Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bwc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 30.A OD2 no hydrogen 3.507 N/A LEU 3.A N ASP 30.A OD2 no hydrogen 3.308 N/A GLY 6.A N VAL 24.A O no hydrogen 2.729 N/A GLY 7.A N ILE 4.A O no hydrogen 2.887 N/A PHE 9.A N LEU 22.A O no hydrogen 2.773 N/A ARG 10.A NE GLU 12.A OE1 no hydrogen 3.381 N/A ARG 10.A NH1 GLU 12.A OE1 no hydrogen 3.428 N/A GLN 19.A NE2 PRO 221.A O no hydrogen 3.673 N/A LEU 22.A N PHE 9.A O no hydrogen 2.894 N/A ARG 23.A NE ASP 44.A OD1 no hydrogen 3.169 N/A VAL 24.A N GLY 7.A O no hydrogen 2.835 N/A GLU 25.A N GLU 42.A O no hydrogen 2.826 N/A LYS 26.A N GLU 42.A O no hydrogen 3.336 N/A VAL 27.A N SER 5.A OG no hydrogen 3.364 N/A LEU 28.A N ILE 40.A O no hydrogen 2.820 N/A TYR 29.A N ILE 40.A O no hydrogen 2.856 N/A ALA 31.A N LEU 38.A O no hydrogen 3.120 N/A THR 33.A N GLN 36.A O no hydrogen 2.748 N/A THR 33.A OG1 GLN 36.A O no hydrogen 2.637 N/A THR 33.A OG1 ASP 115.A OD2 no hydrogen 2.620 N/A PHE 35.A N THR 33.A OG1 no hydrogen 3.308 N/A GLN 36.A N THR 33.A OG1 no hydrogen 3.069 N/A GLN 36.A NE2 ASP 115.A OD2 no hydrogen 3.219 N/A HIS 37.A N ASP 55.A OD1 no hydrogen 2.744 N/A HIS 37.A NE2 ASP 30.A OD1 no hydrogen 2.669 N/A LEU 38.A N ALA 31.A O no hydrogen 3.026 N/A THR 39.A N ALA 53.A O no hydrogen 2.898 N/A THR 39.A OG1 ASP 30.A OD1 no hydrogen 3.076 N/A ILE 40.A N TYR 29.A O no hydrogen 2.659 N/A PHE 41.A N VAL 52.A O no hydrogen 2.983 N/A GLU 42.A N LYS 26.A O no hydrogen 2.717 N/A SER 43.A N GLY 50.A O no hydrogen 2.850 N/A SER 43.A OG GLY 50.A O no hydrogen 2.745 N/A LYS 46.A N ASP 44.A OD2 no hydrogen 2.833 N/A GLY 47.A N ASP 44.A O no hydrogen 2.908 N/A THR 51.A N ASP 62.A OD2 no hydrogen 2.845 N/A THR 51.A OG1 GLU 42.A OE1 no hydrogen 2.893 N/A THR 51.A OG1 ASP 62.A OD2 no hydrogen 3.096 N/A VAL 52.A N PHE 41.A O no hydrogen 2.786 N/A LEU 54.A N CYS 57.A O no hydrogen 2.765 N/A ASP 55.A N HIS 37.A O no hydrogen 2.823 N/A CYS 57.A N LEU 54.A O no hydrogen 3.037 N/A CYS 57.A SG.B ASP 55.A O no hydrogen 3.826 N/A ILE 58.A N GLU 11.A OE2 no hydrogen 2.773 N/A GLN 59.A NE2 CYS 57.A O no hydrogen 3.580 N/A THR 61.A OG1 ASP 64.A OD1 no hydrogen 2.579 N/A ASP 62.A N THR 51.A O no hydrogen 3.140 N/A GLU 65.A N THR 61.A O no hydrogen 3.087 N/A VAL 67.A N ASP 64.A O no hydrogen 2.915 N/A TYR 68.A OH ASP 162.A OD1 no hydrogen 2.579 