Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4b4o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A N ASP 52.A OD2 no hydrogen 2.784 N/A VAL 2.A N GLU 25.A O no hydrogen 2.819 N/A LEU 3.A N ALA 53.A O no hydrogen 2.972 N/A VAL 4.A N THR 27.A O no hydrogen 2.759 N/A GLY 5.A N VAL 55.A O no hydrogen 2.775 N/A GLY 6.A N VAL 29.A O no hydrogen 2.927 N/A GLY 7.A N VAL 4.A O no hydrogen 3.234 N/A GLY 9.A N GLY 6.A O no hydrogen 3.231 N/A THR 13.A N GLY 9.A O no hydrogen 2.864 N/A THR 13.A OG1 GLY 9.A O no hydrogen 2.644 N/A LEU 15.A N ILE 11.A O no hydrogen 2.853 N/A THR 16.A N GLY 12.A O no hydrogen 2.847 N/A THR 16.A OG1 GLY 12.A O no hydrogen 3.043 N/A GLN 17.A N THR 13.A O no hydrogen 3.159 N/A LEU 18.A N ALA 14.A O no hydrogen 3.091 N/A LEU 19.A N LEU 15.A O no hydrogen 2.882 N/A ASN 20.A N THR 16.A O no hydrogen 2.916 N/A ALA 21.A N GLN 17.A O no hydrogen 3.085 N/A ARG 22.A N LEU 18.A O no hydrogen 3.005 N/A ARG 22.A N LEU 19.A O no hydrogen 3.167 N/A ARG 22.A NE GLU 204.A OE2 no hydrogen 3.072 N/A ARG 22.A NH2 GLU 204.A OE1 no hydrogen 2.775 N/A GLY 23.A N ASN 20.A O no hydrogen 2.964 N/A HIS 24.A N LEU 19.A O no hydrogen 2.996 N/A HIS 24.A NE2 GLU 204.A OE2 no hydrogen 2.735 N/A THR 27.A N VAL 2.A O no hydrogen 2.951 N/A LEU 28.A N GLY 36.A O no hydrogen 2.893 N/A VAL 29.A N VAL 4.A O no hydrogen 2.990 N/A SER 30.A N ILE 38.A O no hydrogen 2.994 N/A SER 30.A OG LYS 32.A O no hydrogen 3.088 N/A LYS 32.A N SER 30.A OG no hydrogen 3.092 N/A ARG 37.A NH1 LYS 32.A O no hydrogen 3.432 N/A ILE 38.A N LEU 28.A O no hydrogen 2.831 N/A THR 39.A N GLU 42.A OE1 no hydrogen 3.496 N/A GLU 42.A N THR 39.A OG1 no hydrogen 3.140 N/A LEU 43.A N THR 39.A O no hydrogen 2.966 N/A ALA 44.A N TRP 40.A O no hydrogen 3.059 N/A ALA 45.A N ASP 41.A O no hydrogen 3.100 N/A SER 46.A N GLU 42.A O no hydrogen 2.994 N/A SER 46.A OG GLU 42.A O no hydrogen 3.043 N/A GLY 47.A N LEU 43.A O no hydrogen 2.930 N/A CYS 51.A SG PRO 49.A O no hydrogen 3.475 N/A CYS 51.A SG ALA 53.A O no hydrogen 3.807 N/A ASP 52.A N ARG 1.A O no hydrogen 2.884 N/A ALA 53.A N ARG 1.A O no hydrogen 3.243 N/A ALA 54.A N ALA 101.A O no hydrogen 3.027 N/A VAL 55.A N LEU 3.A O no hydrogen 2.850 N/A ASN 56.A N VAL 103.A O no hydrogen 3.137 N/A ASN 56.A ND2 THR 84.A OG1 no hydrogen 3.111 N/A ASN 56.A ND2 THR 85.A OG1 no hydrogen 2.978 N/A LEU 57.A N GLY 5.A O no hydrogen 2.680 N/A ALA 58.A N ASN 56.A OD1 no hydrogen 3.144 N/A GLU 60.A N SER 80.A OG no hydrogen 2.972 N/A ASN 64.A N ASN 61.A OD1 