Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bwo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 8.A N PRO 5.A O no hydrogen 3.075 N/A VAL 11.A N LYS 324.A O no hydrogen 2.978 N/A LEU 13.A N MET 326.A O no hydrogen 2.810 N/A ASP 14.A N ASN 12.A OD1 no hydrogen 3.058 N/A ASP 17.A N HIS 15.A ND1 no hydrogen 3.359 N/A THR 19.A N ASP 17.A O no hydrogen 2.884 N/A ALA 20.A N LEU 345.A O no hydrogen 3.089 N/A TYR 21.A OH TYR 178.A OH no hydrogen 2.639 N/A GLU 22.A N THR 19.A O no hydrogen 3.196 N/A TYR 24.A OH GLU 255.A O no hydrogen 2.561 N/A TRP 25.A N TYR 21.A O no hydrogen 3.247 N/A TRP 25.A NE1 THR 197.A O no hydrogen 2.811 N/A ARG 26.A N GLU 22.A O no hydrogen 3.129 N/A ARG 26.A N GLU 23.A O no hydrogen 3.085 N/A LYS 27.A N GLU 23.A O no hydrogen 3.199 N/A LYS 27.A NZ GLU 23.A OE1 no hydrogen 3.315 N/A LYS 27.A NZ GLU 23.A OE2 no hydrogen 3.371 N/A MET 28.A N TYR 24.A O no hydrogen 3.114 N/A GLY 29.A N ARG 26.A O no hydrogen 3.222 N/A ARG 31.A NH2 GLU 255.A OE2 no hydrogen 3.454 N/A CYS 32.A N GLY 29.A O no hydrogen 3.202 N/A THR 33.A N ASP 30.A O no hydrogen 3.103 N/A THR 33.A OG1 ASP 30.A O no hydrogen 3.154 N/A ARG 37.A N ASP 40.A OD2 no hydrogen 2.840 N/A ASP 40.A N ARG 37.A O no hydrogen 3.107 N/A PHE 45.A N SER 43.A OG no hydrogen 2.955 N/A SER 46.A N TRP 53.A O no hydrogen 2.785 N/A SER 46.A OG GLU 56.A OE2 no hydrogen 2.184 N/A ASP 47.A N TRP 53.A O no hydrogen 3.000 N/A THR 49.A N ASP 47.A OD1 no hydrogen 2.877 N/A ASN 50.A N ASP 47.A O no hydrogen 3.211 N/A LEU 55.A N CYS 52.A O no hydrogen 3.141 N/A GLU 56.A N GLN 234.A OE1 no hydrogen 3.083 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.668 N/A LEU 59.A N GLU 56.A O no hydrogen 2.939 N/A GLU 60.A N GLU 56.A O no hydrogen 3.098 N/A ASP 61.A N PRO 57.A O no hydrogen 2.878 N/A ALA 62.A N GLU 58.A O no hydrogen 3.338 N/A ILE 63.A N LEU 59.A O no hydrogen 2.920 N/A LYS 64.A N GLU 60.A O no hydrogen 3.110 N/A ASP 65.A N ASP 61.A O no hydrogen 2.867 N/A LEU 66.A N ALA 62.A O no hydrogen 2.908 N/A HIS 67.A N ILE 63.A O no hydrogen 2.882 N/A HIS 67.A ND1 ASN 72.A OD1 no hydrogen 2.788 N/A GLY 68.A N LYS 64.A O no hydrogen 2.816 N/A VAL 69.A N ASP 65.A O no hydrogen 2.883 N/A VAL 70.A N LEU 66.A O no hydrogen 3.014 N/A GLY 71.A N HIS 67.A O no hydrogen 2.624 N/A ASN 72.A ND2 TYR 174.A O no hydrogen 3.034 N/A ALA 74.A N GLN 185.A O no hydrogen 2.822 N/A GLU 76.A N GLU 76.A OE2 no hydrogen 2.842 N/A ARG 78.A