Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wmd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N THR 26.A O no hydrogen 2.952 N/A VAL 4.A N LYS 28.A O no hydrogen 3.004 N/A VAL 5.A N ALA 71.A O no hydrogen 3.037 N/A VAL 6.A N ARG 30.A O no hydrogen 2.716 N/A PHE 7.A N PHE 73.A O no hydrogen 2.817 N/A GLY 11.A N GLY 8.A O no hydrogen 2.833 N/A GLN 13.A NE2 TYR 152.A OH no hydrogen 3.136 N/A GLY 15.A N GLY 11.A O no hydrogen 2.990 N/A SER 16.A N ALA 12.A O no hydrogen 3.331 N/A SER 16.A OG SER 188.A O no hydrogen 2.625 N/A VAL 17.A N GLN 13.A O no hydrogen 3.064 N/A ALA 18.A N GLY 14.A O no hydrogen 2.833 N/A ARG 19.A N GLY 15.A O no hydrogen 2.876 N/A THR 20.A N SER 16.A O no hydrogen 2.953 N/A THR 20.A OG1 SER 16.A O no hydrogen 2.938 N/A LEU 21.A N VAL 17.A O no hydrogen 2.893 N/A LEU 22.A N ALA 18.A O no hydrogen 2.863 N/A GLU 23.A N ARG 19.A O no hydrogen 3.000 N/A ASP 24.A N THR 20.A O no hydrogen 2.884 N/A GLY 25.A N LEU 21.A O no hydrogen 2.926 N/A THR 26.A N ASP 24.A OD2 no hydrogen 2.937 N/A THR 26.A OG1 ASP 24.A OD2 no hydrogen 2.961 N/A LYS 28.A N LYS 2.A O no hydrogen 3.040 N/A ARG 30.A N VAL 4.A O no hydrogen 3.281 N/A ARG 30.A NE GLU 50.A OE1 no hydrogen 2.923 N/A ARG 30.A NH1 ALA 65.A O no hydrogen 2.456 N/A ARG 30.A NH1 ASN 67.A O.A no hydrogen 3.091 N/A ARG 30.A NH1 ASN 67.A O.B no hydrogen 2.860 N/A ARG 30.A NH1 ASN 67.A OD1.A no hydrogen 2.949 N/A ARG 30.A NH2 ASN 67.A O.A no hydrogen 3.480 N/A VAL 31.A N GLU 50.A O no hydrogen 2.784 N/A VAL 32.A N VAL 6.A O no hydrogen 3.148 N/A THR 33.A N VAL 52.A O no hydrogen 3.038 N/A ARG 34.A NH1 GLU 80.A OE2 no hydrogen 3.043 N/A ARG 34.A NH2 GLU 80.A OE1 no hydrogen 3.228 N/A ASN 35.A N THR 33.A OG1 no hydrogen 3.048 N/A ARG 37.A N ASN 35.A OD1 no hydrogen 3.099 N/A LYS 38.A N ASN 35.A O no hydrogen 3.235 N/A ALA 41.A N LYS 38.A O no hydrogen 3.041 N/A LYS 42.A N LYS 38.A O no hydrogen 2.945 N/A GLU 43.A N LYS 39.A O no hydrogen 2.865 N/A LEU 44.A N ALA 40.A O no hydrogen 3.375 N/A ARG 45.A N ALA 41.A O no hydrogen 3.001 N/A LEU 46.A N LYS 42.A O no hydrogen 2.984 N/A GLN 47.A N GLU 43.A O no hydrogen 3.236 N/A GLN 47.A N LEU 44.A O no hydrogen 3.155 N/A GLY 48.A N ARG 45.A O no hydrogen 3.027 N/A ALA 49.A N LEU 44.A O no hydrogen 2.990 N/A GLU 50.A N VAL 29.A O no hydrogen 2.855 N/A VAL 52.A N VAL 31.A O no hydrogen 2.842 N/A GLN 53.A NE2 ARG 34.A O no hydrogen 3.035 N/A GLY 54.A N THR 33.A O no hydrogen 2.901 N/A GLN 56.A NE2 VAL 75.A O no hydrogen 2.863 N/A ASP 57.A N ASP 55.A OD1 no hydrogen 2.743 N/A ASP 58.A N ASP 55.A O no hydrogen 2.849 N/A MET 62.A N ASP 58.A O no hydrogen 2.814 N/A GLU 63.A N GLN 59.A O no hydrogen 2.994 N/A