no hydrogen 3.050 N/A LEU 66.A N ASN 64.A OD1 no hydrogen 2.918 N/A ARG 67.A N ASN 64.A O no hydrogen 3.095 N/A ARG 67.A NH1 GLU 60.A OE2 no hydrogen 3.061 N/A ARG 67.A NH1 GLU 76.A OE1.A no hydrogen 2.395 N/A ARG 67.A NH2 GLU 76.A OE1.A no hydrogen 2.850 N/A ASN 70.A N ARG 68.A O no hydrogen 2.833 N/A PHE 73.A N ASN 70.A OD1 no hydrogen 2.924 N/A GLN 74.A N ASN 70.A O no hydrogen 2.954 N/A LYS 75.A N GLU 71.A O no hydrogen 2.843 N/A GLU 76.A N THR 72.A O no hydrogen 3.076 N/A VAL 77.A N PHE 73.A O no hydrogen 2.855 N/A LEU 78.A N GLN 74.A O no hydrogen 3.056 N/A GLY 79.A N LYS 75.A O no hydrogen 2.728 N/A SER 80.A N GLU 76.A O no hydrogen 2.948 N/A SER 80.A OG GLU 76.A O no hydrogen 2.751 N/A SER 80.A OG VAL 77.A O no hydrogen 3.181 N/A ARG 81.A N LEU 78.A O no hydrogen 3.187 N/A ARG 81.A NH1 GLU 60.A O no hydrogen 2.788 N/A ARG 81.A NH1 VAL 77.A O no hydrogen 3.072 N/A ARG 81.A NH2 GLU 60.A O no hydrogen 2.899 N/A LEU 82.A N LEU 78.A O no hydrogen 3.017 N/A GLU 83.A N GLY 79.A O no hydrogen 2.908 N/A THR 84.A OG1 SER 80.A O no hydrogen 2.817 N/A THR 84.A OG1 ARG 81.A O no hydrogen 3.411 N/A THR 85.A N ARG 81.A O no hydrogen 3.107 N/A THR 85.A OG1 ARG 81.A O no hydrogen 2.678 N/A GLN 86.A N LEU 82.A O no hydrogen 2.805 N/A LEU 87.A N GLU 83.A O no hydrogen 2.908 N/A LEU 88.A N THR 84.A O no hydrogen 3.117 N/A ALA 89.A N THR 85.A O no hydrogen 2.913 N/A LYS 90.A N GLN 86.A O no hydrogen 2.877 N/A ALA 91.A N LEU 87.A O no hydrogen 3.137 N/A ILE 92.A N LEU 88.A O no hydrogen 2.896 N/A THR 93.A N ALA 89.A O no hydrogen 3.001 N/A THR 93.A OG1 ALA 89.A O no hydrogen 3.328 N/A LYS 94.A N LYS 90.A O no hydrogen 3.076 N/A ALA 95.A N ILE 92.A O no hydrogen 3.214 N/A LYS 100.A N ASP 52.A O no hydrogen 2.746 N/A ALA 101.A N ASP 52.A O no hydrogen 3.459 N/A TRP 102.A N ARG 150.A O no hydrogen 2.850 N/A TRP 102.A NE1 ALA 142.A O no hydrogen 2.749 N/A VAL 103.A N ALA 54.A O no hydrogen 2.937 N/A LEU 104.A N VAL 152.A O no hydrogen 2.957 N/A THR 106.A N VAL 154.A O no hydrogen 2.890 N/A THR 106.A OG1 GLU 139.A OE2 no hydrogen 2.913 N/A VAL 108.A N SER 156.A O no hydrogen 3.111 N/A TYR 110.A N GLY 107.A O no hydrogen 3.376 N/A TYR 111.A N VAL 108.A O no hydrogen 2.911 N/A TYR 111.A OH ASN 213.A OD1 no hydrogen 2.636 N/A GLN 112.A NE2 PRO 113.A O no hydrogen 3.020 N/A SER 114.A N GLY 260.A O no hydrogen 2.959 N/A THR 116.A N SER 114.A OG no hydrogen 3.070 N/A THR 116.A OG1 SER 114.A OG no hydrogen 3.300 N/A ALA 117.A N SER 114.A OG no hydrogen 2.863 N/A TYR 