NE GLU 76.A O no hydrogen 2.635 N/A ARG 78.A NH1 ASP 186.A OD1 no hydrogen 2.716 N/A ARG 78.A NH2 GLU 76.A O no hydrogen 3.226 N/A ARG 78.A NH2 ASP 186.A OD1 no hydrogen 2.634 N/A TYR 79.A N VAL 209.A O no hydrogen 2.964 N/A VAL 81.A N ALA 207.A O no hydrogen 2.977 N/A GLY 83.A N GLY 205.A O no hydrogen 3.024 N/A THR 84.A N GLN 88.A OE1 no hydrogen 2.540 N/A THR 84.A OG1 GLN 88.A OE1 no hydrogen 2.893 N/A GLN 88.A N GLY 85.A O no hydrogen 3.212 N/A GLN 88.A NE2 ASN 225.A OD1 no hydrogen 2.964 N/A GLN 88.A NE2 SER 226.A OG no hydrogen 2.973 N/A LEU 89.A N GLY 85.A O no hydrogen 3.495 N/A CYS 90.A N SER 86.A O no hydrogen 2.699 N/A GLN 91.A NE2 THR 87.A O no hydrogen 3.113 N/A ALA 92.A N GLN 88.A O no hydrogen 2.929 N/A ALA 93.A N LEU 89.A O no hydrogen 2.821 N/A VAL 94.A N CYS 90.A O no hydrogen 3.142 N/A HIS 95.A N GLN 91.A O no hydrogen 3.039 N/A ALA 96.A N ALA 92.A O no hydrogen 2.900 N/A LEU 97.A N ALA 93.A O no hydrogen 2.913 N/A SER 98.A N VAL 94.A O no hydrogen 3.112 N/A SER 98.A OG VAL 94.A O no hydrogen 2.972 N/A SER 98.A OG MET 129.A O no hydrogen 3.019 N/A SER 99.A N HIS 95.A O no hydrogen 2.787 N/A LEU 100.A N ALA 96.A O no hydrogen 3.028 N/A ALA 101.A N SER 98.A O no hydrogen 3.280 N/A GLN 104.A NE2 SER 98.A O no hydrogen 2.914 N/A VAL 106.A N MET 129.A O no hydrogen 3.166 N/A SER 107.A N PRO 144.A O no hydrogen 3.045 N/A VAL 108.A N LYS 131.A O no hydrogen 2.799 N/A VAL 109.A N ILE 146.A O no hydrogen 3.035 N/A ALA 110.A N GLY 134.A O no hydrogen 3.280 N/A ALA 112.A N ASP 135.A OD1 no hydrogen 3.232 N/A PHE 114.A N CYS 333.A O no hydrogen 2.859 N/A TYR 118.A N TYR 115.A O no hydrogen 2.756 N/A TYR 118.A OH THR 150.A OG1 no hydrogen 2.985 N/A TYR 118.A OH ASP 170.A OD2 no hydrogen 2.568 N/A VAL 119.A N SER 116.A O no hydrogen 2.964 N/A GLU 121.A N THR 117.A O no hydrogen 3.196 N/A THR 122.A N TYR 118.A O no hydrogen 3.226 N/A THR 122.A OG1 TYR 118.A O no hydrogen 2.755 N/A THR 122.A OG1 VAL 119.A O no hydrogen 3.562 N/A THR 123.A N GLU 120.A O no hydrogen 3.221 N/A THR 123.A OG1 VAL 119.A O no hydrogen 2.610 N/A TYR 124.A N GLU 120.A O no hydrogen 2.910 N/A TYR 124.A OH GLN 91.A OE1 no hydrogen 2.873 N/A ARG 126.A N THR 123.A O no hydrogen 2.923 N/A MET 129.A N SER 127.A OG no hydrogen 3.083 N/A LYS 131.A N VAL 106.A O no hydrogen 2.861 N/A GLU 133.A N VAL 108.A O no hydrogen 2.821 N/A ALA 136.A N ALA 110.A O no hydrogen 3.176 N/A TRP 137.A N ASP 135.A OD1 no hydrogen 