Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7rnw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 8.A N SER 113.A OG no hydrogen 2.925 N/A SER 10.A OG GLU 14.A OE1 no hydrogen 2.823 N/A VAL 13.A N SER 10.A O no hydrogen 2.659 N/A GLU 14.A N SER 10.A O no hydrogen 2.939 N/A GLY 15.A N GLY 11.A O no hydrogen 3.322 N/A CYS 16.A N VAL 13.A O no hydrogen 2.417 N/A CYS 16.A SG LYS 12.A O no hydrogen 3.804 N/A CYS 16.A SG VAL 13.A O no hydrogen 3.636 N/A VAL 18.A N GLY 29.A O no hydrogen 3.129 N/A GLN 19.A N GLN 69.A O no hydrogen 3.411 N/A GLN 19.A NE2 THR 21.A OG1 no hydrogen 3.410 N/A VAL 20.A N LEU 27.A O no hydrogen 2.987 N/A THR 21.A N LEU 67.A O no hydrogen 2.812 N/A THR 21.A OG1 THR 26.A OG1 no hydrogen 2.321 N/A CYS 22.A N THR 25.A O no hydrogen 2.761 N/A THR 25.A N CYS 22.A O no hydrogen 3.189 N/A THR 25.A OG1 CYS 22.A O no hydrogen 3.449 N/A THR 25.A OG1 CYS 44.A O no hydrogen 2.902 N/A THR 26.A OG1 THR 21.A OG1 no hydrogen 2.321 N/A LEU 27.A N VAL 20.A O no hydrogen 2.936 N/A ASN 28.A N CYS 145.A O no hydrogen 2.928 N/A ASN 28.A ND2 CYS 117.A O no hydrogen 2.788 N/A ASN 28.A ND2 CYS 145.A O no hydrogen 3.538 N/A GLY 29.A N VAL 18.A O no hydrogen 3.270 N/A LEU 30.A N TYR 37.A O no hydrogen 2.756 N/A TRP 31.A N CYS 16.A O no hydrogen 2.874 N/A LEU 32.A N VAL 35.A O no hydrogen 2.915 N/A ASP 33.A N THR 98.A OG1 no hydrogen 3.403 N/A VAL 35.A N LEU 32.A O no hydrogen 3.185 N/A VAL 36.A N LEU 89.A O no hydrogen 2.910 N/A TYR 37.A N LEU 30.A O no hydrogen 2.806 N/A CYS 38.A N LEU 87.A O no hydrogen 3.054 N/A CYS 38.A SG PRO 39.A O no hydrogen 3.356 N/A ARG 40.A NH1 ASN 84.A O no hydrogen 3.374 N/A THR 45.A OG1 ASP 48.A OD1 no hydrogen 2.643 N/A GLU 47.A N GLU 47.A OE1 no hydrogen 3.091 N/A ASP 48.A N THR 45.A O no hydrogen 2.811 N/A ASP 48.A N THR 45.A OG1 no hydrogen 3.004 N/A MET 49.A N THR 45.A O no hydrogen 2.899 N/A MET 49.A N SER 46.A O no hydrogen 3.143 N/A LEU 58.A N TYR 54.A O no hydrogen 3.105 N/A ARG 60.A N ASP 56.A O no hydrogen 2.817 N/A ASN 65.A N SER 62.A O no hydrogen 3.252 N/A PHE 66.A N ASN 63.A O no hydrogen 3.317 N/A LEU 67.A N THR 21.A O no hydrogen 2.987 N/A GLN 69.A N GLN 19.A O no hydrogen 3.211 N/A ALA 70.A N VAL 73.A O no hydrogen 2.823 N/A VAL 73.A N ALA 70.A O no hydrogen 3.283 N/A GLN 74.A NE2 GLN 69.A OE1 no hydrogen 3.269 N/A ILE 78.A N LYS 90.A O no hydrogen 2.861 N/A SER 81.A OG LYS 88.A O no hydrogen 3.100 N/A GLN 83.A N VAL 86.A O no hydrogen 2.825 N/A ASN 84.A ND2 GLU 178.A O no hydrogen 3.016 N/A CYS 85.A N GLY 179.A O no hydrogen 3.184 N/A CYS 85.A SG ASP 187.A OD1 no hydrogen 3.025 N/A VAL 86.A N GLN 83.A O no hydrogen 3.269 N/A LEU 87.A N CYS 38.A O no hydrogen 2.821 N/A LYS 88.A N SER 81.A O no hydrogen 2.909 N/A LEU 89.A N VAL 36.A O no hydrogen 2.723 N/A LYS 90.A N