119.A N LYS 262.A O no hydrogen 2.916 N/A TYR 119.A OH GLN 112.A O no hydrogen 2.430 N/A ASP 120.A N SER 123.A OG no hydrogen 2.990 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.840 N/A ASP 122.A N ASP 120.A OD1 no hydrogen 2.989 N/A SER 123.A N ASP 120.A O no hydrogen 2.970 N/A SER 123.A OG ASP 120.A O no hydrogen 3.304 N/A GLY 126.A N TYR 110.A O no hydrogen 2.880 N/A PHE 128.A N SER 132.A OG no hydrogen 3.134 N/A ASP 129.A N SER 132.A OG no hydrogen 2.897 N/A SER 132.A N ASP 129.A OD1 no hydrogen 2.706 N/A SER 132.A OG ASP 129.A O no hydrogen 2.973 N/A SER 132.A OG ASP 129.A OD1 no hydrogen 2.575 N/A ASN 133.A N ASP 129.A O no hydrogen 3.030 N/A LEU 134.A N PHE 130.A O no hydrogen 2.816 N/A VAL 135.A N PHE 131.A O no hydrogen 3.083 N/A THR 136.A N SER 132.A O no hydrogen 3.135 N/A THR 136.A OG1 GLY 126.A O no hydrogen 2.708 N/A THR 136.A OG1 SER 132.A O no hydrogen 3.522 N/A LYS 137.A N ASN 133.A O no hydrogen 3.111 N/A TRP 138.A N LEU 134.A O no hydrogen 2.807 N/A GLU 139.A N VAL 135.A O no hydrogen 2.875 N/A ALA 140.A N THR 136.A O no hydrogen 2.876 N/A ALA 141.A N LYS 137.A O no hydrogen 2.880 N/A ALA 142.A N TRP 138.A O no hydrogen 3.348 N/A ALA 142.A N GLU 139.A O no hydrogen 3.046 N/A ARG 143.A N ALA 140.A O no hydrogen 3.211 N/A LEU 144.A N GLN 151.A OE1 no hydrogen 2.877 N/A THR 149.A OG1 PRO 99.A O no hydrogen 2.630 N/A ARG 150.A N LYS 100.A O no hydrogen 2.886 N/A ARG 150.A NH1 ALA 202.A O no hydrogen 2.961 N/A ARG 150.A NH1 VAL 208.A O no hydrogen 2.686 N/A ARG 150.A NH2 ALA 202.A O no hydrogen 3.006 N/A ARG 150.A NH2 LEU 203.A O no hydrogen 3.379 N/A GLN 151.A NE2 LEU 144.A O no hydrogen 2.798 N/A VAL 152.A N TRP 102.A O no hydrogen 2.987 N/A VAL 153.A N GLY 210.A O no hydrogen 2.887 N/A VAL 154.A N LEU 104.A O no hydrogen 2.780 N/A ARG 155.A N LEU 212.A O no hydrogen 2.848 N/A ARG 155.A NE GLU 139.A OE2 no hydrogen 3.009 N/A ARG 155.A NH1 TYR 111.A OH no hydrogen 2.953 N/A ARG 155.A NH2 GLU 139.A OE1 no hydrogen 3.049 N/A SER 156.A N THR 106.A O no hydrogen 2.946 N/A SER 156.A OG GLY 157.A O no hydrogen 2.822 N/A GLY 157.A N GLY 214.A O no hydrogen 3.012 N/A VAL 158.A N PRO 188.A O no hydrogen 2.984 N/A LEU 160.A N ILE 190.A O no hydrogen 2.801 N/A HIS 168.A N ALA 166.A O no hydrogen 2.924 N/A ARG 173.A N LEU 169.A O no hydrogen 2.925 N/A LEU 174.A N LEU 170.A O no hydrogen 3.037 N/A LEU 174.A N PRO 171.A O no hydrogen 2.991 N/A GLY 175.A N PHE 172.A O no hydrogen 3.007 N/A LEU 176.A N PRO 171.A O no hydrogen 2.910 N/A