Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wmr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N VAL 19.A O no hydrogen 2.700 N/A SER 3.A OG VAL 19.A O no hydrogen 3.450 N/A SER 3.A OG GLY 21.A O no hydrogen 2.550 N/A ALA 4.A N VAL 19.A O no hydrogen 3.298 N/A GLY 6.A N TYR 17.A O no hydrogen 3.243 N/A VAL 8.A N THR 15.A O no hydrogen 2.913 N/A PHE 10.A N TYR 13.A O no hydrogen 2.714 N/A TYR 13.A N PHE 10.A O no hydrogen 2.802 N/A ARG 14.A N THR 69.A OG1 no hydrogen 2.738 N/A ARG 14.A NE THR 7.A OG1 no hydrogen 2.863 N/A ARG 14.A NH2 THR 7.A OG1 no hydrogen 2.612 N/A THR 15.A N VAL 8.A O no hydrogen 2.952 N/A THR 15.A OG1 GLU 87.A OE2 no hydrogen 2.745 N/A TRP 16.A N SER 68.A OG no hydrogen 2.928 N/A TYR 17.A N GLY 6.A O no hydrogen 2.942 N/A ARG 18.A N HIS 59.A O no hydrogen 2.852 N/A VAL 19.A N ALA 4.A O no hydrogen 2.785 N/A THR 20.A N VAL 57.A O no hydrogen 2.834 N/A SER 25.A N ASP 22.A O no hydrogen 3.291 N/A GLY 26.A N SER 25.A OG no hydrogen 2.688 N/A LYS 27.A NZ ALA 53.A O no hydrogen 3.300 N/A LYS 27.A NZ GLU 293.A OE2 no hydrogen 2.569 N/A VAL 30.A N PRO 56.A O no hydrogen 2.759 N/A VAL 31.A N VAL 102.A O no hydrogen 2.845 N/A LEU 32.A N VAL 58.A O no hydrogen 2.975 N/A LEU 33.A N PHE 104.A O no hydrogen 2.769 N/A HIS 34.A ND1 GLY 35.A O no hydrogen 2.840 N/A GLY 35.A N TYR 43.A OH no hydrogen 2.960 N/A THR 40.A N SER 39.A OG no hydrogen 2.777 N/A THR 40.A OG1 ASP 42.A OD2 no hydrogen 2.684 N/A THR 40.A OG1 THR 197.A OG1 no hydrogen 2.667 N/A HIS 41.A N ASP 61.A OD1 no hydrogen 2.987 N/A HIS 41.A ND1 ASP 61.A OD1 no hydrogen 2.877 N/A TYR 43.A N THR 197.A OG1 no hydrogen 3.046 N/A TYR 43.A OH GLN 106.A OE1 no hydrogen 2.481 N/A LEU 44.A N HIS 41.A O no hydrogen 2.866 N/A LEU 45.A N ASP 42.A O no hydrogen 3.073 N/A MET 47.A N LEU 44.A O no hydrogen 3.040 N/A THR 48.A N LEU 45.A O no hydrogen 3.136 N/A THR 48.A OG1 LEU 45.A O no hydrogen 3.046 N/A SER 49.A N ALA 46.A O no hydrogen 3.077 N/A SER 49.A OG ALA 46.A O no hydrogen 3.425 N/A SER 49.A OG HIS 285.A ND1 no hydrogen 2.981 N/A LEU 50.A N MET 47.A O no hydrogen 3.224 N/A THR 51.A N THR 48.A O no hydrogen 3.106 N/A THR 51.A OG1 THR 48.A O no hydrogen 2.715 N/A GLU 52.A N SER 49.A O no hydrogen 2.874 N/A ALA 53.A N LEU 50.A O no hydrogen 3.038 N/A GLY 54.A N THR 51.A O no hydrogen 3.043 N/A TRP 55.A N LEU 50.A O no hydrogen 3.373 N/A VAL 57.A N THR 20.A O no hydrogen 2.986 N/A VAL 58.A N VAL 30.A O no hydrogen 2.937 N/A HIS 59.A N ARG 18.A O no hydrogen 2.943 N/A HIS 59.A NE2 LEU 44.A O no hydrogen 2.851 N/A ASP 61.A N TRP 16.A O no hydrogen 2.993 N/A GLN 62.A N HIS 34.A NE2 no hydrogen 3.045 N/A GLN 62.A NE2 HIS 34.A O no hydrogen 3.035 N/A LEU 63.A N GLU 87.A OE1 no hydrogen 2.922 N/A GLY 