Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m55_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A N GLY 16.A O no hydrogen 2.921 N/A TRP 5.A NE1 GLY 63.A O no hydrogen 2.819 N/A ILE 6.A N LEU 14.A O no hydrogen 2.808 N/A TYR 8.A N GLY 12.A O no hydrogen 2.923 N/A GLY 11.A N TYR 8.A O no hydrogen 2.989 N/A GLY 12.A N ASP 10.A OD1 no hydrogen 2.808 N/A SER 13.A N VAL 32.A O no hydrogen 2.994 N/A LEU 14.A N ILE 6.A O no hydrogen 2.943 N/A VAL 15.A N ALA 30.A O no hydrogen 2.846 N/A GLY 16.A N CYS 4.A O no hydrogen 3.038 N/A ASN 19.A N GLU 23.A O no hydrogen 2.970 N/A ASN 19.A ND2 GLU 23.A OE1 no hydrogen 3.377 N/A ASP 21.A N ASN 19.A OD1 no hydrogen 2.942 N/A GLY 22.A N ASN 19.A O no hydrogen 2.832 N/A GLU 23.A N ASN 19.A OD1 no hydrogen 3.098 N/A THR 25.A N GLU 23.A O no hydrogen 2.876 N/A GLY 26.A N PHE 44.A O no hydrogen 3.053 N/A ILE 29.A N GLY 42.A O no hydrogen 3.020 N/A ALA 30.A N VAL 15.A O no hydrogen 2.977 N/A TYR 31.A N LEU 40.A O no hydrogen 2.930 N/A VAL 32.A N SER 13.A O no hydrogen 2.816 N/A TYR 33.A N THR 38.A O no hydrogen 2.908 N/A TYR 33.A OH ASP 94.A OD2 no hydrogen 2.702 N/A GLU 36.A N TYR 33.A O no hydrogen 2.905 N/A ARG 37.A N ASP 35.A OD1 no hydrogen 2.974 N/A THR 38.A N ASP 35.A OD1 no hydrogen 2.856 N/A THR 38.A OG1 ASP 35.A OD2 no hydrogen 2.592 N/A ALA 39.A N ALA 55.A O no hydrogen 2.960 N/A LEU 40.A N TYR 31.A O no hydrogen 2.825 N/A TYR 41.A N LYS 53.A O no hydrogen 2.877 N/A GLY 42.A N ILE 29.A O no hydrogen 2.802 N/A LYS 43.A N GLU 51.A O no hydrogen 2.926 N/A PHE 44.A N GLY 26.A O no hydrogen 3.044 N/A ILE 45.A N GLU 48.A O no hydrogen 2.893 N/A ASP 46.A N THR 25.A OG1 no hydrogen 2.745 N/A GLY 47.A N MET 24.A O no hydrogen 2.896 N/A GLU 48.A N ILE 45.A O no hydrogen 2.940 N/A ILE 50.A N LYS 43.A O no hydrogen 2.840 N/A GLU 51.A N LYS 43.A O no hydrogen 3.089 N/A GLY 52.A N TYR 76.A O no hydrogen 2.875 N/A LYS 53.A N TYR 41.A O no hydrogen 2.814 N/A LEU 54.A N SER 74.A O no hydrogen 3.132 N/A ALA 55.A N ALA 39.A O no hydrogen 2.832 N/A THR 56.A N GLU 68.A O no hydrogen 2.881 N/A LEU 57.A N ARG 37.A O no hydrogen 2.794 N/A MET 58.A N HIS 66.A O no hydrogen 2.834 N/A SER 59.A N HIS 66.A O no hydrogen 3.481 N/A SER 59.A OG GLU 61.A OE2 no hydrogen 2.821 N/A GLU 61.A N ARG 64.A O no hydrogen 2.866 N/A ARG 64.A N GLU 61.A O no hydrogen 2.961 N/A ARG 64.A NH1 GLU 17.A OE2 no hydrogen 2.944 N/A ARG 64.A NH2 GLU 17.A OE2 no hydrogen 3.062 N/A HIS 66.A N SER 59.A O no hydrogen 2.830 N/A HIS 66.A ND1 ARG 64.A O no hydrogen 2.930 N/A GLU 68.A N THR 56.A O no hydrogen 2.861 N/A MET 70.A N LEU 54.A O no hydrogen 2.921 N/A TYR 76.A N GLY 52.A O