Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q41_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N GLN 36.A O no hydrogen 3.069 N/A ASN 5.A ND2 GLN 63.A O no hydrogen 3.411 N/A ILE 6.A N ASN 38.A O no hydrogen 3.114 N/A GLY 7.A N ALA 66.A O no hydrogen 2.965 N/A VAL 9.A N LEU 68.A O no hydrogen 2.513 N/A LEU 10.A N VAL 42.A O no hydrogen 3.262 N/A SER 11.A N GLU 254.A OE1 no hydrogen 3.013 N/A SER 11.A OG GLU 254.A OE1 no hydrogen 3.111 N/A SER 11.A OG GLU 254.A OE2 no hydrogen 2.705 N/A THR 12.A OG1 HIS 15.A ND1 no hydrogen 2.615 N/A HIS 15.A N THR 12.A O no hydrogen 3.196 N/A HIS 15.A N THR 12.A OG1 no hydrogen 3.192 N/A HIS 15.A ND1 THR 12.A OG1 no hydrogen 2.615 N/A GLU 16.A N THR 12.A O no hydrogen 3.003 N/A GLN 17.A N ARG 13.A O no hydrogen 3.402 N/A MET 18.A N LYS 14.A O no hydrogen 3.211 N/A PHE 19.A N HIS 15.A O no hydrogen 3.002 N/A ARG 20.A N GLU 16.A O no hydrogen 3.055 N/A GLU 21.A N GLN 17.A O no hydrogen 2.874 N/A ALA 22.A N MET 18.A O no hydrogen 3.260 N/A VAL 23.A N PHE 19.A O no hydrogen 3.054 N/A ASN 24.A N ARG 20.A O no hydrogen 3.073 N/A GLN 25.A N GLU 21.A O no hydrogen 2.821 N/A ALA 26.A N ALA 22.A O no hydrogen 3.080 N/A ASN 27.A N VAL 23.A O no hydrogen 3.144 N/A ASN 27.A ND2 LEU 37.A O no hydrogen 2.801 N/A LYS 28.A N ASN 24.A O no hydrogen 3.302 N/A HIS 30.A N ALA 26.A O no hydrogen 3.122 N/A GLN 36.A N LYS 2.A O no hydrogen 2.793 N/A GLN 36.A NE2 SER 32.A O no hydrogen 3.401 N/A LEU 37.A N ASN 27.A OD1 no hydrogen 2.964 N/A ASN 38.A N VAL 4.A O no hydrogen 2.775 N/A ASN 38.A ND2 ASN 5.A OD1 no hydrogen 2.721 N/A THR 40.A N ILE 6.A O no hydrogen 3.216 N/A SER 41.A OG GLU 16.A OE2 no hydrogen 2.698 N/A VAL 42.A N ALA 8.A O no hydrogen 2.984 N/A HIS 44.A N LEU 10.A O no hydrogen 2.857 N/A LYS 45.A NZ SER 54.A OG no hydrogen 2.895 N/A MET 51.A N ASN 47.A O no hydrogen 3.063 N/A ALA 52.A N ALA 48.A O no hydrogen 3.332 N/A LEU 53.A N ILE 49.A O no hydrogen 3.193 N/A SER 54.A N GLN 50.A O no hydrogen 3.137 N/A SER 54.A OG ASP 58.A OD2 no hydrogen 2.880 N/A VAL 55.A N MET 51.A O no hydrogen 3.058 N/A CYS 56.A N ALA 52.A O no hydrogen 3.307 N/A GLU 57.A N LEU 53.A O no hydrogen 2.925 N/A ASP 58.A N SER 54.A O no hydrogen 2.923 N/A ILE 60.A N VAL 55.A O no hydrogen 2.784 N/A SER 61.A N CYS 56.A O no hydrogen 3.069 N/A SER 61.A OG CYS 56.A O no hydrogen 2.719 N/A SER 61.A OG GLU 57.A O no hydrogen 3.390 N/A SER 62.A N LEU 59.A O no hydrogen 2.756 N/A SER 62.A OG ASP 58.A O no hydrogen 3.037 N/A GLN 63.A N ILE 60.A O no hydrogen 3.234 N/A TYR 65.A N ASN 5.A O no hydrogen 3.024 N/A ILE 67.A N PRO 94.A O no hydrogen 2.961 N/A LEU 68.A N GLY 7.A O no hydrogen 2.876 N/A