Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4piw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 7.A N ASN 331.A OD1 no hydrogen 2.991 N/A VAL 8.A N GLU 11.A OE1 no hydrogen 2.751 N/A GLY 9.A N GLU 11.A OE2 no hydrogen 2.886 N/A GLU 11.A N GLU 11.A OE2 no hydrogen 2.778 N/A TYR 14.A OH GLU 223.A OE1 no hydrogen 2.905 N/A TYR 14.A OH GLU 223.A OE2 no hydrogen 3.071 N/A ALA 17.A N TYR 14.A O no hydrogen 3.245 N/A SER 19.A N SER 16.A O no hydrogen 3.203 N/A SER 19.A OG ALA 17.A O no hydrogen 2.462 N/A SER 19.A OG LYS 21.A O no hydrogen 3.471 N/A CYS 23.A SG GLY 24.A O no hydrogen 3.456 N/A GLY 26.A N THR 29.A OG1 no hydrogen 3.162 N/A PHE 28.A N ASP 212.A OD2 no hydrogen 3.372 N/A THR 29.A N ASP 212.A OD1 no hydrogen 2.954 N/A THR 29.A OG1 ASP 212.A OD1 no hydrogen 2.874 N/A ARG 30.A N GLY 26.A O no hydrogen 3.360 N/A ARG 31.A N GLY 27.A O no hydrogen 3.327 N/A CYS 32.A N PHE 28.A O no hydrogen 3.050 N/A CYS 32.A SG PHE 28.A O no hydrogen 3.154 N/A CYS 32.A SG ALA 215.A O no hydrogen 3.408 N/A GLN 33.A N THR 29.A O no hydrogen 3.096 N/A GLN 34.A N ARG 30.A O no hydrogen 2.784 N/A TRP 35.A N ARG 31.A O no hydrogen 2.934 N/A LEU 36.A N CYS 32.A O no hydrogen 3.128 N/A GLU 37.A N GLN 33.A O no hydrogen 3.254 N/A GLN 38.A N GLN 34.A O no hydrogen 3.278 N/A ARG 39.A N TRP 35.A O no hydrogen 3.077 N/A ARG 39.A NH2 ASP 226.A OD2 no hydrogen 3.097 N/A PHE 40.A N LEU 36.A O no hydrogen 3.216 N/A GLY 41.A N GLU 37.A O no hydrogen 2.833 N/A SER 42.A N GLU 37.A O no hydrogen 3.008 N/A SER 42.A OG LYS 44.A O no hydrogen 3.521 N/A SER 42.A OG ASN 184.A OD1 no hydrogen 3.154 N/A LYS 44.A NZ GLU 193.A OE2 no hydrogen 2.398 N/A VAL 45.A N GLU 37.A OE2 no hydrogen 2.846 N/A LEU 46.A N THR 181.A O no hydrogen 2.873 N/A LEU 47.A N GLN 33.A OE1 no hydrogen 3.076 N/A THR 48.A N GLY 179.A O no hydrogen 2.866 N/A THR 48.A OG1 SER 50.A O no hydrogen 2.814 N/A THR 48.A OG1 SER 54.A OG no hydrogen 2.329 N/A CYS 51.A SG ASP 143.A OD2 no hydrogen 3.887 N/A THR 52.A OG1 SER 77.A OG no hydrogen 2.623 N/A ALA 53.A N SER 50.A OG no hydrogen 3.158 N/A SER 54.A N SER 50.A O no hydrogen 3.000 N/A SER 54.A OG THR 48.A OG1 no hydrogen 2.329 N/A SER 54.A OG SER 50.A O no hydrogen 3.322 N/A SER 54.A OG THR 181.A OG1 no hydrogen 2.934 N/A LEU 55.A N CYS 51.A O no hydrogen 2.673 N/A GLU 56.A N THR 52.A O no hydrogen 2.877 N/A ALA 58.A N LEU 55.A O no hydrogen 3.107 N/A LEU 