Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3odw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A N SER 3.A O no hydrogen 3.392 N/A ARG 7.A NE THR 166.A OG1 no hydrogen 3.095 N/A GLN 8.A N GLN 4.A O no hydrogen 3.158 N/A GLN 8.A N VAL 5.A O no hydrogen 3.326 N/A GLN 8.A NE2 ILE 76.A O no hydrogen 3.151 N/A GLU 9.A N VAL 5.A O no hydrogen 3.071 N/A VAL 10.A N LYS 6.A O no hydrogen 2.783 N/A ILE 11.A N ARG 7.A O no hydrogen 3.284 N/A SER 12.A N GLN 8.A O no hydrogen 2.761 N/A GLU 13.A N GLU 9.A O no hydrogen 3.043 N/A LEU 14.A N VAL 10.A O no hydrogen 3.032 N/A LEU 15.A N ILE 11.A O no hydrogen 3.282 N/A VAL 16.A N SER 12.A O no hydrogen 2.923 N/A THR 17.A N GLU 13.A O no hydrogen 2.919 N/A THR 17.A OG1 GLU 13.A O no hydrogen 2.641 N/A THR 17.A OG1 LEU 14.A O no hydrogen 3.478 N/A GLU 18.A N LEU 14.A O no hydrogen 2.971 N/A ALA 19.A N LEU 15.A O no hydrogen 3.019 N/A ALA 20.A N VAL 16.A O no hydrogen 3.121 N/A HIS 21.A N THR 17.A O no hydrogen 3.134 N/A HIS 21.A NE2 GLU 148.A OE1 no hydrogen 2.566 N/A VAL 22.A N GLU 18.A O no hydrogen 3.118 N/A ARG 23.A N ALA 19.A O no hydrogen 2.887 N/A MET 24.A N ALA 20.A O no hydrogen 3.067 N/A LEU 25.A N HIS 21.A O no hydrogen 2.955 N/A ARG 26.A N VAL 22.A O no hydrogen 3.093 N/A VAL 27.A N ARG 23.A O no hydrogen 2.852 N/A LEU 28.A N MET 24.A O no hydrogen 2.682 N/A HIS 29.A N LEU 25.A O no hydrogen 2.900 N/A HIS 29.A ND1 ASP 30.A OD1 no hydrogen 3.127 N/A ASP 30.A N ARG 26.A O no hydrogen 2.882 N/A LEU 31.A N VAL 27.A O no hydrogen 2.947 N/A PHE 33.A N LEU 28.A O no hydrogen 3.231 N/A GLN 34.A N HIS 29.A O no hydrogen 3.001 N/A GLN 34.A NE2 GLU 38.A OE2 no hydrogen 3.041 N/A MET 36.A N PHE 32.A O no hydrogen 3.081 N/A ALA 37.A N GLN 34.A O no hydrogen 2.923 N/A GLU 38.A N GLN 34.A O no hydrogen 2.900 N/A LEU 40.A N ALA 37.A O no hydrogen 3.348 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.396 N/A GLU 46.A N PRO 43.A O no hydrogen 3.081 N/A LEU 47.A N PRO 43.A O no hydrogen 3.212 N/A GLN 48.A N LEU 44.A O no hydrogen 2.988 N/A ASN 49.A N GLU 46.A O no hydrogen 2.763 N/A ILE 50.A N GLU 46.A O no hydrogen 2.900 N/A PHE 51.A N LEU 47.A O no hydrogen 3.021 N/A SER 53.A OG PRO 52.A O no hydrogen 2.549 N/A LEU 54.A N PHE 51.A O no hydrogen 3.454 N/A LEU 57.A N SER 53.A O no hydrogen 2.833 N/A ILE 58.A N LEU 54.A O no hydrogen 2.853 N/A GLU 59.A N ASP 55.A O no hydrogen 