Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q95_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N SER 2.A O no hydrogen 3.457 N/A SER 6.A N LYS 3.A O no hydrogen 3.258 N/A SER 6.A OG ASP 70.A OD1 no hydrogen 2.446 N/A ALA 8.A N SER 6.A OG no hydrogen 3.399 N/A LEU 9.A N SER 6.A O no hydrogen 3.247 N/A SER 10.A N LEU 7.A O no hydrogen 3.247 N/A SER 10.A OG LEU 7.A O no hydrogen 3.071 N/A LEU 11.A N ALA 8.A O no hydrogen 3.304 N/A GLN 15.A N THR 12.A OG1 no hydrogen 3.292 N/A MET 16.A N THR 12.A O no hydrogen 2.795 N/A VAL 17.A N ALA 13.A O no hydrogen 2.904 N/A SER 18.A N ASP 14.A O no hydrogen 2.958 N/A SER 18.A OG ASP 14.A O no hydrogen 2.793 N/A ALA 19.A N GLN 15.A O no hydrogen 2.880 N/A LEU 20.A N MET 16.A O no hydrogen 3.043 N/A LEU 21.A N VAL 17.A O no hydrogen 2.942 N/A ASP 22.A N SER 18.A O no hydrogen 3.119 N/A ALA 23.A N ALA 19.A O no hydrogen 3.056 N/A ALA 23.A N LEU 20.A O no hydrogen 3.135 N/A GLU 24.A N LEU 21.A O no hydrogen 3.144 N/A SER 30.A N ASN 107.A OD1 no hydrogen 2.846 N/A SER 39.A OG SER 42.A OG no hydrogen 3.375 N/A SER 42.A N SER 39.A OG no hydrogen 3.050 N/A SER 42.A OG SER 39.A O no hydrogen 3.073 N/A SER 42.A OG SER 39.A OG no hydrogen 3.375 N/A MET 43.A N SER 39.A O no hydrogen 3.006 N/A MET 44.A N GLU 40.A O no hydrogen 3.109 N/A GLY 45.A N ALA 41.A O no hydrogen 2.976 N/A LEU 46.A N SER 42.A O no hydrogen 2.950 N/A LEU 47.A N MET 43.A O no hydrogen 2.804 N/A THR 48.A N MET 44.A O no hydrogen 2.862 N/A THR 48.A OG1 MET 44.A O no hydrogen 2.743 N/A THR 48.A OG1 GLY 45.A O no hydrogen 3.384 N/A ASN 49.A N GLY 45.A O no hydrogen 2.964 N/A LEU 50.A N LEU 46.A O no hydrogen 3.109 N/A ALA 51.A N LEU 47.A O no hydrogen 2.981 N/A ASP 52.A N THR 48.A O no hydrogen 2.959 N/A ARG 53.A N ASN 49.A O no hydrogen 3.177 N/A ARG 53.A NE ASN 49.A OD1 no hydrogen 2.690 N/A ARG 53.A NH1 TYR 29.A O no hydrogen 3.007 N/A ARG 53.A NH2 TYR 29.A O no hydrogen 2.902 N/A ARG 53.A NH2 ASN 49.A OD1 no hydrogen 3.180 N/A GLU 54.A N LEU 50.A O no hydrogen 2.850 N/A LEU 55.A N ALA 51.A O no hydrogen 2.929 N/A MET 58.A N GLU 54.A O no hydrogen 2.795 N/A ILE 59.A N LEU 55.A O no hydrogen 3.053 N/A ASN 60.A N VAL 56.A O no hydrogen 3.498 N/A TRP 61.A N HIS 57.A O no hydrogen 2.982 N/A ALA 62.A N MET 58.A O no hydrogen 2.826 N/A LYS 63.A N ILE 59.A O no hydrogen 3.167 N/A ARG 64.A N TRP 61.A O no hydrogen 2.954 N/A VAL 65.A N ALA 62.A O no hydrogen 2.985 N/A PHE 68.A N VAL 65.A O no hydrogen 2.894 N/A LEU 71.A N PHE 68.A O no hydrogen 3.198 N/A ASP 75.A N THR 72.A OG1 no hydrogen 3.286 N/A GLN 76.A N THR 72.A O no hydrogen 3.043 N/A GLN 76.A NE2 PHE 68.A O no hydrogen 2.994 N/A VAL 77.A N LEU 73.A O no hydrogen 2.871 N/A HIS 78.A N HIS 74.A O no hydrogen 2.867 N/A HIS 78.A NE2 GLY 156.A O no hydrogen 2.993 N/A HIS 