LEU 64.A N VAL 60.A O no hydrogen 2.905 N/A ALA 65.A N ILE 61.A O no hydrogen 2.817 N/A LEU 66.A N MET 62.A O no hydrogen 3.008 N/A ASN 67.A N.A GLU 63.A O no hydrogen 3.073 N/A ASN 67.A N.B GLU 63.A O no hydrogen 3.036 N/A ALA 69.A N LEU 66.A O no hydrogen 3.192 N/A TYR 70.A N LEU 3.A O no hydrogen 2.811 N/A ALA 71.A N LEU 3.A O no hydrogen 3.139 N/A THR 72.A N TYR 105.A O no hydrogen 3.314 N/A THR 72.A OG1 VAL 5.A O no hydrogen 2.685 N/A PHE 73.A N VAL 5.A O no hydrogen 2.911 N/A ILE 74.A N VAL 107.A O no hydrogen 3.060 N/A THR 76.A OG1 GLU 87.A OE2 no hydrogen 2.699 N/A TRP 79.A N ASN 77.A OD1 no hydrogen 3.187 N/A GLU 80.A N ASN 77.A O no hydrogen 3.166 N/A SER 81.A N TYR 78.A O no hydrogen 3.347 N/A SER 81.A OG TYR 78.A O no hydrogen 3.568 N/A CYS 82.A N TYR 78.A O no hydrogen 2.911 N/A CYS 82.A SG TRP 79.A O no hydrogen 3.763 N/A GLN 86.A N SER 83.A OG no hydrogen 3.175 N/A GLN 86.A NE2 ASP 57.A OD1 no hydrogen 2.880 N/A GLU 87.A N SER 83.A O no hydrogen 3.246 N/A VAL 88.A N GLN 84.A O no hydrogen 2.931 N/A LYS 89.A N GLU 85.A O no hydrogen 2.952 N/A GLN 90.A N GLN 86.A O no hydrogen 3.037 N/A GLN 90.A NE2 ASP 57.A OD1 no hydrogen 2.807 N/A GLY 91.A N GLU 87.A O no hydrogen 2.983 N/A LYS 92.A N VAL 88.A O no hydrogen 2.956 N/A LEU 93.A N LYS 89.A O no hydrogen 2.782 N/A LEU 94.A N GLN 90.A O no hydrogen 3.114 N/A ALA 95.A N GLY 91.A O no hydrogen 2.890 N/A ASP 96.A N LYS 92.A O no hydrogen 2.983 N/A LEU 97.A N LEU 93.A O no hydrogen 3.120 N/A ALA 98.A N LEU 94.A O no hydrogen 3.037 N/A ARG 99.A N ALA 95.A O no hydrogen 3.122 N/A ARG 100.A N ASP 96.A O no hydrogen 2.798 N/A ARG 100.A NH2 GLU 63.A OE1 no hydrogen 2.799 N/A LEU 101.A N LEU 97.A O no hydrogen 2.899 N/A GLY 102.A N ARG 99.A O no hydrogen 3.160 N/A LEU 103.A N ALA 98.A O no hydrogen 2.961 N/A TYR 105.A OH THR 145.A OG1 no hydrogen 2.470 N/A VAL 106.A N PRO 143.A O no hydrogen 2.893 N/A VAL 107.A N THR 72.A O no hydrogen 2.959 N/A TYR 108.A N THR 145.A O no hydrogen 3.012 N/A SER 109.A N ILE 74.A O no hydrogen 2.947 N/A SER 109.A OG GLN 13.A OE1 no hydrogen 2.518 N/A SER 109.A OG VAL 147.A O no hydrogen 3.489 N/A GLY 110.A N SER 146.A OG no hydrogen 3.200 N/A GLU 112.A N GLU 112.A OE1 no hydrogen 2.741 N/A LYS 115.A N ASP 128.A OD1 no hydrogen 2.925 N/A LYS 116.A N ASN 113.A OD1 no hydrogen 3.277 N/A LYS 116.A NZ GLU 135.A OE1 no hydrogen 2.826 N/A LEU 117.A N ASN 113.A O no hydrogen 2.991 N/A THR 118.A N ILE 114.A O no hydrogen 2.811 N/A THR 118.A OG1 ILE 114.A O no hydrogen 2.715 N/A THR 118.A OG1 LEU 122.A O no hydrogen 3.007 N/A ALA 119.A N LYS 116.A O no hydrogen 2.848 N/A GLY 120.A N LYS 115.A O no hydrogen 2.747 N/A ARG 121.A N THR 118.A