64.A N THR 69.A O no hydrogen 2.977 N/A ASN 65.A N GLN 62.A O no hydrogen 3.454 N/A ASN 65.A ND2 GLY 38.A O no hydrogen 2.904 N/A ASN 65.A ND2 GLU 200.A O no hydrogen 3.222 N/A GLY 67.A N ASP 61.A OD2 no hydrogen 2.719 N/A SER 68.A N ASN 65.A O no hydrogen 3.378 N/A SER 68.A OG ASP 61.A O no hydrogen 2.475 N/A THR 69.A N ARG 14.A O no hydrogen 3.094 N/A THR 69.A OG1 ARG 14.A O no hydrogen 3.344 N/A HIS 70.A ND1 ASP 204.A OD2 no hydrogen 2.794 N/A HIS 70.A NE2 GLY 66.A O no hydrogen 2.741 N/A LYS 74.A N LEU 71.A O no hydrogen 3.019 N/A PHE 78.A N GLY 75.A O no hydrogen 3.003 N/A TRP 79.A NE1 LYS 74.A O no hydrogen 3.091 N/A LEU 83.A N THR 80.A OG1 no hydrogen 3.041 N/A GLU 85.A N VAL 81.A O no hydrogen 2.954 N/A ASP 86.A N GLN 82.A O no hydrogen 2.927 N/A GLU 87.A N LEU 83.A O no hydrogen 2.957 N/A LEU 88.A N PHE 84.A O no hydrogen 3.028 N/A ASP 89.A N GLU 85.A O no hydrogen 3.016 N/A ASN 90.A N ASP 86.A O no hydrogen 2.898 N/A LEU 91.A N GLU 87.A O no hydrogen 2.844 N/A LEU 92.A N LEU 88.A O no hydrogen 2.976 N/A ASN 93.A N ASP 89.A O no hydrogen 3.074 N/A GLN 94.A N ASN 90.A O no hydrogen 2.839 N/A LEU 95.A N LEU 91.A O no hydrogen 3.008 N/A GLY 96.A N ASN 93.A O no hydrogen 2.945 N/A ILE 97.A N LEU 92.A O no hydrogen 2.984 N/A ASP 100.A N ILE 97.A O no hydrogen 3.144 N/A TYR 101.A N GLY 123.A O no hydrogen 3.012 N/A TYR 101.A OH HIS 116.A NE2 no hydrogen 2.654 N/A VAL 102.A N PRO 29.A O no hydrogen 2.930 N/A LEU 103.A N GLY 126.A O no hydrogen 3.081 N/A PHE 104.A N VAL 31.A O no hydrogen 2.915 N/A GLY 105.A N VAL 128.A O no hydrogen 2.792 N/A GLN 106.A N LEU 33.A O no hydrogen 2.961 N/A SER 107.A N ALA 130.A O no hydrogen 2.932 N/A TRP 108.A N SER 107.A OG no hydrogen 2.487 N/A TRP 108.A NE1 GLN 62.A OE1 no hydrogen 2.802 N/A GLY 109.A N GLN 106.A O no hydrogen 3.118 N/A GLY 110.A N SER 107.A O no hydrogen 2.836 N/A LEU 112.A N TRP 108.A O no hydrogen 2.899 N/A GLY 113.A N GLY 109.A O no hydrogen 2.770 N/A SER 114.A N GLY 110.A O no hydrogen 3.085 N/A SER 114.A OG GLY 110.A O no hydrogen 2.858 N/A VAL 115.A N MET 111.A O no hydrogen 3.102 N/A HIS 116.A N LEU 112.A O no hydrogen 2.951 N/A HIS 116.A NE2 TYR 101.A OH no hydrogen 2.654 N/A ALA 117.A N GLY 113.A O no hydrogen 2.843 N/A ALA 118.A N SER 114.A O no hydrogen 2.931 N/A ALA 118.A N VAL 115.A O no hydrogen 3.245 N/A ARG 119.A N HIS 116.A O no hydrogen 3.297 N/A ARG 119.A NH1 VAL 115.A O no hydrogen 3.034 N/A ARG 120.A N ALA 117.A O no hydrogen 3.048 N/A ARG 120.A NE ASP 234.A O no hydrogen 2.848 N/A ARG 125.A N TYR 101.A O no hydrogen 2.891 N/A ARG 125.A NE LEU 295.A O no hydrogen 3.199 N/A ARG 125.A NH1 ASP 100.A OD1 no hydrogen 3.228 N/A ARG 125.A NH1 ASP 100.A OD2 no hydrogen 3.048 N/A ARG 125.A NH2 LEU 295.A