Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6c99_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N SER 3.A OG no hydrogen 3.270 N/A LEU 4.A N CYS 93.A O no hydrogen 2.828 N/A LEU 5.A N TRP 26.A O no hydrogen 2.999 N/A TYR 6.A N LEU 91.A O no hydrogen 2.717 N/A TYR 6.A OH GLU 61.A OE1 no hydrogen 2.708 N/A TYR 6.A OH GLU 61.A OE2 no hydrogen 3.307 N/A HIS 7.A N SER 24.A O no hydrogen 2.783 N/A LEU 8.A N GLY 89.A O no hydrogen 2.897 N/A THR 9.A N TRP 22.A O no hydrogen 2.972 N/A ALA 10.A N LEU 87.A O no hydrogen 2.803 N/A VAL 11.A N ALA 20.A O no hydrogen 2.907 N/A SER 12.A N TYR 85.A O no hydrogen 3.030 N/A SER 12.A OG TYR 85.A O no hydrogen 3.492 N/A SER 13.A OG SER 13.A O no hydrogen 2.608 N/A THR 18.A N ALA 15.A O no hydrogen 2.991 N/A THR 18.A OG1 ALA 15.A O no hydrogen 2.643 N/A PHE 21.A N SER 37.A OG no hydrogen 3.070 N/A TRP 22.A N THR 9.A O no hydrogen 2.949 N/A VAL 23.A N TYR 35.A O no hydrogen 2.690 N/A SER 24.A N HIS 7.A O no hydrogen 3.031 N/A GLY 25.A N LEU 33.A O no hydrogen 2.960 N/A TRP 26.A N LEU 5.A O no hydrogen 2.883 N/A TRP 26.A NE1 SER 24.A OG no hydrogen 2.850 N/A LEU 27.A N GLN 30.A O no hydrogen 2.767 N/A GLY 28.A N SER 3.A O no hydrogen 2.905 N/A GLN 30.A N LEU 27.A O no hydrogen 2.946 N/A GLN 30.A NE2 ASN 170.A O no hydrogen 2.707 N/A GLN 30.A NE2 TYR 201.A OH no hydrogen 2.915 N/A GLN 31.A NE2 LEU 33.A O no hydrogen 3.002 N/A TYR 32.A N GLY 25.A O no hydrogen 2.748 N/A TYR 32.A OH GLU 61.A OE2 no hydrogen 2.716 N/A LEU 33.A N GLY 25.A O no hydrogen 3.244 N/A SER 34.A N GLU 43.A O no hydrogen 2.864 N/A TYR 35.A N VAL 23.A O no hydrogen 2.892 N/A TYR 35.A OH GLU 69.A OE2 no hydrogen 2.759 N/A SER 37.A N PHE 21.A O no hydrogen 2.771 N/A SER 37.A OG PHE 21.A O no hydrogen 3.135 N/A ARG 39.A N ASN 36.A OD1 no hydrogen 2.945 N/A GLY 40.A N ASN 36.A O no hydrogen 2.774 N/A ALA 42.A N THR 62.A OG1 no hydrogen 2.961 N/A GLU 43.A N SER 34.A O no hydrogen 2.750 N/A CYS 45.A N TYR 32.A O no hydrogen 2.962 N/A TRP 48.A N CYS 45.A O no hydrogen 2.989 N/A TRP 48.A NE1 GLN 30.A OE1 no hydrogen 3.088 N/A VAL 49.A N GLY 46.A O no hydrogen 3.077 N/A TRP 50.A N ALA 47.A O no hydrogen 3.058 N/A GLU 51.A N TRP 48.A O no hydrogen 3.179 N/A GLN 53.A NE2 GLU 51.A OE1 no hydrogen 3.192 N/A VAL 54.A N GLN 53.A OE1 no hydrogen 2.726 N/A TYR 57.A N VAL 54.A O no hydrogen 3.276 N/A TYR 57.A OH GLU 61.A OE2 no hydrogen 2.581 N/A GLU 59.A N GLU 59.A OE1 no hydrogen 2.632 N/A LYS 60.A N TRP 56.A O no hydrogen 2.998 N/A GLU 61.A N TYR 57.A O no hydrogen 3.100 N/A THR 62.A N TRP 58.A O no hydrogen 2.941 N/A THR 62.A OG1 GLU 41.A OE1 no hydrogen 3.535 N/A THR 62.A OG1 TRP 58.A O no hydrogen 2.900 N/A THR 63.A N GLU 59.A O no hydrogen 2.983 N/A THR 63.A OG1 GLU 59.A O no hydrogen 2.981 N/A ASP 64.A N LYS 60.A O no hydrogen 3.060 N/A LEU 65.A N GLU 61.A O no hydrogen 