Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3d8s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N ASP 178.A OD2 no hydrogen 2.891 N/A ARG 3.A NE ASP 178.A OD2 no hydrogen 2.976 N/A ARG 3.A NH1 GLY 175.A O no hydrogen 3.125 N/A ARG 3.A NH1 ASP 178.A OD1 no hydrogen 2.982 N/A ILE 4.A N THR 25.A O no hydrogen 2.881 N/A ALA 5.A N ALA 179.A O no hydrogen 2.846 N/A TYR 6.A N LEU 27.A O no hydrogen 2.739 N/A TYR 6.A OH ARG 10.A O no hydrogen 2.710 N/A ALA 7.A N ALA 181.A O no hydrogen 3.094 N/A ARG 11.A NE GLU 14.A OE1 no hydrogen 3.023 N/A ARG 11.A NH2 GLU 14.A OE2 no hydrogen 2.773 N/A PHE 15.A N ARG 11.A O no hydrogen 2.796 N/A LYS 16.A N LYS 12.A O no hydrogen 3.001 N/A ALA 17.A N GLU 13.A O.A no hydrogen 3.037 N/A ALA 17.A N GLU 13.A O.B no hydrogen 3.109 N/A LEU 18.A N GLU 14.A O no hydrogen 3.043 N/A ALA 19.A N PHE 15.A O no hydrogen 2.946 N/A GLU 20.A N LYS 16.A O no hydrogen 3.220 N/A LYS 21.A N.A ALA 17.A O no hydrogen 3.117 N/A LYS 21.A N.B ALA 17.A O no hydrogen 3.111 N/A LEU 22.A N LEU 18.A O no hydrogen 3.153 N/A LEU 22.A N ALA 19.A O no hydrogen 2.992 N/A GLY 23.A N GLU 20.A O no hydrogen 3.420 N/A PHE 24.A N ALA 19.A O no hydrogen 2.861 N/A THR 25.A N MET 2.A O no hydrogen 2.721 N/A LEU 27.A N ILE 4.A O no hydrogen 2.944 N/A PHE 29.A N TYR 6.A O no hydrogen 2.926 N/A ALA 33.A N LEU 159.A O no hydrogen 2.802 N/A VAL 37.A N ARG 157.A O no hydrogen 3.036 N/A VAL 39.A N PRO 155.A O no hydrogen 2.934 N/A TYR 42.A N VAL 39.A O no hydrogen 3.063 N/A GLN 45.A N GLU 41.A O no hydrogen 3.007 N/A GLN 45.A NE2 PRO 152.A O no hydrogen 2.784 N/A VAL 46.A N TYR 42.A O no hydrogen 3.067 N/A ARG 47.A N ARG 43.A O no hydrogen 3.014 N/A GLU 48.A N ASP 44.A O no hydrogen 3.000 N/A LEU 49.A N GLN 45.A O no hydrogen 2.954 N/A ALA 50.A N VAL 46.A O no hydrogen 3.149 N/A GLN 51.A N GLU 48.A O no hydrogen 3.025 N/A GLY 52.A N LEU 49.A O no hydrogen 2.912 N/A ASP 54.A N VAL 126.A O no hydrogen 2.846 N/A LEU 55.A N VAL 126.A O no hydrogen 3.062 N/A PHE 56.A N PHE 86.A O no hydrogen 2.842 N/A LEU 57.A N ALA 128.A O no hydrogen 2.919 N/A ALA 58.A N LEU 88.A O no hydrogen 2.896 N/A THR 59.A N GLN 130.A OE1 no hydrogen 2.728 N/A THR 59.A OG1 GLN 130.A O no hydrogen 2.632 N/A THR 60.A N GLN 130.A OE1 no hydrogen 3.092 N/A GLY 63.A N THR 60.A OG1 no hydrogen 2.923 N/A VAL 64.A N THR 60.A O no hydrogen 3.211 N/A ARG 65.A N GLY 61.A O no hydrogen 3.069 N/A ARG 65.A NH1 GLU 100.A OE1 no hydrogen 3.059 N/A ASP 66.A N VAL 62.A O no hydrogen 2.835 N/A LEU 67.A N GLY 63.A O no hydrogen 3.003 N/A LEU 68.A N VAL 64.A O no hydrogen 2.999 N/A GLU 69.A N ARG 65.A