Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7b44_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N LEU 1.A O no hydrogen 3.156 N/A ASN 5.A ND2 GLU 7.A OE2 no hydrogen 2.770 N/A LEU 8.A N ASN 5.A OD1 no hydrogen 2.863 N/A VAL 9.A N ASN 5.A O no hydrogen 2.952 N/A GLN 10.A N PRO 6.A O no hydrogen 2.961 N/A ALA 11.A N GLU 7.A O no hydrogen 3.063 N/A VAL 12.A N LEU 8.A O no hydrogen 3.021 N/A GLN 13.A N GLN 10.A O no hydrogen 3.452 N/A VAL 15.A N VAL 12.A O no hydrogen 2.808 N/A VAL 16.A N VAL 12.A O no hydrogen 3.156 N/A VAL 16.A N GLN 13.A O no hydrogen 3.211 N/A ILE 17.A N ILE 91.A O no hydrogen 2.783 N/A SER 21.A N GLY 18.A O no hydrogen 2.924 N/A LEU 22.A N PRO 19.A O no hydrogen 3.490 N/A ILE 23.A N THR 42.A O no hydrogen 2.853 N/A HIS 25.A N HIS 40.A O no hydrogen 2.972 N/A GLU 28.A N HIS 25.A O no hydrogen 3.115 N/A ILE 30.A N VAL 38.A O no hydrogen 2.840 N/A HIS 34.A N GLY 31.A O no hydrogen 2.815 N/A GLY 36.A N GLY 33.A O no hydrogen 3.119 N/A CYS 37.A SG SER 57.A O no hydrogen 3.436 N/A VAL 38.A N GLY 36.A O no hydrogen 3.053 N/A TYR 39.A N VAL 55.A O no hydrogen 2.757 N/A HIS 40.A N GLU 28.A O no hydrogen 3.101 N/A HIS 40.A ND1 HIS 52.A NE2 no hydrogen 2.762 N/A GLY 41.A N CYS 53.A O no hydrogen 2.977 N/A THR 42.A N ILE 23.A O no hydrogen 2.790 N/A LEU 43.A N ILE 51.A O no hydrogen 2.836 N/A LEU 44.A N SER 21.A O no hydrogen 2.893 N/A ASP 45.A N LYS 49.A O no hydrogen 3.152 N/A ASP 47.A N ASP 45.A OD1 no hydrogen 3.101 N/A GLY 48.A N ASP 45.A O no hydrogen 2.815 N/A LYS 49.A N ASP 45.A OD1 no hydrogen 2.806 N/A ILE 51.A N LEU 43.A O no hydrogen 2.784 N/A HIS 52.A NE2 HIS 40.A ND1 no hydrogen 2.762 N/A CYS 53.A N GLY 41.A O no hydrogen 3.006 N/A ALA 54.A N LEU 100.A O no hydrogen 2.712 N/A VAL 55.A N TYR 39.A O no hydrogen 2.726 N/A LYS 56.A N VAL 98.A O no hydrogen 2.917 N/A LYS 56.A NZ ARG 170.A O no hydrogen 2.906 N/A LYS 56.A NZ ASP 171.A O no hydrogen 3.142 N/A SER 57.A OG ASN 59.A OD1 no hydrogen 3.388 N/A LEU 58.A N PRO 96.A O no hydrogen 2.836 N/A ILE 61.A N LEU 58.A O no hydrogen 3.370 N/A THR 62.A N GLU 66.A OE1 no hydrogen 2.902 N/A THR 62.A OG1 GLU 66.A OE1 no hydrogen 3.164 N/A GLU 66.A N ASP 63.A O no hydrogen 3.153 N/A GLU 66.A N ASP 63.A OD1 no hydrogen 2.830 N/A VAL 67.A N ASP 63.A O no hydrogen 3.134 N/A SER 68.A N ILE 64.A O no hydrogen 2.923 N/A SER 68.A OG ILE 64.A O no hydrogen 2.768 N/A GLN 69.A N GLY 65.A O no hydrogen 3.182 N/A PHE 70.A N GLU 66.A O no hydrogen 