2.721 N/A PHE 139.A N ALA 136.A O no hydrogen 3.203 N/A ILE 146.A N SER 107.A O no hydrogen 2.492 N/A GLU 147.A N LYS 166.A O no hydrogen 2.906 N/A LEU 148.A N VAL 109.A O no hydrogen 2.880 N/A VAL 149.A N ILE 168.A O no hydrogen 2.851 N/A THR 150.A OG1 TYR 118.A OH no hydrogen 2.985 N/A SER 151.A N ASP 170.A O no hydrogen 3.082 N/A ASN 153.A N THR 158.A O no hydrogen 2.840 N/A ASN 153.A ND2 PRO 113.A O no hydrogen 3.327 N/A ASN 153.A ND2 ASP 156.A OD1 no hydrogen 2.796 N/A GLY 157.A N ASN 153.A O no hydrogen 2.691 N/A THR 158.A N ASP 156.A OD1 no hydrogen 2.682 N/A THR 158.A OG1 ASP 156.A OD1 no hydrogen 2.829 N/A ARG 160.A N SER 151.A OG no hydrogen 3.024 N/A ARG 160.A NH1 ALA 111.A O no hydrogen 2.722 N/A ARG 160.A NH1 PRO 113.A O no hydrogen 2.983 N/A ARG 160.A NH2 PRO 113.A O no hydrogen 2.597 N/A ARG 160.A NH2 ASP 156.A OD2 no hydrogen 3.130 N/A VAL 163.A N GLU 147.A OE1 no hydrogen 2.810 N/A LYS 166.A N TYR 145.A O no hydrogen 2.904 N/A ILE 168.A N GLU 147.A O no hydrogen 2.895 N/A HIS 169.A N ILE 189.A O no hydrogen 3.044 N/A ASP 170.A N VAL 149.A O no hydrogen 2.725 N/A PHE 171.A N LEU 191.A O no hydrogen 2.960 N/A ALA 172.A N ASP 170.A OD1 no hydrogen 3.170 N/A TYR 174.A N PHE 171.A O no hydrogen 3.179 N/A TYR 174.A OH ARG 183.A O no hydrogen 2.630 N/A HIS 177.A N HIS 177.A ND1 no hydrogen 2.792 N/A TYR 178.A N TRP 175.A O no hydrogen 2.833 N/A TYR 178.A OH TYR 21.A OH no hydrogen 2.639 N/A THR 179.A N TRP 175.A O no hydrogen 3.046 N/A ARG 184.A NH2 GLU 76.A OE2 no hydrogen 2.564 N/A GLN 185.A N ASN 72.A O no hydrogen 3.109 N/A MET 190.A N LEU 208.A O no hydrogen 2.978 N/A LEU 191.A N HIS 169.A O no hydrogen 2.770 N/A PHE 192.A N TRP 206.A O no hydrogen 2.894 N/A PHE 194.A N ILE 204.A O no hydrogen 2.831 N/A SER 195.A N THR 193.A OG1 no hydrogen 3.069 N/A SER 195.A OG THR 193.A OG1 no hydrogen 3.230 N/A THR 197.A N PHE 194.A O no hydrogen 3.376 N/A THR 197.A OG1 HIS 199.A ND1 no hydrogen 2.472 N/A HIS 199.A N THR 197.A OG1 no hydrogen 3.417 N/A HIS 199.A ND1 THR 197.A OG1 no hydrogen 2.472 N/A ALA 200.A N GLY 198.A O no hydrogen 2.895 N/A SER 202.A N HIS 199.A O no hydrogen 3.497 N/A ARG 203.A N ALA 200.A O no hydrogen 3.144 N/A ARG 203.A NH1 ALA 200.A O no hydrogen 2.808 N/A GLY 205.A N GLY 83.A O no hydrogen 3.242 N/A TRP 206.A N PHE 192.A O no hydrogen 2.851 N/A TRP 206.A NE1 HIS 67.A NE2 no hydrogen 3.022 N/A ALA 207.A N VAL 81.A O no hydrogen 2.713 N/A LEU 208.A N