Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jtd_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N VAL 28.A O no hydrogen 3.019 N/A THR 4.A N LYS 272.A O no hydrogen 2.711 N/A THR 4.A OG1 LYS 272.A O no hydrogen 3.183 N/A THR 4.A OG1 GLY 273.A O no hydrogen 3.188 N/A VAL 6.A N GLN 25.A OE1 no hydrogen 3.009 N/A VAL 7.A N ALA 270.A O no hydrogen 2.873 N/A TRP 9.A N ALA 268.A O no hydrogen 2.945 N/A TRP 9.A NE1 THR 249.A O no hydrogen 2.961 N/A ASN 13.A ND2 THR 19.A OG1 no hydrogen 2.881 N/A TRP 15.A N GLU 17.A OE1 no hydrogen 3.021 N/A GLU 17.A N GLU 17.A OE1 no hydrogen 2.593 N/A ALA 18.A N ASN 13.A OD1 no hydrogen 2.905 N/A THR 19.A N GLY 16.A O no hydrogen 3.447 N/A ALA 24.A N PRO 21.A O no hydrogen 2.842 N/A GLN 25.A N ALA 22.A O no hydrogen 2.930 N/A GLN 25.A NE2 VAL 6.A O no hydrogen 3.162 N/A GLN 25.A NE2 VAL 20.A O no hydrogen 3.395 N/A GLY 27.A N ALA 3.A O no hydrogen 2.820 N/A ASP 29.A N LEU 41.A O no hydrogen 3.024 N/A ALA 32.A N LEU 39.A O no hydrogen 2.891 N/A GLY 33.A N GLU 262.A OE1 no hydrogen 2.776 N/A GLY 34.A N HIS 37.A O no hydrogen 2.650 N/A HIS 37.A NE2 SER 77.A OG no hydrogen 2.768 N/A GLY 38.A N TRP 49.A O no hydrogen 3.050 N/A LEU 39.A N ALA 32.A O no hydrogen 2.868 N/A ALA 40.A N LEU 47.A O no hydrogen 2.773 N/A LEU 41.A N ALA 30.A O no hydrogen 2.915 N/A LYS 42.A N LYS 45.A O no hydrogen 2.838 N/A LYS 42.A NZ GLU 23.A O no hydrogen 2.926 N/A LYS 42.A NZ GLU 23.A OE1 no hydrogen 2.998 N/A LYS 42.A NZ SER 26.A O no hydrogen 3.065 N/A LYS 45.A N LYS 42.A O no hydrogen 2.959 N/A VAL 46.A N THR 63.A O no hydrogen 3.036 N/A LEU 47.A N ALA 40.A O no hydrogen 2.704 N/A TRP 49.A N GLY 38.A O no hydrogen 3.079 N/A TRP 49.A NE1 GLU 17.A O no hydrogen 2.970 N/A ALA 51.A N PHE 36.A O no hydrogen 2.957 N/A ASN 52.A ND2 THR 58.A OG1 no hydrogen 3.029 N/A ASN 54.A N GLN 56.A OE1 no hydrogen 2.965 N/A GLY 55.A N ASN 52.A O no hydrogen 3.108 N/A GLN 56.A N GLN 56.A OE1 no hydrogen 2.758 N/A LEU 57.A N ASN 52.A OD1 no hydrogen 2.705 N/A THR 58.A N GLY 55.A O no hydrogen 3.303 N/A THR 63.A N PRO 60.A O no hydrogen 2.952 N/A THR 63.A OG1 PRO 60.A O no hydrogen 2.882 N/A GLN 64.A N ALA 61.A O no hydrogen 3.041 N/A VAL 67.A N GLY 44.A O no hydrogen 2.832 N/A ASP 68.A N LEU 80.A O no hydrogen 2.755 N/A ALA 69.A N LEU 80.A O no hydrogen 3.428 N/A ALA 71.A N LEU 78.A O no hydrogen 2.972 N/A GLY 73.A N HIS 76.A O no hydrogen 3.113 N/A ASN 74.A N ALA 113.A O no hydrogen 2.946 N/A SER 77.A N TRP 88.A O no hydrogen 2.802 N/A SER 77.A OG HIS 37.A NE2 no hydrogen 2.768 N/A SER 77.A OG GLN 56.A O no hydrogen 2.843 N/A LEU 78.A N ALA 71.A O no hydrogen 