O no hydrogen 3.034 N/A ALA 70.A N ASP 66.A O no hydrogen 2.835 N/A GLY 71.A N LEU 67.A O no hydrogen 2.918 N/A LYS 72.A N LEU 68.A O no hydrogen 3.082 N/A LYS 72.A NZ GLU 79.A OE2 no hydrogen 3.469 N/A ALA 73.A N GLU 69.A O no hydrogen 2.805 N/A LEU 74.A N ALA 70.A O no hydrogen 2.818 N/A GLY 75.A N LYS 72.A O no hydrogen 3.099 N/A LEU 76.A N GLY 71.A O no hydrogen 2.942 N/A GLY 80.A N ASP 77.A OD1 no hydrogen 2.921 N/A LEU 82.A N LEU 78.A O no hydrogen 2.854 N/A ALA 83.A N GLU 79.A O no hydrogen 2.796 N/A ALA 83.A N GLY 80.A O no hydrogen 3.231 N/A ALA 85.A N LEU 82.A O no hydrogen 3.320 N/A PHE 86.A N ASP 54.A O no hydrogen 2.906 N/A ARG 87.A NE LEU 103.A O no hydrogen 2.904 N/A ARG 87.A NE PRO 104.A O no hydrogen 3.211 N/A ARG 87.A NH1 PRO 104.A O no hydrogen 2.767 N/A ARG 87.A NH2 LEU 82.A O no hydrogen 2.967 N/A ARG 87.A NH2 ALA 83.A O no hydrogen 3.320 N/A LEU 88.A N PHE 56.A O no hydrogen 2.886 N/A ALA 89.A N ALA 107.A O no hydrogen 2.939 N/A ARG 90.A N ALA 58.A O no hydrogen 2.937 N/A ARG 90.A NH1 TYR 132.A OH no hydrogen 2.949 N/A ALA 95.A N GLY 91.A O no hydrogen 3.092 N/A ARG 96.A N ALA 92.A O no hydrogen 2.881 N/A ALA 97.A N LYS 93.A O no hydrogen 3.162 N/A LEU 98.A N ALA 94.A O no hydrogen 3.090 N/A LYS 99.A N ALA 95.A O no hydrogen 2.828 N/A GLU 100.A N ARG 96.A O no hydrogen 2.786 N/A ALA 101.A N ALA 97.A O no hydrogen 3.217 N/A ALA 101.A N LEU 98.A O no hydrogen 2.973 N/A GLY 102.A N LYS 99.A O no hydrogen 3.092 N/A LEU 103.A N LEU 98.A O no hydrogen 2.848 N/A HIS 106.A N ARG 87.A O no hydrogen 2.690 N/A ALA 107.A N ARG 87.A O no hydrogen 3.190 N/A GLY 109.A N ALA 89.A O no hydrogen 2.831 N/A ASP 110.A N SER 115.A OG no hydrogen 3.074 N/A GLY 111.A N ARG 90.A O no hydrogen 2.844 N/A THR 112.A N ASP 110.A OD1 no hydrogen 3.036 N/A THR 112.A OG1 ASP 110.A OD1 no hydrogen 2.656 N/A LYS 114.A N GLU 224.A OE1 no hydrogen 3.043 N/A LYS 114.A NZ ARG 223.A O no hydrogen 2.946 N/A LYS 114.A NZ GLU 224.A O no hydrogen 3.415 N/A SER 115.A N THR 112.A O no hydrogen 3.307 N/A SER 115.A OG ASP 110.A OD1 no hydrogen 3.081 N/A SER 115.A OG THR 112.A O no hydrogen 2.606 N/A LEU 116.A N SER 113.A O no hydrogen 2.975 N/A LEU 119.A N LEU 116.A O no hydrogen 2.789 N/A GLN 122.A NE2 GLU 145.A O no hydrogen 3.516 N/A VAL 126.A N ASP 54.A OD2 no hydrogen 3.083 N/A ALA 127.A N ARG 149.A O no hydrogen 2.840 N/A ALA 128.A N LEU 55.A O no hydrogen 2.869 N/A LEU 129.A N LEU 151.A O no hydrogen 2.795 N/A GLN 130.A N LEU 57.A O no hydrogen 3.010 N/A GLN 130.A NE2 THR 60.A OG1 no hydrogen 2.908 N/A GLN 130.A NE2 LEU 131.A O no hydrogen 2.971 N/A TYR 132.A