Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1x78_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N SER 2.A OG no hydrogen 3.330 N/A LEU 6.A N SER 2.A O no hydrogen 2.936 N/A VAL 7.A N PRO 3.A O no hydrogen 2.845 N/A LEU 8.A N GLU 4.A O no hydrogen 3.015 N/A THR 9.A N GLN 5.A O no hydrogen 3.074 N/A LEU 10.A N LEU 6.A O no hydrogen 3.162 N/A LEU 10.A N VAL 7.A O no hydrogen 3.007 N/A LEU 11.A N VAL 7.A O no hydrogen 3.041 N/A GLU 12.A N LEU 8.A O no hydrogen 3.065 N/A ALA 13.A N LEU 10.A O no hydrogen 2.875 N/A GLU 14.A N LEU 11.A O no hydrogen 3.171 N/A ILE 20.A N ASP 97.A OD1 no hydrogen 3.298 N/A SER 21.A N ASP 97.A OD2 no hydrogen 2.816 N/A ARG 22.A N ASP 97.A OD2 no hydrogen 3.437 N/A ARG 22.A NH1 ALA 25.A O no hydrogen 3.464 N/A ARG 22.A NH2 ALA 25.A O no hydrogen 2.621 N/A THR 28.A N SER 31.A OG no hydrogen 2.873 N/A THR 28.A OG1 SER 31.A OG no hydrogen 2.672 N/A SER 31.A N THR 28.A OG1 no hydrogen 3.365 N/A SER 31.A OG THR 28.A O no hydrogen 3.471 N/A SER 31.A OG THR 28.A OG1 no hydrogen 2.672 N/A MET 32.A N THR 28.A O no hydrogen 3.242 N/A MET 33.A N GLU 29.A O no hydrogen 3.213 N/A MET 34.A N ALA 30.A O no hydrogen 3.030 N/A SER 35.A N SER 31.A O no hydrogen 3.122 N/A SER 35.A OG SER 31.A O no hydrogen 3.028 N/A LEU 36.A N MET 32.A O no hydrogen 3.022 N/A THR 37.A N MET 33.A O no hydrogen 3.081 N/A THR 37.A OG1 MET 33.A O no hydrogen 2.956 N/A THR 37.A OG1 MET 34.A O no hydrogen 3.123 N/A LYS 38.A N MET 34.A O no hydrogen 2.978 N/A LYS 38.A NZ ILE 20.A O no hydrogen 2.732 N/A LEU 39.A N SER 35.A O no hydrogen 2.749 N/A ALA 40.A N LEU 36.A O no hydrogen 2.874 N/A ASP 41.A N THR 37.A O no hydrogen 2.976 N/A LYS 42.A N LYS 38.A O no hydrogen 3.161 N/A LYS 42.A NZ LEU 19.A O no hydrogen 2.660 N/A GLU 43.A N LEU 39.A O no hydrogen 2.909 N/A LEU 44.A N ALA 40.A O no hydrogen 2.870 N/A MET 47.A N GLU 43.A O no hydrogen 2.838 N/A ILE 48.A N LEU 44.A O no hydrogen 3.234 N/A ILE 48.A N VAL 45.A O no hydrogen 3.231 N/A SER 49.A N VAL 45.A O no hydrogen 3.498 N/A TRP 50.A N HIS 46.A O no hydrogen 2.949 N/A ALA 51.A N MET 47.A O no hydrogen 2.938 N/A LYS 52.A N ILE 48.A O no hydrogen 3.135 N/A LYS 53.A N SER 49.A O no hydrogen 3.234 N/A LYS 53.A N TRP 50.A O no hydrogen 3.015 N/A ILE 54.A N ALA 51.A O no hydrogen 2.870 N/A PHE 57.A N ILE 54.A O no hydrogen 2.953 N/A GLU 59.A N GLY 56.A O no hydrogen 2.802 N/A LEU 60.A N PHE 57.A O no hydrogen 3.184 N/A SER 61.A N SER 150.A OG no hydrogen 2.974 N/A ASP 64.A N SER 61.A O no hydrogen 2.967 N/A ASP 64.A N SER 61.A OG no hydrogen 3.116 N/A GLN 65.A N SER 61.A O no hydrogen 3.075 N/A GLN 65.A NE2 LEU 60.A O no hydrogen 2.948 N/A VAL 66.A N LEU 62.A