Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pei_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 8.A N ALA 31.A O no hydrogen 3.022 N/A GLU 9.A N ASN 109.A O no hydrogen 2.671 N/A LEU 10.A N GLY 29.A O no hydrogen 2.664 N/A ILE 11.A N PHE 111.A O no hydrogen 2.873 N/A PHE 12.A N ALA 27.A O no hydrogen 2.969 N/A HIS 13.A N HIS 113.A O no hydrogen 3.143 N/A MET 14.A N ILE 25.A O no hydrogen 2.790 N/A ASP 15.A N SER 115.A O no hydrogen 3.016 N/A GLY 16.A N PHE 23.A O no hydrogen 3.111 N/A ASN 17.A N PHE 117.A O no hydrogen 2.925 N/A ASN 17.A ND2 HIS 118.A ND1 no hydrogen 3.392 N/A VAL 18.A N HIS 21.A O no hydrogen 2.986 N/A ASN 19.A N GLY 119.A O no hydrogen 2.847 N/A ASN 19.A ND2 PHE 122.A O no hydrogen 2.842 N/A HIS 21.A N VAL 18.A O no hydrogen 2.678 N/A HIS 21.A NE2 GLY 47.A O no hydrogen 2.999 N/A PHE 23.A N GLY 16.A O no hydrogen 2.895 N/A THR 24.A N LYS 46.A O no hydrogen 3.110 N/A THR 24.A OG1 ASP 15.A OD1 no hydrogen 2.693 N/A ILE 25.A N MET 14.A O no hydrogen 2.873 N/A VAL 26.A N THR 43.A O no hydrogen 2.929 N/A ALA 27.A N PHE 12.A O no hydrogen 3.053 N/A THR 28.A N LYS 41.A O no hydrogen 3.281 N/A GLY 29.A N LEU 10.A O no hydrogen 2.903 N/A LYS 30.A N ASN 39.A O no hydrogen 3.018 N/A ALA 31.A N MET 8.A O no hydrogen 3.103 N/A LYS 32.A N LYS 37.A O no hydrogen 2.815 N/A TYR 34.A OH GLN 2.A OE1 no hydrogen 2.759 N/A GLU 35.A N LYS 32.A O no hydrogen 3.015 N/A GLY 36.A N PRO 33.A O no hydrogen 3.199 N/A LYS 37.A N LYS 32.A O no hydrogen 3.367 N/A GLN 38.A N GLU 206.A O no hydrogen 3.104 N/A ASN 39.A N LYS 30.A O no hydrogen 2.897 N/A LEU 40.A N LEU 204.A O no hydrogen 3.005 N/A LYS 41.A N THR 28.A O no hydrogen 2.986 N/A ALA 42.A N PHE 202.A O no hydrogen 2.784 N/A THR 43.A N VAL 26.A O no hydrogen 2.713 N/A VAL 44.A N THR 200.A O no hydrogen 2.778 N/A THR 45.A N THR 24.A O no hydrogen 2.823 N/A LYS 46.A N THR 24.A O no hydrogen 3.217 N/A LEU 50.A N GLY 199.A O no hydrogen 2.997 N/A SER 53.A N VAL 128.A O no hydrogen 2.798 N/A SER 53.A OG THR 133.A OG1 no hydrogen 3.291 N/A THR 54.A OG1 ASP 197.A OD2 no hydrogen 2.204 N/A ILE 56.A N SER 53.A O no hydrogen 3.305 N/A LEU 57.A N THR 54.A O no hydrogen 2.888 N/A SER 58.A N THR 54.A O no hydrogen 3.233 N/A SER 58.A N ASP 55.A O no hydrogen 3.338 N/A SER 58.A OG ASP 55.A O no hydrogen 2.796 N/A VAL 60.A N LEU 57.A O no hydrogen 2.829 N/A MET 61.A N LEU 57.A O no hydrogen 3.384 N/A MET 61.A N SER 58.A O no