N/A HIS 69.A ND1 GLU 65.A OE2 no hydrogen 2.592 N/A GLU 70.A N PHE 66.A O no hydrogen 2.891 N/A VAL 71.A N VAL 67.A O no hydrogen 2.995 N/A LEU 72.A N TYR 68.A O no hydrogen 3.136 N/A GLY 73.A N HIS 69.A O no hydrogen 3.018 N/A HIS 74.A N GLU 70.A O no hydrogen 2.834 N/A HIS 74.A ND1 HIS 103.A NE2 no hydrogen 2.919 N/A HIS 74.A NE2 GLU 99.A OE1 no hydrogen 2.526 N/A THR 75.A N VAL 71.A O no hydrogen 3.063 N/A THR 75.A OG1 VAL 71.A O no hydrogen 2.593 N/A SER 76.A OG LEU 72.A O no hydrogen 2.669 N/A SER 76.A OG GLY 73.A O no hydrogen 2.906 N/A LEU 77.A N GLY 73.A O no hydrogen 3.232 N/A CYS 78.A N HIS 74.A O no hydrogen 2.820 N/A SER 79.A N SER 76.A O no hydrogen 3.113 N/A SER 79.A OG THR 75.A O no hydrogen 2.679 N/A SER 79.A OG VAL 238.A O no hydrogen 3.522 N/A HIS 80.A N LEU 77.A O no hydrogen 3.013 N/A LYS 82.A N HIS 80.A ND1 no hydrogen 3.118 N/A GLU 84.A N ASP 157.A OD2 no hydrogen 2.854 N/A ARG 85.A N ASP 157.A OD2 no hydrogen 2.885 N/A VAL 86.A N HIS 108.A O no hydrogen 3.069 N/A LEU 87.A N VAL 158.A O no hydrogen 2.818 N/A ILE 88.A N ASP 110.A O no hydrogen 2.752 N/A ILE 89.A N ILE 160.A O no hydrogen 2.806 N/A GLY 90.A N VAL 112.A O no hydrogen 2.779 N/A GLY 92.A N ASP 113.A OD2 no hydrogen 2.943 N/A GLY 94.A N GLY 91.A O no hydrogen 3.021 N/A GLY 95.A N ASP 93.A OD1 no hydrogen 2.815 N/A ARG 98.A N GLY 94.A O no hydrogen 2.930 N/A ARG 98.A NH1.A GLN 127.A O no hydrogen 3.382 N/A ARG 98.A NH1.B GLU 65.A OE1 no hydrogen 3.387 N/A ARG 98.A NH2.A GLU 65.A OE1 no hydrogen 3.405 N/A ARG 98.A NH2.A GLU 99.A OE2 no hydrogen 3.328 N/A ARG 98.A NH2.B GLU 65.A OE2 no hydrogen 2.670 N/A ARG 98.A NH2.B GLU 99.A OE2 no hydrogen 2.778 N/A GLU 99.A N GLY 95.A O no hydrogen 3.269 N/A VAL 100.A N VAL 96.A O no hydrogen 2.904 N/A LEU 101.A N LEU 97.A O no hydrogen 2.902 N/A ARG 102.A N GLU 99.A O no hydrogen 3.276 N/A ARG 102.A NE GLU 99.A OE1 no hydrogen 2.888 N/A ARG 102.A NE GLU 99.A OE2 no hydrogen 3.556 N/A ARG 102.A NH2 GLU 99.A OE2 no hydrogen 3.491 N/A HIS 103.A N VAL 100.A O no hydrogen 3.207 N/A HIS 103.A NE2 HIS 74.A ND1 no hydrogen 2.919 N/A THR 105.A OG1 PRO 83.A O no hydrogen 2.980 N/A VAL 106.A N HIS 103.A O no hydrogen 3.272 N/A GLU 107.A N GLU 84.A O no hydrogen 2.803 N/A HIS 108.A N GLU 84.A O no hydrogen 3.078 N/A HIS 108.A NE2 ASP 110.A OD1 no hydrogen 2.613 N/A CYS 109.A N ARG 136.A O no hydrogen 2.816 N/A