VAL 69.A N LEU 96.A O no hydrogen 2.695 N/A SER 70.A N VAL 9.A O no hydrogen 2.562 N/A SER 70.A OG THR 99.A OG1 no hydrogen 3.338 N/A HIS 71.A ND1 PRO 72.A O no hydrogen 2.836 N/A THR 74.A OG1 ASP 77.A OD2 no hydrogen 2.272 N/A ASN 76.A N THR 74.A OG1 no hydrogen 2.866 N/A ASP 77.A N THR 74.A O no hydrogen 3.213 N/A ASP 77.A N THR 74.A OG1 no hydrogen 2.998 N/A THR 80.A N ASP 77.A O no hydrogen 2.876 N/A THR 80.A OG1 ASP 77.A O no hydrogen 3.265 N/A THR 82.A N PHE 79.A O no hydrogen 2.995 N/A THR 82.A OG1 PHE 79.A O no hydrogen 2.674 N/A SER 85.A N PRO 81.A O no hydrogen 2.676 N/A SER 85.A OG HIS 111.A ND1 no hydrogen 2.775 N/A TYR 86.A N THR 82.A O no hydrogen 2.894 N/A THR 87.A N PRO 83.A O no hydrogen 2.997 N/A THR 87.A OG1 PRO 83.A O no hydrogen 2.954 N/A ALA 88.A N VAL 84.A O no hydrogen 2.954 N/A GLY 89.A N SER 85.A O no hydrogen 2.875 N/A PHE 90.A N TYR 86.A O no hydrogen 3.049 N/A TYR 91.A N ALA 88.A O no hydrogen 3.200 N/A TYR 91.A OH ASN 288.A O no hydrogen 2.851 N/A ARG 92.A N GLY 89.A O no hydrogen 3.020 N/A ARG 92.A NH1 GLY 89.A O no hydrogen 2.857 N/A ILE 93.A N ALA 88.A O no hydrogen 2.978 N/A VAL 95.A N SER 113.A O no hydrogen 2.723 N/A LEU 96.A N ILE 67.A O no hydrogen 2.644 N/A GLY 97.A N LEU 115.A O no hydrogen 2.433 N/A LEU 98.A N VAL 69.A O no hydrogen 2.889 N/A THR 99.A OG1 SER 70.A OG no hydrogen 3.338 N/A THR 99.A OG1 HIS 71.A O no hydrogen 3.335 N/A THR 100.A OG1 HIS 78.A O no hydrogen 2.663 N/A ARG 101.A NE PRO 119.A O no hydrogen 3.139 N/A ARG 101.A NH1 GLU 228.A OE1 no hydrogen 2.806 N/A MET 102.A N THR 100.A OG1 no hydrogen 3.379 N/A SER 103.A N GLU 149.A OE1 no hydrogen 2.686 N/A SER 103.A OG SER 122.A OG no hydrogen 3.072 N/A SER 103.A OG GLU 149.A OE1 no hydrogen 3.215 N/A SER 103.A OG GLU 149.A OE2 no hydrogen 2.697 N/A SER 106.A N SER 103.A O no hydrogen 3.026 N/A ASP 107.A N ILE 104.A O no hydrogen 3.297 N/A HIS 111.A ND1 SER 85.A OG no hydrogen 2.775 N/A SER 113.A OG ILE 93.A O no hydrogen 3.256 N/A LEU 115.A N VAL 95.A O no hydrogen 2.559 N/A ARG 116.A N ASP 322.A OD1 no hydrogen 2.572 N/A ARG 116.A NH1 THR 100.A O no hydrogen 3.208 N/A ARG 116.A NH1 MET 102.A O no hydrogen 2.913 N/A ARG 116.A NH2 MET 102.A O no hydrogen 2.796 N/A ARG 116.A NH2 SER 106.A OG no hydrogen 2.727 N/A THR 117.A N GLY 97.A O no hydrogen 2.882 N/A THR 117.A OG1 GLY 97.A O no hydrogen 3.461 N/A THR 117.A OG1 HIS 257.A ND1 no hydrogen 2.853 N/A TYR 121.A N ARG 101.A O no hydrogen 2.898 N/A SER 122.A N SER 103.A OG no hydrogen 3.243 N/A SER 122.A OG SER 103.A OG no hydrogen 3.072 N/A HIS 123.A N PRO 120.A O no hydrogen 3.226 N/A GLN 124.A N TYR 121.A O no hydrogen 3.084 N/A GLN 124.A