O no hydrogen 3.051 N/A ARG 67.A N PHE 63.A O no hydrogen 3.082 N/A ARG 67.A NH1 ASP 64.A OD1 no hydrogen 2.918 N/A ARG 67.A NH2 SER 147.A OG no hydrogen 2.379 N/A LEU 68.A N ASP 64.A O no hydrogen 2.825 N/A LEU 69.A N GLN 65.A O no hydrogen 3.186 N/A GLU 70.A N VAL 66.A O no hydrogen 2.817 N/A SER 71.A N ARG 67.A O no hydrogen 3.123 N/A SER 71.A OG ARG 67.A O no hydrogen 2.814 N/A SER 71.A OG LEU 68.A O no hydrogen 3.280 N/A SER 71.A OG SER 146.A O no hydrogen 3.295 N/A SER 71.A OG SER 146.A OG no hydrogen 3.216 N/A CYS 72.A N LEU 68.A O no hydrogen 3.212 N/A CYS 72.A SG LEU 68.A O no hydrogen 3.141 N/A TRP 73.A N LEU 69.A O no hydrogen 3.181 N/A TRP 73.A NE1 MET 222.A O no hydrogen 3.033 N/A VAL 76.A N CYS 72.A O no hydrogen 2.964 N/A LEU 77.A N TRP 73.A O no hydrogen 2.842 N/A MET 78.A N MET 74.A O no hydrogen 2.869 N/A MET 79.A N GLU 75.A O no hydrogen 2.744 N/A GLY 80.A N VAL 76.A O no hydrogen 3.022 N/A LEU 81.A N LEU 77.A O no hydrogen 2.913 N/A MET 82.A N MET 78.A O no hydrogen 2.960 N/A TRP 83.A N MET 79.A O no hydrogen 3.149 N/A ARG 84.A N GLY 80.A O no hydrogen 3.135 N/A ARG 84.A NE ILE 93.A O no hydrogen 3.119 N/A ARG 84.A NE PHE 94.A O no hydrogen 3.402 N/A ARG 84.A NH2 PHE 94.A O no hydrogen 3.122 N/A SER 85.A N LEU 81.A O no hydrogen 3.003 N/A SER 85.A OG LEU 81.A O no hydrogen 2.627 N/A HIS 88.A N SER 85.A O no hydrogen 2.962 N/A LYS 91.A N HIS 88.A O no hydrogen 3.036 N/A LEU 92.A N LEU 100.A O no hydrogen 3.012 N/A ILE 93.A N SER 85.A OG no hydrogen 2.840 N/A PHE 94.A N LEU 92.A O no hydrogen 3.105 N/A ALA 95.A N LEU 98.A O no hydrogen 3.319 N/A ASP 97.A N ASP 97.A OD1 no hydrogen 2.546 N/A LEU 98.A N ALA 95.A O no hydrogen 2.858 N/A LEU 100.A N LEU 92.A O no hydrogen 3.144 N/A ASP 101.A N GLU 104.A OE2 no hydrogen 3.037 N/A ARG 102.A NH1 ASP 116.A OD1 no hydrogen 3.316 N/A ASP 103.A N ASP 101.A OD2 no hydrogen 3.115 N/A GLY 105.A N ARG 102.A O no hydrogen 2.842 N/A LYS 106.A N ASP 103.A O no hydrogen 2.776 N/A CYS 107.A N GLU 104.A O no hydrogen 3.332 N/A CYS 107.A SG GLU 104.A O no hydrogen 3.527 N/A ILE 111.A N VAL 108.A O no hydrogen 3.264 N/A PHE 115.A N ILE 111.A O no hydrogen 2.900 N/A ASP 116.A N LEU 112.A O no hydrogen 2.961 N/A MET 117.A N GLU 113.A O no hydrogen 3.187 N/A LEU 118.A N ILE 114.A O no hydrogen 2.855 N/A LEU 119.A N PHE 115.A O no hydrogen 2.677 N/A ALA 120.A N ASP 116.A O no hydrogen 3.005 N/A THR 121.A N MET 117.A O no hydrogen 3.088 N/A THR 121.A OG1 MET 117.A O no hydrogen 2.905 N/A THR 122.A N LEU 118.A O no hydrogen 2.825 N/A THR 122.A OG1 LEU 118.A O no hydrogen 2.708 N/A SER 123.A N LEU 119.A O no hydrogen 2.832 N/A SER 123.A OG GLU 127.A OE2 no hydrogen 