59.A N GLU 56.A O no hydrogen 3.033 N/A LEU 60.A N ALA 57.A O no hydrogen 3.124 N/A LEU 61.A N ALA 57.A O no hydrogen 3.137 N/A ASP 62.A N LEU 59.A O no hydrogen 3.424 N/A ILE 63.A N ALA 58.A O no hydrogen 3.307 N/A GLN 64.A N ASP 67.A OD2 no hydrogen 2.863 N/A GLN 64.A NE2 ASP 62.A OD1 no hydrogen 2.682 N/A GLY 66.A N GLY 86.A O no hydrogen 3.343 N/A ASP 67.A N GLN 64.A O no hydrogen 3.199 N/A GLU 68.A N LYS 112.A O no hydrogen 3.077 N/A VAL 69.A N LYS 88.A O no hydrogen 2.898 N/A ILE 70.A N VAL 115.A O no hydrogen 2.912 N/A SER 72.A OG HIS 298.A ND1 no hydrogen 2.799 N/A TYR 73.A OH TYR 121.A OH no hydrogen 2.961 N/A THR 74.A OG1 THR 78.A OG1 no hydrogen 2.694 N/A SER 77.A OG THR 52.A OG1 no hydrogen 2.623 N/A THR 78.A N PHE 75.A O no hydrogen 2.944 N/A THR 78.A OG1 THR 74.A OG1 no hydrogen 2.694 N/A THR 78.A OG1 PHE 75.A O no hydrogen 3.124 N/A THR 78.A OG1 ASP 143.A OD1 no hydrogen 2.726 N/A ALA 79.A N VAL 76.A O no hydrogen 3.282 N/A ASN 80.A N VAL 76.A O no hydrogen 2.851 N/A ALA 81.A N SER 77.A O no hydrogen 3.098 N/A PHE 82.A N ALA 79.A O no hydrogen 3.141 N/A VAL 83.A N ALA 79.A O no hydrogen 3.155 N/A LEU 84.A N ASN 80.A O no hydrogen 3.335 N/A ARG 85.A N PHE 82.A O no hydrogen 2.979 N/A GLY 86.A N VAL 83.A O no hydrogen 2.724 N/A ALA 87.A N PHE 82.A O no hydrogen 3.296 N/A LYS 88.A N ASP 67.A O no hydrogen 2.843 N/A LYS 88.A NZ GLU 68.A OE2 no hydrogen 3.231 N/A LYS 88.A NZ GLU 308.A OE1 no hydrogen 3.417 N/A ILE 89.A N PHE 306.A O no hydrogen 3.302 N/A VAL 90.A N VAL 69.A O no hydrogen 2.805 N/A PHE 91.A N GLU 308.A O no hydrogen 2.850 N/A ARG 95.A N ASN 99.A O no hydrogen 2.838 N/A ARG 95.A NE ASP 97.A OD2 no hydrogen 2.793 N/A ARG 95.A NH1 GLU 102.A OE1 no hydrogen 3.403 N/A ARG 95.A NH2 ASP 97.A OD1 no hydrogen 2.383 N/A THR 98.A N ARG 95.A O no hydrogen 3.324 N/A ASN 99.A ND2 VAL 124.A O no hydrogen 3.324 N/A ASP 101.A N ASP 93.A O no hydrogen 3.335 N/A GLU 102.A N GLU 102.A OE1 no hydrogen 2.711 N/A THR 103.A N ASP 101.A OD1 no hydrogen 3.092 N/A THR 103.A OG1 ASP 101.A OD1 no hydrogen 2.668 N/A LEU 104.A N ASP 101.A O no hydrogen 3.058 N/A ALA 108.A N ILE 105.A O no hydrogen 2.956 N/A ILE 109.A N GLU 106.A O no hydrogen 3.406 N/A THR 110.A N THR 113.A OG1 no hydrogen 2.950 N/A THR 110.A OG1 GLU 68.A OE1 no hydrogen 2.391 N/A ASP 111.A N ASP 111.A OD2 no hydrogen 2.552 N/A LYS 112.A N THR 110.A OG1 no hydrogen 3.059 N/A THR 