Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3he6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 GLU 94.A OE1 no hydrogen 2.690 N/A PHE 3.A N CYS 93.A O no hydrogen 3.103 N/A ARG 4.A N TRP 24.A O no hydrogen 2.861 N/A CYS 5.A N ALA 91.A O no hydrogen 2.636 N/A LEU 6.A N VAL 22.A O no hydrogen 2.920 N/A GLN 7.A N LEU 89.A O no hydrogen 2.745 N/A GLN 7.A NE2 SER 9.A OG no hydrogen 2.865 N/A MET 8.A N ASP 20.A O no hydrogen 2.678 N/A SER 9.A N ILE 87.A O no hydrogen 2.915 N/A SER 10.A N ARG 18.A O no hydrogen 2.801 N/A SER 10.A OG GLU 86.A OE1 no hydrogen 2.692 N/A PHE 11.A N ILE 85.A O no hydrogen 2.675 N/A ALA 12.A N TRP 16.A O no hydrogen 3.206 N/A SER 15.A N ASN 13.A OD1 no hydrogen 3.270 N/A TRP 16.A N ASN 13.A OD1 no hydrogen 2.778 N/A ARG 18.A N SER 10.A O no hydrogen 3.046 N/A ARG 18.A NE ASP 20.A OD2 no hydrogen 2.820 N/A ARG 18.A NH2 ASP 20.A OD1 no hydrogen 3.321 N/A ARG 18.A NH2 ASP 36.A OD1 no hydrogen 2.531 N/A THR 19.A N ASN 35.A OD1 no hydrogen 3.442 N/A THR 19.A OG1 SER 9.A OG no hydrogen 3.285 N/A ASP 20.A N MET 8.A O no hydrogen 2.759 N/A SER 21.A N TRP 33.A O no hydrogen 2.977 N/A VAL 22.A N LEU 6.A O no hydrogen 2.989 N/A VAL 23.A N HIS 31.A O no hydrogen 2.986 N/A TRP 24.A N ARG 4.A O no hydrogen 2.865 N/A LEU 25.A N LEU 28.A O no hydrogen 2.863 N/A GLY 26.A N THR 2.A O no hydrogen 2.967 N/A LEU 28.A N LEU 25.A O no hydrogen 3.089 N/A GLN 29.A N GLU 231.A OE2 no hydrogen 3.329 N/A THR 30.A N VAL 23.A O no hydrogen 2.747 N/A THR 30.A OG1 VAL 23.A O no hydrogen 3.131 N/A THR 30.A OG1 HIS 31.A ND1 no hydrogen 2.883 N/A HIS 31.A ND1 THR 30.A OG1 no hydrogen 2.883 N/A HIS 31.A NE2 SER 47.A O no hydrogen 3.059 N/A ARG 32.A N SER 41.A O no hydrogen 2.931 N/A TRP 33.A N SER 21.A O no hydrogen 2.840 N/A SER 34.A OG ASP 20.A OD1 no hydrogen 3.368 N/A SER 34.A OG ASP 36.A OD1 no hydrogen 3.265 N/A ASN 35.A N ASP 20.A OD1 no hydrogen 2.941 N/A SER 37.A N SER 34.A O no hydrogen 2.881 N/A SER 37.A OG THR 39.A O no hydrogen 2.800 N/A THR 39.A N SER 37.A OG no hydrogen 3.172 N/A SER 41.A N ARG 32.A O no hydrogen 2.876 N/A THR 43.A N THR 30.A O no hydrogen 2.774 N/A THR 43.A OG1 GLN 29.A O no hydrogen 2.556 N/A LYS 44.A N SER 47.A OG no hydrogen 3.025 N/A LYS 44.A NZ GLN 29.A O no hydrogen 3.419 N/A LYS 44.A NZ GLU 231.A OE1 no hydrogen 2.704 N/A LYS 44.A NZ GLU 231.A OE2 no hydrogen 2.717 N/A TRP 46.A NE1 ASP 170.A OD2 no hydrogen 3.334 N/A SER 47.A N LYS 44.A O no hydrogen 3.260 N/A SER 47.A OG THR 30.A O no hydrogen 2.668 N/A SER 47.A OG LYS 44.A O no hydrogen 3.027 N/A GLN 48.A NE2 LEU 51.A O no hydrogen 2.695 N/A GLN 48.A NE2 ASN 53.A OD1 no hydrogen 3.678 N/A GLY 49.A N TRP 46.A O no hydrogen 2.851 N/A LEU 51.A N GLN 48.A O no hydrogen 3.390 N/A SER 52.A N GLN 55.A OE1 no hydrogen 3.304 N/A SER 52.A OG GLN 54.A OE1 no hydrogen 3.258 N/A SER 