hydrogen 3.105 N/A ARG 63.A N TYR 84.A OH no hydrogen 2.971 N/A ARG 63.A NE GLU 141.A OE2 no hydrogen 3.299 N/A ARG 63.A NH2 TYR 174.A OH no hydrogen 2.939 N/A CYS 64.A N ASN 62.A OD1 no hydrogen 3.210 N/A CYS 64.A SG ASN 62.A OD1 no hydrogen 3.659 N/A ILE 65.A N ASN 62.A O no hydrogen 3.068 N/A HIS 67.A N ALA 208.A O no hydrogen 3.098 N/A TYR 68.A OH HIS 186.A NE2 no hydrogen 2.841 N/A ILE 72.A N PRO 69.A O no hydrogen 3.110 N/A PHE 76.A N ASP 74.A OD1 no hydrogen 3.173 N/A LYS 77.A N ASP 74.A OD1 no hydrogen 3.076 N/A LYS 77.A NZ PRO 33.A O no hydrogen 3.496 N/A LYS 77.A NZ CYS 64.A O no hydrogen 3.000 N/A LYS 77.A NZ VAL 66.A O no hydrogen 2.877 N/A LYS 77.A NZ ASP 74.A OD2 no hydrogen 2.941 N/A GLN 78.A N ASP 74.A O no hydrogen 3.307 N/A GLN 78.A NE2 ASP 74.A O no hydrogen 3.357 N/A GLN 78.A NE2 GLU 181.A O no hydrogen 3.534 N/A SER 79.A N PHE 76.A O no hydrogen 3.118 N/A SER 79.A OG TYR 75.A O no hydrogen 2.949 N/A SER 79.A OG PHE 76.A O no hydrogen 2.750 N/A GLU 82.A N GLU 82.A OE2 no hydrogen 2.462 N/A GLY 83.A N SER 79.A O no hydrogen 2.843 N/A TYR 84.A OH ASN 62.A OD1 no hydrogen 2.530 N/A SER 85.A N LYS 175.A O no hydrogen 2.920 N/A TRP 86.A N ALA 102.A O no hydrogen 2.945 N/A GLU 87.A N SER 173.A O no hydrogen 3.074 N/A ARG 88.A N VAL 100.A O no hydrogen 2.830 N/A ARG 88.A NE THR 172.A OG1 no hydrogen 2.932 N/A ARG 88.A NH1 THR 59.A O no hydrogen 3.016 N/A THR 89.A N HIS 171.A O no hydrogen 2.920 N/A THR 89.A OG1 HIS 171.A O no hydrogen 3.217 N/A PHE 90.A N CYS 98.A O no hydrogen 2.826 N/A ALA 91.A N GLN 169.A O no hydrogen 2.922 N/A PHE 92.A N GLY 96.A O no hydrogen 2.786 N/A GLU 93.A N ARG 167.A O no hydrogen 2.940 N/A GLY 95.A N PHE 92.A O no hydrogen 2.973 N/A GLY 96.A N ASP 94.A OD1 no hydrogen 3.322 N/A PHE 97.A N THR 120.A O no hydrogen 3.088 N/A CYS 98.A N PHE 90.A O no hydrogen 2.986 N/A THR 99.A N HIS 118.A O no hydrogen 2.799 N/A VAL 100.A N ARG 88.A O no hydrogen 2.991 N/A SER 101.A N MET 116.A O no hydrogen 3.017 N/A ALA 102.A N TRP 86.A O no hydrogen 2.912 N/A ASP 103.A N THR 114.A O no hydrogen 3.077 N/A ILE 104.A N TYR 84.A O no hydrogen 3.054 N/A LYS 105.A N ILE 112.A O no hydrogen 2.970 N/A LYS 107.A N CYS 110.A O no hydrogen 3.024 N/A CYS 110.A N LYS 107.A O no hydrogen 3.059 N/A CYS 110.A SG PHE 111.A O no hydrogen 3.575 N/A PHE 111.A N GLU 9.A O no hydrogen 2.700 N/A ILE 112.A N LYS 105.A O no hydrogen 2.878 N/A HIS 113.A N ILE 11.A O no hydrogen 