Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w2e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N ILE 40.A O no hydrogen 2.888 N/A THR 5.A OG1 ILE 40.A O no hydrogen 3.013 N/A LEU 6.A N LEU 41.A O no hydrogen 2.974 N/A GLU 7.A N TYR 13.A OH no hydrogen 3.212 N/A ASP 10.A N ASN 8.A OD1 no hydrogen 2.773 N/A ILE 11.A N ASN 8.A O no hydrogen 3.137 N/A TYR 13.A N PHE 112.A O no hydrogen 2.872 N/A LEU 15.A N ILE 110.A O no hydrogen 2.920 N/A LEU 17.A N ASP 108.A O no hydrogen 2.800 N/A ILE 18.A N ARG 31.A O no hydrogen 2.895 N/A ASP 19.A N ARG 31.A O no hydrogen 3.278 N/A LYS 20.A NZ GLU 102.A OE1 no hydrogen 3.006 N/A GLU 21.A N ARG 29.A O no hydrogen 2.869 N/A VAL 23.A N THR 27.A O no hydrogen 2.900 N/A ASN 24.A N THR 27.A O no hydrogen 3.248 N/A ASN 24.A ND2 LYS 184.A O no hydrogen 3.001 N/A HIS 25.A NE2 ASP 185.A OD1 no hydrogen 2.701 N/A ASP 26.A N ASN 24.A OD1 no hydrogen 3.351 N/A THR 27.A N ASN 24.A OD1 no hydrogen 2.928 N/A THR 27.A OG1 ASN 24.A OD1 no hydrogen 3.177 N/A THR 27.A OG1 ASP 26.A OD1 no hydrogen 3.054 N/A ARG 28.A N ILE 80.A O no hydrogen 2.863 N/A ARG 28.A NE GLU 102.A OE1 no hydrogen 2.944 N/A ARG 28.A NE GLU 102.A OE2 no hydrogen 3.122 N/A ARG 28.A NH1 GLU 102.A OE2 no hydrogen 2.986 N/A ARG 28.A NH2 ASN 24.A O no hydrogen 3.125 N/A ARG 28.A NH2 THR 27.A O no hydrogen 3.402 N/A ARG 29.A N GLU 21.A O no hydrogen 2.784 N/A ARG 29.A NH1 ASP 77.A OD1 no hydrogen 3.045 N/A ARG 29.A NH1 ASP 77.A OD2 no hydrogen 3.461 N/A ARG 29.A NH2 GLU 21.A OE1 no hydrogen 3.464 N/A PHE 30.A N LEU 78.A O no hydrogen 2.921 N/A ARG 31.A N ASP 19.A O no hydrogen 2.819 N/A ARG 31.A NE ASP 77.A OD1 no hydrogen 2.908 N/A ARG 31.A NH2 ASP 77.A OD2 no hydrogen 3.100 N/A PHE 32.A N VAL 76.A O no hydrogen 2.929 N/A ALA 33.A N ARG 16.A O no hydrogen 2.862 N/A LEU 34.A N GLY 74.A O no hydrogen 2.881 N/A SER 36.A OG HIS 39.A ND1 no hydrogen 2.688 N/A GLU 38.A N SER 36.A OG no hydrogen 3.236 N/A HIS 39.A N SER 36.A O no hydrogen 3.079 N/A HIS 39.A ND1 SER 36.A OG no hydrogen 2.688 N/A ILE 40.A N ALA 3.A O no hydrogen 2.848 N/A GLY 42.A N ASP 70.A OD1 no hydrogen 2.802 N/A LEU 43.A N ASP 70.A OD1 no hydrogen 3.261 N/A LEU 43.A N ASP 70.A OD2 no hydrogen 2.747 N/A GLY 46.A N GLN 159.A OE1 no hydrogen 2.731 N/A GLN 47.A N PRO 44.A O no hydrogen 3.109 N/A GLN 47.A NE2 GLY 117.A O no hydrogen 2.962 N/A HIS 48.A N ASN 116.A O no hydrogen 2.890 N/A HIS 48.A NE2 TYR 50.A OH no hydrogen 3.012 N/A ILE 49.A N TYR 64.A O no hydrogen 2.879 N/A TYR 50.A N ARG 113.A O no hydrogen 2.863 N/A LEU 51.A N ARG 62.A O no hydrogen 2.759 N/A SER 52.A N GLU 111.A O no hydrogen 3.249 N/A ALA 53.A N VAL 60.A O no hydrogen 3.020 N/A ILE 55.A N ASN 58.A O no hydrogen 2.776 N/A ASN 58.A N ILE 55.A O no hydrogen 3.013 N/A