Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q0j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N GLU 35.A OE2 no hydrogen 3.065 N/A THR 5.A N GLU 35.A OE1 no hydrogen 2.752 N/A THR 5.A OG1 GLU 35.A OE1 no hydrogen 2.834 N/A LEU 7.A N THR 18.A O no hydrogen 2.889 N/A GLU 9.A N ILE 16.A O no hydrogen 2.946 N/A ARG 10.A NE ASP 46.A OD1 no hydrogen 3.540 N/A ARG 10.A NH2 GLU 42.A OE1 no hydrogen 2.506 N/A ASP 11.A N VAL 14.A O no hydrogen 2.887 N/A ARG 13.A NE SER 197.A O no hydrogen 2.847 N/A ARG 13.A NH1 PRO 47.A O no hydrogen 2.930 N/A VAL 14.A N ASP 11.A O no hydrogen 2.975 N/A GLY 15.A N ALA 51.A O no hydrogen 2.923 N/A ILE 16.A N GLU 9.A O no hydrogen 2.737 N/A ILE 17.A N ILE 53.A O no hydrogen 2.705 N/A THR 18.A N LEU 7.A O no hydrogen 2.821 N/A LEU 19.A N THR 55.A O no hydrogen 2.833 N/A ASN 20.A N THR 5.A O no hydrogen 2.696 N/A ARG 21.A N ASN 26.A OD1 no hydrogen 3.009 N/A ARG 21.A NH1 ALA 27.A O no hydrogen 2.628 N/A ARG 21.A NH1 ASP 66.A OD2 no hydrogen 2.949 N/A ARG 21.A NH2 ASP 66.A OD2 no hydrogen 3.030 N/A ALA 24.A N ARG 21.A O no hydrogen 3.000 N/A LEU 25.A N PRO 22.A O no hydrogen 3.191 N/A ASN 26.A N ARG 21.A O no hydrogen 2.894 N/A ASN 26.A ND2 SER 57.A OG.B no hydrogen 3.350 N/A ASN 26.A ND2 ALA 60.A O no hydrogen 2.731 N/A ASN 26.A ND2 PHE 61.A O no hydrogen 3.642 N/A ALA 27.A N ALA 24.A O no hydrogen 3.111 N/A LEU 28.A N GLY 64.A O no hydrogen 2.827 N/A SER 30.A N GLU 69.A OE1 no hydrogen 3.159 N/A SER 30.A N GLU 69.A OE2 no hydrogen 3.219 N/A SER 30.A OG GLU 69.A OE1 no hydrogen 3.288 N/A VAL 32.A N ASN 29.A OD1 no hydrogen 2.878 N/A MET 33.A N ASN 29.A O no hydrogen 3.001 N/A ASN 34.A N SER 30.A O no hydrogen 2.858 N/A GLU 35.A N GLN 31.A O no hydrogen 2.784 N/A VAL 36.A N VAL 32.A O no hydrogen 2.778 N/A THR 37.A N MET 33.A O no hydrogen 3.166 N/A THR 37.A OG1 MET 33.A O no hydrogen 2.807 N/A THR 37.A OG1 ASN 34.A O no hydrogen 3.172 N/A SER 38.A N ASN 34.A O no hydrogen 2.939 N/A SER 38.A OG ASN 34.A O no hydrogen 2.987 N/A ALA 39.A N GLU 35.A O no hydrogen 2.772 N/A ALA 40.A N VAL 36.A O no hydrogen 2.813 N/A THR 41.A N THR 37.A O no hydrogen 3.031 N/A THR 41.A OG1 THR 37.A O no hydrogen 2.716 N/A GLU 42.A N SER 38.A O no hydrogen 3.177 N/A LEU 43.A N ALA 39.A O no hydrogen 2.956 N/A ASP 44.A N ALA 40.A O no hydrogen 2.808 N/A ASP 45.A N THR 41.A O no hydrogen 3.024 N/A ASP 45.A N GLU 42.A O no hydrogen 3.276 N/A ASP 46.A N LEU 43.A O no