Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jk8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N THR 87.A O no hydrogen 3.278 N/A HIS 6.A N SER 4.A OG no hydrogen 3.084 N/A HIS 7.A N SER 4.A O no hydrogen 3.271 N/A HIS 7.A ND1 THR 87.A O no hydrogen 2.907 N/A TYR 8.A N PRO 5.A O no hydrogen 3.034 N/A VAL 9.A N HIS 6.A O no hydrogen 3.371 N/A TYR 10.A N THR 15.A O no hydrogen 3.138 N/A TYR 10.A OH ASN 18.A O no hydrogen 3.336 N/A THR 13.A N TYR 10.A O no hydrogen 3.126 N/A THR 13.A OG1 TYR 10.A O no hydrogen 3.054 N/A THR 13.A OG1 THR 15.A O no hydrogen 3.539 N/A THR 15.A N THR 13.A OG1 no hydrogen 3.086 N/A THR 15.A OG1 LYS 23.A O no hydrogen 3.177 N/A LYS 17.A N TYR 8.A O no hydrogen 2.930 N/A LYS 17.A NZ HIS 7.A O no hydrogen 2.929 N/A LYS 17.A NZ ASP 84.A OD2 no hydrogen 3.092 N/A ASN 18.A N TYR 10.A OH no hydrogen 3.524 N/A ASN 18.A ND2 LEU 16.A O no hydrogen 3.227 N/A ASN 18.A ND2 ILE 22.A O no hydrogen 2.779 N/A LYS 19.A N THR 68.A O no hydrogen 2.742 N/A TYR 20.A OH ASP 35.A OD1 no hydrogen 2.688 N/A TYR 20.A OH THR 68.A OG1 no hydrogen 2.763 N/A GLY 21.A N ASN 18.A O no hydrogen 3.166 N/A ILE 22.A N ASN 18.A OD1 no hydrogen 3.021 N/A ALA 27.A N ASN 24.A OD1 no hydrogen 3.121 N/A PHE 28.A N ASN 24.A O no hydrogen 2.966 N/A LEU 29.A N LEU 25.A O no hydrogen 3.001 N/A GLU 30.A N ASN 26.A O no hydrogen 3.197 N/A LYS 31.A N ALA 27.A O no hydrogen 3.172 N/A LYS 31.A NZ ASP 35.A OD1 no hydrogen 3.137 N/A LYS 31.A NZ ASP 35.A OD2 no hydrogen 2.740 N/A CYS 32.A N PHE 28.A O no hydrogen 2.833 N/A SER 33.A N LEU 29.A O no hydrogen 3.025 N/A HIS 34.A N GLU 30.A O no hydrogen 3.011 N/A ASP 35.A N LYS 31.A O no hydrogen 2.939 N/A THR 36.A N CYS 32.A O no hydrogen 2.875 N/A THR 36.A OG1 CYS 32.A O no hydrogen 2.871 N/A THR 36.A OG1 SER 33.A O no hydrogen 3.199 N/A ALA 37.A N SER 33.A O no hydrogen 3.132 N/A LYS 38.A N HIS 34.A O no hydrogen 3.378 N/A LYS 38.A NZ HIS 34.A NE2 no hydrogen 2.744 N/A ALA 39.A N ASP 35.A O no hydrogen 3.153 N/A MET 40.A N THR 36.A O no hydrogen 2.988 N/A ILE 41.A N ALA 37.A O no hydrogen 3.379 N/A ASN 42.A N LYS 38.A O no hydrogen 3.327 N/A LEU 43.A N ALA 39.A O no hydrogen 2.733 N/A ARG 44.A N MET 40.A O no hydrogen 2.855 N/A ARG 44.A NH1 GLU 163.A OE2 no hydrogen 3.230 N/A GLU 45.A N ASN 42.A O no hydrogen 2.996 N/A GLU 46.A N LEU 43.A O no hydrogen 3.129 