Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ljx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 9.A N ASP 1.A OD2 no hydrogen 2.985 N/A SER 11.A N ASP 1.A OD2 no hydrogen 2.907 N/A SER 11.A OG ASP 1.A OD2 no hydrogen 2.677 N/A LEU 12.A N CYS 9.A O no hydrogen 3.158 N/A THR 14.A OG1 ASP 43.A OD1 no hydrogen 3.271 N/A THR 14.A OG1 ASP 43.A OD2 no hydrogen 2.688 N/A SER 16.A N GLU 89.A OE1 no hydrogen 2.689 N/A SER 16.A OG GLU 89.A OE1 no hydrogen 2.955 N/A ALA 19.A N ALA 15.A O no hydrogen 2.747 N/A ALA 20.A N SER 16.A O no hydrogen 2.888 N/A ALA 21.A N ARG 17.A O no hydrogen 3.109 N/A ILE 22.A N THR 18.A O no hydrogen 2.836 N/A LEU 23.A N ALA 19.A O no hydrogen 2.808 N/A ASN 24.A N ALA 20.A O no hydrogen 2.926 N/A LEU 25.A N ALA 21.A O no hydrogen 3.119 N/A ALA 26.A N ILE 22.A O no hydrogen 2.759 N/A GLN 27.A N LEU 23.A O no hydrogen 2.893 N/A ARG 28.A N LEU 25.A O no hydrogen 2.994 N/A ARG 28.A NH1 ASP 30.A O no hydrogen 2.948 N/A ARG 28.A NH2 ASP 30.A O no hydrogen 3.531 N/A ALA 35.A N THR 32.A OG1 no hydrogen 2.897 N/A LEU 36.A N THR 32.A O no hydrogen 3.197 N/A ALA 37.A N ALA 33.A O no hydrogen 2.899 N/A GLN 38.A N GLU 34.A O no hydrogen 2.967 N/A LEU 39.A N ALA 35.A O no hydrogen 3.194 N/A ILE 40.A N LEU 36.A O no hydrogen 2.802 N/A GLN 41.A N ALA 37.A O no hydrogen 2.855 N/A THR 42.A N LEU 39.A O no hydrogen 3.160 N/A THR 42.A OG1 LEU 39.A O no hydrogen 2.628 N/A ASP 43.A N ILE 40.A O no hydrogen 2.914 N/A LEU 46.A N ASP 43.A OD2 no hydrogen 2.706 N/A THR 47.A N ASP 43.A O no hydrogen 3.021 N/A THR 47.A OG1 ILE 40.A O no hydrogen 3.107 N/A THR 47.A OG1 ASP 43.A O no hydrogen 2.762 N/A GLY 48.A N PRO 44.A O no hydrogen 2.971 N/A ARG 49.A N ALA 45.A O no hydrogen 3.131 N/A ARG 49.A NH1.B CYS 9.A O no hydrogen 3.187 N/A ARG 49.A NH1.B LEU 12.A O no hydrogen 3.425 N/A ILE 50.A N LEU 46.A O no hydrogen 3.063 N/A LEU 51.A N THR 47.A O no hydrogen 3.005 N/A ARG 52.A N GLY 48.A O no hydrogen 2.851 N/A ARG 52.A NH1 ASP 10.A OD1 no hydrogen 3.350 N/A PHE 53.A N ARG 49.A O no hydrogen 2.891 N/A ALA 54.A N ILE 50.A O no hydrogen 2.903 N/A ASN 55.A N LEU 51.A O no hydrogen 2.819 N/A ASN 55.A ND2 VAL 63.A O no hydrogen 2.948 N/A ASN 55.A ND2 TRP 182.A O no hydrogen 2.749 N/A ALA 56.A N PHE 53.A O no hydrogen 3.255 N/A THR 59.A N ARG 60.A O no hydrogen 2.587 N/A THR 59.A OG1 THR 59.A O no hydrogen 2.271 N/A VAL 63.A N ASN 55.A OD1 no hydrogen 2.757 N/A SER 65.A OG ASP 68.A OD2 no hydrogen 2.617 N/A ASP 68.A N SER 65.A OG no hydrogen 3.125 N/A ALA 69.A N SER 65.A O no hydrogen 2.896 N/A ILE 70.A N VAL 66.A O no hydrogen 2.910 N/A ASP 71.A N ILE 