Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rj4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N THR 80.A OG1 no hydrogen 3.002 N/A TYR 3.A OH ASP 95.A OD2 no hydrogen 2.560 N/A ASP 4.A N SER 76.A OG no hydrogen 2.984 N/A SER 6.A N ASP 4.A OD1 no hydrogen 3.018 N/A SER 6.A OG ASP 4.A OD1 no hydrogen 2.606 N/A SER 6.A OG ASP 4.A OD2 no hydrogen 3.380 N/A LEU 7.A N ASP 4.A O no hydrogen 3.085 N/A LEU 8.A N PRO 5.A O no hydrogen 3.240 N/A GLN 9.A N SER 69.A OG no hydrogen 2.830 N/A GLN 9.A NE2 PRO 10.A O no hydrogen 3.002 N/A VAL 11.A N LEU 64.A O no hydrogen 2.890 N/A ARG 13.A N ALA 62.A O no hydrogen 2.858 N/A ARG 13.A NE SER 61.A O no hydrogen 3.050 N/A ARG 13.A NE SER 61.A OG no hydrogen 2.969 N/A ARG 13.A NH1 ASP 32.A OD2 no hydrogen 2.890 N/A ARG 13.A NH2 ASP 32.A OD2 no hydrogen 2.932 N/A ARG 13.A NH2 SER 61.A OG no hydrogen 2.941 N/A LEU 15.A N PRO 12.A O no hydrogen 3.209 N/A ARG 17.A N ARG 13.A O no hydrogen 3.140 N/A ARG 17.A NE GLU 208.A OE1 no hydrogen 2.896 N/A ARG 17.A NE GLU 208.A OE2 no hydrogen 3.440 N/A ARG 17.A NH1 ALA 59.A O no hydrogen 3.525 N/A ARG 17.A NH2 ALA 59.A O no hydrogen 2.871 N/A ARG 17.A NH2 GLU 208.A OE2 no hydrogen 2.841 N/A ASN 18.A N SER 14.A O no hydrogen 2.892 N/A ASP 19.A N ASN 16.A O no hydrogen 3.215 N/A LEU 20.A N ARG 17.A O no hydrogen 2.766 N/A HIS 21.A N ASN 18.A O no hydrogen 3.188 N/A SER 23.A OG THR 25.A O no hydrogen 2.594 N/A GLN 29.A N SER 241.A O no hydrogen 2.833 N/A GLN 29.A NE2 SER 245.A OG no hydrogen 3.177 N/A CYS 31.A N PHE 239.A O no hydrogen 3.098 N/A CYS 31.A SG SER 245.A O no hydrogen 3.795 N/A ASP 32.A N ILE 57.A O no hydrogen 2.694 N/A ILE 33.A N ASN 237.A O no hydrogen 3.137 N/A TRP 34.A N VAL 55.A O no hydrogen 2.746 N/A THR 35.A N ASP 235.A O no hydrogen 3.094 N/A THR 35.A N ASP 235.A OD1 no hydrogen 3.244 N/A THR 35.A OG1 ASP 235.A OD1 no hydrogen 2.833 N/A LEU 36.A N GLY 53.A O no hydrogen 2.783 N/A TYR 37.A N GLY 233.A O no hydrogen 2.953 N/A SER 40.A OG GLN 49.A O no hydrogen 2.809 N/A TRP 41.A N GLN 49.A O no hydrogen 3.159 N/A LEU 42.A N THR 80.A O no hydrogen 2.952 N/A ASN 43.A N LEU 47.A O no hydrogen 2.918 N/A LYS 45.A N ASN 43.A OD1 no hydrogen 2.969 N/A GLY 46.A N ASN 43.A O no hydrogen 2.908 N/A LEU 47.A N ASN 43.A OD1 no hydrogen 2.865 N/A GLN 49.A N TRP 41.A O no hydrogen 2.758 N/A ALA 51.A N LEU 39.A O no hydrogen 3.026 N/A ILE 52.A N LYS 109.A O no hydrogen 2.932 N/A GLY 53.A N LEU 36.A O no hydrogen 2.978 N/A GLU 54.A N.A ASN 107.A O no hydrogen 2.900 N/A GLU 54.A N.B ASN 107.A O no hydrogen 2.876 N/A VAL 55.A N TRP 34.A O no hydrogen 2.882 N/A