no hydrogen 2.889 N/A HIS 77.A ND1 PHE 78.A O no hydrogen 2.846 N/A PHE 78.A N MET 49.A O no hydrogen 2.907 N/A ASP 79.A N ARG 197.A O no hydrogen 2.799 N/A SER 81.A OG GLY 132.A O no hydrogen 2.673 N/A THR 82.A N CYS 85.A O no hydrogen 2.943 N/A SER 83.A OG.B ARG 134.A O no hydrogen 3.020 N/A SER 84.A N THR 82.A OG1 no hydrogen 3.213 N/A CYS 85.A N THR 82.A OG1 no hydrogen 2.890 N/A CYS 85.A SG SER 87.A O no hydrogen 3.587 N/A SER 87.A OG ASP 79.A OD1 no hydrogen 3.437 N/A THR 88.A N ASP 79.A OD1 no hydrogen 2.831 N/A THR 88.A OG1 ASP 79.A OD1 no hydrogen 3.476 N/A THR 88.A OG1 ASP 79.A OD2 no hydrogen 2.748 N/A ASN 89.A N SER 87.A OG no hydrogen 2.984 N/A LEU 92.A N ASN 89.A O no hydrogen 3.096 N/A TYR 96.A OH VAL 126.A O no hydrogen 2.556 N/A GLU 97.A N ASP 94.A OD1 no hydrogen 2.878 N/A SER 98.A N ASP 94.A O no hydrogen 2.968 N/A SER 98.A OG.A ASP 94.A O no hydrogen 3.322 N/A SER 98.A OG.A PRO 95.A O no hydrogen 2.877 N/A SER 98.A OG.B ASP 94.A O no hydrogen 2.792 N/A GLU 99.A N TYR 96.A O no hydrogen 3.298 N/A ARG 100.A N GLU 97.A O no hydrogen 2.867 N/A ARG 100.A NH1 TYR 96.A O no hydrogen 2.931 N/A ARG 100.A NH2 ASP 35.A OD2 no hydrogen 2.907 N/A VAL 101.A N GLU 97.A O no hydrogen 3.038 N/A TYR 102.A N PHE 116.A O no hydrogen 2.943 N/A TYR 102.A OH ASP 213.A OD2 no hydrogen 2.744 N/A ALA 104.A N GLY 114.A O no hydrogen 3.170 N/A SER 106.A N GLY 112.A O no hydrogen 2.840 N/A SER 106.A OG GLU 215.A OE1 no hydrogen 3.171 N/A SER 106.A OG GLU 215.A OE2 no hydrogen 2.684 N/A LEU 107.A N GLU 215.A OE1 no hydrogen 2.925 N/A ILE 108.A N SER 106.A OG no hydrogen 2.948 N/A ALA 111.A N ILE 108.A O no hydrogen 3.224 N/A GLY 114.A N ALA 104.A O no hydrogen 2.732 N/A PHE 116.A N TYR 102.A O no hydrogen 2.898 N/A SER 117.A N GLU 214.A O no hydrogen 2.877 N/A SER 117.A OG VAL 119.A O no hydrogen 2.582 N/A LYS 118.A N ARG 100.A O no hydrogen 2.832 N/A LYS 118.A NZ SER 98.A O no hydrogen 2.712 N/A VAL 121.A N VAL 210.A O no hydrogen 2.995 N/A ASN 124.A N THR 206.A O no hydrogen 2.817 N/A THR 125.A N THR 206.A OG1 no hydrogen 2.969 N/A THR 125.A OG1 GLY 122.A O no hydrogen 2.824 N/A MET 127.A N ILE 204.A O no hydrogen 2.839 N/A SER 128.A OG GLU 97.A OE2 no hydrogen 2.744 N/A PHE 129.A N GLU 97.A OE2 no hydrogen 2.970 N/A TYR 130.A N LYS 202.A O no hydrogen 2.829 N/A TYR 130.A OH ASN 150.A O no hydrogen 2.700 N/A ASN 131.A N SER 175.A OG no hydrogen 3.334 N/A ASN 131.A ND2 ILE 86.A O no hydrogen 3.155 N/A ASN 131.A ND2 TYR 172.A OH no hydrogen 2.984 N/A VAL 133.A N ASP 161.A O no hydrogen 2.848 N/A ARG 134.A N THR 82.A O no hydrogen 3.013 N/A ARG 134.A NE SER 81.A OG no hydrogen 2.902 N/A