Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jfl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N TYR 1.A O no hydrogen 3.184 N/A THR 5.A N ALA 77.A O no hydrogen 2.767 N/A THR 5.A OG1 ALA 77.A O no hydrogen 3.393 N/A GLU 11.A N ASN 9.A OD1 no hydrogen 2.892 N/A ASP 12.A N ASN 9.A O no hydrogen 2.910 N/A PHE 13.A N PRO 10.A O no hydrogen 3.110 N/A TRP 14.A N PRO 10.A O no hydrogen 2.816 N/A TRP 14.A NE1 ASP 76.A OD2 no hydrogen 3.023 N/A GLU 15.A N GLN 32.A O no hydrogen 2.770 N/A ILE 17.A N LYS 30.A O no hydrogen 2.747 N/A GLY 18.A N LYS 30.A O no hydrogen 3.489 N/A LEU 20.A N VAL 28.A O no hydrogen 2.923 N/A GLY 21.A N VAL 28.A O no hydrogen 3.346 N/A GLY 23.A N GLY 26.A O no hydrogen 2.726 N/A GLY 26.A N GLY 23.A O no hydrogen 2.679 N/A LYS 27.A NZ GLU 19.A OE1 no hydrogen 3.270 N/A VAL 28.A N GLY 21.A O no hydrogen 3.176 N/A TYR 29.A N ALA 42.A O no hydrogen 2.834 N/A LYS 30.A N GLY 18.A O no hydrogen 2.744 N/A ALA 31.A N ALA 40.A O no hydrogen 2.892 N/A GLN 32.A N GLU 15.A O no hydrogen 2.696 N/A GLN 32.A NE2 SER 37.A O no hydrogen 3.526 N/A ASN 33.A N VAL 38.A O no hydrogen 2.868 N/A LYS 34.A N PHE 13.A O no hydrogen 2.926 N/A LYS 34.A NZ GLU 11.A O no hydrogen 3.143 N/A GLU 35.A N ASN 33.A OD1 no hydrogen 3.171 N/A THR 36.A N ASN 33.A OD1 no hydrogen 2.920 N/A SER 37.A N ASN 33.A O no hydrogen 2.857 N/A VAL 38.A N THR 36.A OG1 no hydrogen 3.422 N/A ALA 40.A N ALA 31.A O no hydrogen 2.952 N/A ALA 41.A N ILE 88.A O no hydrogen 2.927 N/A ALA 42.A N TYR 29.A O no hydrogen 2.732 N/A LYS 43.A N ILE 86.A O no hydrogen 2.899 N/A ILE 45.A N LEU 84.A O no hydrogen 2.939 N/A THR 47.A N ASN 82.A O no hydrogen 2.854 N/A THR 47.A OG1 SER 49.A O no hydrogen 3.294 N/A THR 47.A OG1 ASN 82.A O no hydrogen 3.032 N/A LYS 48.A N GLU 52.A OE1 no hydrogen 2.726 N/A SER 49.A N GLU 52.A OE1 no hydrogen 3.257 N/A LEU 53.A N GLU 50.A O no hydrogen 2.949 N/A GLU 54.A N GLU 51.A O no hydrogen 3.268 N/A ASP 55.A N GLU 52.A O no hydrogen 2.918 N/A TYR 56.A N LEU 53.A O no hydrogen 3.069 N/A MET 57.A N GLU 54.A O no hydrogen 3.502 N/A ILE 60.A N TYR 56.A O no hydrogen 3.327 N/A ASP 61.A N MET 57.A O no hydrogen 2.940 N/A ILE 62.A N VAL 58.A O no hydrogen 2.940 N/A LEU 63.A N GLU 59.A O no hydrogen 2.965 N/A ALA 64.A N ILE 60.A O no hydrogen 2.837 N/A SER 65.A N ASP 61.A O no hydrogen 2.839 N/A SER 65.A OG ASP 61.A O no hydrogen 