.921 N/A GLY 238.A N PRO 235.A O no hydrogen 2.926 N/A PHE 239.A N ASN 237.A OD1 no hydrogen 2.999 N/A VAL 241.A N GLN 233.A O no hydrogen 2.982 N/A LEU 243.A N ALA 231.A O no hydrogen 2.892 N/A GLY 244.A N VAL 206.A O no hydrogen 2.944 N/A ASP 246.A N ARG 205.A O no hydrogen 2.828 N/A HIS 247.A N GLY 244.A O no hydrogen 3.338 N/A HIS 247.A ND1 GLY 244.A O no hydrogen 2.827 N/A GLY 251.A N GLU 225.A O no hydrogen 2.905 N/A ILE 256.A N ILE 232.A O no hydrogen 2.938 N/A VAL 258.A N VAL 178.A O no hydrogen 2.923 N/A VAL 259.A N GLY 230.A O no hydrogen 2.811 N/A THR 260.A N GLN 176.A O no hydrogen 3.076 N/A ASP 263.A N THR 260.A O no hydrogen 3.095 N/A ILE 264.A N GLU 261.A O no hydrogen 3.374 N/A LYS 266.A N ASP 263.A O no hydrogen 3.176 N/A LYS 266.A NZ GLU 262.A O no hydrogen 3.210 N/A LYS 266.A NZ ASP 263.A OD1 no hydrogen 2.893 N/A LEU 267.A N ILE 264.A O no hydrogen 3.243 N/A GLY 268.A N ASP 265.A O no hydrogen 3.101 N/A GLN 269.A N LYS 266.A O no hydrogen 3.044 N/A GLN 269.A NE2 ASP 34.A OD2 no hydrogen 2.844 N/A GLN 269.A NE2 ARG 112.A O no hydrogen 2.791 N/A VAL 270.A N LEU 267.A O no hydrogen 3.520 N/A ARG 271.A N GLN 274.A OE1 no hydrogen 2.745 N/A ARG 271.A NH1 GLY 110.A O no hydrogen 2.834 N/A GLY 273.A N VAL 199.A O no hydrogen 2.695 N/A GLN 274.A N ARG 271.A O no hydrogen 3.124 N/A GLN 274.A NE2 ALA 169.A O no hydrogen 3.361 N/A GLN 274.A NE2 ASP 171.A O no hydrogen 2.789 N/A VAL 276.A N TRP 197.A O no hydrogen 2.842 N/A ARG 277.A N VAL 173.A O no hydrogen 2.800 N/A ARG 277.A NE ASN 196.A OD1 no hydrogen 2.790 N/A ARG 277.A NH2 ASN 196.A OD1 no hydrogen 3.554 N/A HIS 279.A N LEU 175.A O no hydrogen 2.845 N/A HIS 279.A NE2 GLU 174.A OE1 no hydrogen 2.613 N/A TRP 280.A NE1 ASP 190.A OD1 no hydrogen 2.810 N/A ALA 281.A N VAL 177.A O no hydrogen 2.690 N/A ARG 284.A NE ASP 190.A OD1 no hydrogen 2.954 N/A ARG 284.A NH1 ASP 183.A OD2 no hydrogen 2.903 N/A ARG 284.A NH2 ASP 190.A OD2 no hydrogen 3.173 N/A