NE2 TYR 121.A O no hydrogen 2.782 N/A SER 125.A N SER 122.A O no hydrogen 3.287 N/A SER 125.A OG SER 122.A O no hydrogen 2.721 N/A SER 126.A N HIS 123.A O no hydrogen 2.826 N/A VAL 127.A N GLN 124.A O no hydrogen 2.961 N/A TRP 128.A N GLN 124.A O no hydrogen 3.031 N/A TRP 128.A NE1 VAL 226.A O no hydrogen 2.814 N/A PHE 129.A N SER 125.A O no hydrogen 3.002 N/A GLU 130.A N SER 126.A O no hydrogen 3.463 N/A MET 131.A N VAL 127.A O no hydrogen 2.867 N/A MET 132.A N TRP 128.A O no hydrogen 2.968 N/A ARG 133.A N PHE 129.A O no hydrogen 3.201 N/A ARG 133.A N GLU 130.A O no hydrogen 2.936 N/A VAL 134.A N GLU 130.A O no hydrogen 3.015 N/A ILE 141.A N VAL 195.A O no hydrogen 3.094 N/A LEU 142.A N LYS 170.A O no hydrogen 3.207 N/A LEU 143.A N ILE 197.A O no hydrogen 2.925 N/A VAL 144.A N LEU 172.A O no hydrogen 2.945 N/A SER 145.A N SER 199.A O no hydrogen 2.947 N/A SER 145.A OG ASP 147.A OD1 no hydrogen 2.624 N/A SER 145.A OG SER 199.A O no hydrogen 3.496 N/A ASP 146.A N PHE 174.A O no hydrogen 2.836 N/A GLY 150.A N ASP 147.A OD1 no hydrogen 3.002 N/A ARG 151.A N ASP 147.A O no hydrogen 3.132 N/A ARG 151.A NH1 ASP 146.A O no hydrogen 3.017 N/A ALA 152.A N HIS 148.A O no hydrogen 2.944 N/A ALA 153.A N GLU 149.A O no hydrogen 3.333 N/A ALA 153.A N GLY 150.A O no hydrogen 3.243 N/A GLN 154.A N GLY 150.A O no hydrogen 3.174 N/A GLN 154.A NE2 GLN 173.A OE1 no hydrogen 2.916 N/A LYS 155.A N ARG 151.A O no hydrogen 2.907 N/A ARG 156.A N ALA 152.A O no hydrogen 3.340 N/A LEU 157.A N ALA 153.A O no hydrogen 3.266 N/A GLU 158.A N GLN 154.A O no hydrogen 2.964 N/A THR 159.A N LYS 155.A O no hydrogen 3.117 N/A THR 159.A OG1 LYS 155.A O no hydrogen 2.739 N/A LEU 160.A N ARG 156.A O no hydrogen 3.179 N/A LEU 161.A N LEU 157.A O no hydrogen 2.890 N/A GLU 162.A N GLU 158.A O no hydrogen 2.817 N/A GLU 162.A N THR 159.A O no hydrogen 3.050 N/A GLU 163.A N THR 159.A O no hydrogen 3.434 N/A ARG 164.A N LEU 161.A O no hydrogen 3.215 N/A SER 166.A OG GLU 165.A O no hydrogen 3.060 N/A GLU 169.A N ILE 140.A O no hydrogen 2.901 N/A LEU 172.A N LEU 142.A O no hydrogen 2.995 N/A PHE 174.A N VAL 144.A O no hydrogen 3.415 N/A GLY 177.A N ASP 204.A OD1 no hydrogen 2.997 N/A GLY 177.A N ASP 204.A OD2 no hydrogen 3.267 N/A THR 178.A N ASP 175.A O no hydrogen 2.915 N/A THR 178.A OG1 ASN 180.A O no hydrogen 3.063 N/A ASN 180.A N THR 178.A OG1 no hydrogen 3.073 N/A LEU 185.A N VAL 181.A O no hydrogen 3.218 N/A MET 186.A N ALA 183.A O no hydrogen 3.228 N/A GLU 187.A N LEU 184.A O no hydrogen 3.149 N/A ALA 188.A N LEU 184.A O no hydrogen 3.241 N/A ARG 189.A N LEU 185.A O no hydrogen 3.082 N/A ARG 189.A NE GLU 190.A OE2 no hydrogen 3.300 N/A