SER 56.A N THR 105.A O no hydrogen 2.949 N/A ILE 57.A N ASP 32.A O no hydrogen 2.798 N/A ALA 59.A N GLY 30.A O no hydrogen 2.918 N/A THR 60.A OG1 GLU 102.A OE1 no hydrogen 2.939 N/A THR 60.A OG1 GLU 102.A OE2 no hydrogen 3.387 N/A SER 61.A N PRO 58.A O no hydrogen 3.009 N/A SER 61.A OG PRO 58.A O no hydrogen 3.077 N/A SER 61.A OG ASN 63.A O no hydrogen 2.770 N/A ASN 63.A N ALA 100.A O no hydrogen 2.933 N/A LEU 64.A N VAL 11.A O no hydrogen 2.822 N/A GLU 66.A N GLN 9.A O no hydrogen 2.946 N/A LYS 68.A N GLU 66.A OE2 no hydrogen 2.937 N/A SER 69.A N GLU 66.A OE1 no hydrogen 2.799 N/A SER 69.A OG GLU 66.A O no hydrogen 2.764 N/A PHE 70.A N GLU 66.A O no hydrogen 3.019 N/A LYS 71.A N SER 67.A O no hydrogen 3.029 N/A LEU 72.A N LYS 68.A O no hydrogen 2.969 N/A TYR 73.A N SER 69.A O no hydrogen 2.936 N/A TYR 73.A OH ASP 95.A OD2 no hydrogen 2.582 N/A LEU 74.A N PHE 70.A O no hydrogen 2.932 N/A ASN 75.A N LYS 71.A O no hydrogen 2.890 N/A SER 76.A N LEU 72.A O no hydrogen 3.129 N/A SER 76.A N TYR 73.A O no hydrogen 3.062 N/A SER 76.A OG TYR 73.A O no hydrogen 2.696 N/A TYR 77.A N LEU 74.A O no hydrogen 2.980 N/A TYR 77.A OH TYR 73.A OH no hydrogen 2.711 N/A ASN 78.A N ASN 75.A O no hydrogen 2.976 N/A THR 80.A N TYR 77.A O no hydrogen 3.027 N/A THR 80.A OG1 SER 76.A O no hydrogen 2.880 N/A ARG 81.A NH1 GLN 44.A O no hydrogen 3.516 N/A PHE 82.A N LEU 42.A O no hydrogen 2.899 N/A ALA 83.A N GLU 87.A OE1 no hydrogen 3.080 N/A GLU 87.A N SER 84.A OG no hydrogen 3.062 N/A VAL 88.A N SER 84.A O no hydrogen 3.327 N/A GLN 89.A N.A TRP 85.A O no hydrogen 3.014 N/A GLN 89.A N.B TRP 85.A O no hydrogen 3.012 N/A THR 90.A N ASP 86.A O.A no hydrogen 2.898 N/A THR 90.A N ASP 86.A O.B no hydrogen 2.891 N/A THR 90.A OG1 ASP 86.A O.A no hydrogen 3.063 N/A THR 90.A OG1 ASP 86.A O.B no hydrogen 3.081 N/A THR 90.A OG1 ASP 86.A OD1.B no hydrogen 3.252 N/A ARG 91.A N GLU 87.A O no hydrogen 2.974 N/A ARG 91.A NE GLU 87.A OE2 no hydrogen 3.094 N/A ARG 91.A NH1 TYR 3.A OH no hydrogen 3.450 N/A ARG 91.A NH2 GLU 87.A OE2 no hydrogen 3.498 N/A LEU 92.A N VAL 88.A O no hydrogen 3.022 N/A VAL 93.A N GLN 89.A O.A no hydrogen 3.015 N/A VAL 93.A N GLN 89.A O.B no hydrogen 3.034 N/A HIS 94.A N THR 90.A O no hydrogen 2.998 N/A HIS 94.A ND1 ASP 95.A OD1 no hydrogen 3.109 N/A ASP 95.A N ARG 91.A O no hydrogen 2.885 N/A LEU 96.A N LEU 92.A O no hydrogen 2.975 N/A SER 97.A N VAL 93.A O no hydrogen 2.991 N/A SER 97.A OG VAL 93.A O no hydrogen 2.686 N/A ALA 98.A N HIS 94.A O no hydrogen 3.039 N/A CYS 99.A N ASP 95.A O no hydrogen 3.074 N/A ALA 100.A N LEU 96.A O no hydrogen 2.934 N/A GLY 101.A