113.A OG1 GLU 68.A OE1 no hydrogen 3.148 N/A ARG 114.A N GLU 68.A O no hydrogen 3.091 N/A ILE 116.A N PHE 139.A O no hydrogen 2.827 N/A VAL 117.A N ILE 70.A O no hydrogen 2.840 N/A HIS 120.A N ASP 143.A O no hydrogen 3.451 N/A HIS 120.A NE2 GLU 142.A OE2 no hydrogen 2.617 N/A TYR 121.A N ASN 99.A OD1 no hydrogen 2.975 N/A TYR 121.A OH HIS 293.A ND1 no hydrogen 2.511 N/A ALA 122.A N GLN 146.A OE1 no hydrogen 3.129 N/A VAL 124.A N TYR 121.A O no hydrogen 2.828 N/A CYS 126.A N HIS 120.A ND1 no hydrogen 3.315 N/A CYS 126.A SG VAL 119.A O no hydrogen 3.305 N/A CYS 126.A SG HIS 120.A ND1 no hydrogen 3.857 N/A ILE 130.A N GLU 127.A O no hydrogen 3.046 N/A LEU 132.A N THR 129.A O no hydrogen 2.928 N/A ALA 133.A N ILE 130.A O no hydrogen 2.981 N/A LYS 135.A N ALA 131.A O no hydrogen 3.252 N/A HIS 136.A N LEU 132.A O no hydrogen 3.080 N/A HIS 136.A NE2 GLU 106.A OE2 no hydrogen 2.650 N/A LEU 138.A N ALA 133.A O no hydrogen 2.862 N/A PHE 139.A N ARG 114.A O no hydrogen 2.997 N/A VAL 140.A N HIS 161.A ND1 no hydrogen 3.214 N/A VAL 141.A N ILE 116.A O no hydrogen 3.336 N/A GLU 142.A N ILE 162.A O no hydrogen 2.600 N/A ASP 143.A N PRO 118.A O no hydrogen 3.039 N/A GLY 147.A N ALA 144.A O no hydrogen 3.425 N/A SER 149.A OG GLY 123.A O no hydrogen 3.077 N/A SER 149.A OG GLY 147.A O no hydrogen 2.327 N/A THR 150.A N VAL 262.A O no hydrogen 3.026 N/A TYR 151.A N ARG 154.A O no hydrogen 2.681 N/A TYR 151.A OH GLU 127.A OE1 no hydrogen 2.615 N/A LYS 152.A N GLY 260.A O no hydrogen 2.539 N/A LYS 152.A NZ ASP 128.A OD2 no hydrogen 2.658 N/A LYS 152.A NZ TYR 151.A OH no hydrogen 3.481 N/A ARG 154.A N TYR 151.A O no hydrogen 3.156 N/A LEU 156.A N SER 149.A O no hydrogen 3.000 N/A GLY 157.A N GLU 142.A OE1 no hydrogen 3.062 N/A GLY 157.A N GLU 142.A OE2 no hydrogen 3.307 N/A THR 158.A N ALA 155.A O no hydrogen 3.250 N/A THR 158.A OG1 ALA 155.A O no hydrogen 2.630 N/A ILE 162.A N VAL 140.A O no hydrogen 3.332 N/A GLY 163.A N LEU 182.A O no hydrogen 2.893 N/A PHE 165.A N ALA 180.A O no hydrogen 2.695 N/A PHE 167.A N GLY 178.A O no hydrogen 2.670 N/A HIS 168.A ND1 THR 170.A OG1 no hydrogen 3.195 N/A THR 170.A N HIS 168.A ND1 no hydrogen 3.378 N/A THR 170.A OG1 HIS 168.A ND1 no hydrogen 3.195 N/A ASN 171.A ND2 ASN 264.A O no hydrogen 3.231 N/A TYR 172.A OH ALA 225.A O no hydrogen 3.283 N/A THR 173.A N GLN 221.A OE1 no hydrogen 3.353 N/A GLY 176.A N THR 173.A O no hydrogen 