ARG 134.A NH1 PRO 200.A O.A no hydrogen 3.330 N/A ARG 134.A NH1 PRO 200.A O.B no hydrogen 3.372 N/A ARG 134.A NH2 PRO 200.A O.A no hydrogen 2.810 N/A ARG 134.A NH2 PRO 200.A O.B no hydrogen 2.947 N/A ILE 135.A N VAL 159.A O no hydrogen 2.863 N/A HIS 137.A NE2 ASP 155.A O no hydrogen 2.900 N/A GLU 139.A N THR 136.A OG1 no hydrogen 3.146 N/A VAL 140.A N THR 136.A O no hydrogen 3.231 N/A ASP 141.A N HIS 137.A O no hydrogen 2.788 N/A SER 142.A N GLN 138.A O no hydrogen 3.011 N/A SER 142.A OG.A GLN 138.A O no hydrogen 2.715 N/A SER 142.A OG.B GLN 138.A O no hydrogen 2.792 N/A ARG 143.A N VAL 140.A O no hydrogen 3.437 N/A ARG 143.A NE ASN 148.A OD1 no hydrogen 2.773 N/A ARG 143.A NH2 ASN 148.A OD1 no hydrogen 3.016 N/A ARG 143.A NH2 ASP 161.A OD2 no hydrogen 2.944 N/A TRP 145.A NE1 GLU 228.A OE2 no hydrogen 2.904 N/A LEU 147.A N ASP 144.A O no hydrogen 2.996 N/A ASN 148.A N TRP 145.A O no hydrogen 2.804 N/A ASN 148.A ND2 VAL 140.A O no hydrogen 3.107 N/A ASN 148.A ND2 ARG 143.A O no hydrogen 3.426 N/A ASN 150.A ND2 VAL 162.A O no hydrogen 2.994 N/A THR 151.A OG1 ASN 148.A O no hydrogen 3.071 N/A LEU 152.A N ILE 160.A O no hydrogen 2.749 N/A LEU 154.A N THR 158.A O no hydrogen 2.913 N/A ASP 155.A N THR 158.A O no hydrogen 3.343 N/A GLU 157.A N ASP 155.A OD1 no hydrogen 2.828 N/A THR 158.A N ASP 155.A OD1 no hydrogen 2.788 N/A VAL 159.A N ILE 135.A O no hydrogen 2.810 N/A ILE 160.A N LEU 152.A O no hydrogen 2.806 N/A ASP 161.A N VAL 133.A O no hydrogen 2.943 N/A TYR 166.A N PRO 163.A O no hydrogen 2.815 N/A HIS 168.A N PRO 165.A O no hydrogen 3.224 N/A LYS 171.A N HIS 168.A O no hydrogen 2.805 N/A TYR 172.A N HIS 168.A O no hydrogen 3.006 N/A TYR 172.A OH SER 175.A OG no hydrogen 2.705 N/A CYS 173.A N ALA 90.A O no hydrogen 2.821 N/A CYS 173.A SG LEU 91.A O no hydrogen 3.379 N/A SER 175.A OG TYR 172.A OH no hydrogen 2.705 N/A LEU 176.A N GLU 97.A OE2 no hydrogen 2.879 N/A GLY 177.A N PHE 129.A O no hydrogen 2.875 N/A LYS 179.A N LEU 176.A O no hydrogen 2.934 N/A LYS 179.A NZ GLU 113.A OE1 no hydrogen 2.563 N/A LYS 179.A NZ ASN 167.A O no hydrogen 2.829 N/A ALA 180.A N GLY 177.A O no hydrogen 3.342 N/A ASN 181.A ND2 GLU 113.A O no hydrogen 2.879 N/A ASN 181.A ND2 GLU 215.A OE2 no hydrogen 3.287 N/A SER 183.A N VAL 218.A O no hydrogen 2.990 N/A THR 185.A N SER 183.A OG no hydrogen 2.968 N/A THR 185.A OG1 SER 183.A OG no hydrogen 3.348 N/A ASN 187.A ND2 GLU 214.A OE2 no hydrogen 3.049 N/A ASN 187.A ND2 GLU 215.A O no hydrogen 2.997 N/A CYS 188.A N THR 217.A O no hydrogen 2.990 N/A CYS 188.A SG ASN 187.A OD1 no hydrogen 3.500 N/A ILE 189.A N ARG 205.A O no hydrogen 2.821 N/A ASP 191.A N