hydrogen 3.250 N/A ASP 48.A N ASP 46.A OD2 no hydrogen 3.026 N/A ILE 49.A N ASP 46.A O no hydrogen 3.035 N/A GLY 50.A N ARG 13.A O no hydrogen 2.715 N/A ALA 51.A N ARG 13.A O no hydrogen 3.296 N/A ILE 52.A N PRO 96.A O no hydrogen 3.017 N/A ILE 53.A N GLY 15.A O no hydrogen 2.814 N/A ILE 54.A N ILE 98.A O no hydrogen 2.808 N/A THR 55.A N ILE 17.A O no hydrogen 2.921 N/A THR 55.A OG1 ALA 100.A O no hydrogen 2.587 N/A SER 57.A N ALA 60.A O no hydrogen 2.902 N/A SER 57.A OG.A ALA 60.A O no hydrogen 3.135 N/A LYS 59.A N SER 57.A OG.A no hydrogen 3.138 N/A ALA 60.A N SER 57.A OG.A no hydrogen 2.918 N/A PHE 61.A N ALA 102.A O no hydrogen 2.969 N/A ALA 62.A N TYR 104.A O no hydrogen 2.922 N/A ALA 63.A N LEU 25.A O no hydrogen 3.101 N/A ASP 66.A N LEU 28.A O no hydrogen 2.910 N/A MET 70.A N ILE 67.A O no hydrogen 3.247 N/A ALA 71.A N ILE 67.A O no hydrogen 3.056 N/A LEU 73.A N MET 70.A O no hydrogen 3.393 N/A THR 74.A N ASP 77.A OD2 no hydrogen 3.320 N/A ASP 77.A N THR 74.A OG1 no hydrogen 3.190 N/A ALA 78.A N THR 74.A O no hydrogen 3.015 N/A PHE 79.A N PHE 75.A O no hydrogen 2.793 N/A THR 80.A N ALA 76.A O no hydrogen 3.072 N/A THR 80.A OG1 ALA 76.A O no hydrogen 3.421 N/A ALA 81.A N ASP 77.A O no hydrogen 3.042 N/A ASP 82.A N PHE 79.A O no hydrogen 3.196 N/A PHE 83.A N ALA 78.A O no hydrogen 2.985 N/A ALA 85.A N ASP 82.A O no hydrogen 2.935 N/A TRP 87.A N PHE 84.A O no hydrogen 2.991 N/A GLY 88.A N ALA 85.A O no hydrogen 2.909 N/A LYS 89.A N THR 86.A O no hydrogen 2.964 N/A LEU 90.A N TRP 87.A O no hydrogen 3.087 N/A ALA 92.A N GLY 88.A O no hydrogen 3.237 N/A VAL 93.A N LEU 90.A O no hydrogen 2.977 N/A ARG 94.A N ASP 44.A OD1 no hydrogen 3.174 N/A ARG 94.A N ASP 44.A OD2 no hydrogen 2.899 N/A THR 95.A N ASP 44.A OD1 no hydrogen 2.850 N/A THR 95.A OG1 ASP 44.A OD1 no hydrogen 3.031 N/A THR 97.A N ASP 117.A OD2 no hydrogen 2.752 N/A THR 97.A OG1 ASP 117.A OD2 no hydrogen 3.099 N/A ILE 98.A N ILE 52.A O no hydrogen 2.692 N/A ALA 99.A N VAL 118.A O no hydrogen 2.829 N/A ALA 100.A N ILE 54.A O no hydrogen 2.971 N/A VAL 101.A N ILE 120.A O no hydrogen 2.792 N/A GLY 103.A N THR 124.A OG1 no hydrogen 3.193 N/A TYR 104.A N LYS 59.A O no hydrogen 2.996 N/A ALA 105.A N LYS 126.A O no hydrogen 2.857 N/A LEU 106.A N ALA 62.A O no hydrogen 3.078 N/A GLY 107.A N GLY 128.A O no hydrogen 2.932 N/A GLY 109.A N LEU 106.A O no hydrogen 2.822 N/A CYS 110.A SG GLN 129.A OE1 no hydrogen 3.395 N/A GLU 