Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5le5_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A ND2 PHE 115.A O no hydrogen 3.019 N/A THR 6.A N GLY 3.A O no hydrogen 3.294 N/A THR 6.A OG1 GLY 3.A O no hydrogen 2.870 N/A SER 8.A N ARG 12.A O no hydrogen 2.828 N/A SER 8.A OG ARG 12.A O no hydrogen 3.369 N/A GLU 10.A N SER 8.A OG no hydrogen 3.264 N/A GLY 11.A N SER 8.A O no hydrogen 2.873 N/A ARG 12.A N SER 8.A OG no hydrogen 3.296 N/A PHE 14.A N THR 6.A O no hydrogen 3.390 N/A GLU 17.A N LEU 13.A O no hydrogen 3.002 N/A TYR 18.A N PHE 14.A O no hydrogen 2.889 N/A ALA 19.A N GLN 15.A O no hydrogen 2.891 N/A ILE 20.A N VAL 16.A O no hydrogen 2.921 N/A GLU 21.A N GLU 17.A O no hydrogen 3.139 N/A ALA 22.A N TYR 18.A O no hydrogen 3.105 N/A ILE 23.A N ILE 20.A O no hydrogen 3.104 N/A LYS 24.A N GLU 21.A O no hydrogen 3.207 N/A LYS 24.A NZ GLY 163.A O no hydrogen 3.085 N/A LYS 24.A NZ SER 166.A OG no hydrogen 2.741 N/A LEU 25.A N ALA 22.A O no hydrogen 2.964 N/A GLY 26.A N ILE 23.A O no hydrogen 2.933 N/A SER 27.A OG GLU 43.A O no hydrogen 2.855 N/A THR 28.A N GLU 43.A OE2 no hydrogen 2.991 N/A ALA 29.A N ILE 162.A O no hydrogen 2.965 N/A ILE 30.A N ALA 41.A O no hydrogen 2.706 N/A GLY 31.A N ARG 160.A O no hydrogen 2.851 N/A ILE 32.A N CYS 39.A O no hydrogen 3.011 N/A GLN 33.A N ASP 158.A O no hydrogen 2.823 N/A THR 34.A N GLY 37.A O no hydrogen 2.912 N/A THR 34.A OG1 GLY 37.A O no hydrogen 2.829 N/A GLU 36.A N THR 34.A OG1 no hydrogen 3.025 N/A GLY 37.A N THR 34.A O no hydrogen 3.192 N/A VAL 38.A N VAL 212.A O no hydrogen 2.921 N/A CYS 39.A N ILE 32.A O no hydrogen 3.018 N/A LEU 40.A N ALA 210.A O no hydrogen 2.927 N/A ALA 41.A N ILE 30.A O no hydrogen 2.830 N/A VAL 42.A N GLU 208.A O no hydrogen 3.012 N/A GLU 43.A N THR 28.A O no hydrogen 2.932 N/A LYS 44.A N ASN 206.A O no hydrogen 2.856 N/A LYS 44.A NZ PRO 53.A O no hydrogen 2.815 N/A LYS 44.A NZ ILE 56.A O no hydrogen 2.678 N/A LYS 44.A NZ GLU 208.A OE2 no hydrogen 3.078 N/A ARG 45.A NE GLU 43.A OE1 no hydrogen 3.329 N/A ARG 45.A NH2 GLU 43.A OE2 no hydrogen 3.224 N/A ARG 45.A NH2 SER 164.A OG no hydrogen 2.918 N/A LEU 50.A N SER 48.A OG no hydrogen 3.170 N/A MET 51.A N SER 48.A O no hydrogen 3.166 N/A SER 55.A N GLU 52.A O no hydrogen 2.987 N/A SER 55.A OG GLU 52.A O no hydrogen 2.726 N/A ILE 56.A N PRO 53.A O no hydrogen 3.108 N/A LYS 58.A N GLU 208.A OE1 no hydrogen 3.237 N/A LYS 58.A N GLU 208.A OE2 no hydrogen 3.157 N/A LYS 58.A NZ SER 27.A OG no hydrogen 2.885 N/A