GLY 79.A O no hydrogen 3.363 N/A LYS 90.A NZ ASP 34.A OD1 no hydrogen 3.271 N/A LYS 90.A NZ ASP 34.A OD2 no hydrogen 3.479 N/A VAL 91.A N ASP 34.A O no hydrogen 3.180 N/A ASP 92.A N ARG 76.A O no hydrogen 3.090 N/A ASN 95.A N ASP 33.A O no hydrogen 2.623 N/A LYS 97.A N ASN 95.A OD1 no hydrogen 3.167 N/A THR 98.A OG1 ASN 95.A O no hydrogen 2.291 N/A TYR 101.A OH ASP 33.A OD2 no hydrogen 2.899 N/A LYS 102.A N VAL 157.A O no hydrogen 2.857 N/A ARG 105.A NH2 PHE 181.A O no hydrogen 3.115 N/A ILE 106.A N TYR 182.A OH no hydrogen 2.848 N/A GLY 109.A N MET 130.A O no hydrogen 2.575 N/A GLN 110.A N GLN 107.A O no hydrogen 3.299 N/A GLN 110.A NE2 THR 111.A O no hydrogen 2.881 N/A THR 111.A OG1 THR 292.A OG1 no hydrogen 3.052 N/A THR 111.A OG1 ASP 295.A OD2 no hydrogen 2.567 N/A PHE 112.A N CYS 128.A O no hydrogen 3.083 N/A SER 113.A N PHE 150.A O no hydrogen 2.944 N/A VAL 114.A N TYR 126.A O no hydrogen 2.683 N/A LEU 115.A N VAL 148.A O no hydrogen 3.265 N/A ALA 116.A N GLY 124.A O no hydrogen 2.800 N/A CYS 117.A N SER 147.A OG no hydrogen 2.815 N/A TYR 118.A N SER 121.A O no hydrogen 2.547 N/A GLY 120.A N ASN 28.A OD1 no hydrogen 2.902 N/A SER 121.A N TYR 118.A O no hydrogen 3.082 N/A SER 123.A N ALA 116.A O no hydrogen 2.855 N/A TYR 126.A N VAL 114.A O no hydrogen 3.007 N/A TYR 126.A OH SER 139.A O no hydrogen 2.823 N/A CYS 128.A N PHE 112.A O no hydrogen 2.799 N/A CYS 128.A SG LYS 137.A O no hydrogen 3.850 N/A MET 130.A N GLN 110.A O no hydrogen 3.094 N/A ARG 131.A N THR 135.A O no hydrogen 2.792 N/A ARG 131.A NE GLU 290.A OE2 no hydrogen 2.891 N/A ARG 131.A NH2 GLU 290.A OE2 no hydrogen 3.357 N/A ASN 133.A N ASP 197.A OD1 no hydrogen 3.053 N/A PHE 134.A N ARG 131.A O no hydrogen 2.498 N/A THR 135.A OG1 ASN 133.A OD1 no hydrogen 2.218 N/A ILE 136.A N HIS 172.A O no hydrogen 3.205 N/A SER 139.A N TYR 126.A OH no hydrogen 2.934 N/A LEU 141.A N TYR 118.A OH no hydrogen 3.048 N/A SER 144.A N LEU 141.A O no hydrogen 3.054 N/A SER 144.A OG SER 147.A OG no hydrogen 3.287 N/A CYS 145.A SG HIS 41.A NE2 no hydrogen 3.298 N/A CYS 145.A SG HIS 163.A O no hydrogen 3.808 N/A CYS 145.A SG HIS 164.A O no hydrogen 2.804 N/A GLY 146.A N HIS 163.A O no hydrogen 3.177 N/A SER 147.A N SER 144.A O no hydrogen 2.930 N/A SER 147.A OG LEU 115.A O no hydrogen 3.275 N/A SER 147.A OG CYS 117.A O no hydrogen 3.347 N/A SER 147.A OG SER 144.A O no hydrogen 2.935 N/A SER 147.A OG SER 144.A OG no hydrogen 3.287 N/A GLY 149.A N TYR 161.A O no hydrogen 2.758 N/A PHE 150.A N SER 113.A O no hydrogen 2.771 N/A ASN 151.A N SER 158.A O no hydrogen 2.844 N/A ASN 151.A ND2 THR 111.A O no hydrogen 2.381 N/A VAL 157.A N LYS 100.A O no hydrogen 3.156 N/A SER 158.A N ASN 151.A O no hydrogen 2.806 N/A SER 158.A OG ASP 153.A OD1 no hydrogen 3.247 N/A PHE 159.A N LYS 102.A