3.357 N/A ARG 124.A N ALA 120.A O no hydrogen 2.829 N/A PHE 125.A N THR 121.A O no hydrogen 2.944 N/A ARG 126.A N THR 122.A O no hydrogen 2.916 N/A ARG 126.A NE ILE 86.A O no hydrogen 2.844 N/A ARG 126.A NH2 ILE 86.A O no hydrogen 3.394 N/A GLU 127.A N SER 123.A O no hydrogen 2.923 N/A LEU 128.A N ARG 124.A O no hydrogen 3.224 N/A LYS 129.A N ARG 126.A O no hydrogen 2.810 N/A LEU 130.A N PHE 125.A O no hydrogen 3.103 N/A GLN 131.A N GLU 134.A OE1 no hydrogen 2.798 N/A GLN 131.A NE2 LYS 129.A O no hydrogen 3.008 N/A GLU 134.A N GLN 131.A O no hydrogen 2.927 N/A TYR 135.A N GLN 131.A O no hydrogen 3.041 N/A LEU 136.A N HIS 132.A O no hydrogen 3.032 N/A CYS 137.A N LYS 133.A O no hydrogen 3.287 N/A CYS 137.A SG LYS 133.A O no hydrogen 3.286 N/A VAL 138.A N GLU 134.A O no hydrogen 2.916 N/A LYS 139.A N TYR 135.A O no hydrogen 2.928 N/A LYS 139.A NZ GLU 14.A OE1 no hydrogen 2.669 N/A LYS 139.A NZ TYR 135.A OH no hydrogen 3.125 N/A ALA 140.A N LEU 136.A O no hydrogen 3.109 N/A MET 141.A N CYS 137.A O no hydrogen 2.820 N/A ILE 142.A N VAL 138.A O no hydrogen 2.937 N/A LEU 143.A N LYS 139.A O no hydrogen 3.396 N/A LEU 144.A N ALA 140.A O no hydrogen 3.091 N/A ASN 145.A N MET 141.A O no hydrogen 2.699 N/A SER 146.A OG LEU 68.A O no hydrogen 3.268 N/A SER 146.A OG SER 71.A OG no hydrogen 3.216 N/A SER 146.A OG LEU 143.A O no hydrogen 2.993 N/A SER 147.A OG SER 147.A O no hydrogen 2.413 N/A MET 148.A N SER 146.A O no hydrogen 2.900 N/A SER 150.A OG ASP 64.A OD2 no hydrogen 2.517 N/A LYS 153.A NZ GLU 59.A O no hydrogen 3.526 N/A LEU 154.A N SER 150.A O no hydrogen 2.968 N/A ALA 155.A N SER 151.A O no hydrogen 2.924 N/A HIS 156.A N ARG 152.A O no hydrogen 2.824 N/A LEU 157.A N LYS 153.A O no hydrogen 2.850 N/A LEU 158.A N LEU 154.A O no hydrogen 2.816 N/A ASN 159.A N ALA 155.A O no hydrogen 2.964 N/A ALA 160.A N HIS 156.A O no hydrogen 2.950 N/A VAL 161.A N LEU 157.A O no hydrogen 2.997 N/A THR 162.A N LEU 158.A O no hydrogen 2.969 N/A THR 162.A OG1 LEU 158.A O no hydrogen 2.837 N/A ASP 163.A N ASN 159.A O no hydrogen 2.907 N/A ALA 164.A N ALA 160.A O no hydrogen 2.958 N/A LEU 165.A N VAL 161.A O no hydrogen 3.047 N/A VAL 166.A N THR 162.A O no hydrogen 3.075 N/A TRP 167.A N ASP 163.A O no hydrogen 3.005 N/A VAL 168.A N ALA 164.A O no hydrogen 2.911 N/A ILE 169.A N LEU 165.A O no hydrogen 3.042 N/A ALA 170.A N VAL 166.A O no hydrogen 2.961 N/A LYS 171.A N TRP 167.A O no hydrogen 3.019 N/A LYS 171.A N VAL 168.A O no hydrogen 3.231 N/A SER 172.A N ILE 169.A O no hydrogen 3.340 N/A SER 172.A OG ILE 169.A O no hydrogen 2.541 N/A GLY 173.A N ALA 170.A O no hydrogen 3.339 N/A GLN 178.A N SER 175.A OG no hydrogen 3.388 N/A