ILE 180.A N ASN 222.A OD1 no hydrogen 2.837 N/A GLY 181.A N LEU 241.A O no hydrogen 2.831 N/A HIS 184.A N SER 182.A OG no hydrogen 3.117 N/A GLN 185.A N GLN 185.A OE1 no hydrogen 2.685 N/A GLN 185.A NE2 ILE 180.A O no hydrogen 2.795 N/A GLN 185.A NE2 LEU 257.A O no hydrogen 3.121 N/A PHE 187.A N ALA 220.A O no hydrogen 2.952 N/A TRP 189.A NE1 SER 218.A OG no hydrogen 3.104 N/A ILE 190.A N VAL 158.A O no hydrogen 2.816 N/A HIS 191.A NE2 GLU 286.A OE1 no hydrogen 2.804 N/A ILE 192.A N LEU 160.A O no hydrogen 2.917 N/A GLY 193.A N HIS 191.A ND1 no hydrogen 2.923 N/A ASP 194.A N HIS 191.A O no hydrogen 2.796 N/A LEU 195.A N HIS 191.A O no hydrogen 3.085 N/A ALA 196.A N ILE 192.A O no hydrogen 3.000 N/A GLY 197.A N GLY 193.A O no hydrogen 2.933 N/A ILE 198.A N ASP 194.A O no hydrogen 2.902 N/A LEU 199.A N LEU 195.A O no hydrogen 2.997 N/A THR 200.A N ALA 196.A O no hydrogen 3.003 N/A THR 200.A OG1 ALA 196.A O no hydrogen 2.813 N/A HIS 201.A N GLY 197.A O no hydrogen 2.829 N/A HIS 201.A NE2 THR 271.A O no hydrogen 2.837 N/A ALA 202.A N ILE 198.A O no hydrogen 2.835 N/A LEU 203.A N LEU 199.A O no hydrogen 2.959 N/A GLU 204.A N THR 200.A O no hydrogen 2.916 N/A ALA 205.A N HIS 201.A O no hydrogen 2.873 N/A HIS 207.A NE2 THR 271.A O no hydrogen 2.916 N/A VAL 208.A N ALA 205.A O no hydrogen 3.365 N/A HIS 209.A ND1 HIS 207.A O no hydrogen 3.057 N/A GLY 210.A N GLN 151.A O no hydrogen 2.767 N/A LEU 212.A N VAL 153.A O no hydrogen 2.831 N/A ASN 213.A N GLU 121.A OE2 no hydrogen 2.849 N/A ASN 213.A ND2 ILE 264.A O no hydrogen 2.868 N/A GLY 214.A N ARG 155.A O no hydrogen 2.604 N/A ALA 216.A N TRP 189.A O no hydrogen 2.827 N/A SER 218.A N ALA 216.A O no hydrogen 2.713 N/A ALA 220.A N SER 218.A OG no hydrogen 3.195 N/A ASN 222.A N GLN 185.A O no hydrogen 2.832 N/A ALA 223.A N GLY 183.A O no hydrogen 2.741 N/A GLU 224.A N THR 221.A OG1 no hydrogen 3.154 N/A PHE 225.A N THR 221.A O no hydrogen 2.933 N/A ALA 226.A N ASN 222.A O no hydrogen 3.027 N/A GLN 227.A N ALA 223.A O no hydrogen 3.104 N/A THR 228.A N GLU 224.A O no hydrogen 2.951 N/A THR 228.A OG1 GLU 224.A O no hydrogen 2.765 N/A PHE 229.A N PHE 225.A O no hydrogen 2.923 N/A GLY 230.A N ALA 226.A O no hydrogen 2.949 N/A ALA 231.A N GLN 227.A O no hydrogen 2.935 N/A ALA 232.A N THR 228.A O no hydrogen 2.958 N/A LEU 233.A N PHE 229.A O no hydrogen 3.055 N/A LEU 233.A N GLY 230.A O no hydrogen 3.085 N/A GLY 234.A N ALA 231.A O no hydrogen 3.054 N/A ARG 235.A N GLY 230.A O no hydrogen 2.923 N/A ARG 235.A