52.A OG GLN 55.A OE1 no hydrogen 3.398 N/A TRP 56.A N SER 52.A O no hydrogen 3.008 N/A LYS 58.A N GLN 54.A O no hydrogen 3.168 N/A LEU 59.A N GLN 55.A O no hydrogen 3.155 N/A GLN 60.A N TRP 56.A O no hydrogen 2.685 N/A HIS 61.A N GLU 57.A O no hydrogen 2.945 N/A MET 62.A N LYS 58.A O no hydrogen 3.055 N/A PHE 63.A N LEU 59.A O no hydrogen 3.193 N/A GLN 64.A N GLN 60.A O no hydrogen 2.773 N/A VAL 65.A N HIS 61.A O no hydrogen 2.974 N/A TYR 66.A N MET 62.A O no hydrogen 3.242 N/A TYR 66.A OH GLN 7.A OE1 no hydrogen 2.528 N/A ARG 67.A N PHE 63.A O no hydrogen 2.947 N/A ARG 67.A NH1 SER 34.A O no hydrogen 3.048 N/A ARG 67.A NH1 SER 37.A O no hydrogen 3.177 N/A ARG 67.A NH2 SER 37.A O no hydrogen 2.771 N/A SER 69.A N VAL 65.A O no hydrogen 2.818 N/A SER 69.A OG VAL 65.A O no hydrogen 2.816 N/A PHE 70.A N TYR 66.A O no hydrogen 2.589 N/A THR 71.A N ARG 67.A O no hydrogen 3.411 N/A THR 71.A OG1 ARG 67.A O no hydrogen 2.979 N/A ARG 72.A N VAL 68.A O no hydrogen 3.336 N/A ASP 73.A N SER 69.A O no hydrogen 3.053 N/A ILE 74.A N PHE 70.A O no hydrogen 3.226 N/A GLN 75.A N THR 71.A O no hydrogen 3.322 N/A GLU 76.A N ARG 72.A O no hydrogen 2.937 N/A LEU 77.A N ASP 73.A O no hydrogen 2.640 N/A VAL 78.A N ILE 74.A O no hydrogen 2.898 N/A LYS 79.A N GLN 75.A O no hydrogen 3.267 N/A LYS 79.A NZ GLU 76.A OE2 no hydrogen 3.094 N/A MET 80.A N GLU 76.A O no hydrogen 3.044 N/A MET 81.A N LEU 77.A O no hydrogen 2.790 N/A ILE 85.A N PHE 11.A O no hydrogen 2.677 N/A GLU 86.A N GLN 109.A OE1 no hydrogen 2.800 N/A ILE 87.A N SER 9.A O no hydrogen 2.815 N/A GLN 88.A N ALA 107.A O no hydrogen 2.906 N/A LEU 89.A N GLN 7.A O no hydrogen 3.051 N/A SER 90.A N HIS 105.A O no hydrogen 2.741 N/A ALA 91.A N CYS 5.A O no hydrogen 2.893 N/A GLY 92.A N PHE 103.A O no hydrogen 2.995 N/A CYS 93.A N PHE 3.A O no hydrogen 3.075 N/A GLU 94.A N GLU 101.A O no hydrogen 3.181 N/A MET 95.A N TYR 1.A O no hydrogen 3.049 N/A TYR 96.A N ALA 99.A O no hydrogen 3.355 N/A SER 102.A OG GLY 92.A O no hydrogen 3.335 N/A SER 102.A OG LEU 152.A O no hydrogen 3.287 N/A PHE 103.A N GLY 92.A O no hydrogen 3.149 N/A HIS 105.A N SER 90.A O no hydrogen 2.737 N/A HIS 105.A ND1 TYR 112.A OH no hydrogen 2.714 N/A VAL 106.A N VAL 114.A O no hydrogen 2.785 N/A ALA 107.A N GLN 88.A O no hydrogen 2.569 N/A PHE 108.A N LYS 111.A O no hydrogen 2.699 N/A GLN 109.A N GLU 86.A O no hydrogen 3.036 N/A GLN 109.A NE2 PRO 84.A O no hydrogen 2.916 N/A LYS 111.A N PHE 108.A O no hydrogen 2.991 N/A TYR 112.A OH HIS 105.A ND1 no hydrogen 2.714 N/A VAL 113.A N VAL 106.A O no hydrogen 3.085 N/A VAL 114.A N VAL 106.A O no hydrogen 3.249 N/A ARG 115.A N GLN 122.A O no hydrogen 3.082 N/A ARG 115.A NH1 GLN 122.A OE1 no hydrogen 2.670 N/A PHE 116.A N LEU 104.A O no hydrogen 2.973 N/A TRP 117.A N SER 120.A O no hydrogen 3.021 N/A SER 120.A N TRP 117.A O no