N SER 97.A O no hydrogen 2.904 N/A VAL 104.A N SER 97.A OG no hydrogen 2.884 N/A THR 105.A N SER 56.A O no hydrogen 3.126 N/A ASN 107.A N GLU 54.A O.A no hydrogen 2.934 N/A ASN 107.A N GLU 54.A O.B no hydrogen 2.855 N/A VAL 108.A N GLN 89.A OE1.A no hydrogen 3.037 N/A LYS 109.A N ILE 52.A O no hydrogen 2.945 N/A LYS 109.A NZ TYR 114.A OH no hydrogen 3.522 N/A SER 110.A N GLU 113.A OE2 no hydrogen 3.087 N/A SER 110.A OG GLU 113.A OE2 no hydrogen 3.390 N/A GLU 113.A N SER 110.A O no hydrogen 3.071 N/A TYR 114.A N LEU 111.A O no hydrogen 2.965 N/A TYR 114.A OH GLU 54.A OE2.A no hydrogen 2.871 N/A THR 115.A N ASN 112.A O.A no hydrogen 3.172 N/A THR 115.A N ASN 112.A O.B no hydrogen 3.232 N/A THR 115.A OG1 ASN 112.A O.A no hydrogen 3.558 N/A GLU 117.A N TYR 114.A O no hydrogen 2.950 N/A VAL 120.A N ARG 252.A O no hydrogen 2.983 N/A GLN 122.A N GLU 177.A OE1 no hydrogen 2.780 N/A GLU 124.A N VAL 155.A O no hydrogen 3.050 N/A CYS 125.A SG HIS 157.A O no hydrogen 4.008 N/A ILE 126.A N HIS 157.A O no hydrogen 2.905 N/A GLN 129.A N ASP 127.A O no hydrogen 2.971 N/A GLN 129.A NE2 ILE 126.A O no hydrogen 2.758 N/A GLN 129.A NE2 ARG 186.A O no hydrogen 3.184 N/A ASN 135.A ND2 GLU 137.A OE2 no hydrogen 3.150 N/A GLU 137.A N ASN 135.A OD1 no hydrogen 3.104 N/A ASP 139.A N SER 195.A OG no hydrogen 3.308 N/A ALA 141.A N ASP 139.A OD1 no hydrogen 3.260 N/A LEU 142.A N ASP 139.A O no hydrogen 3.234 N/A LEU 143.A N ASP 140.A O no hydrogen 3.005 N/A GLN 144.A N ALA 141.A O no hydrogen 2.959 N/A ALA 146.A N LEU 143.A O no hydrogen 2.944 N/A VAL 152.A N GLY 182.A O no hydrogen 2.841 N/A SER 153.A OG HIS 181.A ND1 no hydrogen 2.727 N/A GLU 154.A N TYR 180.A O no hydrogen 3.124 N/A LEU 156.A N ILE 178.A O no hydrogen 2.855 N/A HIS 157.A N GLU 124.A O no hydrogen 2.892 N/A HIS 157.A ND1 GLN 122.A O no hydrogen 2.852 N/A SER 158.A N VAL 176.A O no hydrogen 2.883 N/A SER 158.A OG ASP 127.A OD1 no hydrogen 2.631 N/A HIS 159.A N ASP 127.A OD2 no hydrogen 2.771 N/A HIS 159.A ND1 SER 175.A OG no hydrogen 2.871 N/A LEU 160.A N SER 158.A OG no hydrogen 3.085 N/A LYS 162.A NZ SER 163.A O no hydrogen 2.840 N/A SER 163.A N ASP 172.A O no hydrogen 2.909 N/A SER 163.A OG THR 168.A OG1 no hydrogen 2.792 N/A ASN 164.A ND2 HIS 199.A O no hydrogen 3.227 N/A THR 168.A N ASN 164.A O no hydrogen 3.046 N/A THR 168.A OG1 SER 163.A OG no hydrogen 2.792 N/A THR 168.A OG1 ASN 164.A O no hydrogen 3.137 N/A THR 168.A OG1 GLN 170.A O no hydrogen 2.730 N/A GLN 170.A N THR 168.A O no hydrogen 2.757 N/A ASP 172.A N SER 163.A OG no hydrogen 2.783 N/A GLY 174.A N LEU 161.A O no hydrogen 2.952 N/A SER 