Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3myo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 GLU 326.A O no hydrogen 3.555 N/A ILE 2.A N LEU 325.A O no hydrogen 2.481 N/A ASN 5.A ND2 ASP 155.A O no hydrogen 2.822 N/A LYS 6.A NZ ILE 156.A O no hydrogen 2.991 N/A LYS 6.A NZ ASP 200.A OD2 no hydrogen 2.738 N/A ARG 7.A N THR 3.A O no hydrogen 2.824 N/A ARG 7.A NE GLU 11.A OE2 no hydrogen 3.428 N/A HIS 8.A N ALA 4.A O no hydrogen 3.031 N/A TYR 9.A N ASN 5.A O no hydrogen 3.042 N/A LEU 10.A N LYS 6.A O no hydrogen 2.874 N/A GLU 11.A N ARG 7.A O no hydrogen 2.815 N/A LYS 12.A N HIS 8.A O no hydrogen 3.345 N/A LYS 12.A N TYR 9.A O no hydrogen 3.117 N/A VAL 13.A N LEU 10.A O no hydrogen 3.195 N/A SER 14.A N GLU 11.A O no hydrogen 3.192 N/A SER 14.A OG LEU 10.A O no hydrogen 2.783 N/A HIS 15.A N ILE 18.A O no hydrogen 2.835 N/A ILE 18.A N HIS 15.A O no hydrogen 3.103 N/A ILE 19.A N SER 270.A O no hydrogen 2.854 N/A SER 20.A N SER 63.A OG no hydrogen 2.911 N/A SER 20.A OG SER 63.A OG no hydrogen 3.228 N/A ALA 21.A N VAL 272.A O no hydrogen 3.153 N/A LEU 22.A N SER 64.A O no hydrogen 2.892 N/A ALA 23.A N CYS 274.A O no hydrogen 2.921 N/A PHE 24.A N LEU 66.A O no hydrogen 2.870 N/A GLN 26.A N GLN 26.A OE1 no hydrogen 2.856 N/A ARG 27.A NE ASP 25.A O no hydrogen 3.130 N/A ARG 27.A NH1 GLU 70.A OE1 no hydrogen 3.345 N/A ARG 27.A NH1 GLU 90.A O no hydrogen 2.908 N/A ARG 27.A NH2 GLU 90.A O no hydrogen 3.485 N/A LYS 31.A N ARG 27.A O no hydrogen 3.005 N/A LYS 31.A NZ TYR 71.A OH no hydrogen 2.860 N/A GLN 32.A N GLY 28.A O no hydrogen 3.048 N/A MET 33.A N ALA 29.A O no hydrogen 3.183 N/A MET 34.A N LEU 30.A O no hydrogen 2.962 N/A ALA 35.A N LYS 31.A O no hydrogen 3.046 N/A HIS 37.A N MET 34.A O no hydrogen 2.995 N/A GLN 38.A NE2 GLN 46.A OE1 no hydrogen 3.198 N/A THR 43.A N GLN 46.A OE1 no hydrogen 2.914 N/A GLN 46.A N THR 43.A OG1 no hydrogen 3.221 N/A GLN 46.A NE2 GLN 38.A OE1 no hydrogen 3.130 N/A ILE 47.A N THR 43.A O no hydrogen 3.218 N/A GLU 48.A N VAL 44.A O no hydrogen 2.944 N/A THR 49.A N THR 45.A O no hydrogen 2.797 N/A THR 49.A OG1 THR 45.A O no hydrogen 2.777 N/A LEU 50.A N GLN 46.A O no hydrogen 3.129 N/A LYS 51.A N ILE 47.A O no hydrogen 3.285 N/A LYS 51.A NZ PHE 24.A O no hydrogen 2.775 N/A LYS 51.A NZ GLN 26.A O no hydrogen 2.855 N/A LYS 51.A NZ ASP 68.A OD1 no hydrogen 2.709 N/A VAL 52.A N GLU 48.A O no hydrogen 3.064 N/A LEU 53.A N THR 49.A O no hydrogen 2.892 N/A VAL 54.A N LEU 50.A O no hydrogen 2.950 N/A SER 55.A N LYS 51.A O no hydrogen 3.022 N/A SER 55.A OG ALA 75.A