Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1dfg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N GLU 30.A OE1 no hydrogen 3.304 N/A LEU 3.A N GLU 30.A O no hydrogen 2.675 N/A SER 4.A N GLY 1.A O no hydrogen 2.994 N/A LYS 6.A N LEU 3.A O no hydrogen 3.113 N/A LYS 6.A NZ GLY 137.A O no hydrogen 2.884 N/A ARG 7.A N ASP 85.A OD2 no hydrogen 2.748 N/A ILE 8.A N GLU 33.A O no hydrogen 2.846 N/A LEU 9.A N GLY 86.A O no hydrogen 2.693 N/A VAL 10.A N ALA 35.A O no hydrogen 2.659 N/A THR 11.A N VAL 88.A O no hydrogen 3.037 N/A ALA 14.A N SER 18.A OG no hydrogen 3.212 N/A LYS 16.A NZ TYR 21.A OH no hydrogen 3.217 N/A LYS 16.A NZ GLN 53.A OE1 no hydrogen 3.091 N/A LEU 17.A N SER 15.A OG no hydrogen 2.975 N/A SER 18.A N SER 15.A O no hydrogen 3.213 N/A GLY 22.A N SER 18.A O no hydrogen 3.302 N/A ILE 23.A N ILE 19.A O no hydrogen 2.880 N/A ALA 24.A N ALA 20.A O no hydrogen 2.779 N/A GLN 25.A N TYR 21.A O no hydrogen 2.851 N/A ALA 26.A N GLY 22.A O no hydrogen 3.277 N/A MET 27.A N ILE 23.A O no hydrogen 2.921 N/A HIS 28.A N ALA 24.A O no hydrogen 2.721 N/A ARG 29.A N GLN 25.A O no hydrogen 2.838 N/A ARG 29.A NE GLU 30.A OE2 no hydrogen 2.890 N/A ARG 29.A NH1 ASN 226.A OD1 no hydrogen 3.354 N/A ARG 29.A NH2 GLU 30.A OE2 no hydrogen 2.885 N/A ARG 29.A NH2 ASN 226.A OD1 no hydrogen 2.573 N/A GLU 30.A N ALA 26.A O no hydrogen 2.895 N/A GLY 31.A N HIS 28.A O no hydrogen 2.822 N/A ALA 32.A N MET 27.A O no hydrogen 3.059 N/A GLU 33.A N LYS 6.A O no hydrogen 2.753 N/A PHE 36.A N ILE 58.A O no hydrogen 2.715 N/A THR 37.A N VAL 10.A O no hydrogen 3.334 N/A TYR 38.A N LEU 60.A O no hydrogen 2.615 N/A LEU 43.A N ASN 40.A O no hydrogen 2.953 N/A LYS 44.A N ASP 41.A O no hydrogen 2.980 N/A VAL 47.A N LEU 43.A O no hydrogen 3.167 N/A GLU 48.A N LYS 44.A O no hydrogen 2.876 N/A GLU 49.A N GLY 45.A O no hydrogen 2.683 N/A PHE 50.A N ARG 46.A O no hydrogen 2.906 N/A ALA 51.A N VAL 47.A O no hydrogen 2.924 N/A ALA 52.A N GLU 48.A O no hydrogen 3.148 N/A GLN 53.A N GLU 49.A O no hydrogen 3.071 N/A LEU 54.A N PHE 50.A O no hydrogen 2.867 N/A LEU 54.A N ALA 51.A O no hydrogen 2.707 N/A GLY 55.A N ALA 52.A O no hydrogen 2.923 N/A SER 56.A N ALA 51.A O no hydrogen 2.807 N/A SER 56.A OG LEU 34.A O no hydrogen 2.796 N/A ILE 58.A N SER 56.A OG no hydrogen 3.040 N/A LEU 60.A N PHE 36.A O no hydrogen 2.785 N/A CYS 62.A N TYR 38.A O no hydrogen 2.685 N/A ASP 63.A N SER 69.A OG no hydrogen 2.810 N/A ALA 65.A N ASP 63.A OD1 no hydrogen 2.514 N/A GLU 66.A N ASP 63.A O no hydrogen 3.088 N/A ILE 70.A N GLU 66.A O no hydrogen 3.245 N/A ASP 71.A N ASP 67.A O no hydrogen 2.828 N/A THR 72.A