3.264 N/A VAL 60.A N GLU 56.A O no hydrogen 3.097 N/A HIS 61.A N LEU 57.A O no hydrogen 3.506 N/A HIS 61.A ND1 GLU 18.A OE2 no hydrogen 2.620 N/A HIS 61.A NE2 GLU 148.A OE2 no hydrogen 2.947 N/A SER 62.A N ILE 58.A O no hydrogen 2.928 N/A SER 62.A OG ILE 58.A O no hydrogen 2.392 N/A LEU 63.A N GLU 59.A O no hydrogen 2.836 N/A PHE 64.A N VAL 60.A O no hydrogen 3.155 N/A LEU 65.A N HIS 61.A O no hydrogen 2.831 N/A ASP 66.A N SER 62.A O no hydrogen 2.851 N/A ARG 67.A N LEU 63.A O no hydrogen 3.117 N/A LEU 68.A N PHE 64.A O no hydrogen 3.170 N/A MET 69.A N LEU 65.A O no hydrogen 3.042 N/A LYS 70.A N ASP 66.A O no hydrogen 3.071 N/A ARG 71.A N ARG 67.A O no hydrogen 2.887 N/A ARG 71.A NH1 GLU 78.A O no hydrogen 2.687 N/A ARG 71.A NH1 ASP 81.A OD1 no hydrogen 2.875 N/A ARG 71.A NH2 ASP 81.A OD1 no hydrogen 2.956 N/A ARG 71.A NH2 ASP 81.A OD2 no hydrogen 2.802 N/A ARG 72.A N LEU 68.A O no hydrogen 2.857 N/A GLN 73.A N MET 69.A O no hydrogen 2.680 N/A GLU 74.A N LYS 70.A O no hydrogen 3.178 N/A SER 75.A OG ARG 71.A O no hydrogen 3.208 N/A SER 75.A OG ARG 72.A O no hydrogen 3.420 N/A GLU 78.A N GLU 77.A OE1 no hydrogen 3.106 N/A ILE 79.A N GLU 171.A OE2 no hydrogen 2.743 N/A GLY 80.A N GLU 171.A OE2 no hydrogen 2.985 N/A VAL 82.A N ILE 79.A O no hydrogen 3.112 N/A LEU 83.A N ILE 79.A O no hydrogen 3.306 N/A LEU 84.A N GLY 80.A O no hydrogen 2.927 N/A ALA 85.A N VAL 82.A O no hydrogen 2.738 N/A ARG 86.A N LEU 83.A O no hydrogen 3.347 N/A PHE 87.A N LEU 83.A O no hydrogen 3.161 N/A ASP 88.A N LEU 84.A O no hydrogen 3.207 N/A SER 93.A N GLY 89.A O no hydrogen 3.131 N/A TRP 94.A N ALA 90.A O no hydrogen 3.195 N/A TRP 94.A NE1 GLU 56.A OE2 no hydrogen 3.184 N/A PHE 95.A N GLU 91.A O no hydrogen 3.000 N/A GLN 96.A N GLY 92.A O no hydrogen 2.947 N/A LYS 97.A N SER 93.A O no hydrogen 2.943 N/A ILE 98.A N TRP 94.A O no hydrogen 2.892 N/A SER 99.A N PHE 95.A O no hydrogen 2.948 N/A SER 99.A OG GLU 148.A OE2 no hydrogen 3.046 N/A SER 100.A N GLN 96.A O no hydrogen 2.944 N/A ARG 101.A N LYS 97.A O no hydrogen 3.307 N/A PHE 102.A N ILE 98.A O no hydrogen 3.316 N/A CYS 103.A N SER 99.A O no hydrogen 3.212 N/A CYS 103.A SG SER 99.A O no hydrogen 3.232 N/A SER 104.A N SER 100.A O no hydrogen 3.075 N/A SER 104.A OG SER 100.A O no hydrogen 2.517 N/A SER 104.A OG ALA 192.A O no hydrogen 3.428 N/A GLN 106.A N CYS 103.A O no hydrogen 3.078 N/A SER 