N/A THR 54.A N ASP 116.A OD2 no hydrogen 3.393 N/A THR 54.A OG1 ASP 116.A OD2 no hydrogen 3.462 N/A TYR 56.A N ASP 53.A OD1 no hydrogen 3.305 N/A LEU 57.A N ASP 53.A O no hydrogen 3.094 N/A CYS 58.A N THR 54.A O no hydrogen 2.746 N/A CYS 58.A SG THR 54.A O no hydrogen 3.331 N/A CYS 58.A SG GLY 73.A O no hydrogen 3.423 N/A HIS 59.A N ALA 55.A O no hydrogen 2.985 N/A HIS 59.A NE2 GLU 46.A OE1 no hydrogen 3.272 N/A ILE 60.A N TYR 56.A O no hydrogen 3.076 N/A HIS 61.A N LEU 57.A O no hydrogen 3.178 N/A HIS 61.A ND1 ALA 72.A O no hydrogen 2.333 N/A HIS 61.A NE2 GLU 152.A O no hydrogen 2.636 N/A GLN 62.A N CYS 58.A O no hydrogen 2.789 N/A GLN 63.A N HIS 59.A O no hydrogen 2.857 N/A GLN 63.A NE2 GLN 62.A OE1 no hydrogen 2.964 N/A LEU 64.A N ILE 60.A O no hydrogen 2.943 N/A PHE 65.A N HIS 61.A O no hydrogen 2.917 N/A THR 68.A N PHE 65.A O no hydrogen 3.003 N/A THR 68.A OG1 TYR 20.A OH no hydrogen 2.763 N/A PHE 69.A N PHE 65.A O no hydrogen 3.099 N/A ALA 72.A N PHE 69.A O no hydrogen 3.352 N/A TYR 74.A N TRP 71.A O no hydrogen 2.806 N/A ARG 76.A N PRO 149.A O no hydrogen 3.060 N/A ARG 76.A NE MET 90.A O no hydrogen 3.020 N/A ARG 76.A NH1 HIS 148.A O no hydrogen 2.931 N/A ARG 76.A NH2 ALA 103.A O no hydrogen 3.117 N/A ILE 78.A N LEU 75.A O no hydrogen 3.378 N/A PHE 80.A N ALA 88.A O no hydrogen 2.892 N/A THR 81.A OG1 THR 87.A OG1 no hydrogen 2.821 N/A PHE 82.A N THR 86.A O no hydrogen 2.853 N/A ALA 83.A N GLU 70.A OE1 no hydrogen 3.009 N/A GLY 85.A N PHE 82.A O no hydrogen 2.871 N/A THR 86.A N ASP 84.A OD1 no hydrogen 2.767 N/A THR 86.A OG1 ASP 84.A OD1 no hydrogen 2.426 N/A THR 86.A OG1 ASP 84.A OD2 no hydrogen 3.485 N/A THR 87.A OG1 THR 81.A OG1 no hydrogen 2.821 N/A ALA 88.A N PHE 80.A O no hydrogen 2.965 N/A MET 90.A N ARG 76.A O no hydrogen 2.982 N/A LYS 99.A N THR 96.A O no hydrogen 2.915 N/A ALA 103.A N GLN 146.A O no hydrogen 3.135 N/A ILE 104.A N GLU 107.A OE1 no hydrogen 3.235 N/A GLY 105.A N PRO 91.A O no hydrogen 3.181 N/A GLU 107.A N ILE 104.A O no hydrogen 3.225 N/A GLN 109.A NE2 GLN 113.A OE1 no hydrogen 3.477 N/A GLU 110.A N ASP 106.A O no hydrogen 2.880 N/A GLY 111.A N GLU 107.A O no hydrogen 2.722 N/A LEU 112.A N ILE 108.A O no hydrogen 3.019 N/A GLN 113.A N GLN 109.A O no hydrogen 3.016 N/A ARG 114.A N GLU 110.A O no hydrogen 3.048 N/A LEU 115.A N GLY 111.A O no hydrogen 3.008 N/A