2.805 N/A SER 65.A OG ILE 62.A O no hydrogen 3.495 N/A CYS 66.A N ILE 62.A O no hydrogen 2.931 N/A CYS 66.A SG ILE 62.A O no hydrogen 3.237 N/A ASP 67.A N TYR 125.A OH no hydrogen 2.893 N/A ASN 70.A N HIS 68.A ND1 no hydrogen 3.151 N/A ASN 70.A ND2 ILE 149.A O no hydrogen 2.955 N/A ILE 71.A N HIS 68.A O no hydrogen 3.329 N/A VAL 72.A N LEU 151.A O no hydrogen 3.160 N/A LYS 73.A N GLU 89.A OE1 no hydrogen 3.192 N/A LEU 75.A N LEU 87.A O no hydrogen 2.706 N/A ASP 76.A N LEU 87.A O no hydrogen 3.328 N/A PHE 78.A N TRP 85.A O no hydrogen 2.920 N/A TYR 79.A N THR 5.A O no hydrogen 2.877 N/A TYR 80.A N ASN 83.A O no hydrogen 3.004 N/A TYR 80.A OH GLU 81.A OE1 no hydrogen 3.399 N/A ASN 83.A N TYR 80.A O no hydrogen 3.105 N/A LEU 84.A N ILE 45.A O no hydrogen 2.902 N/A TRP 85.A N PHE 78.A O no hydrogen 2.767 N/A ILE 86.A N LYS 43.A O no hydrogen 2.923 N/A LEU 87.A N ASP 76.A O no hydrogen 2.839 N/A ILE 88.A N ALA 41.A O no hydrogen 2.988 N/A GLU 89.A N LYS 73.A O no hydrogen 3.002 N/A GLY 93.A N PHE 143.A O no hydrogen 2.863 N/A GLY 94.A N CYS 91.A O no hydrogen 3.303 N/A VAL 96.A N ILE 141.A O no hydrogen 3.011 N/A VAL 99.A N ALA 95.A O no hydrogen 3.153 N/A MET 100.A N VAL 96.A O no hydrogen 3.155 N/A LEU 101.A N ASP 97.A O no hydrogen 3.201 N/A GLU 102.A N ALA 98.A O no hydrogen 2.975 N/A LEU 103.A N VAL 99.A O no hydrogen 2.844 N/A ARG 105.A N MET 100.A O no hydrogen 3.038 N/A ARG 105.A NH1 GLU 284.A OE1 no hydrogen 2.810 N/A ARG 105.A NH2 GLU 284.A OE1 no hydrogen 3.384 N/A ARG 105.A NH2 GLU 284.A OE2 no hydrogen 3.312 N/A LEU 107.A N MET 206.A O no hydrogen 2.832 N/A THR 108.A N GLN 111.A OE1 no hydrogen 2.987 N/A THR 108.A OG1 SER 110.A OG no hydrogen 3.346 N/A SER 110.A OG THR 108.A OG1 no hydrogen 3.346 N/A GLN 111.A N THR 108.A OG1 no hydrogen 3.365 N/A GLN 111.A NE2 PRO 277.A O no hydrogen 3.546 N/A ILE 112.A N THR 108.A O no hydrogen 3.011 N/A GLN 113.A N GLU 109.A O no hydrogen 2.952 N/A GLN 113.A NE2 PHE 269.A O no hydrogen 2.805 N/A VAL 114.A N SER 110.A O no hydrogen 3.447 N/A VAL 115.A N GLN 111.A O no hydrogen 3.222 N/A CYS 116.A N ILE 112.A O no hydrogen 2.770 N/A LYS 117.A N GLN 113.A O no hydrogen 2.868 N/A LYS 117.A NZ ASP 121.A OD1 no hydrogen 3.509 N/A LYS 117.A NZ ASP 121.A OD2 no hydrogen 2.833 N/A GLN 118.A N VAL 114.A O no hydrogen 3.093 N/A GLN 118.A NE2 ASP 148.A OD1 no hydrogen 3.111 N/A THR 