ARG 189.A NH1 LEU 215.A O no hydrogen 2.742 N/A ARG 189.A NH2 GLU 190.A OE2 no hydrogen 3.381 N/A LEU 191.A N ALA 188.A O no hydrogen 3.303 N/A ALA 193.A N GLU 169.A OE1 no hydrogen 2.803 N/A ILE 196.A N VAL 223.A O no hydrogen 2.767 N/A ILE 197.A N ILE 141.A O no hydrogen 2.842 N/A LEU 198.A N LEU 225.A O no hydrogen 3.381 N/A SER 199.A N LEU 143.A O no hydrogen 3.013 N/A ASP 204.A N SER 201.A OG no hydrogen 3.199 N/A ALA 205.A N SER 201.A O no hydrogen 2.847 N/A THR 207.A N ASP 203.A O no hydrogen 3.324 N/A THR 207.A OG1 ASP 203.A O no hydrogen 3.438 N/A VAL 208.A N ASP 204.A O no hydrogen 3.230 N/A TYR 209.A N ALA 205.A O no hydrogen 2.876 N/A TYR 209.A OH GLU 230.A O no hydrogen 2.646 N/A ARG 210.A N ALA 206.A O no hydrogen 3.113 N/A ALA 211.A N THR 207.A O no hydrogen 3.171 N/A ALA 212.A N VAL 208.A O no hydrogen 2.725 N/A ALA 213.A N TYR 209.A O no hydrogen 3.088 N/A MET 214.A N ARG 210.A O no hydrogen 3.076 N/A LEU 215.A N ALA 211.A O no hydrogen 3.343 N/A MET 217.A N ALA 212.A O no hydrogen 2.844 N/A VAL 223.A N ARG 194.A O no hydrogen 2.986 N/A TRP 224.A NE1 MET 217.A O no hydrogen 2.799 N/A LEU 225.A N ILE 196.A O no hydrogen 3.054 N/A VAL 226.A N ILE 244.A O no hydrogen 2.873 N/A GLU 228.A N GLN 124.A OE1 no hydrogen 2.923 N/A ARG 229.A N SER 232.A OG no hydrogen 2.945 N/A GLU 230.A N GLY 227.A O no hydrogen 3.113 N/A ASN 234.A N GLU 202.A OE2 no hydrogen 3.348 N/A ASN 234.A ND2 ASP 203.A OD1 no hydrogen 2.693 N/A ARG 237.A N ASN 234.A O no hydrogen 3.129 N/A GLY 242.A N LEU 333.A O no hydrogen 2.971 N/A ILE 243.A N PRO 240.A O no hydrogen 3.373 N/A ILE 244.A N TRP 224.A O no hydrogen 2.814 N/A GLY 245.A N MET 331.A O no hydrogen 2.908 N/A GLN 247.A N SER 329.A O no hydrogen 3.118 N/A LEU 248.A N GLU 228.A OE1 no hydrogen 2.882 N/A ASN 253.A ND2 ASN 250.A OD1 no hydrogen 3.133 N/A SER 255.A OG ASN 253.A OD1 no hydrogen 2.970 N/A ALA 256.A N ASN 253.A OD1 no hydrogen 3.303 N/A HIS 257.A N GLU 254.A O no hydrogen 2.855 N/A HIS 257.A ND1 THR 117.A OG1 no hydrogen 2.853 N/A HIS 257.A NE2 ASN 250.A O no hydrogen 2.677 N/A ILE 258.A N GLU 254.A O no hydrogen 2.816 N/A SER 259.A N SER 255.A O no hydrogen 3.124 N/A ASP 260.A N ALA 256.A O no hydrogen 3.264 N/A ALA 261.A N HIS 257.A O no hydrogen 2.767 N/A VAL 262.A N ILE 258.A O no hydrogen 3.359 N/A GLY 263.A N SER 259.A O no hydrogen 2.840 N/A VAL 264.A N ASP 260.A O no hydrogen 3.049 N/A VAL 265.A N ALA 261.A O no hydrogen 2.871 N/A ALA 266.A N VAL 262.A O no hydrogen 2.839 N/A GLN 267.A N GLY 263.A O no hydrogen 2.830 N/A GLN 267.A NE2 LYS 306.A O no hydrogen 2.904 N/A ALA 268.A N VAL 264.A O no hydrogen 2.943 N/A VAL 269.A N VAL 265.A