Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nez_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LEU 106.A O no hydrogen 3.006 N/A MET 8.A N GLY 31.A O no hydrogen 3.041 N/A PHE 10.A N GLY 29.A O no hydrogen 2.921 N/A LYS 11.A N PHE 111.A O no hydrogen 3.049 N/A LYS 11.A NZ GLU 110.A OE1 no hydrogen 3.338 N/A THR 12.A N GLY 27.A O no hydrogen 2.901 N/A HIS 13.A N TYR 113.A O no hydrogen 3.081 N/A HIS 13.A ND1 GLU 26.A OE2 no hydrogen 2.308 N/A HIS 13.A NE2 GLU 15.A OE2 no hydrogen 2.962 N/A MET 14.A N ILE 25.A O no hydrogen 2.766 N/A GLU 15.A N VAL 115.A O no hydrogen 3.069 N/A GLY 16.A N PHE 23.A O no hydrogen 2.927 N/A SER 17.A N LEU 117.A O no hydrogen 2.977 N/A VAL 18.A N HIS 21.A O no hydrogen 2.961 N/A ASN 19.A N GLY 119.A O no hydrogen 2.868 N/A ASN 19.A ND2 PHE 122.A O no hydrogen 2.930 N/A HIS 21.A N VAL 18.A O no hydrogen 2.953 N/A HIS 21.A NE2 GLY 47.A O no hydrogen 2.664 N/A PHE 23.A N GLY 16.A O no hydrogen 2.965 N/A GLU 24.A N LYS 46.A O no hydrogen 3.045 N/A ILE 25.A N MET 14.A O no hydrogen 2.910 N/A GLU 26.A N LYS 43.A O no hydrogen 2.951 N/A GLY 27.A N THR 12.A O no hydrogen 2.970 N/A GLU 28.A N LYS 41.A O no hydrogen 3.003 N/A GLY 29.A N PHE 10.A O no hydrogen 2.846 N/A GLU 30.A N THR 39.A O no hydrogen 2.904 N/A GLY 31.A N MET 8.A O no hydrogen 2.979 N/A ARG 32.A N THR 37.A O no hydrogen 2.839 N/A ARG 32.A NH1 GLU 35.A OE1 no hydrogen 2.857 N/A TYR 34.A OH ILE 4.A O no hydrogen 2.857 N/A GLU 35.A N ARG 32.A O no hydrogen 3.024 N/A GLY 36.A N ARG 32.A O no hydrogen 3.003 N/A THR 37.A N ARG 32.A O no hydrogen 3.459 N/A THR 37.A OG1 GLU 35.A OE2 no hydrogen 2.881 N/A GLN 38.A N GLU 208.A O no hydrogen 3.057 N/A GLN 38.A NE2 SER 62.A O no hydrogen 3.096 N/A THR 39.A N GLU 30.A O no hydrogen 2.908 N/A THR 39.A OG1.B GLN 206.A O no hydrogen 3.284 N/A ALA 40.A N GLN 206.A O no hydrogen 2.916 N/A LYS 41.A N GLU 28.A O no hydrogen 2.829 N/A LEU 42.A N VAL 204.A O no hydrogen 2.752 N/A LYS 43.A N GLU 26.A O no hydrogen 2.814 N/A VAL 44.A N THR 202.A O no hydrogen 2.823 N/A THR 45.A N GLU 24.A O no hydrogen 2.890 N/A THR 45.A OG1 GLU 24.A O no hydrogen 3.312 N/A LYS 46.A N GLU 24.A O no hydrogen 3.327 N/A ALA 53.A N VAL 128.A O no hydrogen 2.920 N/A TRP 54.A NE1 GLN 206.A OE1 no hydrogen 2.903 N/A ILE 56.A N ALA 53.A O no hydrogen 3.376 N/A LEU 57.A N TRP 54.A O no hydrogen 2.831 N/A SER 58.A N TRP 54.A O no hydrogen 3.312 N/A SER 58.A OG ASP 55.A O no hydrogen 3.140 N/A GLN 60.A N LEU 57.A O no hydrogen 2.969 N/A GLN 60.A