VAL 60.A N ALA 53.A O no hydrogen 2.826 N/A ARG 62.A N LEU 51.A O no hydrogen 2.959 N/A ARG 62.A NH1 ILE 61.A O no hydrogen 2.833 N/A TYR 64.A N ILE 49.A O no hydrogen 2.932 N/A VAL 67.A N ASP 77.A O no hydrogen 3.154 N/A SER 69.A N ASP 72.A OD2 no hydrogen 2.714 N/A SER 69.A OG ASP 71.A OD2 no hydrogen 3.524 N/A SER 69.A OG ASP 72.A OD2 no hydrogen 3.484 N/A ASP 71.A N SER 69.A OG no hydrogen 3.104 N/A ASP 72.A N SER 69.A O no hydrogen 2.946 N/A GLY 74.A N HIS 39.A O no hydrogen 2.769 N/A VAL 76.A N PHE 32.A O no hydrogen 2.930 N/A ASP 77.A N SER 68.A OG no hydrogen 3.257 N/A LEU 78.A N PHE 30.A O no hydrogen 2.884 N/A ILE 80.A N ARG 28.A O no hydrogen 2.838 N/A VAL 82.A N ASP 26.A O no hydrogen 2.660 N/A TYR 83.A N SER 98.A OG no hydrogen 3.017 N/A LYS 85.A N GLN 99.A OE1 no hydrogen 2.880 N/A ASP 86.A N PRO 92.A O no hydrogen 2.906 N/A THR 87.A OG1 LYS 85.A O no hydrogen 2.857 N/A LYS 90.A N HIS 88.A ND1 no hydrogen 3.123 N/A PHE 91.A N HIS 88.A O no hydrogen 2.762 N/A GLY 94.A N PHE 91.A O no hydrogen 2.916 N/A GLY 95.A N TYR 83.A O no hydrogen 2.716 N/A GLN 99.A N GLY 95.A O no hydrogen 3.440 N/A GLN 99.A NE2 ALA 93.A O no hydrogen 3.014 N/A GLN 99.A NE2 GLY 95.A O no hydrogen 2.796 N/A TYR 100.A N LYS 96.A O no hydrogen 3.142 N/A LEU 101.A N MET 97.A O no hydrogen 2.830 N/A GLU 102.A N SER 98.A O no hydrogen 2.939 N/A SER 103.A N GLN 99.A O no hydrogen 2.994 N/A SER 103.A N TYR 100.A O no hydrogen 3.154 N/A SER 103.A OG GLN 99.A O no hydrogen 3.457 N/A SER 103.A OG TYR 100.A O no hydrogen 2.633 N/A MET 104.A N LEU 101.A O no hydrogen 3.098 N/A LYS 105.A N ASP 108.A OD2 no hydrogen 2.964 N/A GLY 107.A N LEU 17.A O no hydrogen 2.749 N/A ASP 108.A N LYS 105.A O no hydrogen 2.905 N/A ILE 110.A N LEU 15.A O no hydrogen 3.078 N/A PHE 112.A N TYR 13.A O no hydrogen 2.841 N/A ARG 113.A N TYR 50.A O no hydrogen 3.014 N/A ARG 113.A NH2 SER 52.A OG no hydrogen 2.978 N/A ASN 116.A N HIS 48.A O no hydrogen 2.914 N/A VAL 120.A N ALA 128.A O no hydrogen 2.758 N/A TYR 121.A N VAL 45.A O no hydrogen 2.776 N/A TYR 121.A OH ASP 170.A OD2 no hydrogen 2.600 N/A TYR 121.A OH THR 172.A OG1 no hydrogen 3.297 N/A GLN 122.A N LYS 126.A O no hydrogen 2.682 N/A LYS 124.A N ASP 170.A OD2 no hydrogen 3.001 N/A LYS 124.A NZ ASP 167.A OD2 no hydrogen 2.689 N/A GLY 125.A N TYR 121.A OH no hydrogen 2.798 N/A LYS 126.A N GLY 123.A O no hydrogen 3.058 N/A PHE 127.A N LYS 140.A O no hydrogen 2.670 N/A ALA 128.A N VAL 120.A O no hydrogen 2.675 N/A ILE 129.A N VAL 138.A O no hydrogen 3.005 N/A ARG 130.A N LEU 118.A O no hydrogen 2.881 N/A ARG 130.A NH1 SER 135.A O no hydrogen 2.954 N/A ASP 132.A N SER 135.A OG no hydrogen 3.085 N/A LYS 134.A N ASP 132.A OD1 no hydrogen 3.150 N/A LYS 134.A NZ ASP 132.A OD2 no hydrogen 2.603 