119.A N VAL 115.A O no hydrogen 2.740 N/A THR 119.A OG1 VAL 115.A O no hydrogen 2.726 N/A LEU 120.A N CYS 116.A O no hydrogen 2.913 N/A ASP 121.A N LYS 117.A O no hydrogen 3.164 N/A ALA 122.A N GLN 118.A O no hydrogen 3.141 N/A LEU 123.A N THR 119.A O no hydrogen 3.053 N/A ASN 124.A N LEU 120.A O no hydrogen 2.983 N/A TYR 125.A N ASP 121.A O no hydrogen 3.091 N/A LEU 126.A N ALA 122.A O no hydrogen 2.899 N/A HIS 127.A N LEU 123.A O no hydrogen 2.758 N/A HIS 127.A NE2 ASP 195.A OD2 no hydrogen 2.640 N/A ASP 128.A N ASN 124.A O no hydrogen 2.896 N/A ASN 129.A N TYR 125.A O no hydrogen 3.018 N/A ASN 129.A ND2 TYR 125.A O no hydrogen 2.980 N/A LYS 130.A N HIS 127.A O no hydrogen 3.032 N/A LYS 130.A NZ ASP 187.A OD1 no hydrogen 3.194 N/A ILE 131.A N LEU 126.A O no hydrogen 2.882 N/A ILE 132.A N ALA 158.A O no hydrogen 2.811 N/A HIS 133.A N ASP 195.A OD2 no hydrogen 2.969 N/A HIS 133.A NE2 ALA 152.A O no hydrogen 2.763 N/A ARG 134.A N ASP 195.A OD1 no hydrogen 3.014 N/A ARG 134.A NH1 VAL 156.A O no hydrogen 2.870 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 3.033 N/A ALA 138.A N GLU 205.A OE2 no hydrogen 2.966 N/A ASN 140.A N LYS 137.A O no hydrogen 2.990 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.778 N/A ILE 141.A N ALA 138.A O no hydrogen 3.342 N/A LEU 142.A N LYS 150.A O no hydrogen 2.872 N/A PHE 143.A N GLY 94.A O no hydrogen 2.892 N/A THR 144.A N ASP 148.A O no hydrogen 2.792 N/A THR 144.A OG1 ASP 148.A O no hydrogen 3.373 N/A ASP 146.A N THR 144.A OG1 no hydrogen 3.315 N/A GLY 147.A N THR 144.A O no hydrogen 3.160 N/A ASP 148.A N THR 144.A OG1 no hydrogen 3.093 N/A ILE 149.A N GLN 118.A OE1 no hydrogen 2.957 N/A LYS 150.A N LEU 142.A O no hydrogen 2.844 N/A LYS 150.A NZ PRO 69.A O no hydrogen 2.551 N/A LEU 151.A N ASN 70.A O no hydrogen 2.753 N/A ALA 152.A N ASN 140.A O no hydrogen 2.933 N/A GLY 155.A N ASP 153.A OD1 no hydrogen 3.294 N/A SER 157.A N PHE 154.A O no hydrogen 3.274 N/A SER 157.A OG HIS 133.A O no hydrogen 2.806 N/A ALA 158.A N ILE 132.A O no hydrogen 2.905 N/A LYS 159.A NZ ASP 61.A OD2 no hydrogen 2.588 N/A ASN 160.A N LYS 130.A O no hydrogen 2.784 N/A ASN 160.A ND2 LYS 130.A O no hydrogen 3.690 N/A ASN 160.A ND2 TYR 192.A OH no hydrogen 3.036 N/A GLN 164.A N THR 161.A O no hydrogen 3.002 N/A ARG 165.A N ARG 162.A O no hydrogen 2.776 N/A ASP 167.A N ILE 163.A O no hydrogen 3.016 