O no hydrogen 3.081 N/A LEU 122.A N THR 118.A OG1 no hydrogen 3.068 N/A ALA 124.A N ASP 128.A OD2 no hydrogen 2.959 N/A ALA 125.A N ASP 253.A OD1 no hydrogen 2.758 N/A PHE 127.A N ALA 124.A O no hydrogen 2.856 N/A ASP 128.A N ALA 124.A O no hydrogen 2.841 N/A GLY 129.A N ALA 125.A O no hydrogen 3.506 N/A LYS 130.A NZ GLU 87.A OE1 no hydrogen 2.937 N/A LYS 130.A NZ GLU 87.A OE2 no hydrogen 2.956 N/A LYS 130.A NZ HIS 126.A O no hydrogen 2.702 N/A GLY 131.A N PHE 127.A O no hydrogen 2.961 N/A GLU 132.A N ASP 128.A O no hydrogen 3.005 N/A VAL 133.A N GLY 129.A O no hydrogen 3.004 N/A GLU 134.A N LYS 130.A O no hydrogen 2.903 N/A GLU 135.A N GLY 131.A O no hydrogen 3.296 N/A TYR 136.A N GLU 132.A O no hydrogen 2.896 N/A TYR 136.A OH ASP 96.A OD1 no hydrogen 2.413 N/A TYR 136.A OH ASP 96.A OD2 no hydrogen 3.308 N/A PHE 137.A N VAL 133.A O no hydrogen 3.039 N/A ARG 138.A N GLU 134.A O no hydrogen 3.380 N/A ARG 138.A NE MET 144.A O no hydrogen 3.245 N/A ARG 138.A NH1 ASN 208.A OD1 no hydrogen 2.810 N/A ARG 138.A NH2 MET 144.A O no hydrogen 2.910 N/A ARG 138.A NH2 GLN 207.A O no hydrogen 2.816 N/A ARG 138.A NH2 ASN 208.A OD1 no hydrogen 3.114 N/A ASP 139.A N GLU 135.A O no hydrogen 2.766 N/A ILE 140.A N TYR 136.A O no hydrogen 2.972 N/A GLY 141.A N ARG 138.A O no hydrogen 3.170 N/A VAL 142.A N PHE 137.A O no hydrogen 2.935 N/A THR 145.A N VAL 106.A O no hydrogen 2.990 N/A THR 145.A OG1 TYR 105.A OH no hydrogen 2.470 N/A THR 145.A OG1 TYR 204.A O no hydrogen 2.736 N/A SER 146.A N GLN 207.A O no hydrogen 3.028 N/A SER 146.A OG TYR 108.A O no hydrogen 3.331 N/A SER 146.A OG GLU 134.A OE2 no hydrogen 2.531 N/A VAL 147.A N TYR 108.A O no hydrogen 2.810 N/A ARG 148.A N ILE 209.A O no hydrogen 2.868 N/A ARG 148.A NE GLU 134.A OE2 no hydrogen 3.125 N/A ARG 148.A NH2 GLU 134.A OE1 no hydrogen 2.797 N/A CYS 151.A SG TYR 152.A O no hydrogen 3.940 N/A PHE 153.A N MET 185.A O no hydrogen 2.910 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.806 N/A ASN 155.A N TYR 152.A O no hydrogen 2.911 N/A LEU 156.A N PHE 153.A O no hydrogen 2.905 N/A LEU 157.A N GLU 154.A O no hydrogen 3.013 N/A SER 158.A N ASN 155.A O no hydrogen 2.993 N/A PHE 160.A N ASN 155.A O no hydrogen 2.999 N/A LEU 161.A N SER 158.A O no hydrogen 3.191 N/A GLN 163.A N LEU 172.A O no hydrogen 2.969 N/A ALA 165.A N SER 170.A O no hydrogen 2.772 N/A GLY 168.A N ALA 165.A O no hydrogen 3.205 N/A LYS 169.A N ASP 167.A OD1 no hydrogen 2.745 N/A TYR 171.A N VAL 232.A O no hydrogen 3.045 N/A TYR 171.A OH LEU 295.A O no hydrogen 2.536 N/A LEU 172.A N GLN 163.A O no hydrogen 2.807 N/A LEU 173.A N HIS 234.A O no hydrogen 2.882 N/A THR 177.A N LEU 175.A O no hydrogen 3.002 