MET 190.A O no hydrogen 2.872 N/A VAL 209.A N TYR 79.A O no hydrogen 2.920 N/A LYS 210.A N ASP 188.A O no hydrogen 2.977 N/A LYS 210.A NZ ASP 186.A O no hydrogen 3.481 N/A LYS 210.A NZ ASP 186.A OD1 no hydrogen 2.774 N/A GLU 213.A N ASP 211.A OD1 no hydrogen 3.104 N/A ALA 215.A N ASP 211.A O no hydrogen 3.104 N/A LYS 216.A N LYS 212.A O no hydrogen 2.856 N/A LYS 217.A N GLU 213.A O no hydrogen 3.176 N/A MET 218.A N VAL 214.A O no hydrogen 2.827 N/A VAL 219.A N ALA 215.A O no hydrogen 2.919 N/A GLU 220.A N LYS 216.A O no hydrogen 3.095 N/A TYR 221.A N LYS 217.A O no hydrogen 2.944 N/A TYR 221.A OH ASN 225.A OD1 no hydrogen 3.415 N/A ILE 222.A N MET 218.A O no hydrogen 3.050 N/A ILE 223.A N VAL 219.A O no hydrogen 2.823 N/A VAL 224.A N GLU 220.A O no hydrogen 3.101 N/A ASN 225.A N TYR 221.A O no hydrogen 2.877 N/A SER 226.A N ILE 222.A O no hydrogen 2.851 N/A SER 226.A OG GLY 228.A O no hydrogen 3.204 N/A ILE 227.A N ILE 223.A O no hydrogen 2.851 N/A SER 230.A OG GLU 232.A OE1 no hydrogen 3.524 N/A LYS 231.A NZ TYR 44.A O no hydrogen 2.812 N/A LYS 231.A NZ SER 46.A OG no hydrogen 3.358 N/A SER 233.A N SER 230.A O no hydrogen 3.264 N/A SER 233.A OG SER 202.A O no hydrogen 2.523 N/A GLN 234.A N SER 230.A O no hydrogen 3.206 N/A GLN 234.A NE2 PHE 54.A O no hydrogen 2.794 N/A GLN 234.A NE2 VAL 229.A O no hydrogen 3.174 N/A VAL 235.A N LYS 231.A O no hydrogen 2.850 N/A ARG 236.A N GLU 232.A O no hydrogen 2.975 N/A THR 237.A N SER 233.A O no hydrogen 2.653 N/A THR 237.A OG1 SER 233.A O no hydrogen 3.213 N/A ALA 238.A N GLN 234.A O no hydrogen 2.943 N/A LYS 239.A N VAL 235.A O no hydrogen 3.151 N/A LYS 239.A NZ ARG 31.A O no hydrogen 3.341 N/A LYS 239.A NZ THR 33.A O no hydrogen 2.724 N/A ILE 240.A N ARG 236.A O no hydrogen 2.948 N/A LEU 241.A N THR 237.A O no hydrogen 2.856 N/A ASN 242.A N ALA 238.A O no hydrogen 2.997 N/A VAL 243.A N LYS 239.A O no hydrogen 3.159 N/A LEU 244.A N ILE 240.A O no hydrogen 2.884 N/A LYS 245.A N LEU 241.A O no hydrogen 3.057 N/A GLU 246.A N ASN 242.A O no hydrogen 2.969 N/A THR 247.A N VAL 243.A O no hydrogen 2.863 N/A THR 247.A OG1 TYR 24.A OH no hydrogen 3.356 N/A THR 247.A OG1 GLU 255.A O no hydrogen 2.993 N/A CYS 248.A N LYS 245.A O no hydrogen 2.926 N/A CYS 248.A SG LEU 244.A O no hydrogen 3.679 N/A CYS 248.A SG TYR 294.A OH no hydrogen 3.072 N/A LYS 249.A N GLU 246.A O no hydrogen 3.082 N/A SER 250.A N THR 247.A O no hydrogen 2.903 N/A SER 250.A OG