2.841 N/A ALA 79.A N ILE 86.A O no hydrogen 2.907 N/A LEU 80.A N ALA 69.A O no hydrogen 2.803 N/A LYS 81.A N GLU 84.A O no hydrogen 2.690 N/A LYS 81.A NZ ALA 62.A O no hydrogen 3.051 N/A LYS 81.A NZ SER 65.A O no hydrogen 3.065 N/A ASP 82.A N ASP 68.A OD2 no hydrogen 3.115 N/A GLU 84.A N LYS 81.A O no hydrogen 2.818 N/A VAL 85.A N ALA 102.A O no hydrogen 3.151 N/A ILE 86.A N ALA 79.A O no hydrogen 2.778 N/A TRP 88.A N SER 77.A O no hydrogen 3.183 N/A GLY 90.A N TYR 75.A O no hydrogen 2.776 N/A ASN 91.A ND2 THR 97.A OG1 no hydrogen 3.167 N/A GLY 94.A N ASN 91.A O no hydrogen 2.968 N/A THR 96.A N ASN 91.A OD1 no hydrogen 2.869 N/A THR 97.A N GLY 94.A O no hydrogen 3.372 N/A ALA 102.A N PRO 99.A O no hydrogen 2.922 N/A ARG 103.A N ALA 100.A O no hydrogen 2.947 N/A ARG 103.A NE GLU 84.A OE1 no hydrogen 3.100 N/A ARG 103.A NH2 GLU 84.A OE1 no hydrogen 3.527 N/A VAL 106.A N GLY 83.A O no hydrogen 2.998 N/A ASP 107.A N LEU 119.A O no hydrogen 2.859 N/A ALA 110.A N TYR 117.A O no hydrogen 3.118 N/A GLY 112.A N ALA 115.A O no hydrogen 2.798 N/A ALA 113.A N GLY 151.A O no hydrogen 3.236 N/A ALA 115.A N GLY 112.A O no hydrogen 3.506 N/A SER 116.A N TRP 127.A O no hydrogen 2.893 N/A SER 116.A OG GLN 95.A O no hydrogen 2.643 N/A TYR 117.A N ALA 110.A O no hydrogen 2.866 N/A TYR 117.A OH GLN 134.A O no hydrogen 2.808 N/A ALA 118.A N ILE 125.A O no hydrogen 2.822 N/A LEU 119.A N ALA 108.A O no hydrogen 2.806 N/A LYS 120.A N LYS 123.A O no hydrogen 2.947 N/A LYS 120.A NZ GLU 101.A O no hydrogen 3.089 N/A LYS 120.A NZ SER 104.A O no hydrogen 2.737 N/A LYS 123.A N LYS 120.A O no hydrogen 2.919 N/A LYS 123.A NZ GLU 101.A OE2 no hydrogen 2.961 N/A VAL 124.A N ALA 141.A O no hydrogen 3.103 N/A ILE 125.A N ALA 118.A O no hydrogen 2.823 N/A TRP 127.A N SER 116.A O no hydrogen 3.009 N/A ASP 129.A N TRP 114.A O no hydrogen 2.903 N/A SER 131.A N ASP 129.A OD1 no hydrogen 3.301 N/A SER 131.A OG ASP 129.A OD1 no hydrogen 3.022 N/A SER 131.A OG ASP 129.A OD2 no hydrogen 3.040 N/A ASP 132.A N GLN 134.A OE1 no hydrogen 2.923 N/A GLY 133.A N ASP 130.A O no hydrogen 2.919 N/A GLN 134.A N GLN 134.A OE1 no hydrogen 2.886 N/A THR 135.A N ASP 130.A OD1 no hydrogen 2.721 N/A THR 135.A OG1 ASP 129.A O no hydrogen 2.733 N/A THR 136.A N GLY 133.A O no hydrogen 3.352 N/A THR 136.A OG1 ASP 130.A OD1 no hydrogen 3.549 N/A THR 136.A OG1 ASP 130.A OD2 no hydrogen 2.440 N/A ALA 141.A N PRO 138.A O no hydrogen 3.060 N/A GLN 142.A N ALA 139.A O no hydrogen 2.952 N/A VAL 145.A N GLY 122.A O no hydrogen 2.874 N/A THR 146.A N VAL 158.A O no hydrogen 2.818 N/A THR 146.A OG1 VAL 158.A O no hydrogen 3.468 N/A ASP 