175.A N ARG 227.A O no hydrogen 3.074 N/A SER 175.A OG HIS 159.A ND1 no hydrogen 2.871 N/A VAL 176.A N SER 158.A O no hydrogen 2.783 N/A GLU 177.A N TYR 225.A O no hydrogen 2.775 N/A ILE 178.A N LEU 156.A O no hydrogen 2.767 N/A ALA 179.A N THR 223.A O no hydrogen 2.907 N/A TYR 180.A N GLU 154.A O no hydrogen 3.053 N/A TYR 180.A OH GLU 154.A OE2 no hydrogen 2.431 N/A HIS 181.A N SER 221.A O no hydrogen 3.003 N/A HIS 181.A ND1 SER 153.A OG no hydrogen 2.727 N/A GLY 182.A N VAL 152.A O no hydrogen 2.963 N/A LYS 184.A N GLU 150.A O no hydrogen 3.269 N/A ARG 186.A NH1 GLU 124.A OE1 no hydrogen 2.911 N/A ARG 186.A NH2 GLU 124.A OE1 no hydrogen 3.304 N/A ARG 186.A NH2 GLU 124.A OE2 no hydrogen 2.851 N/A ARG 186.A NH2 GLU 154.A OE1 no hydrogen 3.062 N/A ALA 188.A N ASN 185.A OD1 no hydrogen 2.895 N/A LEU 189.A N ASN 185.A O no hydrogen 3.087 N/A LEU 190.A N ARG 186.A O no hydrogen 2.872 N/A ARG 191.A N GLU 187.A O no hydrogen 2.904 N/A ARG 191.A NE GLU 187.A OE2 no hydrogen 2.901 N/A ARG 191.A NH1 GLU 132.A O no hydrogen 2.878 N/A ARG 191.A NH2 GLU 132.A O no hydrogen 3.021 N/A ARG 191.A NH2 GLU 187.A OE2 no hydrogen 3.011 N/A TYR 192.A N ALA 188.A O no hydrogen 2.969 N/A TYR 192.A OH ASP 213.A OD2 no hydrogen 2.626 N/A LEU 193.A N LEU 189.A O no hydrogen 2.970 N/A VAL 194.A N LEU 190.A O no hydrogen 2.920 N/A SER 195.A N ARG 191.A O no hydrogen 3.072 N/A SER 195.A N TYR 192.A O no hydrogen 3.080 N/A SER 195.A OG TYR 192.A O no hydrogen 2.698 N/A PHE 196.A N LEU 193.A O no hydrogen 3.185 N/A ARG 197.A N VAL 194.A O no hydrogen 3.309 N/A GLU 198.A N SER 195.A O no hydrogen 3.270 N/A HIS 199.A N PHE 196.A O no hydrogen 3.042 N/A HIS 203.A NE2 ASP 172.A OD2 no hydrogen 3.175 N/A GLU 204.A N GLU 204.A OE1 no hydrogen 2.764 N/A CYS 206.A N PHE 202.A O no hydrogen 3.330 N/A CYS 206.A SG TYR 228.A OH no hydrogen 3.465 N/A VAL 207.A N HIS 203.A O no hydrogen 3.167 N/A GLU 208.A N GLU 204.A O no hydrogen 3.105 N/A ARG 209.A N GLN 205.A O no hydrogen 2.919 N/A ARG 209.A NE ASP 213.A OD1 no hydrogen 3.280 N/A ARG 209.A NE ASP 213.A OD2 no hydrogen 2.921 N/A ARG 209.A NH1 GLU 201.A OE1 no hydrogen 3.492 N/A ILE 210.A N CYS 206.A O no hydrogen 2.864 N/A PHE 211.A N VAL 207.A O no hydrogen 3.016 N/A THR 212.A N GLU 208.A O no hydrogen 2.935 N/A THR 212.A OG1 GLU 208.A O no hydrogen 2.972 N/A THR 212.A OG1 ARG 209.A O no hydrogen 3.188 N/A ASP 213.A N ARG 209.A O no hydrogen 2.874 N/A ILE 214.A N ILE 210.A O no hydrogen 2.901 N/A ARG 215.A NE ASP 213.A OD1 no hydrogen 2.885 N/A ARG 215.A NH1 ASP 213.A OD1 no hydrogen 2.950 N/A TYR 216.A N ASP 213.A O no hydrogen 