N ALA 68.A O no hydrogen 2.839 N/A THR 72.A OG1 ALA 68.A O no hydrogen 2.925 N/A MET 73.A N SER 69.A O no hydrogen 2.914 N/A PHE 74.A N ILE 70.A O no hydrogen 3.122 N/A ALA 75.A N ASP 71.A O no hydrogen 2.965 N/A GLU 76.A N THR 72.A O no hydrogen 2.841 N/A LEU 77.A N MET 73.A O no hydrogen 2.735 N/A GLY 78.A N PHE 74.A O no hydrogen 2.859 N/A LYS 79.A N GLU 76.A O no hydrogen 2.882 N/A VAL 80.A N LEU 77.A O no hydrogen 3.109 N/A TRP 81.A N LEU 77.A O no hydrogen 2.784 N/A LYS 83.A NZ SER 132.A O no hydrogen 2.889 N/A PHE 84.A N MET 133.A O no hydrogen 3.039 N/A ASP 85.A N ARG 7.A O no hydrogen 2.672 N/A VAL 88.A N LEU 9.A O no hydrogen 2.678 N/A HIS 89.A N LEU 141.A O no hydrogen 2.682 N/A HIS 89.A ND1 THR 142.A OG1 no hydrogen 2.969 N/A HIS 89.A NE2 SER 122.A OG no hydrogen 2.687 N/A PHE 93.A N SER 119.A OG no hydrogen 3.034 N/A GLN 98.A N PRO 95.A O no hydrogen 2.782 N/A LEU 99.A N GLY 96.A O no hydrogen 2.641 N/A GLY 101.A N ASN 154.A OD1 no hydrogen 2.752 N/A ASN 105.A N ASP 102.A OD1 no hydrogen 2.966 N/A ALA 106.A N ASP 102.A O no hydrogen 2.612 N/A VAL 107.A N TYR 103.A O no hydrogen 2.711 N/A THR 108.A OG1 GLN 98.A OE1 no hydrogen 3.215 N/A GLY 111.A N THR 108.A OG1 no hydrogen 3.249 N/A PHE 112.A N THR 108.A O no hydrogen 2.872 N/A LYS 113.A N ARG 109.A O no hydrogen 3.074 N/A ILE 114.A N GLU 110.A O no hydrogen 2.867 N/A ALA 115.A N GLY 111.A O no hydrogen 2.980 N/A HIS 116.A N PHE 112.A O no hydrogen 3.097 N/A HIS 116.A ND1 PHE 112.A O no hydrogen 2.717 N/A ASP 117.A N LYS 113.A O no hydrogen 2.890 N/A ILE 118.A N ILE 114.A O no hydrogen 2.905 N/A SER 119.A N ALA 115.A O no hydrogen 2.881 N/A SER 119.A OG ALA 115.A O no hydrogen 2.843 N/A SER 120.A N HIS 116.A O no hydrogen 2.921 N/A SER 120.A OG SER 164.A OG no hydrogen 2.944 N/A TYR 121.A N HIS 116.A O no hydrogen 2.942 N/A SER 122.A N ASP 117.A O no hydrogen 3.143 N/A SER 122.A OG HIS 89.A NE2 no hydrogen 2.687 N/A SER 122.A OG ILE 118.A O no hydrogen 2.729 N/A PHE 123.A N SER 120.A O no hydrogen 3.231 N/A ALA 125.A N TYR 121.A O no hydrogen 2.853 N/A MET 126.A N SER 122.A O no hydrogen 2.988 N/A ALA 127.A N PHE 123.A O no hydrogen 3.340 N/A LYS 128.A N VAL 124.A O no hydrogen 2.819 N/A ALA 129.A N ALA 125.A O no hydrogen 3.093 N/A ALA 129.A N MET 126.A O no hydrogen 3.009 N/A CYS 130.A N MET 126.A O no hydrogen 3.116 N/A CYS 130.A N ALA 127.A O no hydrogen 3.140 N/A CYS 130.A SG MET 126.A O no hydrogen 3.381 N/A CYS 130.A SG ALA 127.A O no hydrogen 3.772 N/A ARG 131.A NE GLU 179.A OE1 no hydrogen 3.276 N/A ARG 131.A NE GLU 179.A OE2 no hydrogen 2.850 N/A ARG 131.A NH2 GLU 179.A OE1 no