GLU 255.A OE1 no hydrogen 3.479 N/A SER 252.A OG SER 254.A OG no hydrogen 2.890 N/A SER 254.A N SER 252.A OG no hydrogen 3.422 N/A SER 254.A OG SER 252.A OG no hydrogen 2.890 N/A ASN 256.A N SER 252.A O no hydrogen 3.033 N/A ASN 256.A ND2 SER 250.A O no hydrogen 3.577 N/A LYS 259.A N ASN 256.A O no hydrogen 2.981 N/A LYS 259.A N ASN 256.A OD1 no hydrogen 2.815 N/A LYS 259.A NZ GLU 253.A OE1 no hydrogen 2.895 N/A LYS 259.A NZ GLU 263.A OE2 no hydrogen 2.798 N/A TYR 260.A N ASN 256.A O no hydrogen 2.861 N/A GLY 261.A N PHE 257.A O no hydrogen 2.633 N/A ARG 262.A N PHE 258.A O no hydrogen 3.141 N/A ARG 262.A NH1 PRO 176.A O no hydrogen 3.312 N/A ARG 262.A NH2 GLU 300.A O no hydrogen 2.085 N/A GLU 263.A N LYS 259.A O no hydrogen 3.040 N/A MET 264.A N TYR 260.A O no hydrogen 3.080 N/A MET 265.A N GLY 261.A O no hydrogen 2.841 N/A LYS 266.A N ARG 262.A O no hydrogen 2.811 N/A LYS 266.A NZ GLU 270.A OE1 no hydrogen 2.784 N/A ASN 267.A N GLU 263.A O no hydrogen 3.189 N/A ARG 268.A N MET 264.A O no hydrogen 3.070 N/A ARG 268.A NH1 MET 344.A O no hydrogen 2.641 N/A ARG 268.A NH1 SER 346.A O no hydrogen 2.820 N/A ARG 268.A NH2 SER 346.A O no hydrogen 3.009 N/A TRP 269.A N MET 265.A O no hydrogen 3.074 N/A TRP 269.A NE1 PRO 303.A O no hydrogen 2.849 N/A GLU 270.A N LYS 266.A O no hydrogen 2.835 N/A LYS 271.A N ASN 267.A O no hydrogen 3.014 N/A LYS 271.A NZ ASN 352.A OD1 no hydrogen 3.081 N/A LEU 272.A N ARG 268.A O no hydrogen 3.113 N/A ARG 273.A N TRP 269.A O no hydrogen 2.822 N/A GLU 274.A N GLU 270.A O no hydrogen 2.942 N/A VAL 275.A N LYS 271.A O no hydrogen 3.232 N/A VAL 276.A N LEU 272.A O no hydrogen 3.033 N/A LYS 277.A N ARG 273.A O no hydrogen 2.959 N/A GLU 278.A N GLU 274.A O no hydrogen 3.168 N/A SER 279.A N VAL 276.A O no hydrogen 2.947 N/A SER 279.A OG VAL 275.A O no hydrogen 2.858 N/A THR 283.A N GLY 309.A O no hydrogen 2.760 N/A TYR 287.A OH ASP 156.A O no hydrogen 2.528 N/A ALA 290.A N LEU 299.A O no hydrogen 3.093 N/A CYS 292.A N LYS 297.A O no hydrogen 2.703 N/A ASN 293.A N ILE 181.A O no hydrogen 2.964 N/A ASN 293.A ND2 ILE 181.A O no hydrogen 2.852 N/A ASN 293.A ND2 THR 182.A O no hydrogen 2.697 N/A LEU 299.A N ALA 290.A O no hydrogen 2.780 N/A TYR 302.A N TYR 178.A O no hydrogen 2.853 N/A ALA 306.A N VAL 342.A O no hydrogen 2.683 N/A LEU 308.A N VAL 340.A O no hydrogen 2.956 N/A GLY 309.A N THR 283.A O no hydrogen 3.042 N/A THR 310.A N LYS 338.A O no hydrogen 2.921 N/A LYS 