N/A SER 135.A N ASP 132.A O no hydrogen 3.269 N/A SER 135.A OG ASP 132.A O no hydrogen 3.184 N/A SER 135.A OG ASP 132.A OD1 no hydrogen 2.732 N/A VAL 138.A N ILE 129.A O no hydrogen 2.752 N/A LYS 140.A N PHE 127.A O no hydrogen 2.801 N/A LYS 140.A NZ GLU 266.A O no hydrogen 3.044 N/A LYS 140.A NZ GLU 266.A OE2 no hydrogen 2.481 N/A VAL 142.A N GLY 125.A O no hydrogen 2.885 N/A VAL 145.A N VAL 173.A O no hydrogen 2.975 N/A GLY 146.A N LEU 240.A O no hydrogen 2.680 N/A MET 147.A N HIS 175.A O no hydrogen 2.736 N/A ILE 148.A N LEU 242.A O no hydrogen 2.883 N/A ALA 149.A N LEU 177.A O no hydrogen 2.928 N/A GLY 150.A N CYS 244.A O no hydrogen 2.952 N/A GLY 151.A N ALA 179.A O no hydrogen 2.894 N/A GLY 153.A N GLY 150.A O no hydrogen 2.937 N/A ILE 154.A N GLY 151.A O no hydrogen 3.126 N/A THR 155.A N THR 152.A O no hydrogen 3.099 N/A THR 155.A OG1 THR 152.A O no hydrogen 3.182 N/A LEU 158.A N ILE 154.A O no hydrogen 2.912 N/A GLN 159.A N THR 155.A O no hydrogen 3.222 N/A GLN 159.A NE2 GLN 47.A O no hydrogen 2.980 N/A GLN 159.A NE2 PRO 66.A O no hydrogen 2.915 N/A VAL 160.A N PRO 156.A O no hydrogen 3.322 N/A ILE 161.A N MET 157.A O no hydrogen 2.818 N/A ARG 162.A N LEU 158.A O no hydrogen 2.907 N/A ALA 163.A N GLN 159.A O no hydrogen 3.060 N/A ILE 164.A N VAL 160.A O no hydrogen 2.980 N/A MET 165.A N ILE 161.A O no hydrogen 2.976 N/A LYS 166.A N ARG 162.A O no hydrogen 3.144 N/A LYS 166.A NZ ASP 71.A OD2 no hydrogen 2.482 N/A ASP 167.A N ILE 164.A O no hydrogen 3.050 N/A ASP 169.A N ASP 167.A OD1 no hydrogen 2.971 N/A ASP 170.A N ASP 167.A O no hydrogen 2.770 N/A THR 172.A N ASP 170.A OD1 no hydrogen 3.148 N/A THR 172.A OG1 TYR 121.A OH no hydrogen 3.297 N/A THR 172.A OG1 ASP 170.A OD1 no hydrogen 2.602 N/A VAL 173.A N LYS 143.A O no hydrogen 3.044 N/A CYS 174.A N ARG 202.A O no hydrogen 2.610 N/A HIS 175.A N VAL 145.A O no hydrogen 2.905 N/A LEU 176.A N LYS 204.A O no hydrogen 2.815 N/A LEU 177.A N MET 147.A O no hydrogen 2.717 N/A PHE 178.A N TRP 206.A O no hydrogen 2.970 N/A ALA 179.A N ALA 149.A O no hydrogen 2.690 N/A ASN 180.A N THR 208.A O no hydrogen 3.115 N/A THR 182.A OG1 ASP 185.A OD2 no hydrogen 2.569 N/A LYS 184.A NZ THR 182.A OG1 no hydrogen 3.014 N/A ASP 185.A N THR 182.A O no hydrogen 2.862 N/A ILE 186.A N GLU 183.A O no hydrogen 3.122 N/A ARG 189.A NE GLU 193.A OE2 no hydrogen 2.775 N/A ARG 189.A NH1 GLU 183.A OE2 no hydrogen 2.686 N/A GLU 191.A N GLU 191.A OE1 no hydrogen 2.746 N/A LEU 192.A N LEU 188.A O no hydrogen 2.887 N/A GLU 193.A N ARG 189.A O no hydrogen 2.895 N/A GLU 194.A N PRO 190.A O no hydrogen 2.876 N/A LEU 195.A N GLU 191.A O no hydrogen 3.068 N/A ARG 196.A N LEU 192.A O no hydrogen 3.024 N/A ARG 196.A NH1 TYR 218.A OH no hydrogen 2.904 N/A ASN 197.A N GLU 193.A O