3.071 N/A GLY 179.A N THR 48.A O no hydrogen 2.781 N/A ALA 180.A N PHE 165.A O no hydrogen 3.013 N/A THR 181.A N LEU 46.A O no hydrogen 2.679 N/A THR 181.A OG1 SER 54.A OG no hydrogen 2.934 N/A LEU 182.A N GLY 163.A O no hydrogen 2.874 N/A ILE 183.A N LYS 44.A O no hydrogen 2.617 N/A ASN 184.A N HIS 161.A O no hydrogen 3.163 N/A ASN 184.A ND2 GLY 157.A O no hydrogen 2.876 N/A ASN 184.A ND2 GLY 160.A O no hydrogen 2.712 N/A ASP 185.A N HIS 161.A O no hydrogen 3.267 N/A ALA 187.A N ASP 185.A OD1 no hydrogen 3.269 N/A LEU 188.A N ASP 185.A O no hydrogen 2.972 N/A ILE 189.A N LYS 186.A O no hydrogen 3.292 N/A ARG 191.A NE ASP 204.A OD2 no hydrogen 3.438 N/A ARG 191.A NH1 LEU 59.A O no hydrogen 2.878 N/A ALA 192.A N LEU 188.A O no hydrogen 3.293 N/A GLU 193.A N ILE 189.A O no hydrogen 3.274 N/A ILE 195.A N ARG 191.A O no hydrogen 3.184 N/A ARG 196.A N ALA 192.A O no hydrogen 3.290 N/A ARG 196.A NH1 LEU 47.A O no hydrogen 2.773 N/A GLU 197.A N ILE 194.A O no hydrogen 3.093 N/A GLY 199.A N GLU 197.A O no hydrogen 2.472 N/A ASN 201.A ND2 GLY 199.A O no hydrogen 3.302 N/A ASN 201.A ND2 THR 200.A O no hydrogen 2.394 N/A ILE 205.A N ASP 204.A OD1 no hydrogen 2.794 N/A SER 207.A N ILE 195.A O no hydrogen 2.767 N/A TYR 209.A N ARG 196.A O no hydrogen 3.286 N/A ASP 212.A N LEU 22.A O no hydrogen 2.536 N/A GLN 214.A N SER 211.A OG no hydrogen 3.405 N/A GLN 214.A NE2 SER 211.A OG no hydrogen 3.026 N/A ALA 215.A N SER 211.A O no hydrogen 3.183 N/A ALA 216.A N ASP 212.A O no hydrogen 2.894 N/A TYR 217.A N LEU 213.A O no hydrogen 3.157 N/A LEU 218.A N GLN 214.A O no hydrogen 2.712 N/A TRP 219.A N ALA 215.A O no hydrogen 2.648 N/A ALA 220.A N ALA 216.A O no hydrogen 3.367 N/A GLN 221.A N TYR 217.A O no hydrogen 3.363 N/A GLN 221.A N LEU 218.A O no hydrogen 2.902 N/A GLN 221.A NE2 PRO 6.A O no hydrogen 2.781 N/A GLN 221.A NE2 GLU 11.A OE1 no hydrogen 3.352 N/A LEU 222.A N LEU 218.A O no hydrogen 2.892 N/A GLU 223.A N TRP 219.A O no hydrogen 3.207 N/A ILE 228.A N ALA 224.A O no hydrogen 3.118 N/A ASN 229.A N ALA 225.A O no hydrogen 3.009 N/A GLN 230.A N ASP 226.A O no hydrogen 2.929 N/A GLN 231.A N ARG 227.A O no hydrogen 3.127 N/A ARG 232.A N ILE 228.A O no hydrogen 2.994 N/A ARG 232.A NE ALA 265.A O no hydrogen 3.113 N/A ARG 232.A NH2 ALA 265.A O no hydrogen 3.336 N/A LEU 233.A N ASN 229.A O no hydrogen 2.882 N/A ALA 234.A N GLN 230.A O no hydrogen 2.823 N/A