78.A NE2 THR 159.A OG1 no hydrogen 2.838 N/A LEU 79.A N ASP 75.A O no hydrogen 3.001 N/A LEU 80.A N GLN 76.A O no hydrogen 3.116 N/A GLU 81.A N VAL 77.A O no hydrogen 2.848 N/A ILE 86.A N ALA 82.A O no hydrogen 2.888 N/A LEU 87.A N TRP 83.A O no hydrogen 2.913 N/A MET 88.A N LEU 84.A O no hydrogen 2.902 N/A ILE 89.A N GLU 85.A O no hydrogen 2.886 N/A GLY 90.A N ILE 86.A O no hydrogen 3.181 N/A LEU 91.A N LEU 87.A O no hydrogen 2.921 N/A VAL 92.A N MET 88.A O no hydrogen 2.904 N/A TRP 93.A N ILE 89.A O no hydrogen 2.999 N/A ARG 94.A N GLY 90.A O no hydrogen 3.071 N/A ARG 94.A NE LEU 103.A O no hydrogen 3.130 N/A ARG 94.A NH2 PHE 104.A O no hydrogen 3.109 N/A SER 95.A N LEU 91.A O no hydrogen 2.972 N/A SER 95.A OG LEU 91.A O no hydrogen 2.879 N/A MET 96.A N TRP 93.A O no hydrogen 3.243 N/A GLU 97.A N GLU 97.A OE1 no hydrogen 2.705 N/A HIS 98.A N SER 95.A O no hydrogen 2.919 N/A LYS 101.A N HIS 98.A O no hydrogen 2.965 N/A LEU 102.A N LEU 110.A O no hydrogen 2.885 N/A LEU 103.A N SER 95.A OG no hydrogen 2.793 N/A PHE 104.A N LEU 108.A O no hydrogen 2.930 N/A ALA 105.A N LEU 108.A O no hydrogen 3.323 N/A ASN 107.A ND2 SER 30.A O no hydrogen 2.959 N/A LEU 108.A N ALA 105.A O no hydrogen 3.003 N/A LEU 110.A N LEU 102.A O no hydrogen 2.957 N/A ASP 111.A N GLN 114.A OE1 no hydrogen 2.978 N/A ARG 112.A NE ASP 125.A OD2 no hydrogen 2.779 N/A ARG 112.A NH1 ASP 125.A OD1 no hydrogen 3.037 N/A GLN 114.A N ASP 111.A O no hydrogen 3.036 N/A GLN 114.A N ASP 111.A OD2 no hydrogen 2.949 N/A GLY 115.A N ARG 112.A O no hydrogen 3.022 N/A LYS 116.A N ASN 113.A O no hydrogen 3.122 N/A GLU 118.A N GLU 40.A OE2 no hydrogen 2.999 N/A MET 120.A N VAL 117.A O no hydrogen 3.128 N/A GLU 122.A N GLU 122.A OE1 no hydrogen 2.979 N/A PHE 124.A N MET 120.A O no hydrogen 2.894 N/A ASP 125.A N VAL 121.A O no hydrogen 2.918 N/A MET 126.A N GLU 122.A O no hydrogen 3.203 N/A LEU 127.A N ILE 123.A O no hydrogen 3.012 N/A LEU 128.A N PHE 124.A O no hydrogen 2.908 N/A ALA 129.A N ASP 125.A O no hydrogen 3.045 N/A THR 130.A N MET 126.A O no hydrogen 3.038 N/A THR 130.A OG1 MET 126.A O no hydrogen 2.720 N/A SER 131.A N LEU 127.A O no hydrogen 2.880 N/A SER 131.A OG VAL 92.A O no hydrogen 3.220 N/A SER 132.A N LEU 128.A O no hydrogen 3.012 N/A ARG 133.A N ALA 129.A O no hydrogen 2.898 N/A PHE 134.A N THR 130.A O no hydrogen 2.986 N/A ARG 135.A N SER 131.A O no hydrogen 2.885 N/A MET 136.A N SER 132.A O no hydrogen 2.811 N/A MET 137.A N ARG 133.A O no hydrogen 3.062 N/A MET 137.A N PHE 134.A O no hydrogen 3.209 N/A ASN 138.A N ARG 135.A O no hydrogen 2.980 N/A LEU 139.A N PHE 134.A O no hydrogen 3.092 N/A GLN 140.A N GLU 143.A OE1 no hydrogen 3.050 N/A GLN 140.A NE2 ASN 138.A O no hydrogen 2.984 N/A PHE 144.A N GLN 140.A O no hydrogen 2.931 N/A VAL 145.A N GLY 141.A