O no hydrogen 2.730 N/A LEU 127.A N PRO 238.A O no hydrogen 3.173 N/A VAL 128.A N LEU 103.A O no hydrogen 2.718 N/A VAL 129.A N MET 240.A O no hydrogen 2.936 N/A ALA 130.A N GLY 105.A O no hydrogen 2.914 N/A ASN 131.A N LEU 242.A O no hydrogen 2.817 N/A ALA 134.A N THR 253.A O no hydrogen 3.000 N/A MET 136.A N TRP 226.A O no hydrogen 2.784 N/A LYS 137.A N SER 135.A OG no hydrogen 3.010 N/A LYS 137.A NZ ASP 225.A OD1 no hydrogen 2.653 N/A ILE 138.A N SER 135.A OG no hydrogen 3.325 N/A TRP 139.A N SER 135.A O no hydrogen 2.950 N/A TRP 139.A NE1 GLU 216.A O no hydrogen 2.997 N/A LEU 140.A N MET 136.A O no hydrogen 2.932 N/A GLN 141.A N LYS 137.A O no hydrogen 3.108 N/A GLU 142.A N ILE 138.A O no hydrogen 2.916 N/A MET 143.A N TRP 139.A O no hydrogen 2.831 N/A ALA 144.A N LEU 140.A O no hydrogen 3.233 N/A ARG 145.A N GLN 141.A O no hydrogen 3.141 N/A ARG 145.A NE GLU 142.A OE1 no hydrogen 3.125 N/A ARG 145.A NE GLU 142.A OE2 no hydrogen 3.049 N/A ARG 145.A NH2 GLU 142.A OE1 no hydrogen 2.868 N/A LEU 146.A N GLU 142.A O no hydrogen 2.888 N/A ARG 147.A N MET 143.A O no hydrogen 2.763 N/A ARG 147.A NH1 GLU 162.A OE1 no hydrogen 3.114 N/A ARG 147.A NH1 GLU 162.A OE2 no hydrogen 2.946 N/A ARG 147.A NH2 GLU 162.A OE1 no hydrogen 2.819 N/A ALA 148.A N ALA 144.A O no hydrogen 3.048 N/A LEU 149.A N LEU 146.A O no hydrogen 3.049 N/A LEU 150.A N ARG 147.A O no hydrogen 3.032 N/A GLN 155.A N PRO 151.A O no hydrogen 3.064 N/A GLN 155.A NE2 ALA 148.A O no hydrogen 3.148 N/A GLN 155.A NE2 LEU 150.A O no hydrogen 2.948 N/A GLU 156.A N PRO 152.A O no hydrogen 3.035 N/A THR 157.A N ASP 153.A O no hydrogen 2.977 N/A THR 157.A OG1 ASP 153.A O no hydrogen 2.772 N/A LEU 158.A N VAL 154.A O no hydrogen 2.898 N/A LEU 159.A N GLN 155.A O no hydrogen 3.073 N/A LYS 160.A N GLU 156.A O no hydrogen 2.977 N/A HIS 161.A N THR 157.A O no hydrogen 3.459 N/A HIS 161.A ND1 THR 166.A OG1 no hydrogen 2.779 N/A HIS 161.A NE2 GLU 171.A OE1 no hydrogen 2.893 N/A GLU 162.A N LEU 158.A O no hydrogen 3.018 N/A ALA 163.A N LEU 159.A O no hydrogen 2.914 N/A ALA 164.A N LYS 160.A O no hydrogen 3.201 N/A ARG 165.A N GLU 162.A O no hydrogen 3.267 N/A THR 166.A N HIS 161.A O no hydrogen 2.854 N/A THR 166.A OG1 HIS 161.A ND1 no hydrogen 2.779 N/A THR 169.A N THR 166.A O no hydrogen 3.194 N/A THR 169.A OG1 THR 166.A O no hydrogen 2.858 N/A TYR 172.A N THR 169.A OG1 no hydrogen 3.309 N/A TYR 172.A OH GLU 162.A OE2 no hydrogen 2.395 N/A PHE 173.A N THR 169.A O no hydrogen 3.219 N/A HIS 174.A N GLU 170.A O no hydrogen 3.132 N/A ALA 175.A N GLU 171.A O no hydrogen 3.334 N/A MET 176.A N TYR 172.A O no hydrogen 2.764 N/A ARG 177.A N PHE 173.A O no hydrogen 2.989 N/A ALA 178.A N HIS 174.A O no hydrogen 3.287 N/A PHE 179.A N