LEU 235.A N GLN 231.A O no hydrogen 3.030 N/A TRP 236.A N ARG 232.A O no hydrogen 2.996 N/A GLN 237.A N LEU 233.A O no hydrogen 3.176 N/A ASN 238.A N ALA 234.A O no hydrogen 3.305 N/A TYR 239.A OH PRO 327.A O no hydrogen 2.788 N/A TYR 240.A N TRP 236.A O no hydrogen 3.260 N/A ASP 241.A N GLN 237.A O no hydrogen 2.938 N/A LEU 243.A N TYR 239.A O no hydrogen 2.927 N/A ALA 247.A N LEU 243.A O no hydrogen 3.162 N/A LYS 248.A N ALA 244.A O no hydrogen 2.845 N/A ALA 249.A N PRO 245.A O no hydrogen 2.932 N/A GLY 250.A N LEU 246.A O no hydrogen 3.072 N/A ARG 251.A N LEU 246.A O no hydrogen 3.040 N/A ARG 251.A NH1 ARG 251.A O no hydrogen 3.308 N/A ARG 251.A NH1 ASP 276.A OD2 no hydrogen 2.774 N/A ARG 251.A NH2 ASP 276.A OD1 no hydrogen 3.238 N/A GLU 253.A N LYS 270.A O no hydrogen 3.057 N/A CYS 261.A N PRO 258.A O no hydrogen 3.199 N/A CYS 261.A SG ALA 125.A O no hydrogen 3.968 N/A VAL 262.A N THR 150.A O no hydrogen 3.074 N/A ASN 264.A ND2 GLN 146.A O no hydrogen 3.124 N/A ASN 264.A ND2 VAL 148.A O no hydrogen 2.676 N/A HIS 266.A ND1 ASN 171.A OD1 no hydrogen 3.039 N/A TYR 268.A OH ASP 97.A O no hydrogen 3.362 N/A ILE 269.A N LEU 324.A O no hydrogen 2.981 N/A LYS 270.A N GLU 253.A O no hydrogen 2.898 N/A LYS 270.A NZ PRO 96.A O no hydrogen 2.741 N/A LYS 270.A NZ GLU 253.A OE1 no hydrogen 3.142 N/A LEU 271.A N ARG 322.A O no hydrogen 2.736 N/A ASP 276.A N ASP 273.A OD1 no hydrogen 2.858 N/A ARG 277.A N ASP 273.A O no hydrogen 3.223 N/A ARG 277.A NH1 SER 320.A O no hydrogen 2.852 N/A ARG 277.A NH1 LEU 323.A O no hydrogen 3.317 N/A SER 278.A N ILE 274.A O no hydrogen 3.294 N/A ALA 279.A N ASP 275.A O no hydrogen 3.114 N/A LEU 280.A N ASP 276.A O no hydrogen 3.283 N/A ILE 281.A N ARG 277.A O no hydrogen 2.918 N/A ASN 282.A N SER 278.A O no hydrogen 3.034 N/A PHE 283.A N ALA 279.A O no hydrogen 3.021 N/A LEU 284.A N LEU 280.A O no hydrogen 2.777 N/A LYS 285.A N ILE 281.A O no hydrogen 2.948 N/A LYS 285.A NZ ASN 282.A OD1 no hydrogen 3.289 N/A GLU 286.A N ASN 282.A O no hydrogen 3.240 N/A ALA 287.A N PHE 283.A O no hydrogen 3.309 N/A GLU 288.A N LYS 285.A O no hydrogen 2.984 N/A ILE 289.A N LEU 284.A O no hydrogen 2.691 N/A HIS 293.A ND1 TYR 121.A OH no hydrogen 2.511 N/A LEU 297.A N SER 72.A O no hydrogen 2.894 N/A HIS 298.A ND1 SER 72.A OG no hydrogen 2.799 N/A GLY 299.A N PRO 296.A O no hydrogen 3.322 N/A CYS 300.A N LEU 297.A O no hydrogen 3.304 N/A