ASP 116.A N LEU 112.A O no hydrogen 2.947 N/A GLN 117.A N GLN 113.A O no hydrogen 2.765 N/A GLN 117.A NE2 GLU 121.A OE2 no hydrogen 3.257 N/A THR 118.A N ARG 114.A O no hydrogen 2.916 N/A THR 118.A OG1 LEU 115.A O no hydrogen 3.495 N/A LEU 119.A N LEU 115.A O no hydrogen 3.238 N/A ALA 120.A N ASP 116.A O no hydrogen 3.140 N/A GLU 121.A N GLN 117.A O no hydrogen 3.171 N/A LYS 122.A N THR 118.A O no hydrogen 3.034 N/A LYS 122.A NZ GLU 136.A OE1 no hydrogen 3.091 N/A LYS 122.A NZ GLU 136.A OE2 no hydrogen 2.552 N/A ASN 124.A N LEU 119.A O no hydrogen 2.721 N/A ASN 124.A ND2 GLU 50.A O no hydrogen 3.324 N/A LEU 125.A N LYS 122.A O no hydrogen 2.792 N/A THR 129.A N GLU 132.A OE2 no hydrogen 3.262 N/A ARG 130.A NH1 GLU 204.A OE1 no hydrogen 3.426 N/A GLU 132.A N THR 129.A OG1 no hydrogen 3.202 N/A PHE 133.A N THR 129.A O no hydrogen 2.846 N/A ASN 134.A N ARG 130.A O no hydrogen 2.797 N/A ASN 134.A ND2 SER 207.A OG no hydrogen 3.088 N/A SER 135.A N GLU 131.A O no hydrogen 2.908 N/A GLU 136.A N GLU 132.A O no hydrogen 3.232 N/A ALA 137.A N PHE 133.A O no hydrogen 2.861 N/A ILE 138.A N ASN 134.A O no hydrogen 3.022 N/A GLU 139.A N SER 135.A O no hydrogen 3.471 N/A LEU 140.A N GLU 136.A O no hydrogen 3.257 N/A PHE 141.A N ALA 137.A O no hydrogen 2.766 N/A ASN 142.A N ILE 138.A O no hydrogen 2.972 N/A SER 143.A N GLU 139.A O no hydrogen 2.899 N/A LEU 144.A N LEU 140.A O no hydrogen 2.894 N/A ASN 145.A N PHE 141.A O no hydrogen 2.961 N/A GLN 146.A N ASN 142.A O no hydrogen 3.108 N/A GLN 146.A N SER 143.A O no hydrogen 3.135 N/A GLN 146.A NE2 ALA 101.A O no hydrogen 3.121 N/A LEU 147.A N LEU 144.A O no hydrogen 3.322 N/A HIS 148.A N LEU 144.A O no hydrogen 3.427 N/A PHE 150.A N ASN 154.A OD1 no hydrogen 2.959 N/A ARG 151.A NH1 ARG 151.A O no hydrogen 3.087 N/A ASN 154.A ND2 PHE 150.A O no hydrogen 2.938 N/A GLN 158.A N ASN 154.A O no hydrogen 2.855 N/A ARG 159.A N GLY 155.A O no hydrogen 2.924 N/A ARG 159.A NH2 ILE 178.A O no hydrogen 3.016 N/A LEU 160.A N ARG 156.A O no hydrogen 3.036 N/A PHE 161.A N THR 157.A O no hydrogen 2.920 N/A PHE 162.A N GLN 158.A O no hydrogen 3.255 N/A GLU 163.A N ARG 159.A O no hydrogen 3.008 N/A ASN 164.A N LEU 160.A O no hydrogen 3.198 N/A ASN 164.A ND2 TYR 56.A OH no hydrogen 2.911 N/A LEU 165.A N PHE 161.A O no hydrogen 2.991 N/A ALA 166.A N PHE 162.A O no hydrogen 2.997 