2.965 N/A LEU 71.A N VAL 67.A O no hydrogen 2.899 N/A THR 72.A N SER 68.A O no hydrogen 3.185 N/A THR 72.A OG1 SER 68.A O no hydrogen 3.143 N/A GLU 73.A N GLN 69.A O no hydrogen 3.013 N/A GLY 74.A N PHE 70.A O no hydrogen 2.968 N/A ILE 75.A N LEU 71.A O no hydrogen 2.894 N/A ILE 76.A N THR 72.A O no hydrogen 2.950 N/A MET 77.A N GLU 73.A O no hydrogen 2.960 N/A LYS 78.A N GLY 74.A O no hydrogen 2.990 N/A LYS 78.A NZ HIS 14.A O no hydrogen 3.443 N/A ASP 79.A N ILE 76.A O no hydrogen 3.208 N/A PHE 80.A N MET 77.A O no hydrogen 2.973 N/A SER 81.A N TYR 137.A OH no hydrogen 3.036 N/A ASN 84.A N HIS 82.A ND1 no hydrogen 2.829 N/A ASN 84.A ND2 VAL 161.A O no hydrogen 2.956 N/A VAL 85.A N HIS 82.A O no hydrogen 3.204 N/A LEU 86.A N VAL 163.A O no hydrogen 2.827 N/A LEU 89.A N VAL 99.A O no hydrogen 2.822 N/A GLY 90.A N VAL 99.A O no hydrogen 3.340 N/A ILE 91.A N VAL 15.A O no hydrogen 2.991 N/A CYS 92.A N LEU 97.A O no hydrogen 2.920 N/A CYS 92.A SG.A ILE 17.A O no hydrogen 3.354 N/A CYS 92.A SG.B ILE 17.A O no hydrogen 3.491 N/A SER 95.A OG ASN 59.A OD1 no hydrogen 2.905 N/A LEU 97.A N CYS 92.A O no hydrogen 2.897 N/A VAL 98.A N LYS 56.A O no hydrogen 2.866 N/A VAL 99.A N GLY 90.A O no hydrogen 2.878 N/A LEU 100.A N ALA 54.A O no hydrogen 2.766 N/A TYR 102.A N HIS 52.A O no hydrogen 3.373 N/A HIS 105.A N LEU 155.A O no hydrogen 2.905 N/A GLY 106.A N MET 103.A O no hydrogen 3.289 N/A LEU 108.A N CYS 153.A O no hydrogen 2.877 N/A ASN 110.A N ASP 107.A OD2 no hydrogen 2.998 N/A PHE 111.A N ASP 107.A O no hydrogen 3.058 N/A ILE 112.A N LEU 108.A O no hydrogen 3.044 N/A ARG 113.A N ARG 109.A O no hydrogen 3.110 N/A ARG 113.A NH2 GLY 216.A O no hydrogen 2.994 N/A ASN 114.A N ASN 110.A O no hydrogen 3.026 N/A ASN 114.A N PHE 111.A O no hydrogen 3.367 N/A THR 116.A N ASN 114.A OD1 no hydrogen 3.067 N/A THR 116.A OG1 ASN 114.A OD1 no hydrogen 2.730 N/A HIS 117.A N ASN 114.A O no hydrogen 3.189 N/A THR 120.A N ASP 123.A OD2 no hydrogen 2.961 N/A LYS 122.A NZ PHE 277.A O no hydrogen 3.143 N/A LYS 122.A NZ PHE 280.A O no hydrogen 3.064 N/A ASP 123.A N THR 120.A OG1 no hydrogen 3.223 N/A LEU 124.A N THR 120.A O no hydrogen 3.059 N/A ILE 125.A N VAL 121.A O no hydrogen 2.945 N/A GLY 126.A N LYS 122.A O no hydrogen 2.873 N/A PHE 127.A N ASP 123.A O no hydrogen 2.886 N/A GLY 128.A N LEU 124.A O no hydrogen 3.161 N/A LEU 129.A N ILE 125.A O no hydrogen 2.882 N/A GLN 130.A N GLY 126.A O no hydrogen 3.032 N/A GLN 130.A NE2 GLY 