OH GLU 189.A OE1 no hydrogen 3.267 N/A TYR 132.A OH GLU 189.A OE2 no hydrogen 2.899 N/A LYS 134.A NZ PRO 135.A O no hydrogen 2.628 N/A LYS 134.A NZ GLU 193.A OE1 no hydrogen 3.041 N/A LYS 134.A NZ GLU 193.A OE2 no hydrogen 2.681 N/A LEU 136.A N GLU 140.A OE2 no hydrogen 2.907 N/A GLU 140.A N LEU 136.A O no hydrogen 2.829 N/A ASN 141.A N PRO 137.A O no hydrogen 2.631 N/A ALA 142.A N LEU 138.A O no hydrogen 3.119 N/A LEU 143.A N LEU 139.A O no hydrogen 2.911 N/A ALA 144.A N GLU 140.A O no hydrogen 3.129 N/A GLU 145.A N ASN 141.A O no hydrogen 2.959 N/A ARG 146.A N ALA 142.A O no hydrogen 2.903 N/A ARG 146.A NH1 GLU 145.A OE1 no hydrogen 3.431 N/A ARG 146.A NH2 LEU 117.A O no hydrogen 2.989 N/A GLY 147.A N ALA 144.A O no hydrogen 2.821 N/A TYR 148.A N LEU 143.A O no hydrogen 2.962 N/A TYR 148.A OH PRO 121.A O no hydrogen 2.938 N/A ARG 149.A N GLY 125.A O no hydrogen 2.740 N/A ARG 149.A NH1 GLU 48.A OE2 no hydrogen 2.810 N/A LEU 151.A N ALA 127.A O no hydrogen 2.889 N/A LEU 153.A N LEU 129.A O no hydrogen 2.749 N/A ARG 157.A N VAL 37.A O no hydrogen 2.683 N/A HIS 158.A N GLY 133.A O no hydrogen 2.767 N/A ASP 161.A N VAL 31.A O no hydrogen 2.846 N/A GLY 164.A N ASP 161.A OD1 no hydrogen 2.902 N/A ILE 165.A N ASP 161.A O no hydrogen 2.784 N/A LEU 166.A N PRO 162.A O no hydrogen 2.975 N/A ARG 167.A N GLU 163.A O no hydrogen 2.976 N/A LEU 168.A N GLY 164.A O no hydrogen 3.112 N/A GLU 169.A N ILE 165.A O no hydrogen 3.006 N/A GLU 170.A N LEU 166.A O no hydrogen 2.915 N/A ALA 171.A N ARG 167.A O no hydrogen 2.843 N/A VAL 172.A N LEU 168.A O no hydrogen 2.951 N/A LEU 173.A N GLU 169.A O no hydrogen 2.950 N/A ARG 174.A N GLU 170.A O no hydrogen 2.877 N/A GLY 175.A N VAL 172.A O no hydrogen 2.956 N/A GLU 176.A N ALA 171.A O no hydrogen 3.030 N/A ASP 178.A N ARG 3.A O no hydrogen 2.784 N/A ALA 179.A N ARG 3.A O no hydrogen 3.207 N/A LEU 180.A N LYS 210.A O no hydrogen 2.862 N/A ALA 181.A N ALA 5.A O no hydrogen 2.799 N/A PHE 182.A N LEU 212.A O no hydrogen 2.784 N/A VAL 183.A N GLN 187.A OE1 no hydrogen 2.808 N/A ALA 184.A N GLN 187.A OE1 no hydrogen 3.215 N/A GLN 187.A N ALA 184.A O no hydrogen 2.966 N/A GLN 187.A NE2 GLN 32.A OE1 no hydrogen 2.935 N/A GLU 189.A N ALA 185.A O no hydrogen 2.983 N/A PHE 190.A N ILE 186.A O no hydrogen 2.902 N/A LEU 191.A N GLN 187.A O no hydrogen 2.988 N/A PHE 192.A N VAL 188.A O no hydrogen 3.141 N/A GLU 193.A N GLU 189.A O no hydrogen 2.920 N/A GLY 194.A N PHE 190.A O no hydrogen 2.906 N/A LYS 196.A N GLU 169.A OE1 no hydrogen 2.894 N/A ASP 197.A N GLU 169.A OE2 no hydrogen 2.722 N/A ALA 200.A N ASP 197.A OD1 no hydrogen 