149.A N LEU 156.A O no hydrogen 2.886 N/A GLY 151.A N THR 154.A O no hydrogen 2.702 N/A ALA 155.A N TRP 166.A O no hydrogen 3.120 N/A LEU 156.A N ASP 149.A O no hydrogen 2.864 N/A ALA 157.A N ILE 164.A O no hydrogen 2.898 N/A VAL 158.A N ALA 147.A O no hydrogen 2.848 N/A LYS 159.A N GLY 162.A O no hydrogen 2.853 N/A LYS 159.A NZ GLU 140.A O no hydrogen 2.934 N/A LYS 159.A NZ GLU 140.A OE2.A no hydrogen 2.800 N/A GLY 162.A N LYS 159.A O no hydrogen 2.723 N/A VAL 163.A N ALA 180.A O no hydrogen 2.941 N/A ILE 164.A N ALA 157.A O no hydrogen 2.823 N/A TRP 166.A N ALA 155.A O no hydrogen 3.130 N/A TRP 166.A NE1 GLN 134.A O no hydrogen 2.974 N/A ASP 168.A N TYR 153.A O no hydrogen 3.005 N/A ASN 169.A ND2 THR 175.A OG1 no hydrogen 3.169 N/A TYR 170.A N ASP 168.A OD1 no hydrogen 3.048 N/A PHE 171.A N GLN 173.A OE1 no hydrogen 3.060 N/A GLY 172.A N ASN 169.A O no hydrogen 3.150 N/A GLN 173.A N GLN 173.A OE1 no hydrogen 2.856 N/A GLN 173.A NE2 ASP 168.A OD1 no hydrogen 2.897 N/A GLN 173.A NE2 ILE 191.A O no hydrogen 3.369 N/A THR 174.A N ASN 169.A OD1 no hydrogen 2.846 N/A THR 174.A OG1 ASP 168.A O no hydrogen 3.146 N/A THR 175.A N GLY 172.A O no hydrogen 3.164 N/A ALA 180.A N PRO 177.A O no hydrogen 2.830 N/A GLN 181.A N ALA 178.A O no hydrogen 3.210 N/A VAL 184.A N GLY 161.A O no hydrogen 2.865 N/A ASP 185.A N LEU 197.A O no hydrogen 2.705 N/A ALA 188.A N LEU 195.A O no hydrogen 3.013 N/A GLY 189.A N ASP 149.A OD2 no hydrogen 2.843 N/A GLY 190.A N HIS 193.A O no hydrogen 2.788 N/A ILE 191.A N GLU 230.A O no hydrogen 2.921 N/A HIS 193.A NE2 SER 233.A OG no hydrogen 2.966 N/A SER 194.A N TRP 205.A O no hydrogen 2.799 N/A SER 194.A OG GLN 173.A O no hydrogen 2.718 N/A LEU 195.A N ALA 188.A O no hydrogen 2.740 N/A ALA 196.A N ILE 203.A O no hydrogen 2.937 N/A LEU 197.A N ASP 186.A O no hydrogen 2.832 N/A LYS 198.A N LYS 201.A O no hydrogen 2.777 N/A LYS 198.A NZ GLU 179.A O no hydrogen 2.705 N/A LYS 198.A NZ SER 182.A O no hydrogen 3.271 N/A ASP 199.A N ASP 185.A OD2 no hydrogen 2.991 N/A LYS 201.A N LYS 198.A O no hydrogen 2.760 N/A LYS 201.A NZ GLU 179.A OE1 no hydrogen 2.792 N/A VAL 202.A N ALA 219.A O no hydrogen 3.091 N/A ILE 203.A N ALA 196.A O no hydrogen 2.960 N/A TRP 205.A N SER 194.A O no hydrogen 3.112 N/A ASP 207.A N PHE 192.A O no hydrogen 2.770 N/A ASN 208.A ND2 THR 214.A OG1 no hydrogen 2.910 N/A ARG 209.A N ASP 207.A OD1 no hydrogen 3.083 N/A ARG 209.A NE ASP 207.A OD1 no hydrogen 2.827 N/A ARG 209.A NE ASP 207.A OD2 no hydrogen 3.277 N/A ARG 209.A NH2 ASP 207.A OD2 no hydrogen 3.137 N/A TYR 210.A N GLN 212.A OE1 no hydrogen 2.791 N/A LYS 211.A N ASN 208.A