126.A O no hydrogen 3.521 N/A VAL 131.A N PHE 127.A O no hydrogen 2.973 N/A ALA 132.A N GLY 128.A O no hydrogen 2.860 N/A LYS 133.A N LEU 129.A O no hydrogen 2.910 N/A GLY 134.A N GLN 130.A O no hydrogen 3.025 N/A MET 135.A N VAL 131.A O no hydrogen 2.935 N/A LYS 136.A N ALA 132.A O no hydrogen 2.767 N/A TYR 137.A N LYS 133.A O no hydrogen 3.045 N/A LEU 138.A N GLY 134.A O no hydrogen 3.002 N/A ALA 139.A N MET 135.A O no hydrogen 2.804 N/A SER 140.A N LYS 136.A O no hydrogen 2.974 N/A SER 140.A OG TYR 137.A O no hydrogen 2.638 N/A LYS 141.A N LEU 138.A O no hydrogen 3.070 N/A LYS 141.A NZ ASP 79.A O no hydrogen 2.874 N/A LYS 141.A NZ TYR 137.A OH no hydrogen 3.390 N/A LYS 142.A N ALA 139.A O no hydrogen 2.891 N/A PHE 143.A N LEU 138.A O no hydrogen 2.922 N/A HIS 145.A N ASP 201.A OD2 no hydrogen 2.816 N/A HIS 145.A NE2 ALA 164.A O no hydrogen 2.724 N/A ARG 146.A N ASP 201.A OD1 no hydrogen 2.934 N/A ASP 147.A N HIS 145.A ND1 no hydrogen 2.983 N/A ALA 150.A N GLU 211.A OE1 no hydrogen 2.810 N/A ARG 151.A NH1 ASP 147.A OD1 no hydrogen 3.209 N/A ASN 152.A N ALA 149.A O no hydrogen 2.933 N/A ASN 152.A ND2 ASP 147.A O no hydrogen 2.763 N/A CYS 153.A N ALA 150.A O no hydrogen 3.297 N/A CYS 153.A SG ALA 149.A O no hydrogen 3.824 N/A MET 154.A N LYS 162.A O no hydrogen 2.850 N/A LEU 155.A N GLY 106.A O no hydrogen 2.848 N/A ASP 156.A N THR 160.A O no hydrogen 3.069 N/A GLU 157.A N GLU 157.A OE1 no hydrogen 2.830 N/A LYS 158.A N ASP 156.A OD1 no hydrogen 2.870 N/A LYS 158.A NZ GLU 157.A OE2 no hydrogen 2.803 N/A PHE 159.A N ASP 156.A O no hydrogen 2.955 N/A THR 160.A N ASP 156.A OD1 no hydrogen 2.981 N/A VAL 161.A N GLN 130.A OE1 no hydrogen 2.731 N/A LYS 162.A N MET 154.A O no hydrogen 2.813 N/A LYS 162.A NZ PRO 83.A O no hydrogen 2.787 N/A VAL 163.A N ASN 84.A O no hydrogen 2.882 N/A ALA 164.A N ASN 152.A O no hydrogen 2.866 N/A ALA 169.A N PHE 166.A O no hydrogen 2.999 N/A ARG 170.A N GLY 167.A O no hydrogen 3.292 N/A ARG 170.A NH1 GLU 73.A OE1 no hydrogen 3.480 N/A ARG 170.A NH2 GLU 73.A OE1 no hydrogen 2.985 N/A MET 172.A N ASP 165.A OD1 no hydrogen 3.427 N/A TYR 173.A OH ARG 151.A O no hydrogen 2.672 N/A ASP 174.A N ASP 171.A O no hydrogen 3.289 N/A LYS 175.A NZ HIS 34.A O no hydrogen 2.849 N/A LYS 175.A NZ TYR 173.A O no hydrogen 3.168 N/A LYS 184.A NZ TYR 220.A O no hydrogen 2.911 N/A LYS 184.A NZ VAL 223.A O no hydrogen 2.861 N/A TRP 185.A N PRO 182.A O no hydrogen 2.935 N/A TRP 185.A NE1 GLU 211.A OE1 no