O no hydrogen 3.140 N/A CYS 146.A SG GLU 142.A O no hydrogen 3.450 N/A LEU 147.A N GLU 143.A O no hydrogen 2.978 N/A LYS 148.A N PHE 144.A O no hydrogen 2.919 N/A LYS 148.A NZ GLU 24.A OE1 no hydrogen 2.782 N/A LYS 148.A NZ GLU 24.A OE2 no hydrogen 3.364 N/A SER 149.A N VAL 145.A O no hydrogen 3.204 N/A SER 149.A OG.A VAL 145.A O no hydrogen 2.826 N/A SER 149.A OG.B VAL 145.A O no hydrogen 3.416 N/A SER 149.A OG.B CYS 146.A O no hydrogen 2.738 N/A ILE 150.A N CYS 146.A O no hydrogen 3.024 N/A ILE 151.A N LEU 147.A O no hydrogen 3.096 N/A LEU 152.A N LYS 148.A O no hydrogen 3.242 N/A LEU 153.A N SER 149.A O no hydrogen 3.024 N/A ASN 154.A N ILE 150.A O no hydrogen 2.755 N/A SER 155.A N ILE 151.A O no hydrogen 3.007 N/A SER 155.A OG GLU 85.A OE1 no hydrogen 2.795 N/A SER 155.A OG GLU 85.A OE2 no hydrogen 3.421 N/A SER 155.A OG ILE 151.A O no hydrogen 3.086 N/A VAL 157.A N ASN 154.A O no hydrogen 3.264 N/A TYR 158.A OH HIS 175.A NE2 no hydrogen 3.228 N/A THR 159.A N GLY 156.A O no hydrogen 3.186 N/A THR 159.A OG1 HIS 78.A NE2 no hydrogen 2.838 N/A THR 159.A OG1 GLY 156.A O no hydrogen 2.832 N/A SER 162.A N SER 167.A O no hydrogen 2.758 N/A SER 162.A OG SER 167.A OG no hydrogen 3.180 N/A LYS 166.A NZ SER 163.A O no hydrogen 3.170 N/A LYS 166.A NZ THR 164.A O no hydrogen 3.538 N/A SER 167.A N SER 162.A OG no hydrogen 2.977 N/A SER 167.A OG SER 162.A OG no hydrogen 3.180 N/A GLU 169.A N PHE 160.A O no hydrogen 2.707 N/A LYS 171.A NZ ASP 75.A OD2 no hydrogen 2.788 N/A ASP 172.A N GLU 170.A OE1 no hydrogen 3.196 N/A HIS 173.A NE2 GLY 67.A O no hydrogen 2.998 N/A HIS 175.A N LYS 171.A O no hydrogen 3.162 N/A HIS 175.A NE2 TYR 158.A OH no hydrogen 3.228 N/A ARG 176.A N ASP 172.A O no hydrogen 2.818 N/A VAL 177.A N HIS 173.A O no hydrogen 2.936 N/A LEU 178.A N ILE 174.A O no hydrogen 2.936 N/A ASP 179.A N HIS 175.A O no hydrogen 3.061 N/A LYS 180.A N ARG 176.A O no hydrogen 3.056 N/A LYS 180.A NZ LYS 180.A O no hydrogen 3.258 N/A ILE 181.A N VAL 177.A O no hydrogen 2.875 N/A THR 182.A N LEU 178.A O no hydrogen 2.931 N/A THR 182.A OG1 LEU 178.A O no hydrogen 3.019 N/A ASP 183.A N ASP 179.A O no hydrogen 3.017 N/A THR 184.A N LYS 180.A O no hydrogen 3.085 N/A THR 184.A OG1 LYS 180.A O no hydrogen 2.827 N/A LEU 185.A N ILE 181.A O no hydrogen 2.993 N/A ILE 186.A N THR 182.A O no hydrogen 3.053 N/A HIS 187.A N ASP 183.A O no hydrogen 2.830 N/A LEU 188.A N THR 184.A O no hydrogen 3.001 N/A MET 189.A N LEU 185.A O no hydrogen 3.115 N/A ALA 190.A N ILE 186.A O no hydrogen 2.926 N/A LYS 191.A N HIS 187.A O no hydrogen 2.809 N/A LYS 191.A NZ ASP 14.A OD1 no hydrogen 3.234 N/A LYS 191.A NZ HIS 187.A NE2 no hydrogen 3.443 N/A ALA 192.A N LEU 188.A O no hydrogen 2.914 N/A GLY 193.A N ALA 190.A O no hydrogen 3.020 N/A LEU 194.A N MET 189.A O no