67.A O no hydrogen 3.069 N/A LEU 72.A N ASP 68.A O no hydrogen 2.996 N/A VAL 73.A N ALA 69.A O no hydrogen 2.803 N/A GLY 74.A N ILE 70.A O no hydrogen 2.758 N/A VAL 78.A N GLY 74.A O no hydrogen 3.324 N/A ARG 79.A N LEU 75.A O no hydrogen 2.787 N/A ARG 79.A NE ALA 26.A O no hydrogen 3.361 N/A GLN 80.A N PRO 76.A O no hydrogen 3.042 N/A ALA 82.A N VAL 78.A O no hydrogen 3.137 N/A LEU 83.A N ARG 79.A O no hydrogen 2.777 N/A SER 84.A N PHE 81.A O no hydrogen 3.129 N/A SER 84.A OG PHE 81.A O no hydrogen 2.530 N/A LEU 85.A N ALA 82.A O no hydrogen 3.389 N/A SER 86.A N LEU 83.A O no hydrogen 3.198 N/A SER 86.A OG LEU 83.A O no hydrogen 2.896 N/A LEU 87.A N SER 84.A O no hydrogen 3.014 N/A CYS 92.A N TYR 97.A OH no hydrogen 3.075 N/A CYS 92.A SG PRO 145.A O no hydrogen 3.379 N/A CYS 92.A SG SER 149.A OG no hydrogen 3.499 N/A ALA 94.A N SER 149.A OG no hydrogen 2.990 N/A PHE 95.A N CYS 92.A O no hydrogen 3.041 N/A ALA 99.A N ASP 96.A OD1 no hydrogen 2.998 N/A TYR 100.A N ASP 96.A O no hydrogen 2.896 N/A TRP 101.A N TYR 97.A O no hydrogen 2.851 N/A GLN 102.A N ALA 98.A O no hydrogen 2.863 N/A LYS 103.A N ALA 99.A O no hydrogen 2.869 N/A SER 104.A N TYR 100.A O no hydrogen 2.973 N/A SER 104.A OG TYR 100.A O no hydrogen 2.978 N/A LEU 105.A N TRP 101.A O no hydrogen 3.296 N/A ALA 106.A N GLN 102.A O no hydrogen 3.072 N/A ARG 107.A N LYS 103.A O no hydrogen 2.907 N/A ARG 107.A NE GLY 130.A O no hydrogen 2.789 N/A ARG 107.A NH1 GLN 217.A OE1 no hydrogen 2.945 N/A ARG 107.A NH2 GLY 130.A O no hydrogen 2.974 N/A ARG 107.A NH2 ASP 134.A OD1 no hydrogen 3.122 N/A ALA 108.A N SER 104.A O no hydrogen 2.956 N/A VAL 109.A N LEU 105.A O no hydrogen 2.787 N/A ALA 110.A N ALA 106.A O no hydrogen 2.865 N/A LEU 111.A N ARG 107.A O no hydrogen 2.859 N/A GLN 112.A N ALA 108.A O no hydrogen 2.984 N/A SER 113.A N VAL 109.A O no hydrogen 3.068 N/A ILE 114.A N ALA 110.A O no hydrogen 2.957 N/A THR 115.A N LEU 111.A O no hydrogen 2.883 N/A THR 115.A OG1 LEU 111.A O no hydrogen 2.978 N/A THR 115.A OG1 GLN 112.A O no hydrogen 3.098 N/A ALA 116.A N GLN 112.A O no hydrogen 2.841 N/A GLN 117.A N ILE 114.A O no hydrogen 3.122 N/A ALA 118.A N THR 115.A O no hydrogen 2.946 N/A THR 120.A OG1 GLN 212.A OE1 no hydrogen 2.713 N/A LYS 124.A NZ ASP 68.A OD1 no hydrogen 2.914 N/A LYS 124.A NZ ASP 68.A OD2 no hydrogen 3.440 N/A ALA 126.A N ALA 122.A O no hydrogen 2.887 N/A PHE 127.A N PRO 123.A O no hydrogen 2.742 N/A THR 128.A OG1 ALA 64.A O no hydrogen 2.808 N/A THR 128.A OG1 LYS 124.A O no hydrogen 3.131 N/A LEU 129.A N GLU 125.A O no hydrogen 3.090 N/A GLY 130.A N ALA 126.A O no hydrogen 2.869 