hydrogen 2.843 N/A MET 186.A N VAL 183.A O no hydrogen 3.146 N/A GLU 189.A N GLU 189.A OE2 no hydrogen 2.783 N/A SER 190.A N ALA 187.A O no hydrogen 2.964 N/A SER 190.A OG LYS 195.A O no hydrogen 2.732 N/A LEU 191.A N ALA 187.A O no hydrogen 3.058 N/A GLN 192.A N LEU 188.A O no hydrogen 3.117 N/A THR 193.A N GLU 189.A O no hydrogen 2.846 N/A THR 193.A OG1 GLU 189.A O no hydrogen 2.745 N/A GLN 194.A N SER 190.A O no hydrogen 2.816 N/A LYS 195.A N THR 193.A OG1 no hydrogen 3.311 N/A THR 197.A N SER 200.A OG no hydrogen 2.773 N/A LYS 199.A NZ ARG 263.A O no hydrogen 2.953 N/A SER 200.A N THR 197.A O no hydrogen 2.998 N/A SER 200.A N THR 197.A OG1 no hydrogen 3.129 N/A SER 200.A OG THR 197.A O no hydrogen 2.740 N/A ASP 201.A N THR 197.A O no hydrogen 3.033 N/A VAL 202.A N THR 198.A O no hydrogen 2.947 N/A TRP 203.A N LYS 199.A O no hydrogen 3.331 N/A SER 204.A N SER 200.A O no hydrogen 3.195 N/A SER 204.A OG TRP 185.A O no hydrogen 2.679 N/A SER 204.A OG SER 200.A O no hydrogen 3.391 N/A PHE 205.A N ASP 201.A O no hydrogen 2.836 N/A GLY 206.A N VAL 202.A O no hydrogen 3.039 N/A VAL 207.A N TRP 203.A O no hydrogen 3.266 N/A LEU 208.A N SER 204.A O no hydrogen 2.896 N/A LEU 209.A N PHE 205.A O no hydrogen 2.850 N/A TRP 210.A N GLY 206.A O no hydrogen 3.072 N/A TRP 210.A NE1 LEU 239.A O no hydrogen 2.789 N/A GLU 211.A N VAL 207.A O no hydrogen 2.890 N/A LEU 212.A N LEU 208.A O no hydrogen 2.907 N/A MET 213.A N LEU 209.A O no hydrogen 2.926 N/A THR 214.A N TRP 210.A O no hydrogen 3.087 N/A THR 214.A OG1 TRP 210.A O no hydrogen 2.998 N/A THR 214.A OG1 GLU 211.A O no hydrogen 3.120 N/A ARG 215.A N LEU 212.A O no hydrogen 3.186 N/A ARG 215.A NE.A ILE 112.A O no hydrogen 2.785 N/A ARG 215.A NH1.A ILE 112.A O no hydrogen 3.327 N/A ARG 215.A NH1.B PRO 119.A O no hydrogen 2.755 N/A ARG 215.A NH2.B PRO 119.A O no hydrogen 2.763 N/A GLY 216.A N GLU 211.A O no hydrogen 2.750 N/A ALA 217.A N THR 214.A OG1 no hydrogen 3.145 N/A VAL 223.A N TYR 220.A O no hydrogen 3.199 N/A PHE 226.A N ASN 224.A OD1 no hydrogen 2.876 N/A ASP 227.A N ASN 224.A O no hydrogen 2.935 N/A ILE 228.A N THR 225.A O no hydrogen 3.429 N/A TYR 231.A N ASP 227.A O no hydrogen 3.132 N/A LEU 232.A N ILE 228.A O no hydrogen 2.943 N/A LEU 233.A N THR 229.A O no hydrogen 2.901 N/A GLN 234.A N VAL 230.A O no hydrogen 3.012 N/A GLN 234.A N TYR 231.A O no hydrogen 3.323 N/A GLY 235.A N LEU 232.A O no hydrogen 2.928 N/A ARG 236.A N TYR 231.A O no hydrogen 3.365 N/A