N/A TYR 173.A N THR 171.A O no hydrogen 3.109 N/A MET 175.A N PRO 172.A O no hydrogen 3.287 N/A GLU 178.A N GLU 178.A OE2 no hydrogen 2.860 N/A VAL 179.A N ALA 176.A O no hydrogen 2.952 N/A VAL 180.A N ALA 176.A O no hydrogen 2.938 N/A MET 181.A N PRO 177.A O no hydrogen 2.806 N/A CYS 182.A N VAL 179.A O no hydrogen 3.356 N/A CYS 182.A SG VAL 180.A O no hydrogen 4.043 N/A GLU 183.A N GLU 178.A O no hydrogen 2.730 N/A LYS 186.A N THR 184.A OG1 no hydrogen 3.378 N/A ASP 187.A N THR 184.A O no hydrogen 3.160 N/A ARG 188.A N THR 184.A O no hydrogen 3.170 N/A TYR 192.A OH LYS 186.A O no hydrogen 2.813 N/A LYS 193.A N PRO 189.A O no hydrogen 3.003 N/A LYS 193.A NZ VAL 255.A O no hydrogen 2.931 N/A LYS 193.A NZ ASP 256.A O no hydrogen 3.394 N/A LYS 193.A NZ ARG 258.A O no hydrogen 3.053 N/A ALA 194.A N ASP 191.A O no hydrogen 3.437 N/A ASP 195.A N TYR 192.A O no hydrogen 3.022 N/A VAL 196.A N LYS 193.A O no hydrogen 3.036 N/A TRP 197.A N LYS 193.A O no hydrogen 3.339 N/A SER 198.A N ALA 194.A O no hydrogen 3.322 N/A SER 198.A OG ALA 194.A O no hydrogen 3.341 N/A LEU 199.A N ASP 195.A O no hydrogen 2.965 N/A GLY 200.A N VAL 196.A O no hydrogen 3.141 N/A ILE 201.A N TRP 197.A O no hydrogen 3.121 N/A THR 202.A N SER 198.A O no hydrogen 2.956 N/A THR 202.A OG1 SER 198.A O no hydrogen 2.706 N/A LEU 203.A N LEU 199.A O no hydrogen 3.018 N/A ILE 204.A N GLY 200.A O no hydrogen 3.279 N/A GLU 205.A N ILE 201.A O no hydrogen 2.768 N/A MET 206.A N THR 202.A O no hydrogen 2.830 N/A ALA 207.A N LEU 203.A O no hydrogen 2.908 N/A GLU 210.A N GLU 208.A O no hydrogen 2.817 N/A HIS 214.A N PRO 211.A O no hydrogen 3.258 N/A HIS 214.A ND1 PRO 211.A O no hydrogen 2.860 N/A GLU 215.A N GLU 215.A OE1 no hydrogen 2.822 N/A LEU 216.A N HIS 213.A O no hydrogen 3.153 N/A MET 219.A N ASN 217.A OD1 no hydrogen 2.941 N/A ARG 220.A N ASN 217.A O no hydrogen 2.903 N/A VAL 221.A N PRO 218.A O no hydrogen 3.350 N/A LYS 224.A N ARG 220.A O no hydrogen 2.920 N/A ILE 225.A N VAL 221.A O no hydrogen 2.928 N/A ALA 226.A N LEU 222.A O no hydrogen 3.018 N/A LYS 227.A N LEU 223.A O no hydrogen 2.789 N/A SER 228.A N LYS 224.A O no hydrogen 3.026 N/A SER 228.A OG LYS 224.A O no hydrogen 2.580 N/A ALA 234.A N GLU 208.A OE2 no hydrogen 2.775 N/A ARG 238.A N GLN 235.A O no hydrogen 3.072 N/A TRP 239.A N PRO 236.A O no hydrogen 3.257 N/A SER 240.A N GLU 109.A OE2 no hydrogen 