Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jay_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N HIS 25.A ND1 no hydrogen 2.999 N/A ARG 2.A N ASP 66.A OD2 no hydrogen 3.426 N/A VAL 3.A N GLU 26.A O no hydrogen 2.840 N/A ALA 4.A N ILE 67.A O no hydrogen 2.915 N/A LEU 5.A N VAL 28.A O no hydrogen 2.850 N/A LEU 6.A N VAL 69.A O no hydrogen 2.924 N/A GLY 7.A N ASN 58.A OD1 no hydrogen 3.209 N/A GLY 8.A N GLY 30.A O no hydrogen 3.052 N/A GLY 10.A N GLY 7.A O no hydrogen 3.338 N/A LYS 14.A N GLY 10.A O no hydrogen 3.079 N/A LEU 16.A N LEU 12.A O no hydrogen 3.122 N/A ALA 17.A N GLY 13.A O no hydrogen 2.924 N/A LEU 18.A N LYS 14.A O no hydrogen 2.924 N/A ARG 19.A N GLY 15.A O no hydrogen 2.956 N/A ARG 19.A NE PHE 140.A O no hydrogen 2.848 N/A ARG 19.A NH2 PHE 140.A O no hydrogen 2.935 N/A LEU 20.A N LEU 16.A O no hydrogen 2.930 N/A ALA 21.A N ALA 17.A O no hydrogen 2.900 N/A THR 22.A N LEU 18.A O no hydrogen 3.300 N/A THR 22.A OG1 LEU 18.A O no hydrogen 3.375 N/A THR 22.A OG1 ARG 19.A O no hydrogen 3.266 N/A LEU 23.A N LEU 20.A O no hydrogen 3.162 N/A GLY 24.A N ALA 21.A O no hydrogen 2.868 N/A HIS 25.A N LEU 20.A O no hydrogen 3.212 N/A HIS 25.A NE2 GLU 170.A OE1 no hydrogen 2.929 N/A GLU 26.A N MET 1.A O no hydrogen 3.132 N/A ILE 27.A N SER 52.A O no hydrogen 3.041 N/A VAL 28.A N VAL 3.A O no hydrogen 2.849 N/A VAL 29.A N THR 54.A O no hydrogen 2.769 N/A GLY 30.A N LEU 5.A O no hydrogen 2.854 N/A SER 31.A N MET 56.A O no hydrogen 3.154 N/A SER 31.A OG ARG 33.A O no hydrogen 3.150 N/A ARG 33.A N SER 31.A OG no hydrogen 3.010 N/A GLU 35.A N GLU 35.A OE1 no hydrogen 2.695 N/A LYS 36.A N ARG 33.A O no hydrogen 3.070 N/A ALA 37.A N ARG 33.A O no hydrogen 3.112 N/A GLU 38.A N GLU 34.A O no hydrogen 2.918 N/A ALA 39.A N GLU 35.A O no hydrogen 2.972 N/A LYS 40.A N LYS 36.A O no hydrogen 2.948 N/A LYS 40.A NZ GLU 43.A OE1 no hydrogen 3.374 N/A LYS 40.A NZ GLU 43.A OE2 no hydrogen 3.256 N/A ALA 41.A N ALA 37.A O no hydrogen 2.829 N/A ALA 42.A N GLU 38.A O no hydrogen 2.944 N/A GLU 43.A N ALA 39.A O no hydrogen 3.002 N/A TYR 44.A N LYS 40.A O no hydrogen 2.805 N/A TYR 44.A OH GLY 8.A O no hydrogen 2.690 N/A ARG 45.A N ALA 41.A O no hydrogen 2.920 N/A ARG 45.A NH1 ILE 53.A O no hydrogen 2.902 N/A ARG 46.A N ALA 42.A O no hydrogen 3.077 N/A ILE 47.A N GLU 43.A O no hydrogen 3.173 N/A ALA 48.A N TYR 44.A O no hydrogen 2.910 N/A GLY 49.A N ARG 45.A O no hydrogen 3.050 N/A SER 52.A OG GLU 26.A OE1 no