O no hydrogen 2.914 N/A GLN 212.A N GLN 212.A OE1 no hydrogen 2.802 N/A GLN 212.A NE2 ASP 207.A OD2 no hydrogen 2.745 N/A THR 214.A N LYS 211.A O no hydrogen 2.995 N/A ALA 219.A N PRO 216.A O no hydrogen 2.980 N/A LEU 220.A N THR 217.A O no hydrogen 2.836 N/A VAL 223.A N GLY 200.A O no hydrogen 2.990 N/A SER 224.A N LEU 236.A O no hydrogen 2.858 N/A SER 224.A OG LEU 236.A O no hydrogen 3.387 N/A ALA 227.A N LEU 234.A O no hydrogen 3.027 N/A SER 228.A OG HIS 193.A NE2 no hydrogen 3.033 N/A SER 228.A OG GLY 229.A O no hydrogen 2.808 N/A SER 228.A OG TYR 232.A O no hydrogen 3.564 N/A GLY 229.A N TYR 232.A O no hydrogen 2.916 N/A GLU 230.A N PRO 265.A O no hydrogen 3.024 N/A TYR 232.A OH GLY 264.A O no hydrogen 2.879 N/A SER 233.A N TRP 244.A O no hydrogen 2.927 N/A LEU 234.A N ALA 227.A O no hydrogen 2.843 N/A ALA 235.A N ILE 242.A O no hydrogen 2.848 N/A LEU 236.A N ALA 225.A O no hydrogen 2.834 N/A LYS 237.A N LYS 240.A O no hydrogen 2.861 N/A LYS 237.A NZ GLU 218.A O no hydrogen 2.858 N/A LYS 237.A NZ GLU 218.A OE2.A no hydrogen 2.752 N/A LYS 237.A NZ SER 221.A O no hydrogen 2.982 N/A LYS 240.A N LYS 237.A O no hydrogen 2.833 N/A LYS 240.A NZ GLU 218.A OE1.B no hydrogen 3.413 N/A LYS 240.A NZ GLU 218.A OE2.B no hydrogen 3.470 N/A VAL 241.A N VAL 254.A O no hydrogen 2.909 N/A ILE 242.A N ALA 235.A O no hydrogen 2.718 N/A TRP 244.A N SER 233.A O no hydrogen 3.339 N/A TRP 244.A NE1 GLN 212.A O no hydrogen 2.776 N/A SER 246.A N TYR 210.A O no hydrogen 2.731 N/A SER 246.A OG TRP 231.A O no hydrogen 2.704 N/A ARG 248.A N GLY 245.A O no hydrogen 2.961 N/A ARG 248.A NH1.A ASN 266.A O no hydrogen 2.913 N/A ARG 248.A NH1.B ASN 266.A O no hydrogen 3.156 N/A ARG 248.A NH2.A ASN 266.A O no hydrogen 3.262 N/A ARG 248.A NH2.B ASN 266.A O no hydrogen 2.915 N/A VAL 254.A N PRO 251.A O no hydrogen 3.154 N/A GLN 255.A N SER 252.A O no hydrogen 3.143 N/A GLN 255.A NE2 ALA 250.A O no hydrogen 3.147 N/A GLN 255.A NE2 PRO 251.A O no hydrogen 3.609 N/A VAL 258.A N GLY 239.A O no hydrogen 2.920 N/A SER 259.A N LEU 271.A O no hydrogen 2.916 N/A SER 259.A OG LEU 271.A O no hydrogen 3.199 N/A GLU 262.A N TYR 269.A O no hydrogen 2.953 N/A GLY 264.A N ALA 267.A O no hydrogen 2.754 N/A ASN 266.A ND2 TYR 35.A OH no hydrogen 3.239 N/A ALA 268.A N TRP 9.A O no hydrogen 2.744 N/A TYR 269.A N GLU 262.A O no hydrogen 2.786 N/A TYR 269.A OH GLU 17.A O no hydrogen 2.496 N/A ALA 270.A N VAL 7.A O no hydrogen 2.741 N/A LEU 271.A N SER 260.A O no hydrogen 2.973 N/A LYS 272.A N SER 5.A O no hydrogen 2.947 N/A LYS 272.A NZ SER 253.A O no hydrogen 2.647 N/A LYS 272.A NZ SER 256.A O no hydrogen 2.728 N/A