N/A LEU 131.A N PHE 127.A O no hydrogen 2.822 N/A LEU 132.A N THR 128.A O no hydrogen 3.068 N/A LEU 132.A N LEU 129.A O no hydrogen 3.204 N/A ALA 133.A N GLY 130.A O no hydrogen 3.328 N/A VAL 135.A N LEU 132.A O no hydrogen 2.972 N/A GLY 136.A N THR 176.A OG1 no hydrogen 2.733 N/A ARG 137.A N ASP 134.A O no hydrogen 2.848 N/A ALA 139.A N VAL 135.A O no hydrogen 3.056 N/A LEU 140.A N GLY 136.A O no hydrogen 3.114 N/A ALA 141.A N ARG 137.A O no hydrogen 3.098 N/A THR 142.A N LEU 138.A O no hydrogen 2.890 N/A THR 142.A OG1 LEU 138.A O no hydrogen 2.708 N/A ALA 143.A N ALA 139.A O no hydrogen 2.848 N/A TRP 144.A N LEU 140.A O no hydrogen 2.868 N/A TYR 148.A N TRP 144.A O no hydrogen 2.683 N/A TYR 148.A OH GLU 164.A OE2 no hydrogen 2.689 N/A SER 149.A N PRO 145.A O no hydrogen 3.048 N/A SER 149.A OG PRO 145.A O no hydrogen 3.144 N/A GLU 150.A N GLU 146.A O no hydrogen 3.296 N/A CYS 151.A N GLU 147.A O no hydrogen 3.181 N/A CYS 151.A SG GLU 147.A O no hydrogen 3.606 N/A LEU 152.A N TYR 148.A O no hydrogen 2.837 N/A ARG 153.A N SER 149.A O no hydrogen 2.988 N/A LYS 154.A N GLU 150.A O no hydrogen 3.178 N/A LYS 154.A N CYS 151.A O no hydrogen 3.184 N/A ALA 155.A N CYS 151.A O no hydrogen 2.984 N/A LEU 160.A N ASP 156.A O no hydrogen 3.004 N/A ILE 161.A N GLY 157.A O no hydrogen 3.103 N/A ALA 162.A N GLU 158.A O no hydrogen 2.904 N/A LEU 163.A N ALA 159.A O no hydrogen 2.917 N/A GLU 164.A N LEU 160.A O no hydrogen 2.781 N/A ARG 165.A N ILE 161.A O no hydrogen 3.069 N/A ARG 165.A NE ASP 171.A OD2 no hydrogen 2.960 N/A ARG 165.A NH2 ASP 171.A OD2 no hydrogen 3.181 N/A GLU 166.A N ALA 162.A O no hydrogen 3.244 N/A ARG 167.A N LEU 163.A O no hydrogen 3.002 N/A ARG 167.A NE GLU 147.A OE1 no hydrogen 3.337 N/A ARG 167.A NH2 GLU 150.A OE1 no hydrogen 2.983 N/A PHE 168.A N GLU 164.A O no hydrogen 2.779 N/A ALA 169.A N ARG 165.A O no hydrogen 2.877 N/A THR 170.A OG1 ASP 171.A O no hydrogen 3.499 N/A THR 170.A OG1 GLU 174.A OE1 no hydrogen 2.733 N/A HIS 172.A N GLU 164.A OE1 no hydrogen 2.689 N/A GLU 174.A N ASP 171.A OD1 no hydrogen 2.689 N/A LEU 175.A N ASP 171.A O no hydrogen 2.810 N/A THR 176.A N HIS 172.A O no hydrogen 3.017 N/A THR 176.A OG1 HIS 172.A O no hydrogen 2.820 N/A ARG 177.A N ASP 173.A O no hydrogen 3.170 N/A LEU 179.A N THR 176.A O no hydrogen 2.773 N/A THR 180.A N ARG 177.A O no hydrogen 2.850 N/A THR 180.A OG1 ARG 177.A O no hydrogen 2.824 N/A TRP 182.A N LEU 178.A O no hydrogen 2.821 N/A GLY 183.A N THR 180.A O no hydrogen 3.206 N/A PHE 184.A N LEU 179.A O no hydrogen 3.060 N/A GLN 186.A NE2 ASP 190.A OD1 no hydrogen 3.377 N/A GLN 186.A NE2 ASP 