2.965 N/A THR 114.A N ASP 103.A O no hydrogen 2.990 N/A THR 114.A OG1 ASP 103.A O no hydrogen 3.501 N/A SER 115.A N HIS 13.A O no hydrogen 3.032 N/A SER 115.A OG HIS 13.A O no hydrogen 3.137 N/A SER 115.A OG HIS 113.A ND1 no hydrogen 3.267 N/A MET 116.A N SER 101.A O no hydrogen 3.009 N/A PHE 117.A N ASP 15.A O no hydrogen 3.203 N/A HIS 118.A N THR 99.A O no hydrogen 2.794 N/A HIS 118.A ND1 ASN 17.A OD1 no hydrogen 3.261 N/A GLY 119.A N ASN 17.A O no hydrogen 2.958 N/A THR 120.A N PHE 97.A O no hydrogen 2.871 N/A THR 120.A OG1 ASN 121.A OD1 no hydrogen 3.196 N/A PHE 122.A N ASN 19.A OD1 no hydrogen 3.214 N/A GLY 126.A N PRO 123.A O no hydrogen 3.032 N/A GLN 130.A N GLY 126.A O no hydrogen 2.982 N/A GLN 130.A NE2 ALA 124.A O no hydrogen 2.987 N/A ARG 131.A N VAL 128.A O no hydrogen 3.262 N/A ARG 131.A NE PHE 52.A O no hydrogen 2.869 N/A ARG 131.A NH2 PHE 52.A O no hydrogen 3.058 N/A ARG 131.A NH2 ASP 197.A OD2 no hydrogen 2.997 N/A LYS 132.A N PRO 127.A O no hydrogen 2.890 N/A THR 133.A OG1 SER 53.A OG no hydrogen 3.291 N/A THR 133.A OG1 ASP 55.A OD2 no hydrogen 2.519 N/A ILE 134.A N LEU 159.A O no hydrogen 2.831 N/A GLN 135.A NE2 ARG 194.A O no hydrogen 3.659 N/A TRP 136.A NE1 ASP 55.A O no hydrogen 2.751 N/A GLU 137.A N PHE 157.A O no hydrogen 2.975 N/A SER 139.A N HIS 190.A O no hydrogen 3.029 N/A GLU 141.A N VAL 188.A O no hydrogen 2.807 N/A LYS 142.A N ASP 153.A O no hydrogen 2.837 N/A LYS 142.A NZ TYR 187.A OH no hydrogen 3.487 N/A MET 143.A N HIS 186.A O no hydrogen 2.922 N/A THR 144.A N LYS 151.A O no hydrogen 2.983 N/A SER 146.A N ILE 149.A O no hydrogen 2.881 N/A ILE 149.A N SER 146.A O no hydrogen 3.152 N/A LYS 151.A N THR 144.A O no hydrogen 2.843 N/A LYS 151.A NZ SER 146.A O no hydrogen 3.067 N/A GLY 152.A N THR 172.A O no hydrogen 2.802 N/A ASP 153.A N LYS 142.A O no hydrogen 2.916 N/A ILE 154.A N PHE 170.A O no hydrogen 3.164 N/A THR 155.A OG1 GLN 169.A OE1 no hydrogen 2.455 N/A MET 156.A N CYS 168.A O no hydrogen 2.821 N/A LEU 158.A N TYR 166.A O no hydrogen 2.816 N/A LEU 159.A N GLN 135.A O no hydrogen 2.844 N/A LEU 160.A N GLY 164.A O no hydrogen 2.974 N/A GLU 161.A N LYS 132.A O no hydrogen 2.822 N/A GLY 163.A N LEU 160.A O no hydrogen 3.093 N/A TYR 166.A N LEU 158.A O no hydrogen 2.838 N/A TYR 166.A OH ASP 94.A OD1 no hydrogen 2.528 N/A TYR 166.A OH ASP 94.A OD2 no hydrogen 3.131 N/A CYS 168.A N MET 156.A O no hydrogen 2.744 N/A CYS 168.A SG GLN 169.A