hydrogen 3.348 N/A THR 54.A N ILE 27.A O no hydrogen 2.978 N/A MET 56.A N VAL 29.A O no hydrogen 2.957 N/A ASN 58.A N SER 31.A O no hydrogen 2.814 N/A ALA 61.A N LYS 57.A O no hydrogen 2.927 N/A ALA 62.A N ASN 58.A O no hydrogen 2.855 N/A GLU 63.A N GLU 59.A O no hydrogen 3.118 N/A ALA 64.A N ASP 60.A O no hydrogen 2.974 N/A CYS 65.A N ALA 61.A O no hydrogen 3.169 N/A CYS 65.A SG ALA 62.A O no hydrogen 3.328 N/A CYS 65.A SG ILE 67.A O no hydrogen 3.411 N/A ASP 66.A N ARG 2.A O no hydrogen 2.962 N/A ILE 67.A N ARG 2.A O no hydrogen 3.345 N/A ALA 68.A N ILE 92.A O no hydrogen 2.838 N/A VAL 69.A N ALA 4.A O no hydrogen 2.781 N/A LEU 70.A N VAL 94.A O no hydrogen 3.034 N/A THR 71.A N LEU 6.A O no hydrogen 3.009 N/A THR 71.A N VAL 69.A O no hydrogen 3.131 N/A THR 71.A OG1 LEU 6.A O no hydrogen 2.832 N/A ALA 77.A N PRO 73.A O no hydrogen 2.872 N/A ILE 78.A N TRP 74.A O no hydrogen 3.160 N/A THR 80.A N HIS 76.A O no hydrogen 3.004 N/A THR 80.A OG1 HIS 76.A O no hydrogen 3.271 N/A ALA 81.A N ALA 77.A O no hydrogen 2.866 N/A ARG 82.A N.A ILE 78.A O no hydrogen 2.996 N/A ARG 82.A N.B ILE 78.A O no hydrogen 3.013 N/A ARG 82.A NH1.A ASP 79.A OD1 no hydrogen 2.511 N/A ARG 82.A NH1.B ASP 79.A OD1 no hydrogen 3.120 N/A ARG 82.A NH2.A ASP 79.A OD1 no hydrogen 3.036 N/A ASP 83.A N ASP 79.A O no hydrogen 2.939 N/A LEU 84.A N THR 80.A O no hydrogen 3.025 N/A LYS 85.A N ARG 82.A O.A no hydrogen 3.211 N/A LYS 85.A N ARG 82.A O.B no hydrogen 3.163 N/A ILE 87.A N LEU 84.A O no hydrogen 3.020 N/A LEU 88.A N LEU 84.A O no hydrogen 2.821 N/A ARG 89.A N LYS 85.A O no hydrogen 2.837 N/A ARG 89.A NE LEU 123.A O no hydrogen 3.207 N/A ARG 89.A NH1 GLU 90.A OE2 no hydrogen 3.455 N/A ARG 89.A NH2 ASN 86.A OD1 no hydrogen 2.673 N/A LYS 91.A N LEU 88.A O no hydrogen 3.041 N/A LYS 91.A NZ GLU 63.A O no hydrogen 3.566 N/A LYS 91.A NZ CYS 65.A O no hydrogen 2.848 N/A ILE 92.A N ASP 66.A O no hydrogen 3.320 N/A VAL 93.A N LYS 127.A O no hydrogen 3.172 N/A VAL 94.A N ALA 68.A O no hydrogen 2.766 N/A SER 95.A N VAL 129.A O no hydrogen 2.817 N/A SER 101.A N THR 108.A O no hydrogen 2.955 N/A GLY 106.A N GLY 103.A O no hydrogen 3.156 N/A PHE 107.A N ASN 197.A OD1 no hydrogen 2.785 N/A THR 108.A N SER 101.A O no hydrogen 2.853 N/A TYR 109.A OH GLU 189.A OE1 no hydrogen 2.599 N/A SER 110.A N PRO 99.A O no hydrogen 2.878 N/A SER 111.A OG ARG 113.A O no hydrogen 2.595 N/A GLU 112.A N GLU 112.A OE1 no hydrogen 2.708 N/A ARG 113.A N SER 111.A OG no