hydrogen 2.878 N/A MET 133.A N CYS 130.A O no hydrogen 2.774 N/A LEU 134.A N ARG 131.A O no hydrogen 3.440 N/A ASN 135.A N PHE 84.A O no hydrogen 2.993 N/A ASN 135.A ND2 ASP 85.A OD1 no hydrogen 3.179 N/A GLY 137.A N GLY 180.A O no hydrogen 2.586 N/A SER 138.A N ASN 135.A O no hydrogen 2.967 N/A SER 138.A OG PHE 84.A O no hydrogen 3.441 N/A SER 138.A OG ASN 135.A O no hydrogen 2.343 N/A ALA 139.A N ASP 85.A O no hydrogen 3.135 N/A LEU 140.A N ARG 182.A O no hydrogen 2.680 N/A LEU 141.A N PHE 87.A O no hydrogen 3.335 N/A THR 142.A N ASN 184.A O no hydrogen 3.302 N/A THR 142.A OG1 HIS 89.A ND1 no hydrogen 2.969 N/A THR 142.A OG1 HIS 89.A O no hydrogen 3.417 N/A SER 144.A N ILE 186.A O no hydrogen 2.856 N/A SER 144.A OG GLU 166.A OE2 no hydrogen 2.606 N/A ALA 148.A N TYR 145.A O no hydrogen 2.944 N/A GLU 149.A N LEU 146.A O no hydrogen 2.841 N/A ARG 150.A N LEU 146.A O no hydrogen 3.045 N/A ARG 150.A NH2 SER 251.A O no hydrogen 2.606 N/A TYR 155.A N ILE 152.A O no hydrogen 3.180 N/A ASN 156.A ND2 GLN 98.A O no hydrogen 3.005 N/A ASN 156.A ND2 GLY 101.A O no hydrogen 3.204 N/A MET 158.A N TYR 155.A O no hydrogen 3.053 N/A GLY 159.A N ASN 156.A O no hydrogen 2.780 N/A ALA 161.A N VAL 157.A O no hydrogen 2.951 N/A LYS 162.A N MET 158.A O no hydrogen 2.827 N/A LYS 162.A NZ LEU 143.A O no hydrogen 3.287 N/A ALA 163.A N GLY 159.A O no hydrogen 2.951 N/A SER 164.A N LEU 160.A O no hydrogen 2.974 N/A SER 164.A OG SER 120.A OG no hydrogen 2.944 N/A LEU 165.A N ALA 161.A O no hydrogen 2.789 N/A GLU 166.A N LYS 162.A O no hydrogen 2.762 N/A ALA 167.A N ALA 163.A O no hydrogen 3.083 N/A ALA 167.A N SER 164.A O no hydrogen 3.075 N/A ASN 168.A N SER 164.A O no hydrogen 3.000 N/A VAL 169.A N LEU 165.A O no hydrogen 3.039 N/A TYR 171.A N ALA 167.A O no hydrogen 3.011 N/A MET 172.A N ASN 168.A O no hydrogen 2.670 N/A ALA 173.A N VAL 169.A O no hydrogen 2.736 N/A ASN 174.A N ARG 170.A O no hydrogen 2.839 N/A ALA 175.A N TYR 171.A O no hydrogen 3.010 N/A ALA 175.A N MET 172.A O no hydrogen 3.006 N/A MET 176.A N MET 172.A O no hydrogen 2.968 N/A GLY 177.A N ALA 173.A O no hydrogen 3.071 N/A GLU 179.A N MET 176.A O no hydrogen 3.120 N/A GLY 180.A N GLY 177.A O no hydrogen 2.869 N/A VAL 181.A N MET 176.A O no hydrogen 3.241 N/A ARG 182.A N SER 138.A O no hydrogen 3.052 N/A ARG 182.A NH1 LEU 231.A O no hydrogen 3.184 N/A ARG 182.A NH1 SER 236.A OG no hydrogen 2.726 N/A ARG 182.A NH1 ILE 239.A O no hydrogen 3.054 N/A VAL 183.A N SER 240.A OG no hydrogen 3.353 N/A ASN 184.A N LEU 140.A O no hydrogen 3.159 N/A ASN 184.A ND2 ILE 239.A O no hydrogen 2.792 N/A ALA 185.A N GLU 242.A