Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jfq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 224.A O no hydrogen 3.301 N/A ASN 2.A ND2 SER 227.A OG no hydrogen 3.291 N/A LYS 3.A NZ ASP 64.A OD1 no hydrogen 3.402 N/A ILE 5.A N THR 29.A O no hydrogen 2.713 N/A GLY 6.A N MET 67.A O no hydrogen 2.840 N/A VAL 7.A N TYR 31.A O no hydrogen 2.800 N/A ILE 8.A N VAL 69.A O no hydrogen 3.020 N/A ASP 9.A N LEU 33.A O no hydrogen 3.035 N/A GLY 11.A N ASP 9.A OD2 no hydrogen 2.946 N/A GLY 14.A N ASP 9.A OD2 no hydrogen 2.705 N/A LEU 15.A N VAL 12.A O no hydrogen 2.941 N/A THR 16.A N GLY 13.A O no hydrogen 3.021 N/A THR 16.A OG1 GLY 13.A O no hydrogen 2.966 N/A THR 16.A OG1 THR 185.A O no hydrogen 2.762 N/A VAL 17.A N GLY 14.A O no hydrogen 2.801 N/A ALA 18.A N GLY 14.A O no hydrogen 3.035 N/A LYS 19.A N LEU 15.A O no hydrogen 2.893 N/A LYS 19.A NZ TRP 252.A O no hydrogen 2.987 N/A ILE 21.A N VAL 17.A O no hydrogen 3.043 N/A MET 22.A N ALA 18.A O no hydrogen 3.016 N/A ARG 23.A N LYS 19.A O no hydrogen 3.170 N/A GLN 24.A N GLU 20.A O no hydrogen 2.923 N/A GLN 24.A NE2 GLU 20.A OE1 no hydrogen 2.632 N/A GLN 24.A NE2 LEU 209.A O no hydrogen 3.075 N/A LEU 25.A N ILE 21.A O no hydrogen 2.675 N/A GLU 28.A N LEU 25.A O no hydrogen 3.067 N/A ILE 30.A N HIS 234.A ND1 no hydrogen 2.819 N/A TYR 31.A N ILE 5.A O no hydrogen 2.955 N/A TYR 32.A N ARG 235.A O no hydrogen 2.921 N/A TYR 32.A OH GLY 11.A O no hydrogen 2.732 N/A LEU 33.A N VAL 7.A O no hydrogen 2.830 N/A GLY 34.A N PHE 237.A O no hydrogen 3.011 N/A ASP 35.A N ASP 9.A O no hydrogen 2.959 N/A GLY 37.A N THR 239.A OG1 no hydrogen 2.856 N/A ARG 38.A N ASP 35.A O no hydrogen 2.879 N/A ARG 38.A NE ASP 35.A OD1 no hydrogen 3.459 N/A ARG 38.A NE ASP 35.A OD2 no hydrogen 2.757 N/A ARG 38.A NH1 GLU 55.A OE1 no hydrogen 2.783 N/A ARG 38.A NH2 ASP 35.A OD2 no hydrogen 3.052 N/A ARG 38.A NH2 GLU 55.A OE1 no hydrogen 3.300 N/A CYS 39.A SG ILE 36.A O no hydrogen 3.639 N/A TYR 41.A OH ASP 35.A OD2 no hydrogen 2.525 N/A ARG 44.A N TYR 41.A O no hydrogen 2.932 N/A ARG 44.A NE ARG 38.A O no hydrogen 3.001 N/A ARG 44.A NE PRO 40.A O no hydrogen 3.169 N/A ARG 44.A NH1 GLN 48.A OE1 no hydrogen 2.993 N/A ARG 44.A NH2 ARG 38.A O no hydrogen 2.818 N/A GLN 48.A N PRO 45.A O no hydrogen 2.807 N/A VAL 49.A N PRO 45.A O no hydrogen 3.032 N/A LYS 50.A N GLY 46.A O no hydrogen 2.926 N/A GLN 51.A N GLU 47.A O no hydrogen 3.297 N/A GLN 51.A NE2 GLU 55.A OE2 no