LYS 58.A NZ LYS 44.A O no hydrogen 2.738 N/A ILE 59.A N GLU 208.A OE1 no hydrogen 3.108 N/A VAL 60.A N CYS 68.A O no hydrogen 2.901 N/A ILE 62.A N ILE 66.A O no hydrogen 2.882 N/A ASP 63.A N ILE 66.A O no hydrogen 3.188 N/A HIS 65.A NE2 MET 99.A O no hydrogen 2.710 N/A ILE 66.A N ASP 63.A O no hydrogen 3.063 N/A GLY 67.A N GLY 136.A O no hydrogen 2.751 N/A CYS 68.A N VAL 60.A O no hydrogen 2.862 N/A CYS 68.A SG ALA 69.A O no hydrogen 3.888 N/A CYS 68.A SG LEU 134.A O no hydrogen 3.731 N/A ALA 69.A N LEU 134.A O no hydrogen 2.774 N/A MET 70.A N LYS 58.A O no hydrogen 3.055 N/A SER 71.A N ALA 132.A O no hydrogen 3.057 N/A SER 71.A OG SER 27.A O no hydrogen 2.709 N/A LEU 73.A N GLY 130.A O no hydrogen 2.725 N/A ALA 77.A N ILE 74.A O no hydrogen 2.963 N/A LYS 78.A N ALA 75.A O no hydrogen 3.242 N/A ILE 81.A N ALA 77.A O no hydrogen 2.904 N/A ASP 82.A N LYS 78.A O no hydrogen 2.992 N/A LYS 83.A N THR 79.A O no hydrogen 3.127 N/A LYS 83.A NZ GLU 87.A OE1 no hydrogen 3.289 N/A ALA 84.A N LEU 80.A O no hydrogen 2.970 N/A ARG 85.A N ILE 81.A O no hydrogen 2.969 N/A ARG 85.A NE GLU 61.A O no hydrogen 2.885 N/A ARG 85.A NH2 GLU 61.A O no hydrogen 2.839 N/A VAL 86.A N ASP 82.A O no hydrogen 2.928 N/A GLU 87.A N LYS 83.A O no hydrogen 2.919 N/A THR 88.A N ALA 84.A O no hydrogen 3.096 N/A THR 88.A OG1 ARG 85.A O no hydrogen 2.862 N/A THR 88.A OG1 GLN 89.A OE1 no hydrogen 3.562 N/A GLN 89.A N ARG 85.A O no hydrogen 3.155 N/A ASN 90.A N VAL 86.A O no hydrogen 2.824 N/A HIS 91.A N GLU 87.A O no hydrogen 2.920 N/A HIS 91.A NE2 GLU 97.A OE1 no hydrogen 2.790 N/A TRP 92.A N THR 88.A O no hydrogen 2.965 N/A PHE 93.A N GLN 89.A O no hydrogen 2.867 N/A THR 94.A N ASN 90.A O no hydrogen 2.994 N/A THR 94.A OG1 ASN 90.A O no hydrogen 3.110 N/A TYR 95.A N HIS 91.A O no hydrogen 2.887 N/A ASN 96.A N TRP 92.A O no hydrogen 2.864 N/A VAL 101.A N ASP 139.A OD2 no hydrogen 2.841 N/A SER 103.A N THR 100.A OG1 no hydrogen 3.064 N/A SER 103.A OG THR 100.A OG1 no hydrogen 2.892 N/A VAL 104.A N THR 100.A O no hydrogen 3.045 N/A THR 105.A N VAL 101.A O no hydrogen 3.041 N/A THR 105.A OG1 VAL 101.A O no hydrogen 2.851 N/A GLN 106.A N GLU 102.A O no hydrogen 2.817 N/A ALA 107.A N SER 103.A O no hydrogen 3.002 N/A VAL 108.A N VAL 104.A O no hydrogen 3.118 N/A SER 109.A N THR 105.A O no hydrogen 2.890 N/A SER 109.A OG GLN 106.A O no hydrogen 3.197 N/A SER 109.A OG GLY 152.A O no hydrogen 3.419 N/A ASN 110.A N GLN 106.A O no hydrogen 3.093 N/A LEU 111.A N VAL 108.A O no hydrogen 