N/A LYS 167.A N GLU 163.A O no hydrogen 3.282 N/A ALA 168.A N ASN 164.A O no hydrogen 3.042 N/A ALA 169.A N LEU 165.A O no hydrogen 2.944 N/A GLY 170.A N LYS 167.A O no hydrogen 3.256 N/A HIS 171.A N ALA 166.A O no hydrogen 2.928 N/A HIS 171.A NE2 LEU 128.A O no hydrogen 2.751 N/A GLN 172.A NE2 ASN 174.A OD1 no hydrogen 2.869 N/A ASN 174.A N ILE 206.A O no hydrogen 3.399 N/A LEU 177.A N ASN 174.A O no hydrogen 3.230 N/A ILE 178.A N PHE 175.A O no hydrogen 3.109 N/A THR 179.A OG1 ARG 232.A O no hydrogen 3.251 N/A ARG 182.A N THR 179.A OG1 no hydrogen 3.210 N/A ARG 182.A NH1 ASP 205.A OD2 no hydrogen 2.946 N/A ARG 182.A NH1 VAL 234.A O no hydrogen 3.340 N/A ARG 182.A NH2 ASP 205.A OD2 no hydrogen 2.866 N/A MET 183.A N THR 179.A O no hydrogen 3.399 N/A MET 184.A N LYS 180.A O no hydrogen 3.152 N/A VAL 185.A N GLU 181.A O no hydrogen 3.031 N/A ALA 186.A N ARG 182.A O no hydrogen 3.001 N/A SER 187.A N MET 183.A O no hydrogen 2.939 N/A SER 187.A OG MET 183.A O no hydrogen 3.028 N/A VAL 188.A N MET 184.A O no hydrogen 2.850 N/A ALA 189.A N VAL 185.A O no hydrogen 2.934 N/A VAL 190.A N ALA 186.A O no hydrogen 3.242 N/A ALA 191.A N SER 187.A O no hydrogen 3.012 N/A GLU 192.A N VAL 188.A O no hydrogen 3.012 N/A ASN 193.A N ALA 189.A O no hydrogen 3.108 N/A ASN 193.A ND2 ALA 189.A O no hydrogen 3.022 N/A GLY 194.A N VAL 190.A O no hydrogen 3.114 N/A ASP 195.A N ALA 189.A O no hydrogen 3.263 N/A GLU 197.A N ASP 195.A OD1 no hydrogen 2.951 N/A GLN 200.A N LEU 196.A O no hydrogen 2.904 N/A HIS 201.A N GLU 197.A O no hydrogen 2.934 N/A LEU 202.A N PRO 198.A O no hydrogen 2.879 N/A PHE 203.A N MET 199.A O no hydrogen 2.800 N/A GLU 204.A N GLN 200.A O no hydrogen 2.840 N/A ASP 205.A N HIS 201.A O no hydrogen 3.015 N/A ILE 206.A N LEU 202.A O no hydrogen 3.128 N/A SER 207.A N GLU 204.A O no hydrogen 3.395 N/A SER 207.A OG PHE 203.A O no hydrogen 2.533 N/A SER 207.A OG GLU 204.A O no hydrogen 3.540 N/A ASN 208.A N GLU 204.A O no hydrogen 3.052 N/A ASN 208.A ND2 GLU 204.A OE2 no hydrogen 3.033 N/A GLU 210.A N ASN 208.A OD1 no hydrogen 2.730 N/A LYS 211.A N ASN 208.A O no hydrogen 2.995 N/A LYS 211.A NZ GLU 204.A OE2 no hydrogen 3.434 N/A LYS 211.A NZ GLU 239.A OE1 no hydrogen 2.724 N/A LYS 211.A NZ GLU 239.A OE2 no hydrogen 3.111 N/A ILE 212.A N ASN 208.A O no hydrogen 2.893 N/A ARG 213.A N PRO 209.A O no hydrogen 