hydrogen 2.913 N/A TYR 52.A N GLN 48.A O no hydrogen 2.995 N/A THR 53.A N VAL 49.A O no hydrogen 2.802 N/A THR 53.A OG1 VAL 49.A O no hydrogen 2.763 N/A VAL 54.A N LYS 50.A O no hydrogen 2.948 N/A GLU 55.A N GLN 51.A O no hydrogen 3.001 N/A ILE 56.A N TYR 52.A O no hydrogen 2.992 N/A ALA 57.A N THR 53.A O no hydrogen 2.969 N/A ARG 58.A N VAL 54.A O no hydrogen 2.962 N/A LYS 59.A N GLU 55.A O no hydrogen 3.219 N/A LYS 59.A NZ GLU 62.A OE2 no hydrogen 2.812 N/A LEU 60.A N ILE 56.A O no hydrogen 3.042 N/A MET 61.A N ALA 57.A O no hydrogen 3.010 N/A GLU 62.A N LYS 59.A O no hydrogen 3.207 N/A PHE 63.A N LEU 60.A O no hydrogen 2.942 N/A ILE 65.A N PHE 63.A O no hydrogen 2.880 N/A LYS 66.A N PRO 4.A O no hydrogen 3.003 N/A LYS 66.A NZ MET 1.A O no hydrogen 2.889 N/A LYS 66.A NZ GLU 28.A OE1 no hydrogen 3.569 N/A LYS 66.A NZ GLU 28.A OE2 no hydrogen 2.681 N/A LYS 66.A NZ GLU 224.A O no hydrogen 2.696 N/A LEU 68.A N SER 90.A O no hydrogen 2.845 N/A VAL 69.A N GLY 6.A O no hydrogen 2.724 N/A ILE 70.A N ILE 92.A O no hydrogen 2.825 N/A ALA 71.A N ILE 8.A O no hydrogen 2.958 N/A ASN 73.A ND2 SER 207.A OG no hydrogen 3.188 N/A THR 74.A OG1 THR 116.A OG1 no hydrogen 2.778 N/A THR 74.A OG1 THR 119.A OG1 no hydrogen 3.424 N/A THR 76.A N CYS 72.A O no hydrogen 2.876 N/A THR 76.A OG1 CYS 72.A O no hydrogen 2.723 N/A ALA 77.A N ASN 73.A O no hydrogen 3.086 N/A VAL 78.A N ALA 75.A O no hydrogen 3.220 N/A ALA 79.A N ALA 75.A O no hydrogen 2.871 N/A LEU 80.A N THR 76.A O no hydrogen 3.264 N/A LEU 83.A N ALA 79.A O no hydrogen 3.075 N/A GLN 84.A N LEU 80.A O no hydrogen 2.724 N/A GLN 84.A NE2 VAL 91.A O no hydrogen 3.144 N/A LYS 85.A N GLU 81.A O no hydrogen 3.103 N/A THR 86.A N TYR 82.A O no hydrogen 2.868 N/A THR 86.A OG1 TYR 82.A O no hydrogen 2.740 N/A LEU 87.A N LEU 83.A O no hydrogen 2.943 N/A ILE 92.A N LEU 68.A O no hydrogen 2.950 N/A ALA 99.A N ILE 95.A O no hydrogen 2.913 N/A ARG 100.A N GLU 96.A O no hydrogen 2.890 N/A ARG 100.A NE GLU 214.A OE1 no hydrogen 2.953 N/A ARG 100.A NE GLU 214.A OE2 no hydrogen 3.424 N/A ARG 100.A NH2 GLU 214.A OE2 no hydrogen 2.846 N/A THR 101.A N PRO 97.A O no hydrogen 3.160 N/A THR 101.A OG1 PRO 97.A O no hydrogen 2.951 N/A THR 101.A OG1 GLU 210.A OE1 no hydrogen 2.848 N/A ALA 102.A N GLY 98.A O no hydrogen 2.942 N/A ILE 103.A N ALA 99.A O no hydrogen 3.107 N/A MET 104.A N ARG 100.A O no hydrogen 3.155 N/A THR 105.A N THR 101.A O no hydrogen 2.888 N/A THR 