2.819 N/A SER 240.A OG GLU 109.A OE1 no hydrogen 2.574 N/A PHE 243.A N SER 240.A OG no hydrogen 3.044 N/A LYS 244.A N SER 240.A O no hydrogen 2.999 N/A LYS 244.A NZ PRO 236.A O no hydrogen 2.896 N/A LYS 244.A NZ TRP 239.A O no hydrogen 3.206 N/A ASP 245.A N SER 241.A O no hydrogen 2.846 N/A PHE 246.A N ASN 242.A O no hydrogen 2.998 N/A LEU 247.A N PHE 243.A O no hydrogen 3.051 N/A LYS 248.A N LYS 244.A O no hydrogen 3.302 N/A LYS 249.A N ASP 245.A O no hydrogen 3.333 N/A LYS 249.A N PHE 246.A O no hydrogen 3.118 N/A CYS 250.A N PHE 246.A O no hydrogen 3.343 N/A CYS 250.A N LEU 247.A O no hydrogen 3.170 N/A CYS 250.A SG PHE 246.A O no hydrogen 3.581 N/A LEU 251.A N LEU 247.A O no hydrogen 2.734 N/A LYS 253.A NZ ILE 225.A O no hydrogen 3.034 N/A LYS 253.A NZ SER 228.A O no hydrogen 2.821 N/A ASN 254.A N GLU 252.A OE2 no hydrogen 3.057 N/A ALA 257.A N ASN 254.A O no hydrogen 2.970 N/A ARG 258.A N ASN 254.A O no hydrogen 2.998 N/A ARG 258.A N VAL 255.A O no hydrogen 3.253 N/A ARG 258.A NE GLU 252.A O no hydrogen 2.945 N/A ARG 258.A NH1 LYS 193.A O no hydrogen 2.844 N/A ARG 258.A NH2 GLU 252.A O no hydrogen 2.910 N/A TRP 259.A N LYS 249.A O no hydrogen 3.027 N/A THR 260.A N GLN 263.A OE1 no hydrogen 2.928 N/A THR 260.A OG1 GLN 263.A OE1 no hydrogen 3.398 N/A THR 261.A OG1 ASN 124.A OD1 no hydrogen 3.081 N/A GLN 263.A N THR 260.A OG1 no hydrogen 3.195 N/A LEU 264.A N THR 260.A O no hydrogen 2.985 N/A LEU 265.A N THR 261.A O no hydrogen 3.122 N/A GLN 266.A N GLN 263.A O no hydrogen 3.117 N/A HIS 267.A N LEU 264.A O no hydrogen 3.014 N/A HIS 267.A NE2 ASP 245.A OD1 no hydrogen 2.723 N/A PHE 269.A N HIS 267.A ND1 no hydrogen 3.109 N/A VAL 270.A N HIS 267.A O no hydrogen 3.119 N/A THR 271.A N PRO 268.A O no hydrogen 3.081 N/A THR 271.A OG1 PRO 268.A O no hydrogen 2.688 N/A VAL 272.A N VAL 270.A O no hydrogen 2.864 N/A ASN 275.A ND2 ASP 148.A OD1 no hydrogen 2.758 N/A LYS 276.A N SER 274.A OG no hydrogen 3.227 N/A ARG 279.A N ASN 275.A O no hydrogen 2.949 N/A ARG 279.A NE ASN 275.A OD1 no hydrogen 2.794 N/A GLU 280.A N LYS 276.A O no hydrogen 3.011 N/A LEU 281.A N PRO 277.A O no hydrogen 3.151 N/A ILE 282.A N ILE 278.A O no hydrogen 2.944 N/A ALA 283.A N ARG 279.A O no hydrogen 3.111 N/A GLU 284.A N GLU 280.A O no hydrogen 3.259 N/A ALA 285.A N LEU 281.A O no hydrogen 3.149 N/A LYS 286.A N ALA 283.A O no hydrogen 3.173 N/A