O no hydrogen 4.003 N/A GLN 169.A N ALA 91.A O no hydrogen 2.922 N/A GLN 169.A NE2 PHE 170.A O no hydrogen 3.302 N/A PHE 170.A N ILE 154.A O no hydrogen 2.837 N/A HIS 171.A N THR 89.A O no hydrogen 3.008 N/A HIS 171.A ND1 ASP 153.A OD2 no hydrogen 3.124 N/A THR 172.A N GLY 152.A O no hydrogen 2.815 N/A SER 173.A N GLU 87.A O no hydrogen 2.865 N/A TYR 174.A N VAL 150.A O no hydrogen 2.760 N/A LYS 175.A N SER 85.A O no hydrogen 2.874 N/A ALA 176.A N TYR 75.A OH no hydrogen 3.111 N/A LYS 177.A N GLY 83.A O no hydrogen 3.201 N/A LYS 177.A NZ ASP 103.A OD1 no hydrogen 2.794 N/A LYS 178.A NZ PHE 80.A O no hydrogen 3.488 N/A LYS 178.A NZ GLU 82.A OE1 no hydrogen 3.531 N/A LYS 178.A NZ GLU 82.A OE2 no hydrogen 2.820 N/A GLU 181.A N GLN 78.A OE1 no hydrogen 2.798 N/A GLN 184.A NE2 GLY 71.A O no hydrogen 3.492 N/A HIS 186.A N MET 143.A O no hydrogen 3.071 N/A HIS 186.A ND1 GLN 184.A O no hydrogen 2.900 N/A HIS 186.A NE2 TYR 68.A OH no hydrogen 2.841 N/A TYR 187.A N ARG 211.A O no hydrogen 2.934 N/A TYR 187.A OH ASN 213.A OD1 no hydrogen 2.852 N/A VAL 188.A N GLU 141.A O no hydrogen 2.961 N/A GLU 189.A N VAL 209.A O no hydrogen 2.820 N/A HIS 190.A N SER 139.A O no hydrogen 2.740 N/A HIS 190.A ND1 GLU 206.A OE1 no hydrogen 3.126 N/A HIS 190.A NE2 GLU 141.A OE2 no hydrogen 3.169 N/A GLU 193.A N ASN 205.A O no hydrogen 2.925 N/A ARG 194.A N GLN 135.A OE1 no hydrogen 3.045 N/A ARG 194.A NE ASP 55.A OD1 no hydrogen 2.840 N/A ARG 194.A NH1 ASP 197.A OD2 no hydrogen 3.174 N/A ARG 194.A NH2 THR 133.A O no hydrogen 3.389 N/A ARG 194.A NH2 ILE 134.A O no hydrogen 3.120 N/A THR 195.A OG1 GLU 203.A O no hydrogen 3.485 N/A ASP 198.A N GLN 201.A O no hydrogen 3.212 N/A GLY 199.A N ASP 197.A OD1 no hydrogen 2.801 N/A THR 200.A N ASP 198.A OD1 no hydrogen 3.335 N/A GLN 201.A N ASP 198.A OD1 no hydrogen 2.927 N/A GLN 201.A NE2 THR 43.A OG1 no hydrogen 3.053 N/A PHE 202.A N ALA 42.A O no hydrogen 3.064 N/A GLU 203.A N THR 195.A O no hydrogen 2.921 N/A LEU 204.A N LEU 40.A O no hydrogen 2.994 N/A ASN 205.A N GLU 193.A O no hydrogen 3.067 N/A ASN 205.A ND2 GLN 38.A O no hydrogen 3.556 N/A GLU 206.A N GLN 38.A O no hydrogen 3.010 N/A HIS 207.A N SER 191.A O no hydrogen 2.981 N/A ALA 208.A N GLY 36.A O no hydrogen 2.739 N/A VAL 209.A N GLU 189.A O no hydrogen 3.070 N/A ALA 210.A N HIS 67.A O no hydrogen 2.939 N/A ARG 211.A N TYR 187.A O no hydrogen 2.887 N/A ILE 215.A N ASN 213.A O no hydrogen 3.119 N/A