CYS 203.A O no hydrogen 3.006 N/A MET 192.A N ASP 191.A OD2 no hydrogen 3.220 N/A PHE 193.A N ILE 201.A O no hydrogen 3.030 N/A VAL 194.A N ASP 10.A OD2 no hydrogen 2.868 N/A HIS 195.A N GLY 199.A O no hydrogen 2.936 N/A HIS 195.A NE2 ASP 94.A OD2 no hydrogen 2.800 N/A ARG 197.A N HIS 195.A ND1 no hydrogen 3.008 N/A ARG 197.A NH1 LEU 92.A O no hydrogen 2.889 N/A ARG 197.A NH2 LEU 92.A O no hydrogen 2.973 N/A PHE 198.A N HIS 195.A ND1 no hydrogen 3.177 N/A GLY 199.A N HIS 195.A O no hydrogen 2.833 N/A ILE 201.A N PHE 193.A O no hydrogen 2.876 N/A LYS 202.A NZ SER 153.A O no hydrogen 2.751 N/A CYS 203.A N ASP 191.A O no hydrogen 2.776 N/A CYS 203.A SG ASP 191.A O no hydrogen 3.706 N/A ILE 204.A N SER 128.A O no hydrogen 2.830 N/A ARG 205.A N ILE 189.A O no hydrogen 2.844 N/A ARG 205.A NE ASP 191.A OD1 no hydrogen 2.924 N/A ARG 205.A NH1 ASN 124.A O no hydrogen 2.809 N/A ARG 205.A NH1 ASN 124.A OD1.B no hydrogen 3.138 N/A ARG 205.A NH2 ASP 10.A O no hydrogen 3.129 N/A THR 206.A N THR 125.A O no hydrogen 2.878 N/A THR 206.A OG1 GLY 122.A O no hydrogen 2.808 N/A THR 206.A OG1 ARG 208.A O no hydrogen 3.461 N/A LEU 207.A N ASN 187.A O no hydrogen 2.827 N/A ARG 208.A NH1 ALA 209.A O no hydrogen 2.871 N/A ARG 208.A NH1 GLU 214.A OE2 no hydrogen 2.932 N/A ARG 208.A NH2 GLU 214.A OE2 no hydrogen 2.831 N/A VAL 210.A N VAL 121.A O no hydrogen 2.828 N/A GLU 211.A N GLU 214.A OE1 no hydrogen 2.915 N/A ASP 213.A N SER 117.A O no hydrogen 2.639 N/A GLU 214.A N GLU 211.A O no hydrogen 3.197 N/A LEU 216.A N LEU 115.A O no hydrogen 2.661 N/A THR 217.A N ASN 187.A OD1 no hydrogen 2.938 N/A VAL 218.A N ASN 181.A O no hydrogen 3.189 N/A TYR 220.A N HIS 182.A ND1 no hydrogen 2.979 N/A TYR 220.A OH ALA 180.A O no hydrogen 2.670 N/A TYR 222.A N TYR 233.A OH no hydrogen 3.290 N/A HIS 224.A NE2 TYR 233.A OH no hydrogen 2.585 N/A SER 225.A N ASP 223.A OD2 no hydrogen 3.131 N/A GLU 228.A N ASP 223.A O no hydrogen 3.028 N/A TYR 233.A N PRO 230.A O no hydrogen 3.125 N/A TYR 233.A OH HIS 224.A NE2 no hydrogen 2.585 N/A GLN 234.A N PRO 230.A O no hydrogen 3.181 N/A GLN 234.A NE2 ALA 229.A O no hydrogen 2.985 N/A VAL 235.A N GLU 231.A O no hydrogen 2.856 N/A GLU 236.A N TRP 232.A O no hydrogen 3.010 N/A LEU 237.A N TYR 233.A O no hydrogen 2.701 N/A LYS 238.A N GLN 234.A O no hydrogen 3.151 N/A ALA 239.A N VAL 235.A O no hydrogen 3.481 N/A PHE 240.A N GLU 236.A O no hydrogen 2.917 N/A GLN 241.A N LEU 237.A O no hydrogen 2.853 N/A ALA 242.A N LYS 238.A O no hydrogen 3.022 N/A THR 243.A N ALA 239.A O no hydrogen 3.191 N/A THR 243.A OG1 PHE 240.A O no hydrogen 2.816 N/A GLN 244.A N GLN 241.A O no hydrogen 3.295 N/A