3.044 N/A ARG 66.A N THR 62.A O no hydrogen 2.891 N/A ARG 66.A NE GLY 40.A O no hydrogen 2.837 N/A ARG 66.A NH2 GLY 40.A O no hydrogen 3.067 N/A ILE 67.A N THR 63.A O no hydrogen 3.211 N/A LYS 68.A N ASP 64.A O no hydrogen 3.129 N/A LYS 68.A NZ GLU 148.A OE2 no hydrogen 3.051 N/A GLU 69.A N LEU 65.A O no hydrogen 2.722 N/A LYS 70.A N ARG 66.A O no hydrogen 3.153 N/A LEU 71.A N ILE 67.A O no hydrogen 3.036 N/A PHE 72.A N LYS 68.A O no hydrogen 2.803 N/A LEU 73.A N GLU 69.A O no hydrogen 2.903 N/A GLU 74.A N LYS 70.A O no hydrogen 2.847 N/A ALA 75.A N LEU 71.A O no hydrogen 3.075 N/A ALA 75.A N PHE 72.A O no hydrogen 3.032 N/A PHE 76.A N LEU 73.A O no hydrogen 3.310 N/A ALA 78.A N GLU 74.A O no hydrogen 3.394 N/A LEU 79.A N PHE 76.A O no hydrogen 2.997 N/A GLY 80.A N PHE 76.A O no hydrogen 3.243 N/A GLY 80.A N LYS 77.A O no hydrogen 3.349 N/A TYR 85.A N SER 12.A OG no hydrogen 2.811 N/A TYR 85.A OH GLY 80.A O no hydrogen 3.404 N/A THR 86.A N ASN 110.A OD1 no hydrogen 2.890 N/A LEU 87.A N ALA 10.A O no hydrogen 2.892 N/A GLN 88.A N ALA 108.A O no hydrogen 2.912 N/A GLY 89.A N LEU 8.A O no hydrogen 2.834 N/A LEU 90.A N LYS 106.A O no hydrogen 2.793 N/A LEU 91.A N TYR 6.A O no hydrogen 3.112 N/A GLY 92.A N THR 104.A O no hydrogen 2.954 N/A CYS 93.A N LEU 4.A O no hydrogen 2.863 N/A GLU 94.A N VAL 102.A O no hydrogen 3.030 N/A GLY 96.A N THR 100.A O no hydrogen 2.681 N/A ASN 99.A N GLY 96.A O no hydrogen 2.997 N/A VAL 102.A N GLU 94.A O no hydrogen 2.653 N/A THR 104.A N GLY 92.A O no hydrogen 2.808 N/A LYS 106.A N LEU 90.A O no hydrogen 3.022 N/A PHE 107.A N MET 115.A O no hydrogen 2.814 N/A ALA 108.A N GLN 88.A O no hydrogen 2.894 N/A LEU 109.A N GLU 112.A O no hydrogen 2.860 N/A ASN 110.A N THR 86.A O no hydrogen 2.818 N/A GLU 112.A N LEU 109.A O no hydrogen 3.056 N/A PHE 114.A N PHE 107.A O no hydrogen 2.885 N/A MET 115.A N PHE 107.A O no hydrogen 3.323 N/A ASN 116.A N GLY 125.A O no hydrogen 2.956 N/A PHE 117.A N ALA 105.A O no hydrogen 3.140 N/A ASP 118.A N THR 123.A O no hydrogen 2.687 N/A LYS 120.A N ASP 118.A OD1 no hydrogen 2.836 N/A GLN 121.A N ASP 118.A OD1 no hydrogen 3.190 N/A THR 123.A N ASP 118.A O no hydrogen 3.164 N/A TRP 124.A N GLN 139.A OE1 no hydrogen 3.355 N/A TRP 124.A NE1 GLU 148.A OE1 no hydrogen 2.918 N/A GLY 125.A N ASN 116.A O no hydrogen 2.855 N/A GLU 130.A N GLU 130.A OE2 no hydrogen 2.688 N/A LEU 132.A N TRP 128.A O no hydrogen 3.097 N/A ALA 133.A N PRO 129.A O no hydrogen 2.902 N/A ILE 134.A N GLU 130.A O no hydrogen 3.009 N/A SER 135.A N ALA 131.A O no hydrogen 2.787 N/A SER 135.A OG TRP 124.A O no hydrogen 2.439 N/A GLN 136.A N LEU 132.A O no hydrogen 2.813 N/A ARG 137.A N ALA 133.A O no hydrogen 3.099 N/A TRP 138.A N ILE 134.A O no hydrogen 2.845 N/A TRP 138.A NE1 LEU 71.A O no hydrogen 2.985 N/A GLN 139.A N SER 135.A O no hydrogen 2.576 N/A