O no hydrogen 2.771 N/A GLU 56.A N VAL 52.A O no hydrogen 2.741 N/A GLU 57.A N LEU 53.A O no hydrogen 3.034 N/A LEU 58.A N VAL 54.A O no hydrogen 2.939 N/A THR 59.A N SER 55.A O no hydrogen 3.216 N/A THR 59.A OG1 SER 55.A O no hydrogen 2.576 N/A TYR 61.A N LEU 58.A O no hydrogen 2.935 N/A ALA 62.A N THR 59.A O no hydrogen 3.330 N/A SER 63.A N SER 20.A O no hydrogen 2.759 N/A SER 63.A N SER 20.A OG no hydrogen 3.311 N/A SER 63.A OG VAL 13.A O no hydrogen 2.761 N/A SER 63.A OG SER 20.A OG no hydrogen 3.228 N/A SER 64.A OG VAL 13.A O no hydrogen 2.827 N/A ILE 65.A N GLY 84.A O no hydrogen 2.897 N/A LEU 66.A N LEU 22.A O no hydrogen 2.756 N/A LEU 67.A N LEU 86.A O no hydrogen 2.860 N/A TYR 71.A N ASP 68.A OD2 no hydrogen 2.679 N/A GLY 72.A N ASP 68.A O no hydrogen 2.970 N/A THR 76.A N LEU 73.A O no hydrogen 3.278 N/A THR 76.A OG1 LEU 73.A O no hydrogen 2.414 N/A LYS 77.A N LEU 74.A O no hydrogen 3.156 N/A ARG 79.A NE THR 76.A O no hydrogen 2.809 N/A ARG 79.A NH1 THR 83.A O no hydrogen 2.914 N/A ARG 79.A NH2 THR 76.A O no hydrogen 3.445 N/A ALA 80.A N THR 59.A OG1 no hydrogen 3.146 N/A THR 83.A N ALA 80.A O no hydrogen 3.157 N/A THR 83.A OG1 THR 59.A O no hydrogen 2.707 N/A THR 83.A OG1 ALA 62.A O no hydrogen 3.404 N/A THR 83.A OG1 ALA 80.A O no hydrogen 3.519 N/A GLY 84.A N SER 63.A O no hydrogen 3.028 N/A LEU 85.A N ASP 120.A OD2 no hydrogen 2.845 N/A LEU 86.A N ILE 65.A O no hydrogen 2.860 N/A LEU 87.A N ALA 121.A O no hydrogen 3.249 N/A ALA 88.A N LEU 67.A O no hydrogen 2.900 N/A TYR 89.A OH GLU 150.A OE1 no hydrogen 2.638 N/A TYR 89.A OH GLU 150.A OE2 no hydrogen 3.342 N/A GLU 90.A N GLU 90.A OE1 no hydrogen 2.816 N/A LYS 91.A N ASP 104.A O no hydrogen 2.886 N/A LYS 91.A NZ ASP 104.A OD2 no hydrogen 2.806 N/A THR 97.A N ASP 95.A OD1 no hydrogen 2.980 N/A THR 97.A OG1 ASP 95.A OD1 no hydrogen 2.661 N/A THR 97.A OG1 ASP 95.A OD2 no hydrogen 3.244 N/A THR 98.A N ASP 95.A O no hydrogen 3.468 N/A CYS 105.A N TYR 143.A OH no hydrogen 2.845 N/A CYS 105.A SG TYR 143.A OH no hydrogen 3.315 N/A LEU 106.A N TYR 89.A O no hydrogen 2.897 N/A TRP 109.A N LEU 106.A O no hydrogen 3.067 N/A VAL 111.A N GLU 150.A OE2 no hydrogen 2.994 N/A LYS 112.A NZ GLU 154.A OE1 no hydrogen 3.167 N/A LYS 112.A NZ GLU 154.A OE2 no hydrogen 3.129 N/A ARG 113.A N SER 110.A OG no hydrogen 3.251 N/A LEU 114.A N SER 110.A O no hydrogen 2.930 N/A LYS 115.A N VAL 111.A O no hydrogen 2.860 N/A LYS 115.A NZ GLU 154.A O no hydrogen 2.522 N/A ALA 116.A N LYS 112.A O no hydrogen 2.914 N/A ALA 117.A N ARG 113.A O no hydrogen 2.914 