3.063 N/A ALA 112.A N.A SER 109.A O no hydrogen 3.038 N/A ALA 112.A N.B SER 109.A O no hydrogen 3.114 N/A GLN 114.A N LEU 111.A O no hydrogen 3.192 N/A GLN 114.A NE2 ASN 110.A O no hydrogen 2.528 N/A PHE 115.A N LEU 113.A O no hydrogen 2.872 N/A GLY 116.A N MET 125.A O no hydrogen 3.048 N/A GLY 123.A N ASP 121.A OD1 no hydrogen 2.929 N/A ALA 124.A N ASP 121.A O no hydrogen 3.291 N/A ARG 127.A NH1 ASP 76.A OD2 no hydrogen 2.847 N/A ARG 127.A NH1 PRO 128.A O no hydrogen 2.975 N/A ARG 127.A NH2 ASP 76.A OD1 no hydrogen 2.913 N/A GLY 130.A N ASP 76.A OD2 no hydrogen 2.896 N/A ALA 132.A N SER 71.A O no hydrogen 2.927 N/A LEU 133.A N MET 148.A O no hydrogen 2.970 N/A LEU 134.A N ALA 69.A O no hydrogen 2.793 N/A PHE 135.A N PHE 146.A O no hydrogen 2.815 N/A GLY 136.A N GLY 67.A O no hydrogen 2.935 N/A GLY 137.A N GLN 144.A O no hydrogen 2.936 N/A VAL 138.A N HIS 65.A O no hydrogen 2.995 N/A ASP 139.A N GLY 142.A O no hydrogen 3.249 N/A GLU 140.A N GLU 140.A OE1 no hydrogen 2.698 N/A LYS 141.A N ASP 139.A OD1 no hydrogen 2.820 N/A GLY 142.A N ASP 139.A O no hydrogen 2.802 N/A GLN 144.A N GLY 137.A O no hydrogen 2.704 N/A LEU 145.A N GLN 33.A OE1 no hydrogen 2.837 N/A PHE 146.A N PHE 135.A O no hydrogen 2.796 N/A HIS 147.A N VAL 155.A O no hydrogen 2.869 N/A MET 148.A N LEU 133.A O no hydrogen 2.983 N/A ASP 149.A N THR 153.A O no hydrogen 3.341 N/A SER 151.A N ASP 149.A OD1 no hydrogen 2.918 N/A SER 151.A OG ASP 149.A OD1 no hydrogen 2.573 N/A SER 151.A OG THR 153.A OG1 no hydrogen 2.699 N/A GLY 152.A N ASP 149.A O no hydrogen 2.976 N/A THR 153.A N SER 151.A OG no hydrogen 3.115 N/A THR 153.A OG1 SER 151.A OG no hydrogen 2.699 N/A VAL 155.A N HIS 147.A O no hydrogen 3.013 N/A GLN 156.A NE2 GLN 33.A OE1 no hydrogen 2.752 N/A GLN 156.A NE2 ASP 158.A OD1 no hydrogen 3.246 N/A CYS 157.A N LEU 145.A O no hydrogen 2.829 N/A ARG 160.A N GLY 31.A O no hydrogen 2.957 N/A ALA 161.A N GLN 170.A OE1 no hydrogen 2.812 N/A ILE 162.A N ALA 29.A O no hydrogen 2.884 N/A SER 164.A N GLY 26.A O no hydrogen 2.887 N/A SER 164.A OG GLY 26.A O no hydrogen 3.465 N/A ALA 165.A N THR 28.A OG1 no hydrogen 3.259 N/A SER 166.A N GLY 163.A O no hydrogen 3.044 N/A SER 166.A OG GLY 163.A O no hydrogen 2.940 N/A ALA 169.A N ALA 165.A O no hydrogen 2.963 N/A GLN 170.A N SER 166.A O no hydrogen 2.814 N/A GLN 170.A NE2 ALA 159.A O no hydrogen 3.110 N/A SER 171.A N GLU 167.A O.B no hydrogen 3.125 N/A SER 171.A OG GLU 167.A O.B no hydrogen 3.041 N/A SER 172.A N GLY 168.A O no hydrogen 