O no hydrogen 3.118 N/A CYS 160.A N GLY 149.A O no hydrogen 2.782 N/A CYS 160.A SG GLY 149.A O no hydrogen 3.153 N/A TYR 161.A N GLY 149.A O no hydrogen 3.459 N/A TYR 161.A OH HIS 163.A ND1 no hydrogen 2.844 N/A MET 162.A N THR 175.A O no hydrogen 2.545 N/A HIS 163.A N SER 147.A O no hydrogen 3.148 N/A HIS 163.A ND1 TYR 161.A OH no hydrogen 2.844 N/A HIS 164.A N ALA 173.A O no hydrogen 3.347 N/A HIS 164.A NE2 CYS 85.A O no hydrogen 3.078 N/A MET 165.A N ALA 173.A O no hydrogen 2.886 N/A LEU 167.A N VAL 171.A O no hydrogen 2.996 N/A GLY 170.A N LEU 167.A O no hydrogen 2.825 N/A HIS 172.A N ILE 136.A O no hydrogen 2.711 N/A HIS 172.A NE2 GLY 138.A O no hydrogen 2.996 N/A ALA 173.A N MET 165.A O no hydrogen 2.864 N/A THR 175.A N MET 162.A O no hydrogen 2.929 N/A THR 175.A OG1 MET 162.A O no hydrogen 3.499 N/A THR 175.A OG1 ASP 176.A O no hydrogen 2.890 N/A ASP 176.A N ASN 180.A O no hydrogen 3.219 N/A GLU 178.A N ASP 176.A OD1 no hydrogen 3.221 N/A GLY 179.A N ASP 176.A O no hydrogen 3.016 N/A ASN 180.A N ASP 176.A OD1 no hydrogen 2.734 N/A ASN 180.A ND2 GLU 178.A OE1 no hydrogen 3.518 N/A TYR 182.A N GLY 174.A O no hydrogen 3.106 N/A TYR 182.A OH CYS 160.A O no hydrogen 3.176 N/A VAL 186.A N GLN 192.A OE1 no hydrogen 2.966 N/A GLN 189.A N MET 49.A O no hydrogen 2.908 N/A GLN 192.A NE2 VAL 186.A O no hydrogen 3.008 N/A GLN 192.A NE2 ARG 188.A O no hydrogen 3.634 N/A GLN 192.A NE2 THR 190.A O no hydrogen 3.338 N/A THR 198.A OG1 THR 199.A O no hydrogen 3.246 N/A THR 198.A OG1 ASN 238.A O no hydrogen 3.551 N/A THR 198.A OG1 GLU 240.A OE2 no hydrogen 2.712 N/A THR 199.A N ASN 238.A O no hydrogen 3.187 N/A ILE 200.A N ASP 289.A OD2 no hydrogen 2.937 N/A ASN 203.A ND2 GLY 109.A O no hydrogen 3.009 N/A ASN 203.A ND2 ASP 289.A O no hydrogen 2.555 N/A VAL 204.A N ILE 200.A O no hydrogen 3.260 N/A LEU 205.A N THR 201.A O no hydrogen 2.983 N/A ALA 206.A N VAL 202.A O no hydrogen 2.917 N/A TRP 207.A N ASN 203.A O no hydrogen 2.989 N/A LEU 208.A N VAL 204.A O no hydrogen 2.812 N/A TYR 209.A N LEU 205.A O no hydrogen 3.207 N/A TYR 209.A OH ILE 259.A O no hydrogen 2.697 N/A ALA 210.A N ALA 206.A O no hydrogen 2.911 N/A ALA 211.A N TRP 207.A O no hydrogen 2.993 N/A VAL 212.A N LEU 208.A O no hydrogen 3.154 N/A ILE 213.A N TYR 209.A O no hydrogen 3.021 N/A ASN 214.A N ALA 211.A O no hydrogen 2.932 N/A ASN 214.A ND2 ALA 210.A O no hydrogen 2.702 N/A GLY 215.A N VAL 212.A O no hydrogen 2.544 N/A ASP 216.A N ALA 211.A O no hydrogen 3.276 N/A ARG 217.A NE GLY 215.A O no hydrogen 3.094 N/A LEU 220.A N ARG 217.A O no hydrogen 3.033 N/A THR 224.A OG1 THR 225.A O no hydrogen 3.144 N/A THR 225.A OG1 THR 226.A O no hydrogen 3.274 N/A ASP 229.A N THR 226.A OG1 no hydrogen 2.655 N/A PHE 230.A N THR 226.A O no hydrogen 3.048 N/A ASN 231.A N LEU 227.A O