MET 176.A O no hydrogen 3.031 N/A TYR 180.A N MET 176.A O no hydrogen 2.914 N/A ASP 181.A N ARG 177.A O no hydrogen 2.817 N/A ARG 182.A N PHE 179.A O no hydrogen 3.006 N/A ARG 182.A NH1 LEU 149.A O no hydrogen 3.031 N/A HIS 183.A N PHE 179.A O no hydrogen 2.993 N/A VAL 184.A N TYR 180.A O no hydrogen 2.826 N/A CYS 185.A N TYR 180.A O no hydrogen 3.024 N/A CYS 185.A SG ILE 187.A O no hydrogen 3.438 N/A ARG 186.A N GLU 279.A OE2 no hydrogen 2.930 N/A ARG 186.A NH1 ARG 182.A O no hydrogen 2.853 N/A ARG 192.A NE ASP 193.A OD1 no hydrogen 3.255 N/A ARG 192.A NH2 ASP 193.A OD1 no hydrogen 2.687 N/A ALA 195.A N PRO 191.A O no hydrogen 2.923 N/A ALA 196.A N ARG 192.A O no hydrogen 2.597 N/A THR 197.A N ASP 193.A O no hydrogen 3.314 N/A THR 197.A OG1 THR 40.A O no hydrogen 3.277 N/A THR 197.A OG1 THR 40.A OG1 no hydrogen 2.667 N/A PHE 198.A N PHE 194.A O no hydrogen 2.996 N/A MET 199.A N ALA 195.A O no hydrogen 2.907 N/A GLU 200.A N ALA 196.A O no hydrogen 3.151 N/A ILE 201.A N THR 197.A O no hydrogen 3.064 N/A TYR 202.A N PHE 198.A O no hydrogen 3.181 N/A ASN 203.A N MET 199.A O no hydrogen 3.035 N/A ASN 203.A ND2 MET 199.A O no hydrogen 2.918 N/A ASP 204.A N GLU 200.A O no hydrogen 3.150 N/A THR 206.A N ASP 204.A OD1 no hydrogen 3.204 N/A THR 206.A OG1 ASP 204.A OD1 no hydrogen 2.534 N/A TYR 208.A OH GLU 216.A OE2 no hydrogen 2.885 N/A THR 209.A N PRO 205.A O no hydrogen 2.937 N/A THR 209.A OG1 PRO 205.A O no hydrogen 2.671 N/A THR 209.A OG1 THR 206.A O no hydrogen 3.452 N/A THR 210.A N THR 206.A O no hydrogen 2.990 N/A THR 210.A OG1 THR 206.A O no hydrogen 2.592 N/A MET 211.A N VAL 207.A O no hydrogen 2.864 N/A ASN 212.A N TYR 208.A O no hydrogen 2.819 N/A GLY 213.A N TYR 208.A O no hydrogen 2.942 N/A ASN 215.A ND2 TYR 172.A OH no hydrogen 3.056 N/A GLU 216.A N TYR 180.A OH no hydrogen 2.943 N/A PHE 217.A N ASN 215.A OD1 no hydrogen 3.088 N/A HIS 218.A N ASN 215.A OD1 no hydrogen 2.821 N/A GLY 221.A N ASN 212.A O no hydrogen 2.866 N/A THR 222.A N THR 210.A O no hydrogen 2.969 N/A LEU 223.A N MET 211.A O no hydrogen 2.834 N/A ARG 224.A N GLY 221.A O no hydrogen 3.134 N/A ARG 224.A NH1 VAL 219.A O no hydrogen 2.928 N/A TRP 226.A N LEU 223.A O no hydrogen 2.886 N/A SER 227.A OG ALA 134.A O no hydrogen 3.414 N/A SER 227.A OG GLU 229.A OE1 no hydrogen 2.492 N/A VAL 228.A N ALA 134.A O no hydrogen 2.907 N/A GLU 229.A N SER 227.A OG no hydrogen 3.219 N/A CYS 231.A N VAL 228.A O no hydrogen 3.055 N/A CYS 231.A SG SER 114.A O no hydrogen 3.850 N/A CYS 231.A SG VAL 228.A O no hydrogen 3.204 N/A LEU 232.A N GLU 229.A O no hydrogen 3.314 N/A ASP 234.A N CYS 231.A O no hydrogen 3.007 N/A ILE 235.A N LEU 232.A O no hydrogen 3.239 N/A THR 239.A N ASP 263.A O no hydrogen 2.861 N/A THR 239.A