GLN 139.A NE2 GLY 122.A O no hydrogen 3.140 N/A GLN 140.A N GLN 136.A O no hydrogen 3.052 N/A GLN 141.A N TRP 138.A O no hydrogen 3.060 N/A ALA 144.A N GLN 141.A O no hydrogen 3.140 N/A LYS 147.A N LYS 143.A O no hydrogen 3.021 N/A GLU 148.A N ALA 144.A O no hydrogen 2.931 N/A LEU 149.A N ALA 145.A O no hydrogen 2.863 N/A THR 150.A N ASN 146.A O no hydrogen 2.900 N/A THR 150.A OG1 ASN 146.A O no hydrogen 3.214 N/A PHE 151.A N LYS 147.A O no hydrogen 2.745 N/A LEU 152.A N GLU 148.A O no hydrogen 3.007 N/A LEU 153.A N LEU 149.A O no hydrogen 2.875 N/A PHE 154.A N THR 150.A O no hydrogen 2.873 N/A SER 155.A N THR 150.A O no hydrogen 2.987 N/A CYS 156.A N PHE 151.A O no hydrogen 2.800 N/A CYS 156.A SG.A LEU 4.A O no hydrogen 3.777 N/A CYS 156.A SG.B PHE 151.A O no hydrogen 3.122 N/A HIS 158.A N PHE 154.A O no hydrogen 3.053 N/A ARG 159.A N SER 155.A O no hydrogen 2.825 N/A ARG 159.A NH1 ASP 64.A OD2 no hydrogen 2.910 N/A ARG 159.A NH2 ASP 64.A OD2 no hydrogen 3.050 N/A LEU 160.A N CYS 156.A O no hydrogen 2.795 N/A ARG 161.A N PRO 157.A O no hydrogen 2.934 N/A ARG 161.A NH1 ASN 99.A O no hydrogen 3.032 N/A ARG 161.A NH1 ASN 99.A OD1 no hydrogen 3.444 N/A ARG 161.A NH2 ASN 99.A OD1 no hydrogen 2.909 N/A GLU 162.A N HIS 158.A O no hydrogen 2.993 N/A HIS 163.A N ARG 159.A O no hydrogen 2.879 N/A HIS 163.A ND1 GLU 51.A OE2 no hydrogen 2.590 N/A HIS 163.A NE2 TYR 57.A OH no hydrogen 2.513 N/A LEU 164.A N LEU 160.A O no hydrogen 2.816 N/A GLU 165.A N ARG 161.A O no hydrogen 2.929 N/A GLU 165.A N GLU 162.A O no hydrogen 3.273 N/A ARG 166.A N GLU 162.A O no hydrogen 2.805 N/A ARG 166.A NH1 ASN 52.A O no hydrogen 2.907 N/A GLY 167.A N HIS 163.A O no hydrogen 2.710 N/A LEU 171.A N GLY 167.A O no hydrogen 3.295 N/A LEU 171.A N ARG 168.A O no hydrogen 3.231 N/A GLU 172.A N ARG 168.A O no hydrogen 3.072 N/A GLU 175.A N TYR 201.A O no hydrogen 2.760 N/A SER 178.A N PHE 198.A O no hydrogen 2.918 N/A ARG 180.A N SER 196.A O no hydrogen 2.982 N/A ARG 180.A NH1 MET 179.A O no hydrogen 2.934 N/A LYS 182.A N THR 194.A O no hydrogen 3.049 N/A ARG 184.A N VAL 192.A O no hydrogen 2.951 N/A ARG 184.A NH1 PRO 185.A O no hydrogen 3.558 N/A SER 186.A N PHE 190.A O no hydrogen 2.945 N/A PHE 190.A N SER 187.A O no hydrogen 2.835 N/A SER 191.A N VAL 239.A O no hydrogen 2.864 N/A SER 191.A OG SER 241.A OG no hydrogen 3.098 N/A SER 191.A OG GLU 244.A OE2 no hydrogen 2.847 N/A VAL 192.A N ARG 184.A O no hydrogen 2.919 N/A LEU 193.A N LEU 237.A O no hydrogen 2.786 N/A THR 194.A N LYS 182.A O no hydrogen 2.752 N/A THR 194.A OG1 SER 236.A OG no hydrogen 2.675 N/A CYS 195.A N SER 235.A O no hydrogen 2.758 N/A SER 196.A N ARG 180.A O no hydrogen 2.807 N/A SER 196.A OG SER 234.A OG.B no hydrogen 3.178 N/A ALA 197.A N ALA 233.A O no hydrogen 2.739 N/A PHE 198.A N SER 178.A O no hydrogen 2.777 N/A SER 199.A OG.B