NE ARG 173.A O no hydrogen 2.704 N/A ARG 235.A NH1 GLY 234.A O no hydrogen 3.345 N/A ARG 235.A NH2 ARG 173.A O no hydrogen 3.569 N/A ILE 239.A N GLY 177.A O no hydrogen 3.120 N/A LEU 241.A N PRO 179.A O no hydrogen 2.845 N/A VAL 245.A N PRO 242.A O no hydrogen 3.271 N/A VAL 246.A N PRO 242.A O no hydrogen 3.252 N/A GLN 247.A N SER 243.A O no hydrogen 2.882 N/A ALA 248.A N ALA 244.A O no hydrogen 2.921 N/A VAL 249.A N VAL 245.A O no hydrogen 3.127 N/A PHE 250.A N VAL 246.A O no hydrogen 2.962 N/A GLY 251.A N GLN 247.A O no hydrogen 2.747 N/A ARG 254.A NE PHE 250.A O no hydrogen 2.950 N/A ARG 254.A NH1 ILE 62.A O no hydrogen 2.762 N/A ARG 254.A NH1 ASN 64.A O no hydrogen 3.103 N/A ARG 254.A NH2 ARG 67.A O no hydrogen 2.814 N/A ARG 254.A NH2 PHE 250.A O no hydrogen 3.310 N/A ALA 255.A N GLY 251.A O no hydrogen 2.932 N/A LEU 258.A N ALA 255.A O no hydrogen 2.746 N/A GLU 259.A N ILE 256.A O no hydrogen 3.132 N/A GLN 261.A NE2 TYR 111.A O no hydrogen 3.463 N/A LYS 262.A NZ GLU 118.A OE1 no hydrogen 3.363 N/A ILE 264.A N TYR 119.A O no hydrogen 2.805 N/A ARG 266.A NE ASP 120.A OD2 no hydrogen 2.742 N/A ARG 266.A NH2 ASP 120.A OD2 no hydrogen 2.867 N/A ARG 267.A N GLU 121.A OE1 no hydrogen 2.948 N/A ARG 267.A NE VAL 211.A O no hydrogen 2.967 N/A ARG 267.A NH2 VAL 211.A O no hydrogen 3.513 N/A THR 268.A N GLU 121.A OE2 no hydrogen 3.433 N/A THR 268.A OG1 GLU 121.A OE2 no hydrogen 3.322 N/A THR 268.A OG1 ASN 213.A O no hydrogen 2.689 N/A LEU 269.A N PRO 265.A O no hydrogen 3.106 N/A ALA 270.A N ARG 266.A O no hydrogen 3.041 N/A THR 271.A N ARG 267.A O no hydrogen 3.160 N/A THR 271.A N THR 268.A O no hydrogen 3.189 N/A THR 271.A OG1 THR 268.A O no hydrogen 2.654 N/A GLY 272.A N LEU 269.A O no hydrogen 3.065 N/A TYR 273.A N THR 271.A OG1 no hydrogen 3.276 N/A TYR 273.A OH ASP 194.A OD1 no hydrogen 2.709 N/A TYR 275.A OH VAL 215.A O no hydrogen 2.628 N/A SER 276.A N ASP 194.A OD1 no hydrogen 2.782 N/A PHE 277.A N ASP 194.A OD2 no hydrogen 2.879 N/A GLY 281.A N GLU 279.A OE2.A no hydrogen 2.897 N/A ALA 283.A N GLU 279.A O no hydrogen 3.166 N/A LEU 284.A N LEU 280.A O no hydrogen 2.924 N/A LYS 285.A N GLY 281.A O no hydrogen 2.959 N/A LYS 285.A NZ GLU 289.A OE1 no hydrogen 3.395 N/A LYS 285.A NZ GLU 289.A OE2 no hydrogen 2.915 N/A GLU 286.A N ALA 282.A O no hydrogen 3.174 N/A ILE 287.A N ALA 283.A O no hydrogen 3.255 N/A ALA 288.A N LEU 284.A O no hydrogen 2.834 N/A GLU 289.A N LYS 285.A O no hydrogen 2.922 N/A ASN 290.A ND2 GLU 286.A O no hydrogen 2.610 N/A