N/A GLY 118.A N LYS 115.A O no hydrogen 2.846 N/A ALA 119.A N LEU 114.A O no hydrogen 3.153 N/A ASP 120.A N LEU 85.A O no hydrogen 2.739 N/A ALA 121.A N LEU 85.A O no hydrogen 3.227 N/A ILE 122.A N PRO 157.A O no hydrogen 2.908 N/A LYS 123.A N LEU 87.A O no hydrogen 2.983 N/A LYS 123.A NZ ASP 25.A OD2 no hydrogen 2.662 N/A LYS 123.A NZ GLU 90.A OE2 no hydrogen 2.953 N/A LYS 123.A NZ GLU 161.A OE1 no hydrogen 2.663 N/A PHE 124.A N PHE 159.A O no hydrogen 3.058 N/A LEU 125.A N GLU 90.A OE1 no hydrogen 2.930 N/A LEU 126.A N GLU 161.A O no hydrogen 2.855 N/A TYR 128.A N LEU 163.A O no hydrogen 2.996 N/A ASP 131.A N ASP 129.A OD1 no hydrogen 2.890 N/A GLY 132.A N ASP 129.A O no hydrogen 2.974 N/A ASP 133.A N GLU 167.A OE2 no hydrogen 2.884 N/A GLN 135.A N ASP 133.A OD2 no hydrogen 3.195 N/A ILE 136.A N ASP 133.A OD2 no hydrogen 3.051 N/A ASN 137.A N ASP 133.A O no hydrogen 3.085 N/A ASN 137.A ND2 ASP 129.A O no hydrogen 2.946 N/A LEU 138.A N GLU 134.A O no hydrogen 2.935 N/A GLN 139.A N GLN 135.A O no hydrogen 3.042 N/A LYS 140.A N ILE 136.A O no hydrogen 3.007 N/A LYS 140.A NZ SER 100.A O no hydrogen 2.673 N/A LYS 140.A NZ ARG 101.A O no hydrogen 3.397 N/A GLN 141.A N ASN 137.A O no hydrogen 2.803 N/A GLN 141.A NE2 TYR 128.A OH no hydrogen 3.103 N/A ALA 142.A N LEU 138.A O no hydrogen 2.886 N/A TYR 143.A N GLN 139.A O no hydrogen 3.000 N/A ILE 144.A N LYS 140.A O no hydrogen 3.050 N/A GLU 145.A N GLN 141.A O no hydrogen 3.108 N/A ARG 146.A N ALA 142.A O no hydrogen 3.169 N/A ILE 147.A N TYR 143.A O no hydrogen 3.230 N/A GLY 148.A N ILE 144.A O no hydrogen 2.676 N/A SER 149.A N GLU 145.A O no hydrogen 2.833 N/A SER 149.A OG GLU 145.A O no hydrogen 3.031 N/A GLU 150.A N ARG 146.A O no hydrogen 2.946 N/A CYS 151.A N ILE 147.A O no hydrogen 3.009 N/A CYS 151.A SG ILE 147.A O no hydrogen 3.436 N/A THR 152.A N GLY 148.A O no hydrogen 2.914 N/A THR 152.A OG1 GLY 148.A O no hydrogen 2.983 N/A ALA 153.A N SER 149.A O no hydrogen 2.897 N/A GLU 154.A N GLU 150.A O no hydrogen 2.929 N/A ASP 155.A N THR 152.A O no hydrogen 3.238 N/A ILE 156.A N CYS 151.A O no hydrogen 2.964 N/A PHE 158.A N ASP 200.A OD2 no hydrogen 2.810 N/A PHE 159.A N ILE 122.A O no hydrogen 2.740 N/A LEU 160.A N VAL 201.A O no hydrogen 3.070 N/A GLU 161.A N PHE 124.A O no hydrogen 2.837 N/A LEU 162.A N LYS 203.A O no hydrogen 2.934 N/A LEU 163.A N LEU 126.A O no hydrogen 3.056 N/A SER 164.A N GLU 205.A OE2 no hydrogen 2.962 N/A SER 164.A OG TYR 177.A OH no hydrogen 2.539 N/A SER 164.A OG GLU 205.A OE2 no hydrogen 2.844 N/A TYR 165.A N