107.A OG GLU 197.A OE2 no hydrogen 2.835 N/A ALA 109.A N ARG 105.A O no hydrogen 2.727 N/A LEU 110.A N GLN 106.A O no hydrogen 3.108 N/A GLU 111.A N SER 107.A O no hydrogen 3.096 N/A GLN 112.A N PHE 108.A O no hydrogen 2.784 N/A LEU 113.A N ALA 109.A O no hydrogen 2.769 N/A LYS 114.A N LEU 110.A O no hydrogen 2.946 N/A ALA 115.A N GLU 111.A O no hydrogen 2.935 N/A LYS 116.A N GLN 112.A O no hydrogen 3.439 N/A LYS 116.A NZ ASP 120.A OD2 no hydrogen 3.405 N/A GLN 117.A N LEU 113.A O no hydrogen 2.994 N/A ARG 118.A N LYS 114.A O no hydrogen 3.002 N/A LYS 119.A N ALA 115.A O no hydrogen 2.866 N/A ASP 120.A N LYS 116.A O no hydrogen 3.177 N/A ARG 122.A N ASP 120.A OD1 no hydrogen 3.217 N/A ARG 122.A NH2 CYS 39.A O no hydrogen 3.068 N/A CYS 124.A N ASP 120.A O no hydrogen 3.302 N/A ALA 125.A N PRO 121.A O no hydrogen 3.127 N/A PHE 126.A N ARG 122.A O no hydrogen 3.237 N/A VAL 127.A N PHE 123.A O no hydrogen 3.071 N/A GLN 128.A N CYS 124.A O no hydrogen 2.796 N/A GLU 129.A N ALA 125.A O no hydrogen 3.012 N/A ALA 130.A N PHE 126.A O no hydrogen 3.094 N/A GLU 131.A N VAL 127.A O no hydrogen 2.889 N/A SER 132.A OG GLU 129.A O no hydrogen 2.857 N/A ARG 133.A N ALA 130.A O no hydrogen 2.947 N/A ARG 135.A NH1 ASP 30.A OD2 no hydrogen 3.228 N/A ARG 135.A NH2 ASP 30.A OD2 no hydrogen 3.404 N/A CYS 136.A N ARG 133.A O no hydrogen 2.927 N/A CYS 136.A SG ALA 130.A O no hydrogen 3.330 N/A ARG 137.A N PRO 134.A O no hydrogen 2.877 N/A LEU 139.A N CYS 136.A O no hydrogen 3.339 N/A GLN 140.A N ASP 143.A OD2 no hydrogen 3.151 N/A GLN 140.A NE2 GLU 131.A OE1 no hydrogen 3.303 N/A LEU 141.A N GLU 131.A OE2 no hydrogen 2.796 N/A ASP 143.A N GLN 140.A O no hydrogen 2.610 N/A MET 144.A N GLN 140.A O no hydrogen 3.046 N/A MET 144.A N LEU 141.A O no hydrogen 3.204 N/A ILE 145.A N LEU 141.A O no hydrogen 3.417 N/A THR 147.A N MET 144.A O no hydrogen 2.766 N/A THR 147.A OG1 MET 144.A O no hydrogen 2.605 N/A ARG 151.A N THR 147.A O no hydrogen 2.854 N/A ARG 151.A NE GLU 18.A OE1 no hydrogen 2.993 N/A ARG 151.A NE TYR 155.A OH no hydrogen 3.447 N/A ARG 151.A NH1 THR 17.A OG1 no hydrogen 3.002 N/A ARG 151.A NH2 THR 17.A OG1 no hydrogen 3.308 N/A ARG 151.A NH2 GLU 18.A OE1 no hydrogen 2.787 N/A LEU 152.A N GLU 148.A O no hydrogen 3.244 N/A THR 153.A N MET 149.A O no hydrogen 3.287 N/A THR 153.A OG1 GLN 150.A O no hydrogen 3.085 N/A LYS 154.A N ARG 151.A