ARG 236.A NE GLN 234.A OE1 no hydrogen 2.779 N/A ARG 237.A NE TRP 256.A O no hydrogen 2.981 N/A ARG 237.A NH1 LEU 232.A O no hydrogen 2.952 N/A ARG 237.A NH1 ARG 236.A O no hydrogen 2.869 N/A ARG 237.A NH2 TRP 256.A O no hydrogen 2.975 N/A GLN 240.A NE2 CYS 244.A O no hydrogen 2.783 N/A GLN 240.A NE2 ASP 246.A OD1 no hydrogen 2.811 N/A CYS 244.A N PRO 241.A O no hydrogen 3.155 N/A CYS 244.A SG PRO 245.A O no hydrogen 3.455 N/A TYR 249.A N PRO 245.A O no hydrogen 3.027 N/A TYR 249.A OH LEU 238.A O no hydrogen 2.695 N/A GLU 250.A N ASP 246.A O no hydrogen 3.035 N/A VAL 251.A N PRO 247.A O no hydrogen 3.172 N/A MET 252.A N LEU 248.A O no hydrogen 3.098 N/A LEU 253.A N TYR 249.A O no hydrogen 2.931 N/A LYS 254.A N GLU 250.A O no hydrogen 3.020 N/A CYS 255.A N VAL 251.A O no hydrogen 3.224 N/A CYS 255.A SG VAL 202.A O no hydrogen 3.660 N/A CYS 255.A SG VAL 251.A O no hydrogen 3.426 N/A TRP 256.A N LEU 253.A O no hydrogen 3.089 N/A HIS 257.A N LYS 254.A O no hydrogen 3.385 N/A LYS 259.A N HIS 257.A ND1 no hydrogen 2.920 N/A GLU 261.A N GLU 261.A OE1 no hydrogen 2.862 N/A MET 262.A N LYS 259.A O no hydrogen 3.000 N/A ARG 263.A N ALA 260.A O no hydrogen 3.209 N/A ARG 263.A NE HIS 257.A O no hydrogen 2.848 N/A ARG 263.A NH1 GLU 189.A OE1 no hydrogen 2.785 N/A ARG 263.A NH1 GLU 189.A OE2 no hydrogen 3.504 N/A ARG 263.A NH1 LYS 199.A O no hydrogen 2.908 N/A ARG 263.A NH2 GLU 189.A OE1 no hydrogen 3.548 N/A ARG 263.A NH2 GLU 189.A OE2 no hydrogen 2.712 N/A ARG 263.A NH2 HIS 257.A O no hydrogen 2.951 N/A GLU 268.A N SER 265.A OG no hydrogen 3.083 N/A LEU 269.A N SER 265.A O no hydrogen 2.984 N/A VAL 270.A N PHE 266.A O no hydrogen 2.818 N/A SER 271.A N SER 267.A O no hydrogen 3.047 N/A SER 271.A OG SER 267.A O no hydrogen 3.323 N/A ARG 272.A N GLU 268.A O no hydrogen 2.850 N/A ARG 272.A NE GLU 268.A OE2 no hydrogen 2.728 N/A ARG 272.A NH1 GLU 268.A OE2 no hydrogen 3.157 N/A ILE 273.A N LEU 269.A O no hydrogen 2.894 N/A SER 274.A N VAL 270.A O no hydrogen 2.808 N/A SER 274.A OG VAL 270.A O no hydrogen 2.807 N/A SER 274.A OG SER 271.A O no hydrogen 2.735 N/A ALA 275.A N SER 271.A O no hydrogen 3.170 N/A ILE 276.A N ARG 272.A O no hydrogen 3.175 N/A PHE 277.A N ILE 273.A O no hydrogen 2.840 N/A SER 278.A N SER 274.A O no hydrogen 2.924 N/A SER 278.A OG SER 274.A O no hydrogen 3.306 N/A THR 279.A N ILE 276.A O no hydrogen 3.073 N/A THR 279.A OG1 ILE 276.A O no hydrogen 2.594 N/A PHE 280.A N PHE 277.A O no hydrogen 3.146 N/A