TYR 128.A O no hydrogen 3.411 N/A TYR 165.A OH THR 99.A O no hydrogen 2.638 N/A GLU 167.A N ASP 129.A OD2 no hydrogen 2.922 N/A ARG 168.A N ASP 166.A OD2 no hydrogen 2.914 N/A ILE 169.A N ASP 166.A O no hydrogen 3.075 N/A ASN 173.A N ASP 171.A OD1 no hydrogen 2.805 N/A SER 174.A N ASP 171.A O no hydrogen 3.381 N/A SER 174.A OG ASP 171.A O no hydrogen 2.880 N/A TYR 177.A OH SER 164.A OG no hydrogen 2.539 N/A ALA 178.A N SER 174.A O no hydrogen 3.047 N/A LYS 179.A N ALA 175.A O no hydrogen 3.450 N/A LEU 180.A N TYR 177.A O no hydrogen 2.844 N/A LYS 181.A N ALA 178.A O no hydrogen 3.418 N/A LYS 181.A NZ VAL 206.A O no hydrogen 2.929 N/A LYS 181.A NZ VAL 208.A O no hydrogen 3.278 N/A HIS 183.A NE2 ASP 131.A OD1 no hydrogen 2.901 N/A LYS 184.A N LEU 180.A O no hydrogen 3.142 N/A LYS 184.A NZ ASP 129.A OD1 no hydrogen 2.688 N/A LYS 184.A NZ ASP 131.A OD2 no hydrogen 2.799 N/A LYS 184.A NZ ASP 166.A OD1 no hydrogen 2.876 N/A VAL 185.A N LYS 181.A O no hydrogen 2.917 N/A ASN 186.A N PRO 182.A O no hydrogen 3.054 N/A ASN 186.A ND2 ALA 231.A O no hydrogen 3.460 N/A GLY 187.A N HIS 183.A O no hydrogen 2.954 N/A ALA 188.A N LYS 184.A O no hydrogen 3.199 N/A MET 189.A N VAL 185.A O no hydrogen 3.099 N/A SER 190.A N ASN 186.A O no hydrogen 3.070 N/A SER 190.A OG ALA 238.A O no hydrogen 3.563 N/A VAL 191.A N GLY 187.A O no hydrogen 3.048 N/A PHE 192.A N ALA 188.A O no hydrogen 3.095 N/A SER 193.A N SER 190.A O no hydrogen 3.342 N/A SER 193.A OG MET 189.A O no hydrogen 2.745 N/A SER 193.A OG SER 239.A OG no hydrogen 2.702 N/A ASP 194.A N VAL 191.A O no hydrogen 3.436 N/A ARG 196.A N ASP 194.A OD1 no hydrogen 2.805 N/A PHE 197.A N ASP 194.A O no hydrogen 3.077 N/A GLY 198.A N LYS 195.A O no hydrogen 3.053 N/A ASP 200.A N PHE 158.A O no hydrogen 2.950 N/A VAL 201.A N PHE 158.A O no hydrogen 3.207 N/A LEU 202.A N PRO 242.A O no hydrogen 2.957 N/A LYS 203.A N LEU 160.A O no hydrogen 2.854 N/A LYS 203.A NZ GLU 161.A OE1 no hydrogen 3.282 N/A VAL 204.A N ILE 244.A O no hydrogen 2.886 N/A ASN 209.A N TYR 223.A OH no hydrogen 3.130 N/A ALA 211.A N ASN 209.A OD1 no hydrogen 3.354 N/A TYR 212.A N ASN 209.A O no hydrogen 2.817 N/A TYR 212.A OH ASN 173.A O no hydrogen 2.970 N/A VAL 213.A N MET 210.A O no hydrogen 3.006 N/A GLU 214.A N TYR 223.A O no hydrogen 3.006 N/A PHE 216.A N VAL 213.A O no hydrogen 2.983 N/A HIS 222.A N TYR 212.A O no hydrogen 2.859 N/A HIS 222.A NE2 GLU 220.A OE1 no hydrogen 3.022 N/A TYR 223.A N TYR 212.A O no hydrogen 3.223 N/A TYR 223.A OH ALA 178.A O no hydrogen 2.533 N/A SER 224.A N GLU 