GLU 175.A OE2 no hydrogen 3.182 N/A PHE 200.A N PHE 231.A O no hydrogen 3.050 N/A TYR 201.A N GLU 175.A O no hydrogen 3.071 N/A GLN 206.A N GLN 252.A O no hydrogen 3.080 N/A ARG 208.A N ILE 250.A O no hydrogen 2.935 N/A ARG 208.A NE GLN 206.A OE1 no hydrogen 2.922 N/A PHE 209.A N GLY 217.A O no hydrogen 2.841 N/A LEU 210.A N CYS 248.A O no hydrogen 2.909 N/A ARG 211.A N LEU 214.A O no hydrogen 2.712 N/A ARG 211.A NE ASP 243.A OD2 no hydrogen 2.947 N/A ARG 211.A NH2 ASP 243.A OD1 no hydrogen 3.148 N/A ARG 211.A NH2 ASP 243.A OD2 no hydrogen 3.402 N/A ASN 212.A N HIS 246.A O no hydrogen 2.836 N/A LEU 214.A N ARG 211.A O no hydrogen 3.135 N/A ALA 216.A N PHE 209.A O no hydrogen 2.839 N/A THR 218.A OG1 GLY 219.A O no hydrogen 3.338 N/A GLN 220.A N SER 236.A O no hydrogen 2.875 N/A ASP 222.A N SER 234.A O no hydrogen 2.804 N/A GLY 224.A N HIS 232.A O no hydrogen 2.918 N/A ASN 226.A N SER 230.A O no hydrogen 2.796 N/A ASN 226.A ND2 SER 230.A OG no hydrogen 2.996 N/A GLY 229.A N ASN 226.A O no hydrogen 3.086 N/A SER 230.A N ASP 228.A OD1 no hydrogen 2.985 N/A SER 230.A OG ASP 228.A OD1 no hydrogen 2.780 N/A PHE 231.A N PHE 200.A O no hydrogen 2.779 N/A HIS 232.A N GLY 224.A O no hydrogen 2.814 N/A ALA 233.A N ALA 197.A O no hydrogen 3.012 N/A SER 234.A N ASP 222.A O no hydrogen 2.953 N/A SER 234.A OG.A ASP 222.A OD1 no hydrogen 2.658 N/A SER 234.A OG.B CYS 195.A O no hydrogen 3.342 N/A SER 234.A OG.B SER 196.A OG no hydrogen 3.178 N/A SER 235.A N CYS 195.A O no hydrogen 2.841 N/A SER 235.A OG.A THR 218.A O no hydrogen 2.543 N/A SER 236.A N GLN 220.A O no hydrogen 2.950 N/A SER 236.A OG THR 194.A OG1 no hydrogen 2.675 N/A LEU 237.A N LEU 193.A O no hydrogen 2.825 N/A VAL 239.A N SER 191.A O no hydrogen 2.835 N/A SER 241.A N GLY 189.A O no hydrogen 2.746 N/A SER 241.A OG SER 191.A OG no hydrogen 3.098 N/A GLY 242.A N GLU 244.A OE2 no hydrogen 3.291 N/A ASP 243.A N LYS 240.A O no hydrogen 2.930 N/A GLU 244.A N GLU 244.A OE1 no hydrogen 2.664 N/A HIS 246.A N ASP 243.A O no hydrogen 3.069 N/A HIS 246.A ND1 ASP 243.A OD1 no hydrogen 2.445 N/A TYR 247.A N GLU 244.A O no hydrogen 3.111 N/A CYS 248.A N LEU 210.A O no hydrogen 2.934 N/A CYS 248.A SG.B GLU 263.A OE1 no hydrogen 3.027 N/A CYS 248.A SG.B GLU 263.A OE2 no hydrogen 3.235 N/A CYS 249.A N VAL 262.A O no hydrogen 3.073 N/A CYS 249.A SG.A ARG 208.A O no hydrogen 3.767 N/A ILE 250.A N ARG 208.A O no hydrogen 2.719 N/A VAL 251.A N LEU 260.A O no hydrogen 2.978 N/A GLN 252.A N GLN 206.A O no hydrogen 2.987 N/A HIS 253.A NE2 PRO 202.A O no hydrogen 2.916 N/A GLY 255.A N HIS 253.A ND1 no hydrogen 2.971 N/A LEU 256.A N HIS 253.A O no hydrogen 2.931 N/A LEU 260.A N VAL 251.A O no hydrogen 2.899 N/A ARG 261.A NE GLU 263.A OE2 no hydrogen 3.186 N/A VAL 262.A N CYS 249.A O no hydrogen 2.698 N/A GLU 265.A N LEU 181.A O no hydrogen 3.071 N/A