190.A OD2 no hydrogen 2.840 N/A PHE 188.A N PRO 185.A O no hydrogen 3.116 N/A ASP 190.A N GLN 186.A O no hydrogen 2.779 N/A ALA 191.A N VAL 187.A O no hydrogen 2.872 N/A LEU 192.A N PHE 188.A O no hydrogen 2.967 N/A GLN 193.A N ILE 189.A O no hydrogen 2.866 N/A LEU 194.A N ASP 190.A O no hydrogen 2.831 N/A SER 195.A N ALA 191.A O no hydrogen 2.875 N/A SER 195.A OG LEU 192.A O no hydrogen 2.559 N/A GLN 196.A N GLN 193.A O no hydrogen 3.054 N/A GLN 197.A N LEU 194.A O no hydrogen 3.074 N/A ILE 200.A N GLU 234.A OE2 no hydrogen 3.010 N/A ARG 201.A NE GLU 199.A OE2 no hydrogen 2.865 N/A ARG 205.A NH1 THR 120.A O no hydrogen 2.743 N/A ARG 208.A N GLY 204.A O no hydrogen 2.971 N/A PHE 209.A N ARG 205.A O no hydrogen 2.834 N/A ALA 210.A N THR 206.A O no hydrogen 2.903 N/A ARG 211.A N GLY 207.A O no hydrogen 2.936 N/A ARG 211.A NH1 ILE 200.A O no hydrogen 2.752 N/A ARG 211.A NH1 ASP 202.A O no hydrogen 2.921 N/A ARG 211.A NH2 ASP 202.A O no hydrogen 3.067 N/A GLN 212.A N ARG 208.A O no hydrogen 2.986 N/A LEU 213.A N PHE 209.A O no hydrogen 2.851 N/A ALA 214.A N ALA 210.A O no hydrogen 2.830 N/A LEU 215.A N ARG 211.A O no hydrogen 2.967 N/A ALA 216.A N GLN 212.A O no hydrogen 3.009 N/A GLN 217.A N LEU 213.A O no hydrogen 2.908 N/A GLN 217.A NE2 ASP 221.A OD2 no hydrogen 2.975 N/A HIS 218.A N ALA 214.A O no hydrogen 2.906 N/A HIS 218.A ND1 ALA 214.A O no hydrogen 2.733 N/A ILE 219.A N LEU 215.A O no hydrogen 2.911 N/A ALA 220.A N ALA 216.A O no hydrogen 3.057 N/A ASP 221.A N GLN 217.A O no hydrogen 2.891 N/A HIS 222.A N HIS 218.A O no hydrogen 2.898 N/A HIS 222.A N ILE 219.A O no hydrogen 3.221 N/A ARG 223.A N ILE 219.A O no hydrogen 3.153 N/A ARG 223.A NE LEU 245.A O no hydrogen 2.295 N/A ARG 223.A NH2 LEU 245.A O no hydrogen 2.418 N/A LEU 224.A N ALA 220.A O no hydrogen 3.170 N/A ALA 225.A N HIS 222.A O no hydrogen 3.231 N/A LEU 231.A N SER 228.A OG no hydrogen 3.255 N/A ARG 232.A N SER 228.A O no hydrogen 2.988 N/A ALA 233.A N PRO 229.A O no hydrogen 2.801 N/A GLU 234.A N LEU 230.A O no hydrogen 2.822 N/A ALA 235.A N LEU 231.A O no hydrogen 2.648 N/A ARG 236.A N ARG 232.A O no hydrogen 2.777 N/A ARG 237.A N ALA 233.A O no hydrogen 2.967 N/A ARG 237.A NH1 ARG 201.A O no hydrogen 3.448 N/A ARG 237.A NH2 ARG 201.A O no hydrogen 3.221 N/A CYS 238.A N GLU 234.A O no hydrogen 3.065 N/A CYS 238.A SG GLU 234.A O no hydrogen 3.241 N/A CYS 238.A SG ALA 235.A O no hydrogen 3.887 N/A GLY 239.A N ALA 235.A O no hydrogen 3.052 N/A GLY 239.A N ARG 236.A O no hydrogen 2.844 N/A ALA 246.A N GLU 243.A O no hydrogen 3.211 N/A ARG 247.A NH1 ARG 247.A O no hydrogen 3.046 N/A