227.A OE1 no hydrogen 3.019 N/A GLN 225.A N GLU 214.A OE2 no hydrogen 3.303 N/A GLN 225.A NE2 GLU 214.A O no hydrogen 3.153 N/A GLU 227.A N SER 224.A OG no hydrogen 3.162 N/A ALA 228.A N SER 224.A O no hydrogen 3.079 N/A ILE 229.A N GLN 225.A O no hydrogen 2.857 N/A LYS 230.A N ALA 226.A O no hydrogen 3.211 N/A LYS 230.A NZ ASP 234.A OD1 no hydrogen 3.547 N/A ALA 231.A N GLU 227.A O no hydrogen 3.099 N/A PHE 232.A N ALA 228.A O no hydrogen 3.134 N/A GLN 233.A N ILE 229.A O no hydrogen 2.984 N/A GLN 233.A NE2 ALA 265.A O no hydrogen 3.075 N/A ASP 234.A N LYS 230.A O no hydrogen 2.896 N/A GLN 235.A N ALA 231.A O no hydrogen 2.940 N/A GLN 235.A NE2 GLU 205.A O no hydrogen 2.797 N/A GLU 236.A N PHE 232.A O no hydrogen 3.114 N/A ALA 237.A N GLN 233.A O no hydrogen 3.060 N/A ALA 238.A N GLN 235.A O no hydrogen 3.124 N/A SER 239.A OG SER 193.A OG no hydrogen 2.702 N/A LEU 241.A N SER 239.A OG no hydrogen 2.926 N/A TYR 243.A OH GLU 236.A OE1 no hydrogen 2.670 N/A ILE 244.A N LEU 202.A O no hydrogen 2.785 N/A TYR 245.A N GLY 271.A O no hydrogen 3.189 N/A TYR 245.A OH GLN 235.A OE1 no hydrogen 2.634 N/A LEU 246.A N VAL 204.A O no hydrogen 2.972 N/A VAL 250.A N SER 247.A O no hydrogen 3.327 N/A LYS 253.A NZ GLU 257.A OE1 no hydrogen 2.745 N/A LEU 254.A N SER 251.A OG no hydrogen 3.316 N/A PHE 255.A N SER 251.A O no hydrogen 2.891 N/A GLN 256.A N ALA 252.A O no hydrogen 2.956 N/A GLU 257.A N LYS 253.A O no hydrogen 2.960 N/A THR 258.A N LEU 254.A O no hydrogen 2.867 N/A THR 258.A OG1 LEU 254.A O no hydrogen 2.597 N/A LEU 259.A N PHE 255.A O no hydrogen 2.986 N/A TYR 260.A N GLN 256.A O no hydrogen 3.172 N/A TYR 260.A OH GLU 315.A OE1 no hydrogen 2.787 N/A PHE 261.A N GLU 257.A O no hydrogen 3.057 N/A ALA 262.A N THR 258.A O no hydrogen 2.708 N/A ALA 263.A N LEU 259.A O no hydrogen 2.957 N/A ALA 264.A N TYR 260.A O no hydrogen 2.994 N/A ALA 265.A N PHE 261.A O no hydrogen 2.983 N/A GLY 266.A N ALA 262.A O no hydrogen 3.266 N/A GLY 266.A N ALA 263.A O no hydrogen 3.171 N/A ALA 267.A N ALA 262.A O no hydrogen 2.952 N/A GLN 268.A N GLU 236.A OE1 no hydrogen 2.670 N/A SER 270.A N TYR 243.A O no hydrogen 2.848 N/A SER 270.A OG SER 318.A O no hydrogen 2.951 N/A VAL 272.A N ILE 19.A O no hydrogen 2.872 N/A LEU 273.A N TYR 245.A O no hydrogen 2.886 N/A CYS 274.A N ALA 21.A O no hydrogen 2.964 N/A CYS 274.A SG THR 278.A OG1 no hydrogen 3.616 N/A GLY 275.A N SER 247.A OG no hydrogen 3.301 N/A THR 278.A N GLY 275.A O no hydrogen 2.989 N/A TRP 279.A N GLY 275.A O no hydrogen 3.294 N/A TRP 279.A NE1 ALA 23.A O no