O no hydrogen 2.554 N/A TYR 155.A N ARG 151.A O no hydrogen 3.342 N/A TYR 155.A OH GLU 18.A OE1 no hydrogen 2.442 N/A TYR 155.A OH GLU 18.A OE2 no hydrogen 2.921 N/A TYR 155.A OH HIS 61.A ND1 no hydrogen 3.162 N/A LEU 158.A N LYS 154.A O no hydrogen 2.956 N/A LEU 159.A N TYR 155.A O no hydrogen 2.866 N/A GLN 160.A N PRO 156.A O no hydrogen 2.593 N/A SER 161.A OG LEU 157.A O no hydrogen 3.322 N/A SER 161.A OG LEU 158.A O no hydrogen 3.534 N/A ILE 162.A N LEU 158.A O no hydrogen 3.281 N/A ILE 162.A N LEU 159.A O no hydrogen 3.297 N/A GLY 163.A N LEU 159.A O no hydrogen 3.120 N/A GLN 164.A N GLN 160.A O no hydrogen 3.194 N/A ASN 165.A ND2 SER 161.A O no hydrogen 3.132 N/A THR 166.A N GLY 163.A O no hydrogen 2.774 N/A THR 166.A OG1 ILE 162.A O no hydrogen 2.858 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.438 N/A THR 170.A OG1 GLU 168.A OE1 no hydrogen 2.978 N/A GLU 171.A N GLU 168.A OE1 no hydrogen 3.191 N/A ARG 172.A N GLU 168.A O no hydrogen 2.921 N/A GLU 173.A N PRO 169.A O no hydrogen 3.099 N/A VAL 175.A N GLU 171.A O no hydrogen 3.119 N/A GLU 176.A N ARG 172.A O no hydrogen 2.823 N/A LEU 177.A N GLU 173.A O no hydrogen 3.065 N/A ALA 178.A N LYS 174.A O no hydrogen 2.925 N/A ALA 179.A N VAL 175.A O no hydrogen 2.900 N/A GLU 180.A N GLU 176.A O no hydrogen 2.989 N/A CYS 181.A N LEU 177.A O no hydrogen 2.896 N/A CYS 181.A SG ASP 88.A OD1 no hydrogen 3.740 N/A CYS 181.A SG LEU 177.A O no hydrogen 3.309 N/A CYS 182.A N ALA 178.A O no hydrogen 3.149 N/A CYS 182.A SG ALA 178.A O no hydrogen 3.475 N/A ARG 183.A N ALA 179.A O no hydrogen 3.251 N/A ARG 183.A N GLU 180.A O no hydrogen 3.106 N/A GLU 184.A N GLU 180.A O no hydrogen 3.004 N/A ILE 185.A N CYS 181.A O no hydrogen 2.746 N/A LEU 186.A N CYS 182.A O no hydrogen 3.110 N/A HIS 187.A N ARG 183.A O no hydrogen 2.837 N/A HIS 188.A N GLU 184.A O no hydrogen 3.066 N/A VAL 189.A N ILE 185.A O no hydrogen 2.911 N/A ASN 190.A N LEU 186.A O no hydrogen 3.074 N/A GLN 191.A N HIS 187.A O no hydrogen 3.319 N/A GLN 191.A NE2 ASP 195.A OD2 no hydrogen 2.972 N/A ALA 192.A N HIS 188.A O no hydrogen 3.146 N/A VAL 193.A N VAL 189.A O no hydrogen 2.874 N/A ARG 194.A N ASN 190.A O no hydrogen 3.123 N/A ASP 195.A N GLN 191.A O no hydrogen 2.788 N/A MET 196.A N ALA 192.A O no hydrogen 3.283 N/A MET 196.A N VAL 193.A O no hydrogen 3.235 N/A GLU 197.A N VAL 193.A O no hydrogen 3.031 