111.A N GLY 107.A O no hydrogen 3.113 N/A LEU 112.A N GLY 108.A O no hydrogen 2.707 N/A ALA 113.A N GLY 109.A O no hydrogen 3.032 N/A MET 114.A N CYS 110.A O no hydrogen 3.029 N/A MET 115.A N GLU 111.A O no hydrogen 3.092 N/A MET 115.A N LEU 112.A O no hydrogen 3.192 N/A CYS 116.A N ALA 113.A O no hydrogen 3.234 N/A CYS 116.A SG LEU 112.A O no hydrogen 3.789 N/A ASP 117.A N THR 97.A O no hydrogen 3.122 N/A ASP 117.A N THR 97.A OG1 no hydrogen 3.177 N/A VAL 118.A N THR 97.A O no hydrogen 3.027 N/A LEU 119.A N SER 177.A OG no hydrogen 2.996 N/A ILE 120.A N ALA 99.A O no hydrogen 2.839 N/A ALA 121.A N ARG 178.A O no hydrogen 2.916 N/A ALA 122.A N VAL 101.A O no hydrogen 2.842 N/A ASP 123.A N VAL 180.A O no hydrogen 2.781 N/A ALA 125.A N ALA 122.A O no hydrogen 2.960 N/A LYS 126.A N GLY 103.A O no hydrogen 2.731 N/A PHE 127.A N MET 165.A O no hydrogen 2.885 N/A GLN 129.A NE2 GLY 107.A O no hydrogen 3.530 N/A GLN 129.A NE2 GLU 131.A OE1 no hydrogen 2.957 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.929 N/A LYS 133.A N PRO 130.A O no hydrogen 3.099 N/A LYS 133.A NZ THR 161.A O no hydrogen 3.250 N/A LEU 134.A N GLU 131.A O no hydrogen 2.942 N/A GLY 135.A N ILE 132.A O no hydrogen 3.028 N/A VAL 136.A N GLU 131.A O no hydrogen 3.325 N/A MET 140.A N GLU 111.A OE2 no hydrogen 2.809 N/A GLY 142.A N GLU 111.A OE2 no hydrogen 2.747 N/A GLN 144.A N GLY 141.A O no hydrogen 2.859 N/A GLN 144.A NE2 SER 143.A OG no hydrogen 2.978 N/A ARG 145.A N GLY 141.A O no hydrogen 2.797 N/A LEU 146.A N GLY 142.A O no hydrogen 3.008 N/A THR 147.A OG1 SER 143.A O no hydrogen 2.707 N/A ARG 148.A N GLN 144.A O no hydrogen 3.293 N/A ARG 148.A NH1 GLN 144.A O no hydrogen 3.310 N/A ARG 148.A NH1 GLN 144.A OE1 no hydrogen 2.912 N/A ALA 149.A N ARG 145.A O no hydrogen 2.986 N/A ILE 150.A N LEU 146.A O no hydrogen 2.914 N/A GLY 151.A N THR 147.A O no hydrogen 2.973 N/A LYS 154.A NZ GLU 169.A OE2 no hydrogen 3.285 N/A ALA 155.A N GLY 151.A O no hydrogen 3.119 N/A MET 156.A N LYS 152.A O no hydrogen 2.805 N/A ASP 157.A N ALA 153.A O no hydrogen 3.173 N/A LEU 158.A N LYS 154.A O no hydrogen 2.938 N/A ILE 159.A N ALA 155.A O no hydrogen 2.869 N/A LEU 160.A N MET 156.A O no hydrogen 2.906 N/A THR 161.A N ASP 157.A O no hydrogen 2.955 N/A THR 161.A OG1 ASP 157.A O no hydrogen 2.848 N/A THR 161.A OG1 ASP 157.A OD1 no hydrogen 3.534 N/A GLY 162.A N LEU 158.A O no hydrogen 2.847 N/A ARG 163.A N THR 161.A OG1 no hydrogen 