hydrogen 2.959 N/A ALA 280.A N ARG 276.A O no hydrogen 2.766 N/A SER 282.A N TRP 279.A O no hydrogen 2.896 N/A SER 282.A OG TRP 279.A O no hydrogen 2.688 N/A VAL 283.A N ALA 280.A O no hydrogen 3.075 N/A TYR 286.A N SER 282.A O no hydrogen 2.763 N/A ILE 287.A N VAL 283.A O no hydrogen 3.108 N/A THR 288.A N PRO 284.A O no hydrogen 2.913 N/A THR 288.A OG1 PRO 284.A O no hydrogen 2.820 N/A LYS 289.A N VAL 285.A O no hydrogen 2.818 N/A GLY 290.A N TYR 286.A O no hydrogen 2.955 N/A ALA 294.A N GLY 290.A O no hydrogen 3.231 N/A ARG 295.A N GLU 291.A O no hydrogen 3.134 N/A ARG 295.A NH1 ASP 292.A OD1 no hydrogen 3.064 N/A LYS 296.A N ASP 292.A O no hydrogen 3.117 N/A TRP 297.A N GLU 293.A O no hydrogen 2.995 N/A LEU 298.A N ALA 294.A O no hydrogen 2.942 N/A CYS 299.A N ARG 295.A O no hydrogen 3.060 N/A CYS 299.A SG GLU 57.A OE1 no hydrogen 3.181 N/A CYS 299.A SG ARG 295.A O no hydrogen 3.520 N/A THR 300.A N TRP 297.A O no hydrogen 3.197 N/A THR 300.A OG1 LYS 296.A O no hydrogen 2.713 N/A THR 300.A OG1 TRP 297.A O no hydrogen 3.372 N/A THR 300.A OG1 GLU 301.A OE2 no hydrogen 3.348 N/A GLU 301.A N THR 300.A OG1 no hydrogen 2.796 N/A GLY 302.A N TRP 297.A O no hydrogen 2.801 N/A PHE 303.A N LEU 298.A O no hydrogen 2.678 N/A GLN 304.A N THR 300.A O no hydrogen 2.963 N/A ASN 305.A N GLU 301.A O no hydrogen 3.041 N/A ASN 305.A ND2 THR 278.A O no hydrogen 2.916 N/A ILE 306.A N GLY 302.A O no hydrogen 3.177 N/A ASP 307.A N PHE 303.A O no hydrogen 2.769 N/A GLU 308.A N GLN 304.A O no hydrogen 3.053 N/A LEU 309.A N ASN 305.A O no hydrogen 3.196 N/A ASN 310.A N ILE 306.A O no hydrogen 2.846 N/A ASN 310.A ND2 TYR 61.A O no hydrogen 2.800 N/A ARG 311.A N ASP 307.A O no hydrogen 3.048 N/A VAL 312.A N GLU 308.A O no hydrogen 3.058 N/A LEU 313.A N LEU 309.A O no hydrogen 2.805 N/A GLU 314.A N ASN 310.A O no hydrogen 2.944 N/A GLU 315.A N ARG 311.A O no hydrogen 3.230 N/A THR 316.A N VAL 312.A O no hydrogen 2.896 N/A THR 316.A N LEU 313.A O no hydrogen 3.204 N/A THR 316.A OG1 VAL 312.A O no hydrogen 2.609 N/A ALA 317.A N LEU 313.A O no hydrogen 2.961 N/A SER 318.A N PHE 269.A O no hydrogen 2.800 N/A TRP 320.A N GLY 17.A O no hydrogen 2.852 N/A TRP 320.A NE1 SER 14.A OG no hydrogen 2.888 N/A GLU 322.A N PRO 319.A O no hydrogen 3.108 N/A LYS 323.A N TRP 320.A O no hydrogen 2.970 N/A LYS 323.A NZ GLU 236.A OE1 no hydrogen 3.565 N/A LYS 323.A NZ GLU 236.A OE2 no hydrogen 3.086 N/A LYS 323.A NZ GLN 268.A O no hydrogen 2.937 N/A ILE 324.A N TRP 320.A O no hydrogen 2.912 N/A HIS 327.A N ILE 2.A O no hydrogen 2.730 N/A