2.928 N/A TYR 216.A OH ASP 140.A OD2 no hydrogen 2.648 N/A CYS 217.A N ILE 214.A O no hydrogen 2.786 N/A GLN 218.A N ILE 214.A O no hydrogen 3.323 N/A GLN 220.A N HIS 181.A O no hydrogen 2.805 N/A SER 221.A N HIS 181.A O no hydrogen 3.434 N/A LEU 222.A N SER 242.A OG no hydrogen 2.960 N/A THR 223.A N ALA 179.A O no hydrogen 2.776 N/A THR 223.A OG1 SER 241.A OG no hydrogen 2.799 N/A THR 223.A OG1 GLN 244.A OE1 no hydrogen 2.753 N/A VAL 224.A N ARG 240.A O no hydrogen 2.808 N/A TYR 225.A N GLU 177.A O no hydrogen 2.958 N/A ALA 226.A N PRO 238.A O no hydrogen 3.109 N/A ARG 227.A N SER 175.A O no hydrogen 2.901 N/A ARG 227.A NE GLN 255.A OE1 no hydrogen 2.766 N/A ARG 227.A NH1 TYR 225.A OH no hydrogen 2.727 N/A ARG 227.A NH1 ASN 250.A OD1 no hydrogen 2.919 N/A ARG 227.A NH2 ASN 250.A OD1 no hydrogen 3.091 N/A ARG 227.A NH2 GLN 255.A OE1 no hydrogen 3.032 N/A TYR 228.A N ILE 236.A O no hydrogen 3.122 N/A TYR 228.A OH HIS 203.A O no hydrogen 2.997 N/A THR 229.A N TRP 173.A O no hydrogen 2.901 N/A ARG 230.A NE GLN 255.A O no hydrogen 3.453 N/A ARG 230.A NH2 GLN 255.A O no hydrogen 2.871 N/A ARG 231.A N LEU 234.A O.A no hydrogen 3.003 N/A ARG 231.A N LEU 234.A O.B no hydrogen 3.006 N/A ARG 231.A NE ASP 172.A OD1 no hydrogen 2.795 N/A ARG 231.A NH2 ASP 172.A OD1 no hydrogen 3.154 N/A ASP 235.A N THR 35.A O no hydrogen 3.030 N/A ASN 237.A N ILE 33.A O no hydrogen 2.740 N/A ASN 237.A ND2 ILE 33.A O no hydrogen 2.967 N/A ASN 237.A ND2 ASP 235.A OD1 no hydrogen 2.947 N/A PHE 239.A N CYS 31.A O no hydrogen 2.849 N/A ARG 240.A N VAL 224.A O no hydrogen 2.955 N/A ARG 240.A NE GLU 208.A OE2 no hydrogen 2.814 N/A ARG 240.A NH1 CYS 31.A O no hydrogen 3.131 N/A ARG 240.A NH1 ASP 32.A OD1 no hydrogen 2.984 N/A ARG 240.A NH1 PHE 239.A O no hydrogen 2.919 N/A ARG 240.A NH2 ASP 32.A OD1 no hydrogen 2.879 N/A ARG 240.A NH2 GLU 208.A OE2 no hydrogen 2.997 N/A SER 241.A N GLN 29.A O no hydrogen 2.885 N/A SER 241.A OG LEU 222.A O no hydrogen 3.340 N/A SER 241.A OG THR 223.A OG1 no hydrogen 2.799 N/A SER 242.A N LEU 222.A O no hydrogen 2.843 N/A SER 242.A OG LEU 222.A O no hydrogen 3.330 N/A SER 242.A OG HIS 243.A ND1 no hydrogen 3.178 N/A HIS 243.A N HIS 243.A ND1 no hydrogen 2.755 N/A HIS 243.A ND1 SER 242.A OG no hydrogen 3.178 N/A GLN 244.A N SER 241.A OG no hydrogen 2.809 N/A ASN 250.A ND2 THR 35.A OG1 no hydrogen 3.038 N/A GLN 251.A N.A HIS 249.A ND1 no hydrogen 3.098 N/A GLN 251.A N.B HIS 249.A ND1 no hydrogen 3.104 N/A ARG 254.A NH2 SER 175.A OG no hydrogen 2.973 N/A GLN 255.A NE2 TYR 228.A O no hydrogen 2.887 N/A GLN 255.A NE2 ASN 237.A OD1 no hydrogen 2.867 N/A