hydrogen 3.493 N/A TRP 121.A N ASN 139.A OD1 no hydrogen 2.953 N/A GLN 122.A N ARG 115.A O no hydrogen 2.998 N/A VAL 124.A N VAL 113.A O no hydrogen 2.780 N/A ALA 127.A N VAL 124.A O no hydrogen 3.023 N/A ASP 132.A N SER 129.A O no hydrogen 3.307 N/A ILE 135.A N LEU 131.A O no hydrogen 3.119 N/A LYS 136.A N ASP 132.A O no hydrogen 2.973 N/A VAL 137.A N LEU 133.A O no hydrogen 2.895 N/A LEU 138.A N PRO 134.A O no hydrogen 3.067 N/A ASN 139.A N ILE 135.A O no hydrogen 2.782 N/A ASN 139.A ND2 TRP 121.A O no hydrogen 2.893 N/A ALA 140.A N VAL 137.A O no hydrogen 3.236 N/A ASP 141.A N LEU 138.A O no hydrogen 3.460 N/A THR 144.A N ASP 141.A OD1 no hydrogen 2.850 N/A THR 144.A OG1 ASP 141.A OD2 no hydrogen 3.218 N/A SER 145.A N ASP 141.A O no hydrogen 3.417 N/A ALA 146.A N GLN 142.A O no hydrogen 3.008 N/A THR 147.A N GLY 143.A O no hydrogen 3.291 N/A THR 147.A OG1 GLY 143.A O no hydrogen 2.796 N/A THR 147.A OG1 THR 144.A O no hydrogen 2.904 N/A VAL 148.A N THR 144.A O no hydrogen 2.817 N/A GLN 149.A N SER 145.A O no hydrogen 3.108 N/A GLN 149.A NE2 SER 145.A O no hydrogen 2.883 N/A GLN 149.A NE2 SER 145.A OG no hydrogen 3.053 N/A MET 150.A N ALA 146.A O no hydrogen 3.223 N/A LEU 151.A N THR 147.A O no hydrogen 3.056 N/A LEU 152.A N VAL 148.A O no hydrogen 2.972 N/A ASN 153.A N GLN 149.A O no hydrogen 2.661 N/A ASP 154.A N MET 150.A O no hydrogen 2.838 N/A THR 155.A N MET 150.A O no hydrogen 2.804 N/A THR 155.A OG1 MET 150.A O no hydrogen 3.409 N/A CYS 156.A N LEU 151.A O no hydrogen 2.743 N/A LEU 158.A N ASP 154.A O no hydrogen 3.293 N/A PHE 159.A N THR 155.A O no hydrogen 3.016 N/A VAL 160.A N CYS 156.A O no hydrogen 3.091 N/A ARG 161.A N PRO 157.A O no hydrogen 3.194 N/A ARG 161.A NH2 GLY 98.A O no hydrogen 2.667 N/A LEU 163.A N PHE 159.A O no hydrogen 3.138 N/A LEU 164.A N VAL 160.A O no hydrogen 2.897 N/A ALA 166.A N GLY 162.A O no hydrogen 3.095 N/A GLY 167.A N LEU 163.A O no hydrogen 2.645 N/A LEU 171.A N GLY 167.A O no hydrogen 3.109 N/A GLU 172.A N LYS 168.A O no hydrogen 3.261 N/A GLU 172.A N SER 169.A O no hydrogen 2.934 N/A GLU 175.A N TYR 202.A O no hydrogen 2.759 N/A VAL 178.A N SER 199.A O no hydrogen 2.924 N/A TRP 180.A N HIS 197.A O no hydrogen 2.866 N/A SER 182.A N VAL 195.A O no hydrogen 3.082 N/A SER 182.A OG HIS 197.A NE2 no hydrogen 2.783 N/A VAL 184.A N GLN 193.A O no hydrogen 2.853 N/A SER 186.A N HIS 191.A O no hydrogen 3.371 N/A SER 186.A OG ASP 240.A OD2 no hydrogen 2.690 N/A ALA 188.A N SER 186.A OG no hydrogen 3.314 N/A HIS 191.A N ALA 188.A O no hydrogen 3.257 N/A ARG 192.A N VAL 241.A O no hydrogen 2.707 N/A GLN 193.A N VAL 184.A O no hydrogen 2.967 N/A GLN 193.A NE2 THR 238.A OG1 no hydrogen 3.329 N/A LEU 194.A N LEU 239.A O no hydrogen 2.801 N/A VAL 195.A N SER 182.A O no hydrogen 2.621 N/A CYS 196.A N ALA 237.A O no hydrogen 3.007 N/A HIS 