3.245 N/A SER 172.A OG GLY 168.A O no hydrogen 3.427 N/A LEU 173.A N ALA 169.A O no hydrogen 2.906 N/A GLN 174.A N GLN 170.A O no hydrogen 2.943 N/A GLU 175.A N SER 171.A O no hydrogen 3.154 N/A VAL 176.A N SER 172.A O no hydrogen 2.960 N/A TYR 177.A N LEU 173.A O no hydrogen 2.895 N/A TYR 177.A OH GLN 33.A O no hydrogen 2.783 N/A SER 180.A OG HIS 178.A ND1 no hydrogen 3.408 N/A MET 181.A N HIS 178.A O no hydrogen 3.133 N/A THR 182.A N GLU 185.A OE1 no hydrogen 3.020 N/A LEU 183.A N GLU 36.A OE1 no hydrogen 2.931 N/A GLU 185.A N THR 182.A OG1 no hydrogen 3.134 N/A ALA 186.A N THR 182.A O no hydrogen 3.007 N/A ILE 187.A N LEU 183.A O no hydrogen 2.892 N/A LYS 188.A N LYS 184.A O no hydrogen 3.090 N/A SER 189.A N GLU 185.A O no hydrogen 2.859 N/A SER 189.A OG GLU 185.A O no hydrogen 2.867 N/A SER 190.A N ALA 186.A O no hydrogen 2.976 N/A SER 190.A OG ALA 186.A O no hydrogen 3.512 N/A SER 190.A OG ILE 187.A O no hydrogen 3.144 N/A LEU 191.A N ILE 187.A O no hydrogen 3.150 N/A ILE 192.A N LYS 188.A O no hydrogen 2.863 N/A ILE 193.A N SER 189.A O no hydrogen 2.942 N/A LEU 194.A N SER 190.A O no hydrogen 2.886 N/A LYS 195.A N LEU 191.A O no hydrogen 2.814 N/A GLN 196.A N ILE 192.A O no hydrogen 3.009 N/A GLN 196.A NE2 SER 172.A OG no hydrogen 3.392 N/A VAL 197.A N ILE 193.A O no hydrogen 3.075 N/A MET 198.A N LEU 194.A O no hydrogen 2.899 N/A ASN 203.A N ASN 206.A OD1 no hydrogen 2.924 N/A THR 205.A N ASN 203.A OD1 no hydrogen 2.798 N/A THR 205.A OG1 ASN 203.A OD1 no hydrogen 2.733 N/A ASN 206.A N ASN 203.A O no hydrogen 3.416 N/A ASN 206.A N ASN 203.A OD1 no hydrogen 2.906 N/A ASN 206.A ND2 LYS 201.A O no hydrogen 2.925 N/A GLU 208.A N VAL 42.A O no hydrogen 2.967 N/A ALA 210.A N LEU 40.A O no hydrogen 2.890 N/A THR 211.A N HIS 219.A O no hydrogen 2.932 N/A VAL 212.A N VAL 38.A O no hydrogen 3.066 N/A GLN 213.A N GLN 216.A O no hydrogen 3.323 N/A PHE 218.A N ALA 64.A O no hydrogen 2.700 N/A HIS 219.A N THR 211.A O no hydrogen 2.933 N/A PHE 221.A N LEU 209.A O no hydrogen 2.812 N/A THR 222.A N GLU 225.A OE1 no hydrogen 3.059 N/A GLU 225.A N THR 222.A OG1 no hydrogen 3.265 N/A LEU 226.A N THR 222.A O no hydrogen 2.925 N/A GLU 227.A N LYS 223.A O no hydrogen 2.827 N/A GLU 228.A N GLU 224.A O no hydrogen 3.060 N/A VAL 229.A N GLU 225.A O no hydrogen 3.234 N/A ILE 230.A N LEU 226.A O no hydrogen 2.783 N/A LYS 231.A N GLU 227.A O no hydrogen 3.288 N/A LYS 231.A NZ GLU 228.A OE1 no hydrogen 2.693 N/A ILE 233.A N ILE 230.A O no hydrogen 3.360 N/A