N/A ASP 198.A N ARG 194.A O no hydrogen 3.156 N/A LEU 199.A N ASP 195.A O no hydrogen 3.106 N/A LEU 200.A N MET 196.A O no hydrogen 2.983 N/A ARG 201.A N GLU 197.A O no hydrogen 3.162 N/A LEU 202.A N ASP 198.A O no hydrogen 2.711 N/A LYS 203.A N LEU 199.A O no hydrogen 2.743 N/A ASP 204.A N LEU 200.A O no hydrogen 3.184 N/A TYR 205.A N ARG 201.A O no hydrogen 3.175 N/A TYR 205.A OH GLU 235.A OE1 no hydrogen 2.942 N/A GLN 206.A N LEU 202.A O no hydrogen 2.847 N/A GLN 206.A NE2 LEU 225.A O no hydrogen 3.221 N/A ARG 207.A N LYS 203.A O no hydrogen 3.267 N/A ARG 207.A N ASP 204.A O no hydrogen 3.312 N/A ARG 208.A N TYR 205.A O no hydrogen 2.708 N/A ARG 208.A NE GLU 264.A O no hydrogen 2.883 N/A ARG 208.A NH1 ASP 204.A OD2 no hydrogen 2.717 N/A ARG 208.A NH2 GLU 264.A O no hydrogen 3.335 N/A ASP 210.A N LEU 266.A O no hydrogen 2.685 N/A SER 212.A OG ASP 210.A OD1 no hydrogen 3.426 N/A LEU 214.A N LEU 211.A O no hydrogen 3.056 N/A ARG 215.A N LEU 211.A O no hydrogen 3.353 N/A ARG 215.A NE LYS 223.A O no hydrogen 3.234 N/A SER 220.A N MET 218.A O no hydrogen 2.341 N/A SER 220.A OG MET 218.A O no hydrogen 3.180 N/A PHE 222.A N LEU 219.A O no hydrogen 3.173 N/A LYS 223.A N ASN 224.A OD1 no hydrogen 2.583 N/A ILE 227.A N GLN 206.A OE1 no hydrogen 2.532 N/A THR 228.A N ASP 226.A OD1 no hydrogen 3.152 N/A THR 228.A OG1 ASP 226.A OD1 no hydrogen 2.927 N/A LYS 230.A NZ ASP 254.A OD1 no hydrogen 2.827 N/A LYS 231.A N ASP 253.A OD2 no hydrogen 2.899 N/A LYS 231.A NZ ASP 195.A OD1 no hydrogen 2.559 N/A VAL 233.A N LEU 251.A O no hydrogen 2.992 N/A HIS 234.A N LEU 251.A O no hydrogen 3.088 N/A GLY 236.A N VAL 249.A O no hydrogen 3.193 N/A LEU 238.A N VAL 247.A O no hydrogen 3.030 N/A THR 239.A N VAL 307.A O no hydrogen 2.920 N/A THR 239.A OG1 GLU 246.A OE1 no hydrogen 2.756 N/A THR 239.A OG1 GLU 246.A OE2 no hydrogen 2.680 N/A TRP 240.A N VAL 245.A O no hydrogen 2.939 N/A ARG 241.A N GLU 305.A O no hydrogen 2.959 N/A VAL 247.A N LEU 238.A O no hydrogen 3.016 N/A HIS 248.A N LEU 259.A O no hydrogen 2.657 N/A HIS 248.A NE2 GLU 235.A OE1 no hydrogen 2.590 N/A VAL 249.A N GLY 236.A O no hydrogen 3.098 N/A LEU 250.A N LEU 257.A O no hydrogen 2.957 N/A LEU 251.A N HIS 234.A O no hydrogen 2.764 N/A LEU 252.A N LEU 255.A O no hydrogen 3.011 N/A ASP 253.A N LYS 231.A O no hydrogen 3.043 N/A LEU 256.A N LEU 277.A O no hydrogen 2.682 N/A LEU 257.A N