CYS 109.A SG VAL 86.A O no hydrogen 3.668 N/A CYS 109.A SG ASP 110.A O no hydrogen 3.957 N/A ASP 110.A N VAL 86.A O no hydrogen 2.850 N/A LEU 111.A N THR 138.A O no hydrogen 2.998 N/A VAL 112.A N ILE 88.A O no hydrogen 2.814 N/A ASP 113.A N ARG 140.A O no hydrogen 3.101 N/A ASP 115.A N ASP 113.A OD1 no hydrogen 2.831 N/A GLU 117.A N ASP 115.A OD1 no hydrogen 2.968 N/A VAL 118.A N ASP 115.A O no hydrogen 3.353 N/A GLN 120.A N GLU 117.A O no hydrogen 2.963 N/A SER 121.A N VAL 118.A O no hydrogen 2.951 N/A SER 121.A OG VAL 118.A O no hydrogen 2.575 N/A LYS 122.A NZ GLU 119.A OE2 no hydrogen 2.719 N/A GLN 123.A N GLU 119.A O no hydrogen 3.291 N/A HIS 124.A N GLN 120.A O no hydrogen 2.985 N/A PHE 125.A N SER 121.A O no hydrogen 2.775 N/A ILE 128.A N PHE 125.A O no hydrogen 3.156 N/A SER 129.A N PHE 125.A O no hydrogen 3.016 N/A SER 129.A OG SER 121.A O no hydrogen 2.973 N/A SER 129.A OG PHE 125.A O no hydrogen 2.730 N/A SER 131.A OG GLY 94.A O no hydrogen 2.559 N/A SER 131.A OG ILE 128.A O no hydrogen 3.288 N/A LEU 132.A N SER 129.A O no hydrogen 3.014 N/A ALA 133.A N ARG 130.A O no hydrogen 3.439 N/A ASP 134.A N SER 131.A O no hydrogen 3.067 N/A ARG 136.A N ASP 134.A OD1 no hydrogen 2.801 N/A ARG 136.A NH1 LEU 101.A O no hydrogen 3.333 N/A ARG 136.A NH1 HIS 103.A O no hydrogen 3.409 N/A ARG 136.A NH1 VAL 106.A O no hydrogen 3.269 N/A ARG 136.A NH2 LEU 101.A O no hydrogen 2.920 N/A ALA 137.A N ASP 134.A O no hydrogen 2.851 N/A THR 138.A N CYS 109.A O no hydrogen 2.993 N/A ARG 140.A N LEU 111.A O no hydrogen 2.699 N/A ARG 140.A NH1 ASP 110.A OD1 no hydrogen 3.316 N/A GLY 142.A N ASP 113.A O no hydrogen 2.879 N/A LEU 145.A N ASP 143.A OD1 no hydrogen 3.057 N/A PHE 147.A N ASP 143.A O no hydrogen 3.049 N/A VAL 148.A N GLY 144.A O no hydrogen 3.014 N/A ARG 149.A N LEU 145.A O no hydrogen 3.318 N/A GLN 150.A N ALA 146.A O no hydrogen 3.251 N/A GLN 150.A N PHE 147.A O no hydrogen 3.219 N/A THR 151.A N VAL 148.A O no hydrogen 3.410 N/A THR 151.A OG1 PHE 147.A O no hydrogen 2.705 N/A ASN 154.A N ARG 175.A O no hydrogen 3.043 N/A THR 155.A N ILE 176.A O no hydrogen 2.712 N/A THR 155.A OG1 PRO 152.A O no hydrogen 2.595 N/A TYR 156.A N ILE 176.A O no hydrogen 2.965 N/A TYR 156.A OH ASP 110.A OD2 no hydrogen 2.476 N/A ASP 157.A N ARG 85.A O no hydrogen 2.768 N/A VAL 158.A N ARG 85.A O no hydrogen 3.403 N/A VAL 159.A N ILE 182.A O