3.252 N/A ARG 213.A NH1 GLU 210.A O no hydrogen 3.085 N/A LEU 215.A N LYS 211.A O no hydrogen 3.108 N/A LYS 216.A N ILE 212.A O no hydrogen 2.869 N/A GLU 217.A N ARG 213.A O no hydrogen 3.177 N/A PHE 218.A N LEU 214.A O no hydrogen 3.272 N/A MET 219.A N LEU 215.A O no hydrogen 2.800 N/A HIS 220.A N LYS 216.A O no hydrogen 3.054 N/A THR 221.A N PHE 218.A O no hydrogen 2.854 N/A THR 221.A OG1 PHE 218.A O no hydrogen 2.784 N/A MET 222.A N MET 219.A O no hydrogen 3.215 N/A LYS 223.A N HIS 220.A O no hydrogen 2.749 N/A THR 225.A N MET 222.A O no hydrogen 3.205 N/A THR 225.A OG1 MET 222.A O no hydrogen 2.630 N/A ARG 227.A N THR 225.A OG1 no hydrogen 3.336 N/A ARG 232.A N VAL 229.A O no hydrogen 2.799 N/A MET 235.A N TYR 263.A O no hydrogen 2.878 N/A VAL 236.A N ASP 205.A OD2 no hydrogen 3.230 N/A ALA 237.A N ILE 265.A O no hydrogen 2.874 N/A LYS 238.A N TYR 243.A OH no hydrogen 2.896 N/A GLY 240.A N ALA 289.A O no hydrogen 3.048 N/A GLU 241.A N LYS 238.A O no hydrogen 3.258 N/A THR 242.A OG1 THR 288.A OG1 no hydrogen 2.814 N/A TYR 243.A N PHE 287.A O no hydrogen 2.986 N/A GLY 245.A N ILE 285.A O no hydrogen 3.267 N/A THR 246.A N ASN 258.A O no hydrogen 3.311 N/A TYR 247.A N ASP 283.A O no hydrogen 2.788 N/A ARG 248.A N ALA 256.A O no hydrogen 2.961 N/A GLY 251.A N GLY 254.A O no hydrogen 2.737 N/A GLY 254.A N GLU 217.A OE1 no hydrogen 3.283 N/A PHE 255.A N GLY 266.A O no hydrogen 2.911 N/A ALA 256.A N GLY 249.A O no hydrogen 3.208 N/A LEU 257.A N ILE 264.A O no hydrogen 2.867 N/A ASN 258.A N THR 246.A O no hydrogen 3.055 N/A VAL 259.A N ALA 262.A O no hydrogen 2.944 N/A ALA 262.A N VAL 259.A O no hydrogen 3.295 N/A TYR 263.A N PRO 233.A O no hydrogen 3.015 N/A ILE 265.A N MET 235.A O no hydrogen 2.744 N/A GLY 266.A N PHE 255.A O no hydrogen 3.288 N/A ILE 268.A N GLU 253.A O no hydrogen 2.889 N/A HIS 270.A N ASN 267.A O no hydrogen 3.076 N/A LEU 271.A N ILE 268.A O no hydrogen 3.241 N/A GLN 275.A N PRO 272.A O no hydrogen 2.909 N/A LEU 276.A N PRO 272.A O no hydrogen 3.426 N/A LYS 280.A N ASP 283.A OD2 no hydrogen 2.966 N/A GLY 282.A N TYR 247.A O no hydrogen 2.729 N/A ASP 283.A N LYS 280.A O no hydrogen 3.238 N/A ILE 285.A N GLY 245.A O no hydrogen 2.996 N/A PHE 287.A N TYR 243.A O no hydrogen 3.008 N/A THR 288.A OG1 THR 242.A OG1 no hydrogen 2.814 N/A ALA 289.A N GLU 241.A O no hydrogen 3.144 N/A