CYS 300.A SG PRO 296.A O no hydrogen 3.641 N/A GLU 304.A N CYS 300.A O no hydrogen 3.176 N/A HIS 305.A N ALA 302.A O no hydrogen 3.191 N/A PHE 306.A N ALA 302.A O no hydrogen 2.731 N/A GLY 307.A N GLY 303.A O no hydrogen 2.915 N/A GLU 308.A N ILE 89.A O no hydrogen 2.762 N/A HIS 310.A N PHE 91.A O no hydrogen 2.934 N/A ARG 314.A N ASP 93.A OD2 no hydrogen 3.324 N/A TYR 315.A N ASP 93.A OD1 no hydrogen 3.290 N/A TYR 315.A N ASP 93.A OD2 no hydrogen 3.100 N/A THR 316.A N ASP 93.A OD1 no hydrogen 2.886 N/A THR 316.A OG1 ASP 93.A OD1 no hydrogen 2.474 N/A THR 317.A N ASP 313.A OD1 no hydrogen 3.345 N/A THR 317.A OG1 ASP 313.A OD2 no hydrogen 2.437 N/A GLU 319.A N TYR 315.A O no hydrogen 2.928 N/A SER 320.A N THR 316.A O no hydrogen 3.296 N/A SER 320.A OG THR 316.A O no hydrogen 3.128 N/A SER 320.A OG THR 317.A O no hydrogen 2.619 N/A GLU 321.A N LYS 318.A O no hydrogen 3.177 N/A ARG 322.A N GLU 319.A O no hydrogen 3.378 N/A ARG 322.A NE LEU 271.A O no hydrogen 3.214 N/A ARG 322.A NH1 GLU 319.A OE1 no hydrogen 2.578 N/A ARG 322.A NH1 GLU 319.A OE2 no hydrogen 2.984 N/A ARG 322.A NH2 LEU 271.A O no hydrogen 2.759 N/A LEU 324.A N ILE 269.A O no hydrogen 2.869 N/A ARG 325.A N VAL 291.A O no hydrogen 2.916 N/A ARG 325.A NE PHE 292.A O no hydrogen 3.068 N/A ARG 325.A NH2 PHE 292.A O no hydrogen 3.074 N/A LEU 326.A N PHE 267.A O no hydrogen 3.118 N/A LEU 328.A N PHE 2.A O no hydrogen 3.297 N/A ASN 331.A ND2 VAL 7.A O no hydrogen 3.323 N/A LEU 332.A N PHE 329.A O no hydrogen 3.324 N/A ASN 336.A N SER 333.A O no hydrogen 3.164 N/A ASN 336.A N SER 333.A OG no hydrogen 3.389 N/A GLN 337.A N SER 333.A O no hydrogen 3.113 N/A GLN 337.A NE2 LEU 235.A O no hydrogen 2.796 N/A GLN 337.A NE2 ASN 238.A OD1 no hydrogen 3.634 N/A ARG 338.A N PRO 334.A O no hydrogen 3.449 N/A THR 339.A OG1 VAL 335.A O no hydrogen 2.901 N/A VAL 340.A N ASN 336.A O no hydrogen 3.335 N/A ILE 341.A N GLN 337.A O no hydrogen 3.166 N/A ALA 342.A N ARG 338.A O no hydrogen 2.731 N/A THR 343.A N THR 339.A O no hydrogen 3.016 N/A THR 343.A N VAL 340.A O no hydrogen 2.980 N/A THR 343.A OG1 THR 339.A O no hydrogen 2.616 N/A LEU 344.A N VAL 340.A O no hydrogen 2.817 N/A LEU 345.A N ILE 341.A O no hydrogen 3.015 N/A TYR 347.A N THR 343.A O no hydrogen 3.208 N/A TYR 347.A N LEU 344.A O no hydrogen 2.927 N/A TYR 347.A OH ASP 276.A OD1 no hydrogen 2.882 N/A PHE 348.A N LEU 344.A O no hydrogen 3.198 N/A