no hydrogen 3.027 N/A ILE 160.A N LEU 87.A O no hydrogen 2.743 N/A ILE 161.A N CYS 184.A O no hydrogen 2.578 N/A ASP 162.A N ILE 89.A O no hydrogen 2.724 N/A LYS 171.A N GLU 167.A O no hydrogen 2.941 N/A LYS 171.A NZ THR 206.A O no hydrogen 3.226 N/A ASP 172.A N ALA 168.A O no hydrogen 3.060 N/A VAL 173.A N PHE 169.A O no hydrogen 2.884 N/A LEU 174.A N TYR 170.A O no hydrogen 3.001 N/A ARG 175.A N LYS 171.A O no hydrogen 3.062 N/A ARG 175.A NE ASP 153.A OD1 no hydrogen 3.262 N/A ARG 175.A NH1 VAL 148.A O no hydrogen 3.258 N/A ARG 175.A NH1 THR 151.A O no hydrogen 3.247 N/A ARG 175.A NH1 ASP 172.A OD1 no hydrogen 3.271 N/A ARG 175.A NH2 THR 151.A O no hydrogen 2.781 N/A ARG 175.A NH2 ASP 153.A OD1 no hydrogen 2.944 N/A ILE 176.A N ASP 172.A O no hydrogen 2.914 N/A LEU 177.A N VAL 173.A O no hydrogen 3.314 N/A LYS 178.A N TYR 156.A O no hydrogen 2.826 N/A LYS 178.A NZ THR 155.A O no hydrogen 3.514 N/A GLY 181.A N LYS 178.A O no hydrogen 2.705 N/A ILE 182.A N ASP 157.A O no hydrogen 2.969 N/A CYS 183.A N CYS 230.A O no hydrogen 2.903 N/A CYS 184.A N VAL 159.A O no hydrogen 2.732 N/A CYS 184.A SG LEU 72.A O no hydrogen 3.815 N/A CYS 184.A SG THR 227.A OG1 no hydrogen 3.305 N/A ASN 185.A N LEU 228.A O no hydrogen 3.006 N/A GLN 186.A N ILE 161.A O no hydrogen 3.333 N/A GLY 187.A N GLY 226.A O no hydrogen 2.805 N/A SER 189.A OG SER 224.A O no hydrogen 3.385 N/A TRP 191.A N SER 189.A OG no hydrogen 3.193 N/A ASP 193.A N SER 189.A O no hydrogen 3.213 N/A GLU 198.A N LEU 194.A O no hydrogen 3.279 N/A LYS 199.A N GLU 195.A O no hydrogen 3.206 N/A ARG 201.A N GLU 198.A O no hydrogen 3.046 N/A PHE 202.A N LYS 199.A O no hydrogen 2.832 N/A ARG 204.A N SER 200.A O no hydrogen 3.270 N/A GLU 205.A N ARG 201.A O no hydrogen 2.832 N/A THR 206.A N PHE 202.A O no hydrogen 3.034 N/A THR 206.A OG1 PHE 202.A O no hydrogen 2.731 N/A GLY 207.A N ARG 204.A O no hydrogen 3.195 N/A ALA 209.A N SER 231.A O no hydrogen 2.861 N/A SER 210.A N SER 231.A O no hydrogen 3.329 N/A GLN 212.A N VAL 229.A O no hydrogen 3.117 N/A GLN 212.A NE2 VAL 211.A O no hydrogen 3.044 N/A GLN 212.A NE2 ASN 274.A O no hydrogen 3.360 N/A TYR 213.A N ASN 274.A OD1 no hydrogen 2.752 N/A TYR 213.A OH GLU 188.A O no hydrogen 2.717 N/A ALA 214.A N THR 227.A O no hydrogen 2.813 N/A LEU 215.A N SER 263.A O no hydrogen 2.642 N/A HIS 216.A N TYR 255.A OH no hydrogen 3.034 N/A THR 