GLN 179.A N SER 176.A O no hydrogen 2.985 N/A GLN 179.A NE2 ILE 174.A O no hydrogen 2.683 N/A GLN 179.A NE2 SER 175.A O no hydrogen 3.545 N/A SER 180.A N SER 176.A O no hydrogen 3.091 N/A SER 180.A OG SER 176.A O no hydrogen 3.256 N/A MET 181.A N GLN 177.A O no hydrogen 3.166 N/A ARG 182.A N GLN 178.A O no hydrogen 3.096 N/A ARG 182.A NE GLU 134.A OE2 no hydrogen 2.655 N/A ARG 182.A NH1 LEU 128.A O no hydrogen 2.800 N/A ARG 182.A NH2 LEU 128.A O no hydrogen 3.106 N/A ARG 182.A NH2 LYS 129.A O no hydrogen 3.256 N/A ARG 182.A NH2 GLU 134.A OE1 no hydrogen 2.629 N/A ARG 182.A NH2 GLU 134.A OE2 no hydrogen 3.225 N/A LEU 183.A N GLN 179.A O no hydrogen 2.935 N/A ALA 184.A N SER 180.A O no hydrogen 2.913 N/A ASN 185.A N MET 181.A O no hydrogen 2.939 N/A LEU 186.A N ARG 182.A O no hydrogen 3.011 N/A LEU 187.A N LEU 183.A O no hydrogen 3.068 N/A MET 188.A N ALA 184.A O no hydrogen 2.792 N/A LEU 189.A N LEU 186.A O no hydrogen 3.053 N/A LEU 190.A N LEU 187.A O no hydrogen 3.170 N/A VAL 193.A N LEU 189.A O no hydrogen 3.082 N/A ARG 194.A N LEU 190.A O no hydrogen 2.779 N/A ARG 194.A NE GLU 75.A OE1 no hydrogen 2.548 N/A HIS 195.A N SER 191.A O no hydrogen 2.893 N/A ALA 196.A N HIS 192.A O no hydrogen 2.926 N/A SER 197.A N VAL 193.A O no hydrogen 2.870 N/A SER 197.A N ARG 194.A O no hydrogen 3.177 N/A ASN 198.A N ARG 194.A O no hydrogen 2.970 N/A LYS 199.A N HIS 195.A O no hydrogen 3.200 N/A GLY 200.A N ALA 196.A O no hydrogen 3.114 N/A MET 201.A N SER 197.A O no hydrogen 2.967 N/A GLU 202.A N ASN 198.A O no hydrogen 3.027 N/A HIS 203.A N LYS 199.A O no hydrogen 2.933 N/A HIS 203.A NE2 GLU 109.A O no hydrogen 2.967 N/A LEU 204.A N GLY 200.A O no hydrogen 3.044 N/A LEU 205.A N MET 201.A O no hydrogen 2.785 N/A ASN 206.A N GLU 202.A O no hydrogen 3.042 N/A MET 207.A N HIS 203.A O no hydrogen 3.015 N/A LYS 208.A N LEU 204.A O no hydrogen 2.813 N/A LYS 208.A NZ ASN 224.A OD1 no hydrogen 3.072 N/A CYS 209.A N LEU 205.A O no hydrogen 2.919 N/A CYS 209.A SG LEU 205.A O no hydrogen 3.577 N/A LYS 210.A N ASN 206.A O no hydrogen 3.190 N/A LYS 210.A N MET 207.A O no hydrogen 3.260 N/A ASN 211.A N LYS 208.A O no hydrogen 2.704 N/A VAL 212.A N MET 207.A O no hydrogen 3.234 N/A LEU 219.A N ASP 41.A OD1 no hydrogen 3.292 N/A LEU 220.A N TYR 216.A O no hydrogen 2.612 N/A GLU 221.A N ASP 217.A O no hydrogen 2.822 N/A MET 222.A N LEU 218.A O no hydrogen 2.990 N/A LEU 223.A N LEU 219.A O no hydrogen 3.007 N/A ASN 224.A N LEU 220.A O no hydrogen 2.894 N/A ALA 225.A N GLU 221.A O no hydrogen 2.756 N/A HIS 226.A N MET 222.A O no hydrogen 3.306 N/A VAL 227.A N LEU 223.A O no hydrogen 2.720 N/A LEU 228.A N ASN 224.A O no hydrogen 2.883 N/A