OG1 VAL 237.A O no hydrogen 3.167 N/A MET 240.A N LEU 127.A O no hydrogen 2.882 N/A VAL 241.A N ARG 265.A O no hydrogen 2.710 N/A LEU 242.A N VAL 129.A O no hydrogen 3.174 N/A ILE 243.A N GLU 267.A O no hydrogen 3.070 N/A GLY 244.A N ASP 247.A OD2 no hydrogen 3.294 N/A ARG 245.A N LEU 269.A O no hydrogen 2.923 N/A ARG 245.A NE GLU 270.A OE1 no hydrogen 2.869 N/A ARG 245.A NH2 GLU 270.A OE2 no hydrogen 3.272 N/A HIS 246.A N SER 272.A O no hydrogen 2.970 N/A ASP 247.A N GLY 244.A O no hydrogen 3.100 N/A GLU 248.A N HIS 183.A O no hydrogen 3.215 N/A ALA 249.A N ASP 247.A OD1 no hydrogen 2.735 N/A THR 250.A OG1 GLU 142.A OE1 no hydrogen 2.719 N/A THR 253.A N THR 250.A O no hydrogen 2.849 N/A THR 253.A N THR 250.A OG1 no hydrogen 3.399 N/A THR 253.A OG1 THR 250.A O no hydrogen 2.662 N/A VAL 254.A N THR 250.A O no hydrogen 3.280 N/A LYS 255.A NZ ASP 259.A OD2 no hydrogen 3.154 N/A PHE 257.A N VAL 254.A O no hydrogen 2.953 N/A LEU 258.A N VAL 254.A O no hydrogen 3.471 N/A ASP 259.A N LYS 255.A O no hydrogen 2.977 N/A LEU 260.A N PRO 256.A O no hydrogen 2.946 N/A VAL 261.A N PHE 257.A O no hydrogen 3.092 N/A ARG 265.A N THR 239.A O no hydrogen 2.901 N/A ARG 265.A NH1 SER 294.A OG no hydrogen 3.293 N/A GLU 267.A N VAL 241.A O no hydrogen 2.829 N/A LEU 269.A N ILE 243.A O no hydrogen 2.924 N/A ASN 271.A N GLU 280.A OE2 no hydrogen 2.743 N/A SER 272.A N LEU 269.A O no hydrogen 3.122 N/A SER 272.A OG GLU 280.A OE2 no hydrogen 2.881 N/A SER 273.A N GLU 279.A OE1 no hydrogen 2.744 N/A SER 273.A N GLU 279.A OE2 no hydrogen 3.413 N/A SER 273.A OG GLU 279.A OE1 no hydrogen 3.565 N/A SER 273.A OG GLU 279.A OE2 no hydrogen 2.628 N/A HIS 274.A ND1 ASP 247.A OD1 no hydrogen 2.758 N/A VAL 275.A N GLU 279.A OE1 no hydrogen 3.262 N/A HIS 277.A NE2 TYR 43.A O no hydrogen 2.689 N/A LEU 278.A N VAL 275.A O no hydrogen 2.876 N/A GLU 279.A N VAL 275.A O no hydrogen 2.979 N/A GLU 280.A N PRO 276.A O no hydrogen 2.803 N/A ARG 283.A NH1 GLU 286.A OE1 no hydrogen 3.208 N/A PHE 284.A N GLU 280.A O no hydrogen 2.963 N/A HIS 285.A N PRO 281.A O no hydrogen 3.223 N/A HIS 285.A ND1 SER 49.A OG no hydrogen 2.981 N/A GLU 286.A N GLU 282.A O no hydrogen 2.914 N/A VAL 287.A N ARG 283.A O no hydrogen 2.959 N/A MET 288.A N PHE 284.A O no hydrogen 2.896 N/A ILE 289.A N HIS 285.A O no hydrogen 2.885 N/A ASP 290.A N GLU 286.A O no hydrogen 3.026 N/A TYR 291.A N VAL 287.A O no hydrogen 3.052 N/A TYR 291.A OH PRO 238.A O no hydrogen 2.683 N/A LEU 292.A N MET 288.A O no hydrogen 2.732 N/A GLU 293.A N ILE 289.A O no hydrogen 2.863 N/A SER 294.A N TYR 291.A O no hydrogen 3.119 N/A SER 294.A OG TYR 291.A O no hydrogen 2.761 N/A LEU 295.A N LEU 292.A O no hydrogen 3.071 N/A VAL 296.A N GLU 293.A O no hydrogen 3.254 N/A