O no hydrogen 2.742 N/A ILE 186.A N THR 142.A O no hydrogen 2.862 N/A SER 187.A N VAL 244.A O no hydrogen 2.723 N/A GLY 189.A N VAL 246.A O no hydrogen 3.143 N/A SER 197.A OG ILE 199.A O no hydrogen 3.342 N/A ILE 199.A N SER 197.A OG no hydrogen 2.722 N/A MET 205.A N ASP 201.A O no hydrogen 3.330 N/A LEU 206.A N PHE 202.A O no hydrogen 2.832 N/A ALA 207.A N ARG 203.A O no hydrogen 2.867 N/A HIS 208.A N LYS 204.A O no hydrogen 2.853 N/A CYS 209.A N MET 205.A O no hydrogen 2.970 N/A CYS 209.A SG MET 205.A O no hydrogen 3.005 N/A GLU 210.A N LEU 206.A O no hydrogen 3.333 N/A VAL 212.A N HIS 208.A O no hydrogen 3.240 N/A THR 213.A N CYS 209.A O no hydrogen 2.613 N/A THR 213.A OG1 CYS 209.A O no hydrogen 2.532 N/A ILE 215.A N GLY 248.A O no hydrogen 3.331 N/A ARG 216.A N THR 213.A O no hydrogen 2.531 N/A ARG 216.A NH1 THR 213.A O no hydrogen 2.737 N/A ARG 217.A NH1 THR 218.A O no hydrogen 2.475 N/A ARG 217.A NH1 ASP 223.A OD2 no hydrogen 2.764 N/A ARG 217.A NH2 ASP 223.A OD1 no hydrogen 3.206 N/A ARG 217.A NH2 ASP 223.A OD2 no hydrogen 2.727 N/A THR 220.A N ASP 223.A OD2 no hydrogen 3.002 N/A THR 220.A OG1 GLU 222.A OE1 no hydrogen 3.568 N/A ASP 223.A N THR 220.A OG1 no hydrogen 2.788 N/A VAL 224.A N THR 220.A O no hydrogen 2.824 N/A GLY 225.A N ILE 221.A O no hydrogen 2.570 N/A ASN 226.A N GLU 222.A O no hydrogen 3.005 N/A SER 227.A N ASP 223.A O no hydrogen 3.371 N/A SER 227.A OG ASP 223.A O no hydrogen 3.509 N/A ALA 228.A N VAL 224.A O no hydrogen 2.969 N/A ALA 229.A N GLY 225.A O no hydrogen 2.751 N/A PHE 230.A N ASN 226.A O no hydrogen 3.072 N/A LEU 231.A N SER 227.A O no hydrogen 2.994 N/A CYS 232.A N ALA 228.A O no hydrogen 3.147 N/A CYS 232.A N ALA 229.A O no hydrogen 3.152 N/A CYS 232.A SG ALA 228.A O no hydrogen 3.948 N/A SER 233.A N PHE 230.A O no hydrogen 3.099 N/A SER 233.A OG PHE 230.A O no hydrogen 2.956 N/A LEU 235.A N SER 233.A OG no hydrogen 2.817 N/A SER 236.A N SER 233.A O no hydrogen 3.096 N/A SER 236.A OG PHE 230.A O no hydrogen 2.851 N/A SER 236.A OG SER 233.A O no hydrogen 2.975 N/A ALA 237.A N ASP 234.A O no hydrogen 3.272 N/A ILE 239.A N SER 236.A O no hydrogen 2.770 N/A GLY 241.A N VAL 183.A O no hydrogen 2.597 N/A GLU 242.A N ASN 184.A OD1 no hydrogen 2.698 N/A VAL 244.A N ALA 185.A O no hydrogen 2.915 N/A HIS 245.A NE2 GLU 149.A OE2 no hydrogen 2.653 N/A VAL 246.A N SER 187.A O no hydrogen 2.787 N/A PHE 250.A N ASP 247.A O no hydrogen 3.223 N/A SER 251.A N ASP 247.A OD2 no hydrogen 2.914 N/A ILE 252.A N GLY 249.A O no hydrogen 3.025 N/A ALA 253.A N PHE 250.A O no hydrogen 3.295 N/A ASN 256.A ND2 ALA 254.A O no hydrogen 3.634 N/A