3.201 N/A ARG 163.A NE ASP 157.A OD2 no hydrogen 2.577 N/A ARG 163.A NH1 THR 164.A O no hydrogen 3.265 N/A ARG 163.A NH1 GLU 169.A OE1 no hydrogen 3.005 N/A ARG 163.A NH1 GLU 169.A OE2 no hydrogen 3.342 N/A ARG 163.A NH2 ASP 157.A OD2 no hydrogen 3.248 N/A ARG 163.A NH2 GLU 169.A OE2 no hydrogen 2.936 N/A MET 165.A N PHE 127.A O no hydrogen 2.801 N/A GLU 169.A N ASP 166.A OD1 no hydrogen 2.975 N/A ALA 170.A N ASP 166.A O no hydrogen 3.095 N/A GLU 171.A N ALA 167.A O no hydrogen 3.000 N/A ARG 172.A N ALA 168.A O no hydrogen 3.202 N/A SER 173.A N GLU 169.A O no hydrogen 2.922 N/A SER 173.A OG GLU 169.A O no hydrogen 2.779 N/A GLY 174.A N ALA 170.A O no hydrogen 3.262 N/A LEU 175.A N ALA 170.A O no hydrogen 2.883 N/A VAL 176.A N ALA 170.A O no hydrogen 3.401 N/A SER 177.A N LEU 119.A O no hydrogen 2.761 N/A ARG 178.A N LEU 119.A O no hydrogen 3.447 N/A ARG 178.A NH2 THR 192.A OG1 no hydrogen 2.823 N/A VAL 180.A N ALA 121.A O no hydrogen 2.895 N/A ALA 182.A N ASP 123.A OD2 no hydrogen 3.234 N/A ASP 184.A N PRO 181.A O no hydrogen 2.885 N/A LEU 185.A N ALA 182.A O no hydrogen 3.247 N/A GLU 188.A N ASP 184.A O no hydrogen 2.857 N/A ALA 189.A N LEU 185.A O no hydrogen 2.914 N/A ARG 190.A N LEU 186.A O no hydrogen 3.024 N/A ARG 190.A NH2 GLU 9.A OE2 no hydrogen 3.471 N/A ALA 191.A N THR 187.A O no hydrogen 3.009 N/A THR 192.A N GLU 188.A O no hydrogen 3.049 N/A THR 192.A OG1 GLU 188.A O no hydrogen 3.318 N/A ALA 193.A N ALA 189.A O no hydrogen 2.761 N/A THR 194.A N ARG 190.A O no hydrogen 2.640 N/A THR 194.A OG1 ARG 190.A O no hydrogen 2.902 N/A THR 195.A N ALA 191.A O no hydrogen 2.854 N/A THR 195.A OG1 ALA 191.A O no hydrogen 3.120 N/A ILE 196.A N THR 192.A O no hydrogen 2.990 N/A SER 197.A N ALA 193.A O no hydrogen 2.863 N/A SER 197.A OG ALA 193.A O no hydrogen 3.006 N/A SER 197.A OG THR 194.A O no hydrogen 2.815 N/A GLN 198.A N THR 194.A O no hydrogen 3.022 N/A GLN 198.A N THR 195.A O no hydrogen 3.262 N/A MET 199.A N ILE 196.A O no hydrogen 3.311 N/A SER 200.A OG ASP 238.A OD2 no hydrogen 2.668 N/A SER 202.A OG SER 200.A OG no hydrogen 3.260 N/A ALA 203.A N SER 200.A OG no hydrogen 3.365 N/A ALA 204.A N SER 200.A O no hydrogen 3.017 N/A ARG 205.A N ALA 201.A O no hydrogen 2.938 N/A ARG 205.A NH2 THR 95.A OG1 no hydrogen 3.400 N/A MET 206.A N SER 202.A O no hydrogen 2.861 N/A ALA 207.A N ALA 203.A O no hydrogen 2.938 N/A LYS 208.A N ALA 204.A O no hydrogen 3.013 N/A LYS 208.A