N/A THR 177.A OG1 GLY 178.A O no hydrogen 2.539 N/A THR 177.A OG1 VAL 180.A O no hydrogen 3.256 N/A VAL 180.A N THR 177.A O no hydrogen 3.310 N/A MET 182.A N HIS 216.A O no hydrogen 2.954 N/A GLY 184.A N CYS 214.A O no hydrogen 3.118 N/A SER 186.A OG GLU 154.A OE2 no hydrogen 2.660 N/A VAL 187.A N GLU 154.A OE1 no hydrogen 2.744 N/A SER 188.A N SER 186.A OG no hydrogen 3.223 N/A ASP 189.A N SER 186.A O no hydrogen 3.013 N/A LEU 190.A N VAL 187.A O no hydrogen 3.025 N/A GLY 191.A N SER 16.A OG no hydrogen 2.966 N/A VAL 194.A N LEU 190.A O no hydrogen 3.016 N/A LEU 195.A N GLY 191.A O no hydrogen 2.794 N/A SER 196.A N PRO 192.A O no hydrogen 2.951 N/A SER 196.A OG PRO 192.A O no hydrogen 3.151 N/A SER 196.A OG LEU 275.A O no hydrogen 2.559 N/A LEU 197.A N VAL 193.A O no hydrogen 3.406 N/A LEU 198.A N VAL 194.A O no hydrogen 3.026 N/A LYS 199.A N LEU 195.A O no hydrogen 3.096 N/A LYS 199.A N SER 196.A O no hydrogen 3.191 N/A LYS 199.A NZ ASP 24.A OD1 no hydrogen 3.147 N/A MET 200.A N LEU 197.A O no hydrogen 3.148 N/A LYS 203.A N MET 200.A O no hydrogen 3.149 N/A TYR 204.A N PRO 201.A O no hydrogen 3.332 N/A VAL 205.A N PRO 201.A O no hydrogen 3.297 N/A GLY 206.A N MET 144.A O no hydrogen 2.766 N/A GLN 207.A N TYR 204.A O no hydrogen 3.006 N/A ILE 209.A N SER 146.A O no hydrogen 2.723 N/A LEU 211.A N ARG 148.A O no hydrogen 2.943 N/A SER 212.A N THR 272.A OG1 no hydrogen 2.843 N/A SER 212.A OG ASP 183.A OD1 no hydrogen 2.482 N/A THR 213.A N GLY 184.A O no hydrogen 2.797 N/A THR 213.A OG1 GLY 184.A O no hydrogen 3.475 N/A THR 213.A OG1 LEU 280.A O no hydrogen 2.626 N/A CYS 214.A N SER 212.A OG no hydrogen 3.276 N/A CYS 214.A SG THR 213.A OG1 no hydrogen 3.744 N/A ARG 215.A NE ASP 183.A OD2 no hydrogen 3.246 N/A ARG 215.A NH2 ASP 183.A OD1 no hydrogen 2.837 N/A ARG 215.A NH2 ARG 267.A O no hydrogen 2.997 N/A HIS 216.A N MET 182.A O no hydrogen 2.990 N/A THR 217.A N GLU 220.A OE1 no hydrogen 3.401 N/A ALA 218.A N THR 177.A OG1 no hydrogen 3.192 N/A GLU 220.A N THR 217.A O no hydrogen 2.967 N/A GLU 220.A N THR 217.A OG1 no hydrogen 3.087 N/A TYR 221.A N THR 217.A O no hydrogen 3.001 N/A ALA 222.A N ALA 218.A O no hydrogen 2.665 N/A ALA 223.A N GLU 219.A O no hydrogen 2.896 N/A LEU 224.A N GLU 220.A O no hydrogen 2.799 N/A LEU 225.A N TYR 221.A O no hydrogen 2.893 N/A THR 226.A N ALA 222.A O no hydrogen 3.091 N/A THR 226.A OG1 ALA 222.A O no hydrogen 2.741 N/A LYS 227.A N ALA 223.A O no hydrogen 3.043 N/A LYS 227.A NZ ASP 283.A OD1 no hydrogen 2.440 N/A HIS 228.A N LEU 224.A O no hydrogen 3.244 N/A HIS 228.A NE2 ASP 283.A OD1 no hydrogen 2.659 N/A THR 229.A N LEU 225.A O no hydrogen 3.065 N/A THR 229.A OG1 LEU 225.A O