105.A OG1 THR 101.A O no hydrogen 3.342 N/A THR 105.A OG1 ALA 102.A O no hydrogen 3.549 N/A THR 105.A OG1 THR 179.A OG1 no hydrogen 3.312 N/A THR 106.A N ALA 102.A O no hydrogen 2.909 N/A THR 106.A OG1 ASP 178.A OD1 no hydrogen 2.968 N/A ARG 107.A N ASP 178.A OD2 no hydrogen 2.827 N/A ASN 108.A N ASP 178.A OD2 no hydrogen 3.119 N/A ASN 108.A ND2 GLU 176.A O no hydrogen 2.802 N/A ASN 110.A N THR 106.A OG1 no hydrogen 3.355 N/A VAL 111.A N GLU 137.A O no hydrogen 2.856 N/A LEU 112.A N THR 179.A O no hydrogen 2.837 N/A VAL 113.A N HIS 139.A O no hydrogen 2.691 N/A LEU 114.A N ILE 181.A O no hydrogen 3.053 N/A GLY 115.A N VAL 141.A O no hydrogen 3.279 N/A THR 116.A OG1 THR 74.A OG1 no hydrogen 2.778 N/A THR 116.A OG1 THR 119.A OG1 no hydrogen 3.297 N/A GLY 118.A N GLY 42.A O no hydrogen 2.965 N/A THR 119.A N THR 116.A OG1 no hydrogen 3.256 N/A THR 119.A OG1 THR 74.A OG1 no hydrogen 3.424 N/A THR 119.A OG1 THR 116.A OG1 no hydrogen 3.297 N/A ILE 120.A N THR 116.A O no hydrogen 2.940 N/A LYS 121.A N GLU 117.A O no hydrogen 2.835 N/A LYS 121.A NZ GLU 117.A OE2 no hydrogen 3.038 N/A SER 122.A N GLY 118.A O no hydrogen 3.109 N/A SER 122.A N THR 119.A O no hydrogen 3.254 N/A SER 122.A OG THR 119.A O no hydrogen 2.711 N/A GLU 123.A N ILE 120.A O no hydrogen 3.108 N/A ALA 124.A N SER 122.A OG no hydrogen 3.123 N/A THR 127.A N GLU 123.A O no hydrogen 2.982 N/A THR 127.A OG1 GLU 123.A O no hydrogen 2.911 N/A HIS 128.A N ALA 124.A O no hydrogen 2.969 N/A ILE 129.A N TYR 125.A O no hydrogen 2.959 N/A LYS 130.A N ARG 126.A O no hydrogen 2.929 N/A LYS 130.A NZ PRO 134.A O no hydrogen 3.445 N/A LYS 130.A NZ VAL 136.A O no hydrogen 2.782 N/A ARG 131.A N THR 127.A O no hydrogen 3.095 N/A ILE 132.A N ILE 129.A O no hydrogen 3.186 N/A ASN 133.A N ILE 129.A O no hydrogen 2.773 N/A VAL 136.A N ASN 133.A O no hydrogen 3.278 N/A GLU 137.A N GLN 109.A O no hydrogen 2.738 N/A HIS 139.A N VAL 111.A O no hydrogen 3.045 N/A VAL 141.A N VAL 113.A O no hydrogen 2.757 N/A CYS 143.A N GLY 115.A O no hydrogen 2.860 N/A CYS 143.A SG VAL 141.A O no hydrogen 3.534 N/A PHE 146.A N CYS 143.A O no hydrogen 2.961 N/A LEU 149.A N GLY 145.A O no hydrogen 3.418 N/A VAL 150.A N PHE 146.A O no hydrogen 3.109 N/A GLU 151.A N VAL 147.A O no hydrogen 2.823 N/A GLN 152.A N PRO 148.A O no hydrogen 2.830 N/A GLN 152.A NE2 PRO 148.A O no hydrogen 3.696 N/A MET 153.A N VAL 150.A O no hydrogen 3.080 N/A ARG 154.A N LEU 149.A O no hydrogen 