2.916 N/A LEU 201.A N ASP 197.A O no hydrogen 3.000 N/A ARG 202.A N PRO 198.A O no hydrogen 2.972 N/A ARG 202.A NE TRP 225.A O no hydrogen 2.596 N/A ARG 202.A NH1 TRP 225.A O no hydrogen 3.527 N/A GLU 203.A N LYS 199.A O no hydrogen 3.135 N/A ALA 204.A N ALA 200.A O no hydrogen 2.990 N/A LEU 205.A N LEU 201.A O no hydrogen 3.048 N/A ASN 206.A N GLU 203.A O no hydrogen 3.293 N/A ASN 206.A ND2 GLY 226.A O no hydrogen 2.807 N/A THR 207.A N ALA 204.A O no hydrogen 3.147 N/A THR 207.A OG1 GLU 203.A O no hydrogen 2.723 N/A THR 207.A OG1 ALA 204.A O no hydrogen 3.544 N/A VAL 209.A N ALA 204.A O no hydrogen 2.889 N/A LYS 210.A N ASP 178.A O no hydrogen 2.957 N/A LEU 212.A N LEU 180.A O no hydrogen 2.662 N/A ALA 213.A N TYR 231.A O no hydrogen 3.033 N/A VAL 214.A N PHE 182.A O no hydrogen 2.984 N/A GLY 215.A N ASP 233.A O no hydrogen 2.667 N/A THR 218.A OG1 VAL 214.A O no hydrogen 2.606 N/A ALA 219.A N GLY 215.A O no hydrogen 3.231 N/A ASP 220.A N ARG 216.A O no hydrogen 2.818 N/A ALA 221.A N VAL 217.A O no hydrogen 3.326 N/A ALA 221.A N THR 218.A O no hydrogen 3.242 N/A LEU 222.A N THR 218.A O no hydrogen 3.319 N/A ARG 223.A N ALA 219.A O no hydrogen 3.084 N/A ARG 223.A NH1 ASP 110.A OD2 no hydrogen 2.879 N/A ARG 223.A NH2 ASP 110.A O no hydrogen 3.142 N/A ARG 223.A NH2 ASP 220.A OD1 no hydrogen 3.367 N/A GLU 224.A N ASP 220.A O no hydrogen 2.979 N/A TRP 225.A N ALA 221.A O no hydrogen 3.300 N/A TRP 225.A N LEU 222.A O no hydrogen 2.952 N/A GLY 226.A N ARG 223.A O no hydrogen 3.096 N/A VAL 227.A N LEU 222.A O no hydrogen 2.919 N/A LYS 228.A N ASN 206.A OD1 no hydrogen 2.860 N/A PHE 230.A N ALA 211.A O no hydrogen 2.866 N/A TYR 231.A N ALA 211.A O no hydrogen 3.481 N/A TYR 231.A OH ASP 233.A OD1 no hydrogen 2.695 N/A ASP 233.A N ALA 213.A O no hydrogen 2.912 N/A THR 235.A N ASP 233.A OD2 no hydrogen 3.012 N/A THR 235.A OG1 ASP 233.A OD2 no hydrogen 2.544 N/A THR 235.A OG1 SER 240.A OG no hydrogen 3.020 N/A ARG 237.A N THR 235.A OG1 no hydrogen 3.128 N/A SER 240.A N ARG 237.A O no hydrogen 2.945 N/A SER 240.A OG ASP 233.A OD1 no hydrogen 2.678 N/A SER 240.A OG ASP 233.A OD2 no hydrogen 3.251 N/A SER 240.A OG THR 235.A OG1 no hydrogen 3.020 N/A LEU 241.A N ARG 237.A O no hydrogen 2.985 N/A LEU 242.A N LEU 238.A O no hydrogen 3.015 N/A GLN 243.A N GLY 239.A O no hydrogen 2.992 N/A GLY 244.A N SER 240.A O no hydrogen 2.981 N/A PHE 245.A N LEU 241.A O no hydrogen 2.900 N/A LYS 246.A N LEU 242.A O no hydrogen 2.933 N/A LYS 246.A NZ LEU 22.A O no hydrogen 3.125 N/A ARG 247.A N GLN 243.A O no hydrogen 2.977 N/A ALA 248.A N GLY 244.A O no hydrogen 2.992 N/A