311.A N ALA 281.A O no hydrogen 2.996 N/A LEU 316.A N LYS 337.A O no hydrogen 2.923 N/A SER 318.A N ASP 315.A O no hydrogen 2.734 N/A SER 318.A OG ASP 315.A OD1 no hydrogen 2.577 N/A GLU 319.A N ASP 315.A O no hydrogen 3.040 N/A LEU 320.A N LEU 316.A O no hydrogen 2.935 N/A ARG 321.A N VAL 317.A O no hydrogen 3.214 N/A ARG 322.A N SER 318.A O no hydrogen 2.977 N/A HIS 323.A N LEU 320.A O no hydrogen 3.179 N/A HIS 323.A ND1 GLU 319.A O no hydrogen 3.174 N/A LYS 324.A N ARG 321.A O no hydrogen 2.781 N/A LYS 324.A NZ SER 7.A O no hydrogen 2.774 N/A VAL 325.A N LEU 320.A O no hydrogen 2.928 N/A MET 326.A N VAL 11.A O no hydrogen 2.740 N/A ARG 328.A N ARG 341.A O no hydrogen 3.076 N/A ARG 328.A NE ASP 14.A OD1 no hydrogen 3.015 N/A ARG 328.A NE ASP 14.A OD2 no hydrogen 3.504 N/A ARG 328.A NH1 SER 116.A OG no hydrogen 3.070 N/A ARG 328.A NH2 ASP 14.A OD2 no hydrogen 3.152 N/A GLY 330.A N HIS 339.A O no hydrogen 2.839 N/A ARG 332.A N ALA 329.A O no hydrogen 2.720 N/A CYS 333.A N GLY 330.A O no hydrogen 2.817 N/A GLY 334.A N GLU 331.A O no hydrogen 3.304 N/A SER 335.A N GLY 330.A O no hydrogen 2.912 N/A LYS 337.A NZ GLU 331.A OE1 no hydrogen 2.709 N/A LYS 337.A NZ GLU 331.A OE2 no hydrogen 3.268 N/A LYS 338.A N ASP 336.A OD2 no hydrogen 3.043 N/A HIS 339.A N ASP 336.A O no hydrogen 3.125 N/A HIS 339.A ND1 ASP 336.A OD2 no hydrogen 2.950 N/A VAL 340.A N LEU 308.A O no hydrogen 2.869 N/A ARG 341.A N ARG 328.A O no hydrogen 2.775 N/A ARG 341.A NH1 ASN 154.A OD1 no hydrogen 2.962 N/A ARG 341.A NH2 ASP 14.A O no hydrogen 2.852 N/A VAL 342.A N ALA 306.A O no hydrogen 2.937 N/A SER 343.A N LEU 13.A O no hydrogen 3.197 N/A MET 344.A N ALA 304.A O no hydrogen 2.672 N/A LEU 345.A N SER 343.A OG no hydrogen 3.096 N/A SER 346.A OG ARG 347.A O no hydrogen 3.228 N/A VAL 350.A N ASP 349.A OD2 no hydrogen 2.618 N/A PHE 351.A N ARG 347.A O no hydrogen 2.943 N/A ASN 352.A N GLU 348.A O no hydrogen 2.972 N/A VAL 353.A N ASP 349.A O no hydrogen 2.965 N/A PHE 354.A N VAL 350.A O no hydrogen 3.054 N/A LEU 355.A N PHE 351.A O no hydrogen 3.017 N/A GLU 356.A N ASN 352.A O no hydrogen 3.027 N/A ARG 357.A N VAL 353.A O no hydrogen 3.036 N/A ARG 357.A NH1 PHE 9.A O no hydrogen 2.833 N/A ARG 357.A NH2 MET 6.A O no hydrogen 3.092 N/A ARG 357.A NH2 PHE 9.A O no hydrogen 2.548 N/A LEU 358.A N PHE 354.A O no hydrogen 2.892 N/A ALA 359.A N LEU 355.A O no hydrogen 3.178 N/A ASN 360.A N GLU 356.A O no hydrogen 3.268 N/A