2.970 N/A ARG 154.A NH1 MET 153.A O no hydrogen 3.395 N/A THR 161.A N ASP 157.A O no hydrogen 3.307 N/A THR 161.A OG1 ASP 157.A O no hydrogen 3.294 N/A THR 161.A OG1 PRO 158.A O no hydrogen 3.341 N/A SER 162.A N PRO 158.A O no hydrogen 3.230 N/A SER 162.A OG PRO 158.A O no hydrogen 3.256 N/A SER 162.A OG THR 159.A O no hydrogen 2.780 N/A ILE 163.A N THR 159.A O no hydrogen 3.334 N/A VAL 164.A N ILE 160.A O no hydrogen 3.104 N/A ILE 165.A N THR 161.A O no hydrogen 2.859 N/A HIS 166.A N SER 162.A O no hydrogen 2.803 N/A GLN 167.A N ILE 163.A O no hydrogen 3.107 N/A THR 168.A N VAL 164.A O no hydrogen 3.324 N/A THR 168.A N ILE 165.A O no hydrogen 3.029 N/A THR 168.A OG1 VAL 164.A O no hydrogen 2.783 N/A LEU 169.A N ILE 165.A O no hydrogen 2.696 N/A LYS 170.A N HIS 166.A O no hydrogen 2.746 N/A LYS 170.A NZ GLN 167.A OE1 no hydrogen 2.566 N/A TRP 172.A N LEU 169.A O no hydrogen 2.790 N/A ARG 173.A N LYS 170.A O no hydrogen 3.303 N/A ARG 173.A NE TYR 197.A O no hydrogen 2.820 N/A ARG 173.A NH2 TYR 197.A O no hydrogen 3.272 N/A SER 175.A N TRP 172.A O no hydrogen 3.024 N/A SER 175.A OG TRP 172.A O no hydrogen 3.124 N/A SER 177.A OG ASN 110.A OD1 no hydrogen 2.877 N/A ASP 178.A N ASN 110.A O no hydrogen 3.276 N/A THR 179.A OG1 THR 105.A OG1 no hydrogen 3.312 N/A THR 179.A OG1 ASP 178.A OD1 no hydrogen 3.014 N/A VAL 180.A N THR 203.A O no hydrogen 2.763 N/A ILE 181.A N LEU 112.A O no hydrogen 2.763 N/A LEU 182.A N ILE 205.A O no hydrogen 2.807 N/A GLY 183.A N LEU 114.A O no hydrogen 2.804 N/A THR 185.A OG1 HIS 186.A ND1 no hydrogen 2.861 N/A HIS 186.A ND1 THR 185.A OG1 no hydrogen 2.861 N/A HIS 186.A NE2 GLU 151.A OE1 no hydrogen 2.679 N/A TYR 187.A N CYS 184.A O no hydrogen 3.355 N/A LEU 189.A N HIS 186.A O no hydrogen 3.104 N/A LEU 190.A N TYR 187.A O no hydrogen 2.769 N/A TYR 191.A N PRO 188.A O no hydrogen 2.981 N/A LYS 192.A NZ ASP 196.A OD2 no hydrogen 2.851 N/A ILE 194.A N LEU 190.A O no hydrogen 2.987 N/A TYR 195.A N TYR 191.A O no hydrogen 2.858 N/A ASP 196.A N LYS 192.A O no hydrogen 2.860 N/A TYR 197.A N PRO 193.A O no hydrogen 2.943 N/A PHE 198.A N ILE 194.A O no hydrogen 3.363 N/A GLY 199.A N ASP 196.A O no hydrogen 2.853 N/A GLY 200.A N TYR 195.A O no hydrogen 3.100 N/A LYS 201.A N PHE 198.A O no hydrogen 3.290 N/A LYS 202.A NZ SER 175.A O no hydrogen 2.875 N/A LYS 202.A NZ SER 175.A OG no hydrogen 3.315 N/A THR 203.A N ASP 178.A O no hydrogen 2.830 N/A ILE 205.A N VAL 