no hydrogen 2.951 N/A GLU 198.A N GLU 194.A O no hydrogen 2.937 N/A HIS 199.A N LEU 195.A O no hydrogen 2.877 N/A ARG 202.A N HIS 199.A O no hydrogen 2.994 N/A ARG 202.A NH1 ILE 164.A O no hydrogen 3.150 N/A ARG 202.A NH1 ASP 167.A O no hydrogen 3.064 N/A ARG 202.A NH1 ASP 170.A O no hydrogen 2.713 N/A ARG 202.A NH2 MET 165.A O no hydrogen 3.057 N/A ARG 202.A NH2 HIS 199.A ND1 no hydrogen 3.301 N/A LYS 204.A N CYS 174.A O no hydrogen 2.680 N/A LYS 204.A NZ SER 200.A O no hydrogen 2.726 N/A TRP 206.A N LEU 176.A O no hydrogen 2.982 N/A TRP 206.A NE1 SER 219.A OG no hydrogen 3.015 N/A TYR 207.A OH GLU 193.A OE2 no hydrogen 2.783 N/A THR 208.A N PHE 178.A O no hydrogen 3.045 N/A THR 208.A OG1 GLY 221.A O no hydrogen 2.750 N/A VAL 209.A N SER 219.A O no hydrogen 3.313 N/A ASP 210.A N ASN 180.A O no hydrogen 2.924 N/A ARG 211.A N GLN 181.A O no hydrogen 3.035 N/A TRP 216.A NE1 SER 219.A O no hydrogen 2.669 N/A SER 219.A N TYR 207.A O no hydrogen 2.937 N/A GLN 220.A NE2 ASP 210.A O no hydrogen 2.826 N/A GLY 221.A N VAL 209.A O no hydrogen 2.631 N/A MET 227.A N ASN 224.A OD1 no hydrogen 2.946 N/A ILE 228.A N ASN 224.A O no hydrogen 3.270 N/A ARG 229.A N GLU 225.A O no hydrogen 2.934 N/A ARG 229.A NH2 GLU 225.A OE2 no hydrogen 2.545 N/A ASP 230.A N GLU 226.A O no hydrogen 2.859 N/A LEU 232.A N ILE 228.A O no hydrogen 3.209 N/A GLU 237.A N PRO 234.A O no hydrogen 3.081 N/A GLU 238.A N PRO 235.A O no hydrogen 2.870 N/A VAL 241.A N ARG 267.A O no hydrogen 2.788 N/A LEU 242.A N GLY 146.A O no hydrogen 2.710 N/A MET 243.A N PHE 269.A O no hydrogen 2.869 N/A CYS 244.A N ILE 148.A O no hydrogen 2.884 N/A ILE 250.A N PRO 246.A O no hydrogen 3.165 N/A GLN 251.A N PRO 247.A O no hydrogen 2.799 N/A TYR 252.A N PRO 248.A O no hydrogen 2.747 N/A ALA 253.A N MET 249.A O no hydrogen 2.948 N/A CYS 254.A N MET 249.A O no hydrogen 2.882 N/A CYS 254.A SG MET 249.A O no hydrogen 3.641 N/A LEU 255.A N ILE 250.A O no hydrogen 3.009 N/A ASN 257.A ND2 VAL 223.A O no hydrogen 3.602 N/A ASN 257.A ND2 ALA 253.A O no hydrogen 2.829 N/A LEU 258.A N CYS 254.A O no hydrogen 2.767 N/A GLU 259.A N LEU 255.A O no hydrogen 3.030 N/A ARG 260.A N PRO 256.A O no hydrogen 2.934 N/A ARG 260.A NH1 ASN 257.A OD1 no hydrogen 2.590 N/A VAL 261.A N ASN 257.A O no hydrogen 2.973 N/A GLY 262.A N LEU 258.A O no hydrogen 2.949 N/A HIS 263.A N LEU 258.A O no hydrogen 2.876 N/A ARG 267.A N PRO 264.A O no hydrogen 3.090 N/A ARG 267.A NE GLU 266.A OE1 no hydrogen 2.855 N/A ARG 267.A NH1 GLU 238.A O no hydrogen 2.974 N/A ARG 267.A NH2 GLU 266.A OE2 no hydrogen 3.467 N/A CYS 268.A N LYS 265.A O no hydrogen 2.923 N/A CYS 268.A SG PRO 264.A O no hydrogen 3.389 N/A PHE 269.A N VAL 241.A O no hydrogen 2.845 N/A PHE 271.A N MET 243.A O no hydrogen 2.955 N/A