no hydrogen 2.465 N/A THR 229.A OG1 LYS 231.A O no hydrogen 3.524 N/A ARG 230.A N THR 226.A O no hydrogen 3.080 N/A LYS 231.A N THR 229.A OG1 no hydrogen 3.246 N/A VAL 233.A N THR 226.A OG1 no hydrogen 2.876 N/A HIS 234.A N TYR 171.A O no hydrogen 2.877 N/A ALA 236.A N LEU 173.A O no hydrogen 2.810 N/A LYS 237.A N ASP 235.A OD1 no hydrogen 2.748 N/A THR 239.A N ASP 242.A OD2 no hydrogen 2.837 N/A ASP 242.A N THR 239.A OG1 no hydrogen 3.035 N/A TYR 243.A N THR 239.A O no hydrogen 3.184 N/A GLU 244.A N PRO 240.A O no hydrogen 2.977 N/A LYS 245.A N GLU 241.A O no hydrogen 2.990 N/A GLY 247.A N GLU 244.A O no hydrogen 2.745 N/A ALA 251.A N PHE 248.A O no hydrogen 2.921 N/A ARG 252.A NH1 GLU 244.A OE2 no hydrogen 2.775 N/A LEU 254.A N GLY 250.A O no hydrogen 2.848 N/A ALA 255.A N ALA 251.A O no hydrogen 2.833 N/A ASN 256.A N ARG 252.A O no hydrogen 2.899 N/A ASN 256.A ND2 ALA 123.A O no hydrogen 2.888 N/A MET 257.A N ASP 253.A O no hydrogen 2.960 N/A PHE 258.A N LEU 254.A O no hydrogen 3.060 N/A ARG 259.A N ALA 255.A O no hydrogen 2.908 N/A ARG 259.A NH1 GLU 244.A OE1 no hydrogen 2.947 N/A ARG 259.A NH1 ASN 256.A OD1 no hydrogen 2.733 N/A ARG 259.A NH2 GLU 244.A OE1 no hydrogen 2.908 N/A PHE 260.A N ASN 256.A O no hydrogen 2.932 N/A TYR 261.A N MET 257.A O no hydrogen 2.720 N/A ALA 262.A N PHE 258.A O no hydrogen 3.061 N/A LEU 263.A N PHE 260.A O no hydrogen 2.899 N/A ARG 264.A N TYR 261.A O no hydrogen 2.866 N/A ARG 267.A NH1 GLU 112.A OE2 no hydrogen 2.584 N/A ARG 267.A NH1 ASP 266.A O no hydrogen 2.924 N/A ARG 267.A NH2 GLU 112.A OE1 no hydrogen 2.861 N/A ASP 268.A N GLY 210.A O no hydrogen 2.878 N/A LEU 271.A N ASP 268.A OD1 no hydrogen 3.079 N/A THR 272.A N ASP 268.A O no hydrogen 2.885 N/A THR 272.A OG1 SER 212.A O no hydrogen 3.141 N/A THR 272.A OG1 ASP 268.A O no hydrogen 2.830 N/A LEU 273.A N ILE 269.A O no hydrogen 3.010 N/A ARG 274.A N GLU 270.A O no hydrogen 2.734 N/A LEU 275.A N LEU 271.A O no hydrogen 3.072 N/A ASN 276.A N THR 272.A O no hydrogen 2.912 N/A ASN 276.A ND2 ASP 189.A O no hydrogen 2.889 N/A LYS 278.A N ASN 276.A OD1 no hydrogen 2.917 N/A ALA 279.A N ASN 276.A O no hydrogen 2.965 N/A LEU 280.A N ASP 189.A OD2 no hydrogen 2.832 N/A THR 281.A N GLN 284.A OE1 no hydrogen 3.016 N/A GLN 284.A N THR 281.A OG1 no hydrogen 3.089 N/A TRP 285.A N THR 281.A O no hydrogen 2.759 N/A LEU 286.A N LEU 282.A O no hydrogen 2.972 N/A GLU 287.A N ASP 283.A O no hydrogen 3.063 N/A GLN 288.A N GLN 284.A O no hydrogen 3.202 N/A HIS 289.A N TRP 285.A O no hydrogen 2.783 N/A HIS 289.A ND1 ASP 292.A OD2 no hydrogen 2.716 N/A ASP 292.A N HIS 289.A O no hydrogen 2.960 N/A PHE 293.A N LYS 290.A O no hydrogen 3.351 N/A