180.A O no hydrogen 2.827 N/A SER 207.A OG LEU 182.A O no hydrogen 2.844 N/A GLU 210.A N SER 206.A O no hydrogen 3.323 N/A THR 211.A N SER 207.A O no hydrogen 2.893 N/A THR 211.A OG1 SER 207.A O no hydrogen 2.782 N/A ALA 212.A N GLY 208.A O no hydrogen 3.143 N/A ARG 213.A N LEU 209.A O no hydrogen 3.389 N/A GLU 214.A N GLU 210.A O no hydrogen 2.950 N/A VAL 215.A N THR 211.A O no hydrogen 2.729 N/A SER 216.A N ALA 212.A O no hydrogen 2.925 N/A ALA 217.A N ARG 213.A O no hydrogen 2.991 N/A LEU 218.A N GLU 214.A O no hydrogen 2.837 N/A LEU 219.A N VAL 215.A O no hydrogen 2.858 N/A THR 220.A N SER 216.A O no hydrogen 3.103 N/A THR 220.A OG1 SER 216.A O no hydrogen 3.217 N/A THR 220.A OG1 HIS 225.A NE2 no hydrogen 2.838 N/A PHE 221.A N ALA 217.A O no hydrogen 2.890 N/A SER 222.A N LEU 218.A O no hydrogen 3.053 N/A SER 222.A OG LEU 218.A O no hydrogen 2.833 N/A ASN 223.A N THR 220.A O no hydrogen 3.024 N/A GLU 224.A N LEU 219.A O no hydrogen 2.799 N/A HIS 225.A NE2 THR 220.A OG1 no hydrogen 2.838 N/A ALA 226.A N GLU 28.A OE1 no hydrogen 2.800 N/A SER 227.A N ASN 2.A OD1 no hydrogen 2.899 N/A TYR 228.A OH GLU 230.A OE2 no hydrogen 3.268 N/A THR 229.A N ASN 27.A OD1 no hydrogen 2.947 N/A THR 229.A OG1 ASN 27.A O no hydrogen 3.433 N/A THR 229.A OG1 SER 227.A O no hydrogen 2.920 N/A ARG 235.A N ILE 30.A O no hydrogen 2.943 N/A ARG 235.A NE GLU 260.A OE2 no hydrogen 3.043 N/A ARG 235.A NH2 GLU 260.A OE1 no hydrogen 2.580 N/A ARG 235.A NH2 GLU 260.A OE2 no hydrogen 3.365 N/A PHE 237.A N TYR 32.A O no hydrogen 2.742 N/A ALA 238.A N GLU 260.A O no hydrogen 3.027 N/A THR 239.A N GLY 34.A O no hydrogen 3.281 N/A THR 239.A OG1 ASP 35.A OD1 no hydrogen 2.784 N/A THR 243.A N ASP 241.A OD1 no hydrogen 2.775 N/A THR 243.A OG1 ASP 241.A OD1 no hydrogen 2.673 N/A HIS 244.A NE2 GLU 151.A O no hydrogen 3.165 N/A THR 246.A N THR 242.A O no hydrogen 2.977 N/A THR 246.A OG1 THR 242.A O no hydrogen 2.515 N/A ASN 247.A N THR 243.A O no hydrogen 3.156 N/A ILE 248.A N HIS 244.A O no hydrogen 2.943 N/A ILE 249.A N ILE 245.A O no hydrogen 2.945 N/A LYS 250.A N THR 246.A O no hydrogen 3.145 N/A GLU 251.A N ASN 247.A O no hydrogen 2.883 N/A TRP 252.A N ILE 248.A O no hydrogen 2.690 N/A TRP 252.A NE1 TYR 155.A OH no hydrogen 3.017 N/A LEU 253.A N ILE 249.A O no hydrogen 2.894 N/A GLU 260.A N PHE 236.A O no hydrogen 2.826 N/A ILE 262.A N ALA 238.A O no hydrogen 2.823 N/A ASP 266.A N VAL 264.A O no hydrogen 2.626 N/A