197.A N TRP 180.A O no hydrogen 2.730 N/A HIS 197.A ND1 TYR 234.A OH no hydrogen 2.915 N/A HIS 197.A NE2 SER 182.A OG no hydrogen 2.783 N/A VAL 198.A N LEU 235.A O no hydrogen 2.748 N/A SER 199.A N VAL 178.A O no hydrogen 2.981 N/A GLY 200.A N TRP 233.A O no hydrogen 2.818 N/A TYR 202.A N GLU 175.A O no hydrogen 3.347 N/A TYR 202.A OH ASP 27.A OD1 no hydrogen 2.818 N/A TRP 207.A N LYS 254.A O no hydrogen 2.809 N/A MET 209.A N ARG 252.A O no hydrogen 3.035 N/A TRP 210.A NE1 ALA 237.A O no hydrogen 2.985 N/A MET 211.A N ALA 250.A O no hydrogen 2.615 N/A ARG 212.A N GLN 215.A O no hydrogen 2.915 N/A ARG 212.A NH2 GLU 245.A O no hydrogen 2.775 N/A ARG 212.A NH2 ALA 247.A O no hydrogen 3.358 N/A GLN 217.A N TRP 210.A O no hydrogen 2.642 N/A THR 220.A N GLN 217.A O no hydrogen 3.402 N/A THR 220.A OG1 GLN 217.A O no hydrogen 2.845 N/A HIS 221.A N THR 238.A O no hydrogen 2.852 N/A GLY 223.A N GLN 236.A O no hydrogen 3.016 N/A LEU 226.A N TYR 234.A O no hydrogen 2.721 N/A ASN 228.A N THR 232.A O no hydrogen 2.813 N/A ASN 228.A ND2 THR 232.A OG1 no hydrogen 3.028 N/A THR 232.A OG1 ASP 230.A OD1 no hydrogen 2.547 N/A TRP 233.A N PHE 201.A O no hydrogen 2.929 N/A TRP 233.A NE1 ASP 27.A OD2 no hydrogen 2.793 N/A TYR 234.A N LEU 226.A O no hydrogen 2.660 N/A TYR 234.A OH HIS 197.A ND1 no hydrogen 2.915 N/A TYR 234.A OH GLN 236.A OE1 no hydrogen 2.732 N/A LEU 235.A N VAL 198.A O no hydrogen 2.877 N/A ALA 237.A N CYS 196.A O no hydrogen 3.228 N/A THR 238.A N HIS 221.A O no hydrogen 2.856 N/A LEU 239.A N LEU 194.A O no hydrogen 2.960 N/A VAL 241.A N ARG 192.A O no hydrogen 2.940 N/A ALA 243.A N GLY 190.A O no hydrogen 3.204 N/A GLY 244.A N GLU 246.A OE2 no hydrogen 2.785 N/A LEU 249.A N GLU 246.A O no hydrogen 3.174 N/A ALA 250.A N MET 211.A O no hydrogen 3.042 N/A CYS 251.A N LEU 265.A O no hydrogen 2.756 N/A ARG 252.A N MET 209.A O no hydrogen 2.771 N/A ARG 252.A NE ASP 262.A OD2 no hydrogen 3.000 N/A VAL 253.A N ILE 263.A O no hydrogen 2.970 N/A LYS 254.A N TRP 207.A O no hydrogen 2.693 N/A LYS 254.A NZ ASP 262.A OD2 no hydrogen 2.994 N/A HIS 255.A ND1 SER 257.A OG no hydrogen 2.675 N/A HIS 255.A NE2 PRO 203.A O no hydrogen 2.925 N/A SER 256.A OG GLN 174.A OE1 no hydrogen 3.016 N/A SER 257.A N HIS 255.A ND1 no hydrogen 3.304 N/A SER 257.A OG GLU 175.A O no hydrogen 3.184 N/A SER 257.A OG HIS 255.A ND1 no hydrogen 2.675 N/A LEU 258.A N HIS 255.A O no hydrogen 3.266 N/A ILE 263.A N VAL 253.A O no hydrogen 3.338 N/A LEU 265.A N CYS 251.A O no hydrogen 2.875 N/A TRP 267.A N LEU 249.A O no hydrogen 3.158 N/A LEU 273.A N LEU 269.A O no hydrogen 3.465 N/A ASP 274.A N HIS 270.A O no hydrogen 3.360 N/A ALA 275.A N HIS 271.A O no hydrogen 3.101 N/A GLN 276.A N LEU 273.A O no hydrogen 3.254 N/A LYS 277.A N ASP 274.A O no hydrogen 3.314 N/A HIS 285.A ND1 HIS 282.A O no hydrogen 3.018 N/A