hydrogen 3.292 N/A ARG 113.A NH1 GLU 121.A OE1 no hydrogen 3.490 N/A ARG 113.A NH1 GLU 121.A OE2 no hydrogen 2.753 N/A ARG 113.A NH2 GLU 121.A OE1 no hydrogen 3.274 N/A SER 114.A OG GLU 117.A OE2 no hydrogen 2.738 N/A ALA 115.A N GLU 189.A OE1 no hydrogen 2.938 N/A ALA 116.A N GLU 189.A OE2 no hydrogen 3.021 N/A GLU 117.A N SER 114.A OG no hydrogen 3.070 N/A ILE 118.A N SER 114.A O no hydrogen 3.025 N/A VAL 119.A N ALA 115.A O no hydrogen 2.933 N/A ALA 120.A N ALA 116.A O no hydrogen 2.943 N/A GLU 121.A N GLU 117.A O no hydrogen 3.017 N/A VAL 122.A N ILE 118.A O no hydrogen 2.981 N/A LEU 123.A N VAL 119.A O no hydrogen 2.913 N/A GLU 124.A N GLU 121.A O no hydrogen 3.220 N/A SER 125.A N ALA 120.A O no hydrogen 3.095 N/A SER 125.A OG ARG 89.A O no hydrogen 3.476 N/A LYS 127.A N SER 125.A OG no hydrogen 2.880 N/A LYS 127.A NZ GLU 90.A O no hydrogen 3.519 N/A VAL 129.A N VAL 93.A O no hydrogen 2.877 N/A SER 130.A N CYS 154.A O.A no hydrogen 2.841 N/A SER 130.A N CYS 154.A O.B no hydrogen 2.797 N/A SER 130.A OG SER 185.A OG.A no hydrogen 2.773 N/A SER 130.A OG SER 185.A OG.B no hydrogen 3.338 N/A ALA 131.A N SER 95.A O no hydrogen 2.942 N/A ILE 135.A N LEU 132.A O no hydrogen 3.388 N/A ARG 139.A N GLU 206.A OE2 no hydrogen 3.191 N/A ARG 139.A NE GLU 145.A OE1 no hydrogen 3.101 N/A ARG 139.A NH1 GLU 206.A O no hydrogen 2.891 N/A ARG 139.A NH2 GLU 145.A OE2 no hydrogen 2.723 N/A ARG 139.A NH2 LYS 146.A O no hydrogen 3.521 N/A PHE 140.A N PRO 136.A O no hydrogen 2.987 N/A ALA 141.A N ALA 137.A O no hydrogen 2.929 N/A ASN 142.A N ARG 139.A O no hydrogen 3.174 N/A GLU 145.A N ASN 142.A O no hydrogen 2.909 N/A TRP 149.A N GLY 173.A O no hydrogen 2.815 N/A ASP 150.A N ILE 209.A O.A no hydrogen 2.848 N/A ASP 150.A N ILE 209.A O.B no hydrogen 2.849 N/A VAL 151.A N ARG 175.A O no hydrogen 2.856 N/A VAL 153.A N LEU 177.A O no hydrogen 2.811 N/A CYS 154.A N.A SER 130.A O no hydrogen 3.011 N/A CYS 154.A N.B SER 130.A O no hydrogen 3.064 N/A CYS 154.A SG.B SER 185.A OG.B no hydrogen 2.844 N/A GLY 155.A N GLY 180.A O no hydrogen 2.968 N/A SER 160.A N ASP 157.A OD1 no hydrogen 2.924 N/A SER 160.A OG ASP 157.A OD1 no hydrogen 2.642 N/A LYS 161.A N ASP 157.A O no hydrogen 2.944 N/A LYS 161.A NZ GLY 155.A O no hydrogen 3.144 N/A LYS 161.A NZ ASP 178.A OD1 no hydrogen 2.708 N/A LYS 161.A NZ ASP 178.A OD2 no hydrogen 3.485 N/A LYS 161.A NZ GLY 180.A O no hydrogen 2.822 N/A LYS 162.A N ASP 158.A O no hydrogen 2.968 N/A VAL 163.A