NZ VAL 93.A O no hydrogen 2.842 N/A LYS 208.A NZ THR 95.A O no hydrogen 2.777 N/A LYS 208.A NZ ASP 117.A OD1 no hydrogen 3.466 N/A LYS 208.A NZ ASP 117.A OD2 no hydrogen 2.749 N/A GLU 209.A N ARG 205.A O no hydrogen 3.131 N/A ALA 210.A N MET 206.A O no hydrogen 2.831 N/A VAL 211.A N ALA 207.A O no hydrogen 3.038 N/A ASN 212.A N LYS 208.A O no hydrogen 3.015 N/A ARG 213.A N GLU 209.A O no hydrogen 3.148 N/A ARG 213.A N ALA 210.A O no hydrogen 3.040 N/A ARG 213.A NH1 GLU 209.A O no hydrogen 3.099 N/A ALA 214.A N VAL 211.A O no hydrogen 3.107 N/A PHE 215.A N ASN 212.A O no hydrogen 3.376 N/A GLU 216.A N ARG 213.A O no hydrogen 2.967 N/A SER 217.A OG SER 218.A O no hydrogen 3.326 N/A GLU 221.A N SER 218.A OG no hydrogen 3.319 N/A GLY 222.A N SER 218.A O no hydrogen 2.938 N/A LEU 223.A N LEU 219.A O no hydrogen 2.817 N/A LEU 224.A N SER 220.A O no hydrogen 3.345 N/A TYR 225.A N GLU 221.A O no hydrogen 2.965 N/A TYR 225.A OH GLU 209.A OE1 no hydrogen 2.579 N/A GLU 226.A N GLY 222.A O no hydrogen 3.054 N/A ARG 227.A N LEU 223.A O no hydrogen 3.114 N/A ARG 228.A N LEU 224.A O no hydrogen 3.050 N/A LEU 229.A N TYR 225.A O no hydrogen 3.039 N/A PHE 230.A N GLU 226.A O no hydrogen 2.802 N/A HIS 231.A N ARG 227.A O no hydrogen 2.915 N/A SER 232.A N ARG 228.A O no hydrogen 3.016 N/A ALA 233.A N LEU 229.A O no hydrogen 3.074 N/A ALA 233.A N PHE 230.A O no hydrogen 3.191 N/A PHE 234.A N HIS 231.A O no hydrogen 2.906 N/A ALA 235.A N SER 232.A O no hydrogen 2.879 N/A THR 236.A N ALA 233.A O no hydrogen 3.037 N/A THR 236.A OG1 ALA 233.A O no hydrogen 2.800 N/A GLN 239.A N THR 236.A OG1 no hydrogen 3.429 N/A GLN 239.A NE2 PHE 234.A O no hydrogen 3.384 N/A GLU 241.A N GLU 237.A O no hydrogen 3.014 N/A GLY 242.A N ASP 238.A O no hydrogen 2.883 N/A MET 243.A N GLN 239.A O no hydrogen 2.939 N/A ALA 244.A N SER 240.A O no hydrogen 2.893 N/A ALA 245.A N GLU 241.A O no hydrogen 2.956 N/A PHE 246.A N GLY 242.A O no hydrogen 3.376 N/A ILE 247.A N MET 243.A O no hydrogen 3.239 N/A GLU 248.A N ALA 244.A O no hydrogen 2.808 N/A LYS 249.A N PHE 246.A O no hydrogen 3.186 N/A ARG 250.A N ALA 245.A O no hydrogen 2.828 N/A ARG 250.A NE GLU 248.A OE1 no hydrogen 2.809 N/A ARG 250.A NH1 GLU 241.A OE2 no hydrogen 3.016 N/A ARG 250.A NH1 ALA 251.A O no hydrogen 3.045 N/A ARG 250.A NH2 GLU 241.A OE1 no hydrogen 3.379 N/A ARG 250.A NH2 GLU 248.A OE1 no hydrogen 3.411 N/A GLN 253.A N GLU 241.A OE2 no hydrogen 2.666 N/A