O no hydrogen 2.961 N/A HIS 270.A N ALA 266.A O no hydrogen 3.364 N/A LEU 272.A N ALA 268.A O no hydrogen 2.957 N/A LEU 273.A N VAL 269.A O no hydrogen 3.163 N/A GLU 274.A N GLU 271.A O no hydrogen 3.412 N/A LYS 275.A N LEU 272.A O no hydrogen 3.041 N/A THR 279.A OG1 ASP 280.A O no hydrogen 3.496 N/A ARG 283.A NE GLN 63.A OE1 no hydrogen 3.481 N/A ARG 283.A NH2 GLN 63.A OE1 no hydrogen 3.383 N/A ASN 288.A N CYS 285.A O no hydrogen 3.230 N/A TRP 292.A N TYR 91.A O no hydrogen 3.478 N/A THR 294.A OG1 THR 279.A O no hydrogen 3.127 N/A GLY 295.A N TRP 292.A O no hydrogen 2.776 N/A PHE 298.A N THR 294.A O no hydrogen 2.778 N/A LYS 299.A N GLY 295.A O no hydrogen 3.051 N/A LYS 299.A NZ LEU 112.A O no hydrogen 3.124 N/A ARG 300.A N PRO 296.A O no hydrogen 3.069 N/A VAL 301.A N LEU 297.A O no hydrogen 2.913 N/A LEU 302.A N PHE 298.A O no hydrogen 2.920 N/A MET 303.A N LYS 299.A O no hydrogen 3.051 N/A SER 304.A N ARG 300.A O no hydrogen 3.225 N/A SER 304.A OG ARG 300.A O no hydrogen 2.834 N/A SER 304.A OG VAL 301.A O no hydrogen 3.343 N/A SER 305.A N LEU 302.A O no hydrogen 3.265 N/A SER 305.A OG VAL 301.A O no hydrogen 2.954 N/A THR 312.A OG1 ASP 260.A OD1 no hydrogen 2.776 N/A VAL 315.A N TYR 307.A O no hydrogen 2.763 N/A ASN 318.A N ARG 323.A O no hydrogen 3.393 N/A GLU 319.A N GLU 319.A OE2 no hydrogen 2.681 N/A LYS 324.A NZ THR 312.A O no hydrogen 3.187 N/A TYR 328.A N TYR 344.A O no hydrogen 2.982 N/A SER 329.A N GLN 247.A O no hydrogen 3.077 N/A SER 329.A OG GLN 247.A O no hydrogen 3.408 N/A MET 331.A N GLY 245.A O no hydrogen 2.690 N/A ASN 332.A N VAL 339.A O no hydrogen 2.869 N/A ASN 332.A ND2 ILE 357.A O no hydrogen 3.102 N/A LEU 333.A N ILE 243.A O no hydrogen 3.094 N/A GLN 334.A N LYS 337.A O no hydrogen 3.162 N/A GLN 334.A NE2 LYS 355.A O no hydrogen 3.049 N/A ARG 336.A N ASP 241.A OD2 no hydrogen 3.414 N/A ARG 336.A NH1 LEU 236.A O no hydrogen 2.850 N/A ARG 336.A NH2 LEU 236.A O no hydrogen 3.399 N/A ARG 336.A NH2 ARG 237.A O no hydrogen 3.140 N/A LYS 337.A N GLN 334.A O no hydrogen 3.059 N/A VAL 339.A N ASN 332.A O no hydrogen 2.893 N/A GLN 340.A NE2 GLY 342.A O no hydrogen 3.095 N/A VAL 341.A N ILE 330.A O no hydrogen 3.188 N/A ILE 343.A N ILE 350.A O no hydrogen 3.282 N/A TYR 344.A N TYR 328.A O no hydrogen 2.918 N/A ASN 345.A N HIS 348.A O no hydrogen 3.273 N/A THR 347.A N ASN 345.A OD1 no hydrogen 2.609 N/A HIS 348.A N ASN 345.A OD1 no hydrogen 2.307 N/A ILE 350.A N ILE 343.A O no hydrogen 2.945 N/A ASN 352.A ND2 GLN 340.A O no hydrogen 2.962 N/A TRP 358.A N GLU 362.A O no hydrogen 2.824 N/A GLN 370.A NE2 VAL 371.A O no hydrogen 3.520 N/A VAL 371.A N TYR 369.A O no hydrogen 2.470 N/A