N GLU 159.A O no hydrogen 2.976 N/A VAL 164.A N SER 160.A O no hydrogen 3.031 N/A MET 165.A N LYS 161.A O no hydrogen 2.814 N/A SER 166.A N LYS 162.A O no hydrogen 2.926 N/A LEU 167.A N VAL 163.A O no hydrogen 3.005 N/A ILE 168.A N VAL 164.A O no hydrogen 2.972 N/A SER 169.A N MET 165.A O no hydrogen 2.893 N/A GLU 170.A N SER 166.A O no hydrogen 3.244 N/A GLU 170.A N LEU 167.A O no hydrogen 3.163 N/A ILE 171.A N ILE 168.A O no hydrogen 3.043 N/A LEU 174.A N ILE 171.A O no hydrogen 3.102 N/A ARG 175.A N TRP 149.A O no hydrogen 2.995 N/A ARG 175.A NE ASP 150.A OD1 no hydrogen 2.845 N/A ARG 175.A NH2 ASP 150.A OD1 no hydrogen 3.358 N/A ARG 175.A NH2 ASP 150.A OD2 no hydrogen 2.785 N/A ARG 175.A NH2 PHE 211.A O no hydrogen 3.047 N/A LEU 177.A N VAL 151.A O no hydrogen 2.944 N/A ALA 179.A N VAL 153.A O no hydrogen 2.810 N/A GLY 180.A N ASP 178.A OD1 no hydrogen 2.791 N/A LEU 182.A N ASP 156.A OD1 no hydrogen 2.872 N/A ASN 184.A N PRO 181.A O no hydrogen 2.908 N/A ASN 184.A ND2 ALA 179.A O no hydrogen 2.845 N/A SER 185.A N.A LEU 182.A O no hydrogen 2.871 N/A SER 185.A N.B LEU 182.A O no hydrogen 2.871 N/A SER 185.A OG.A SER 130.A OG no hydrogen 2.773 N/A SER 185.A OG.A GLU 189.A OE2 no hydrogen 2.778 N/A SER 185.A OG.B LEU 182.A O no hydrogen 3.083 N/A VAL 188.A N ASN 184.A O no hydrogen 3.285 N/A GLU 189.A N SER 185.A O.A no hydrogen 2.801 N/A GLU 189.A N SER 185.A O.B no hydrogen 2.803 N/A SER 190.A N ARG 186.A O no hydrogen 2.912 N/A SER 190.A OG ARG 186.A O no hydrogen 2.726 N/A LEU 191.A N VAL 188.A O no hydrogen 3.035 N/A THR 192.A N GLU 189.A O no hydrogen 3.208 N/A THR 192.A OG1 HIS 133.A O no hydrogen 2.735 N/A LEU 194.A N SER 190.A O no hydrogen 3.398 N/A ILE 195.A N LEU 191.A O no hydrogen 2.880 N/A LEU 196.A N THR 192.A O no hydrogen 2.828 N/A ASN 197.A N PRO 193.A O no hydrogen 2.993 N/A ASN 197.A ND2 PHE 107.A O no hydrogen 2.986 N/A ILE 198.A N LEU 194.A O no hydrogen 2.959 N/A MET 199.A N ILE 195.A O no hydrogen 2.901 N/A ARG 200.A N LEU 196.A O no hydrogen 2.981 N/A ARG 200.A NH1 GLY 103.A O no hydrogen 3.046 N/A ARG 200.A NH2 ALA 104.A O no hydrogen 2.759 N/A PHE 201.A N ASN 197.A O no hydrogen 2.828 N/A ASN 202.A N ILE 198.A O no hydrogen 3.121 N/A ASN 202.A ND2 ILE 198.A O no hydrogen 2.864 N/A MET 204.A N MET 199.A O no hydrogen 3.031 N/A LYS 210.A NZ ASP 148.A OD2 no hydrogen 3.129 N/A LYS 210.A NZ ASP 150.A OD1 no hydrogen 2.808 N/A PHE 211.A N ASP 150.A OD2 no hydrogen 2.697 N/A