no hydrogen 2.822 N/A ASN 231.A N ASN 228.A O no hydrogen 2.885 N/A LEU 232.A N ASN 228.A O no hydrogen 3.251 N/A ALA 234.A N PHE 230.A O no hydrogen 2.869 N/A MET 235.A N ASN 231.A O no hydrogen 3.227 N/A LYS 236.A N LEU 232.A O no hydrogen 3.105 N/A TYR 237.A N ALA 234.A O no hydrogen 2.877 N/A ASN 238.A N MET 235.A O no hydrogen 3.473 N/A TYR 239.A N ALA 234.A O no hydrogen 3.039 N/A GLU 240.A N THR 199.A O no hydrogen 3.007 N/A THR 243.A N HIS 246.A ND1 no hydrogen 3.169 N/A THR 243.A OG1 ASP 245.A OD2 no hydrogen 3.562 N/A VAL 247.A N THR 243.A O no hydrogen 2.888 N/A ASP 248.A N GLN 244.A O no hydrogen 2.804 N/A ILE 249.A N ASP 245.A O no hydrogen 3.221 N/A GLY 251.A N ASP 248.A O no hydrogen 3.176 N/A SER 254.A N LEU 250.A O no hydrogen 3.017 N/A SER 254.A OG ILE 259.A O no hydrogen 2.652 N/A ALA 255.A N GLY 251.A O no hydrogen 2.820 N/A GLN 256.A N PRO 252.A O no hydrogen 2.967 N/A THR 257.A N LEU 253.A O no hydrogen 3.071 N/A THR 257.A N SER 254.A O no hydrogen 3.199 N/A THR 257.A OG1 LEU 253.A O no hydrogen 2.489 N/A THR 257.A OG1 SER 254.A O no hydrogen 2.907 N/A GLY 258.A N SER 254.A O no hydrogen 2.579 N/A ILE 259.A N THR 257.A OG1 no hydrogen 3.388 N/A ASP 263.A N ALA 260.A O no hydrogen 2.990 N/A MET 264.A N ALA 260.A O no hydrogen 3.281 N/A CYS 265.A N VAL 261.A O no hydrogen 3.085 N/A CYS 265.A SG VAL 261.A O no hydrogen 2.863 N/A ALA 266.A N LEU 262.A O no hydrogen 3.145 N/A SER 267.A N ASP 263.A O no hydrogen 3.105 N/A SER 267.A OG PHE 219.A O no hydrogen 3.179 N/A LEU 268.A N MET 264.A O no hydrogen 2.824 N/A LYS 269.A N CYS 265.A O no hydrogen 2.732 N/A LYS 269.A NZ ASP 229.A OD1 no hydrogen 3.564 N/A GLU 270.A N ALA 266.A O no hydrogen 3.187 N/A LEU 271.A N SER 267.A O no hydrogen 3.261 N/A LEU 272.A N LEU 268.A O no hydrogen 2.943 N/A GLN 273.A N LYS 269.A O no hydrogen 3.203 N/A ASN 274.A N GLU 270.A O no hydrogen 3.062 N/A ASN 274.A N LEU 271.A O no hydrogen 3.354 N/A GLY 275.A N LEU 271.A O no hydrogen 2.770 N/A ILE 281.A N SER 284.A O no hydrogen 2.794 N/A SER 284.A N ILE 281.A O no hydrogen 2.958 N/A SER 284.A OG LEU 286.A O no hydrogen 3.297 N/A SER 284.A OG GLU 288.A OE2 no hydrogen 2.666 N/A THR 292.A OG1 THR 111.A OG1 no hydrogen 3.052 N/A THR 292.A OG1 ASP 295.A OD2 no hydrogen 2.746 N/A ASP 295.A N THR 292.A O no hydrogen 3.024 N/A VAL 296.A N THR 292.A O no hydrogen 3.250 N/A VAL 297.A N PRO 293.A O no hydrogen 3.211 N/A ARG 298.A N PHE 294.A O no hydrogen 2.801 N/A ARG 298.A NH1 MET 6.A O no hydrogen 3.363 N/A ARG 298.A NH1 ASP 295.A OD1 no hydrogen 3.349 N/A ARG 298.A NH2 MET 6.A O no hydrogen 2.793 N/A GLN 299.A N ASP 295.A O no hydrogen 2.918 N/A GLN 299.A NE2 ARG 4.A O no hydrogen 2.812 N/A CYS 300.A N VAL 296.A O no hydrogen 2.659 N/A SER 301.A OG SER 301.A O no hydrogen 2.176 N/A