219.A N ASP 64.A OD2 no hydrogen 3.147 N/A THR 219.A OG1 ASP 64.A OD2 no hydrogen 2.612 N/A TYR 220.A N VAL 217.A O no hydrogen 3.475 N/A CYS 222.A SG SER 189.A OG no hydrogen 2.685 N/A CYS 222.A SG SER 224.A O no hydrogen 3.301 N/A GLY 223.A N TYR 220.A O no hydrogen 2.615 N/A THR 227.A N ALA 214.A O no hydrogen 2.910 N/A THR 227.A OG1 ASN 185.A O no hydrogen 2.554 N/A LEU 228.A N ASN 185.A O no hydrogen 2.816 N/A VAL 229.A N GLN 212.A O no hydrogen 2.866 N/A CYS 230.A N CYS 183.A O no hydrogen 2.752 N/A CYS 230.A SG.A CYS 183.A O no hydrogen 3.185 N/A CYS 230.A SG.B CYS 183.A O no hydrogen 3.468 N/A CYS 230.A SG.B LEU 228.A O no hydrogen 3.843 N/A SER 231.A N SER 210.A O no hydrogen 2.795 N/A SER 231.A OG LYS 233.A O no hydrogen 3.353 N/A LYS 232.A N GLY 181.A O no hydrogen 3.120 N/A LYS 232.A NZ LEU 174.A O no hydrogen 2.598 N/A LYS 232.A NZ LEU 177.A O no hydrogen 2.841 N/A THR 239.A N ASP 237.A OD1 no hydrogen 3.343 N/A THR 239.A OG1 ASP 237.A OD1 no hydrogen 2.664 N/A THR 239.A OG1 ASP 237.A OD2 no hydrogen 3.154 N/A LYS 240.A NZ ASP 237.A OD2 no hydrogen 3.373 N/A ARG 243.A N CYS 78.A O no hydrogen 3.153 N/A ARG 243.A NE HIS 80.A O no hydrogen 2.973 N/A ARG 243.A NH2 LEU 77.A O no hydrogen 3.453 N/A ASP 247.A N PRO 244.A O no hydrogen 3.238 N/A ASP 252.A N PHE 249.A O no hydrogen 2.910 N/A LYS 254.A N GLU 70.A OE2 no hydrogen 2.851 N/A TYR 255.A N GLU 70.A OE1 no hydrogen 2.827 N/A TYR 256.A N GLU 70.A OE1 no hydrogen 2.849 N/A TYR 256.A OH HIS 260.A ND1 no hydrogen 2.605 N/A SER 258.A N GLU 246.A OE2 no hydrogen 2.940 N/A SER 258.A OG GLU 246.A OE1 no hydrogen 2.634 N/A HIS 260.A ND1 TYR 256.A OH no hydrogen 2.605 N/A HIS 260.A NE2 VAL 238.A O no hydrogen 2.659 N/A LYS 261.A N SER 258.A O no hydrogen 3.121 N/A LYS 261.A NZ GLU 259.A OE2 no hydrogen 2.847 N/A ALA 262.A N GLU 259.A O no hydrogen 3.143 N/A SER 263.A OG HIS 260.A O no hydrogen 2.628 N/A PHE 264.A N LYS 261.A O no hydrogen 3.417 N/A ALA 265.A N ALA 262.A O no hydrogen 2.933 N/A ALA 270.A N PRO 267.A O no hydrogen 2.850 N/A ARG 271.A N ARG 268.A O no hydrogen 3.246 N/A HIS 272.A NE2 GLU 198.A OE2 no hydrogen 2.674 N/A ILE 273.A N ALA 270.A O no hydrogen 3.282 N/A ASN 274.A N ARG 271.A O no hydrogen 2.966 N/A ASN 274.A ND2 TYR 213.A O no hydrogen 2.885 N/A ASN 274.A ND2 PHE 264.A O no hydrogen 3.089 N/A ASN 275.A N ARG 271.A O no hydrogen 2.997 N/A