LEU 250.A O no hydrogen 3.200 N/A LEU 258.A N PRO 275.A O no hydrogen 2.940 N/A LEU 259.A N HIS 248.A O no hydrogen 3.086 N/A GLN 260.A N LEU 267.A O no hydrogen 2.569 N/A ARG 265.A NE ARG 208.A O no hydrogen 3.272 N/A ARG 265.A NE LEU 209.A O no hydrogen 3.062 N/A ARG 265.A NH2 LEU 209.A O no hydrogen 2.667 N/A LEU 266.A N ARG 208.A O no hydrogen 2.888 N/A LEU 267.A N GLN 260.A O no hydrogen 2.896 N/A LYS 269.A NZ HIS 213.A NE2 no hydrogen 3.355 N/A HIS 271.A N LYS 269.A O no hydrogen 2.776 N/A ARG 274.A N TYR 304.A OH no hydrogen 3.259 N/A LEU 279.A N ASP 254.A O no hydrogen 2.695 N/A ALA 282.A N LEU 279.A O no hydrogen 2.892 N/A ARG 285.A N TYR 295.A O no hydrogen 3.002 N/A VAL 287.A N ALA 293.A O no hydrogen 3.218 N/A LYS 292.A N ASP 290.A OD1 no hydrogen 3.415 N/A LYS 292.A NZ GLN 309.A O no hydrogen 3.300 N/A ALA 293.A N ASP 290.A O no hydrogen 3.091 N/A PHE 294.A N LEU 306.A O no hydrogen 3.141 N/A TYR 295.A N ARG 285.A O no hydrogen 2.809 N/A VAL 296.A N TYR 304.A O no hydrogen 2.941 N/A LEU 297.A N MET 283.A O no hydrogen 2.937 N/A THR 299.A N SER 281.A O no hydrogen 2.924 N/A THR 299.A OG1 SER 281.A O no hydrogen 3.295 N/A TYR 304.A N VAL 296.A O no hydrogen 3.113 N/A LEU 306.A N PHE 294.A O no hydrogen 2.916 N/A VAL 307.A N THR 239.A O no hydrogen 2.713 N/A ALA 308.A N LYS 292.A O no hydrogen 2.758 N/A THR 310.A N GLU 313.A OE1 no hydrogen 2.839 N/A ARG 314.A N THR 310.A O no hydrogen 3.371 N/A ARG 314.A NH2 GLU 286.A OE2 no hydrogen 2.802 N/A LYS 315.A N VAL 311.A O no hydrogen 2.824 N/A ASN 316.A N SER 312.A O no hydrogen 3.024 N/A TRP 317.A N GLU 313.A O no hydrogen 2.838 N/A CYS 318.A N ARG 314.A O no hydrogen 3.084 N/A CYS 318.A SG ARG 314.A O no hydrogen 3.399 N/A ALA 319.A N LYS 315.A O no hydrogen 3.193 N/A LEU 320.A N ASN 316.A O no hydrogen 2.850 N/A ILE 321.A N TRP 317.A O no hydrogen 2.952 N/A THR 322.A N CYS 318.A O no hydrogen 3.069 N/A THR 322.A OG1 CYS 318.A O no hydrogen 2.460 N/A THR 322.A OG1 ALA 319.A O no hydrogen 3.375 N/A GLU 323.A N ALA 319.A O no hydrogen 3.087 N/A THR 324.A N LEU 320.A O no hydrogen 3.089 N/A THR 324.A OG1 LEU 320.A O no hydrogen 2.579 N/A ALA 325.A N ILE 321.A O no hydrogen 2.813 N/A GLY 326.A N THR 322.A O no hydrogen 3.101 N/A SER 327.A N GLU 323.A O no hydrogen 2.804 N/A SER 327.A OG GLU 323.A O no hydrogen 3.095 N/A LEU 328.A N ALA 325.A O no hydrogen 2.964 N/A