hydrogen 3.127 N/A THR 195.A N GLN 198.A OE1 no hydrogen 3.097 N/A GLN 198.A N THR 195.A OG1 no hydrogen 3.267 N/A GLN 199.A N THR 195.A O no hydrogen 2.722 N/A GLN 199.A NE2 LEU 194.A O no hydrogen 2.629 N/A HIS 200.A N LEU 196.A O no hydrogen 2.920 N/A GLN 201.A N GLN 197.A O no hydrogen 2.859 N/A ARG 202.A N GLN 198.A O no hydrogen 2.859 N/A ARG 202.A NE GLU 143.A OE2 no hydrogen 2.769 N/A ARG 202.A NH1 MET 137.A O no hydrogen 2.885 N/A ARG 202.A NH2 MET 137.A O no hydrogen 2.910 N/A ARG 202.A NH2 GLU 143.A OE1 no hydrogen 2.842 N/A ARG 202.A NH2 GLU 143.A OE2 no hydrogen 3.511 N/A LEU 203.A N GLN 199.A O no hydrogen 2.929 N/A ALA 204.A N HIS 200.A O no hydrogen 3.082 N/A GLN 205.A N GLN 201.A O no hydrogen 3.111 N/A LEU 206.A N ARG 202.A O no hydrogen 2.990 N/A LEU 207.A N LEU 203.A O no hydrogen 2.984 N/A LEU 208.A N ALA 204.A O no hydrogen 2.819 N/A ILE 209.A N GLN 205.A O no hydrogen 3.194 N/A ILE 209.A N LEU 206.A O no hydrogen 3.201 N/A LEU 210.A N LEU 207.A O no hydrogen 3.191 N/A SER 211.A N LEU 208.A O no hydrogen 3.215 N/A SER 211.A OG.B LEU 208.A O no hydrogen 2.556 N/A ILE 213.A N ILE 209.A O no hydrogen 2.967 N/A ARG 214.A N LEU 210.A O no hydrogen 3.004 N/A ARG 214.A NH1 SER 155.A O no hydrogen 3.152 N/A ARG 214.A NH2 SER 155.A O no hydrogen 3.113 N/A HIS 215.A N SER 211.A O no hydrogen 3.043 N/A MET 216.A N HIS 212.A O no hydrogen 2.895 N/A SER 217.A N ILE 213.A O no hydrogen 2.937 N/A ASN 218.A N ARG 214.A O no hydrogen 3.058 N/A LYS 219.A N HIS 215.A O no hydrogen 3.151 N/A GLY 220.A N MET 216.A O no hydrogen 2.766 N/A MET 221.A N SER 217.A O no hydrogen 2.825 N/A GLU 222.A N ASN 218.A O no hydrogen 3.064 N/A HIS 223.A N LYS 219.A O no hydrogen 2.839 N/A HIS 223.A NE2 GLU 118.A O no hydrogen 2.945 N/A LEU 224.A N GLY 220.A O no hydrogen 2.759 N/A TYR 225.A N MET 221.A O no hydrogen 2.964 N/A SER 226.A N GLU 222.A O no hydrogen 2.998 N/A MET 227.A N HIS 223.A O no hydrogen 3.053 N/A LYS 228.A N LEU 224.A O no hydrogen 2.994 N/A CYS 229.A N TYR 225.A O no hydrogen 3.001 N/A CYS 229.A SG TYR 225.A O no hydrogen 3.245 N/A LYS 230.A N SER 226.A O no hydrogen 3.151 N/A ASN 231.A N LYS 228.A O no hydrogen 2.965 N/A VAL 232.A N MET 227.A O no hydrogen 3.097 N/A SER 236.A OG ASP 52.A OD1 no hydrogen 2.844 N/A LEU 239.A N SER 236.A OG no hydrogen 3.157 N/A LEU 240.A N SER 236.A O no hydrogen 2.942 N/A GLU 241.A N ASP 237.A O no hydrogen 2.974 N/A MET 242.A N LEU 238.A O no hydrogen 2.873 N/A LEU 243.A N LEU 239.A O no hydrogen 2.847 N/A ASP 244.A N LEU 240.A O no hydrogen 2.890 N/A ALA 245.A N GLU 241.A O no hydrogen 3.096 N/A HIS 246.A N LEU 243.A O no hydrogen 3.115 N/A HIS 246.A NE2 GLU 81.A O no hydrogen 2.606 N/A HIS 249.A N GLU 222.A OE1 no hydrogen 3.235 N/A HIS 249.A N GLU 222.A OE2 no hydrogen 3.164 N/A