NE2 ILE 56.A O no hydrogen 2.953 N/A PHE 61.A N SER 58.A O no hydrogen 3.239 N/A SER 62.A OG GLN 38.A OE1 no hydrogen 2.712 N/A SER 62.A OG TYR 113.A OH no hydrogen 2.681 N/A LYS 63.A NZ GLU 141.A OE1 no hydrogen 2.748 N/A LYS 63.A NZ TYR 190.A OH no hydrogen 2.620 N/A TYR 65.A N SER 62.A O no hydrogen 3.154 N/A TYR 65.A OH MET 8.A O no hydrogen 2.720 N/A LYS 67.A N CYS 210.A O no hydrogen 2.991 N/A HIS 68.A ND1 VAL 66.A O no hydrogen 3.095 N/A HIS 68.A NE2 TYR 186.A OH no hydrogen 2.827 N/A ILE 72.A N PRO 69.A O no hydrogen 3.082 N/A LYS 77.A N ASP 74.A OD1 no hydrogen 3.439 N/A LYS 77.A NZ PRO 33.A O no hydrogen 2.975 N/A LYS 77.A NZ ALA 64.A O no hydrogen 2.927 N/A LYS 77.A NZ ASP 74.A OD2 no hydrogen 2.793 N/A LEU 78.A N ASP 74.A O no hydrogen 2.861 N/A SER 79.A N TYR 75.A O no hydrogen 3.128 N/A SER 79.A OG LEU 76.A O no hydrogen 2.781 N/A PHE 80.A N LYS 77.A O no hydrogen 3.272 N/A GLY 83.A N SER 79.A O no hydrogen 2.726 N/A PHE 84.A N SER 104.A O no hydrogen 3.083 N/A LYS 85.A N LYS 175.A O no hydrogen 3.017 N/A TRP 86.A N GLN 102.A O no hydrogen 3.040 N/A GLU 87.A N THR 173.A O no hydrogen 3.128 N/A ARG 88.A N VAL 100.A O no hydrogen 2.889 N/A ARG 88.A NE THR 172.A OG1 no hydrogen 2.922 N/A ARG 88.A NH1 PRO 59.A O no hydrogen 2.926 N/A ARG 88.A NH1 GLN 60.A OE1 no hydrogen 2.917 N/A ARG 88.A NH2 TYR 174.A OH no hydrogen 3.071 N/A VAL 89.A N LYS 171.A O no hydrogen 2.911 N/A MET 90.A N VAL 98.A O no hydrogen 2.787 N/A ASN 91.A N GLU 169.A O no hydrogen 2.820 N/A PHE 92.A N GLY 96.A O no hydrogen 2.920 N/A GLU 93.A N ASP 167.A O no hydrogen 2.951 N/A GLY 95.A N PHE 92.A O no hydrogen 3.125 N/A VAL 97.A N THR 120.A O no hydrogen 3.008 N/A VAL 98.A N MET 90.A O no hydrogen 3.000 N/A THR 99.A N HIS 118.A O no hydrogen 2.928 N/A VAL 100.A N ARG 88.A O no hydrogen 2.983 N/A THR 101.A N LYS 116.A O no hydrogen 2.919 N/A GLN 102.A N TRP 86.A O no hydrogen 2.884 N/A ASP 103.A N LYS 114.A O no hydrogen 2.899 N/A SER 104.A N PHE 84.A O no hydrogen 2.855 N/A SER 104.A OG GLN 102.A OE1 no hydrogen 2.708 N/A SER 105.A N ILE 112.A O no hydrogen 3.048 N/A LEU 106.A N PRO 81.A O no hydrogen 3.137 N/A GLN 107.A N GLU 110.A O no hydrogen 2.985 N/A GLN 107.A NE2 SER 105.A OG no hydrogen 2.850 N/A GLU 110.A N GLN 107.A O no hydrogen 3.177 N/A PHE 111.A N ARG 9.A O no hydrogen 2.898 N/A ILE 112.A N SER 105.A O no hydrogen 2.809 N/A TYR 113.A N LYS 11.A O no hydrogen 2.898 N/A TYR 113.A OH SER 62.A OG no hydrogen 2.681 N/A LYS 114.A N ASP 103.A O no hydrogen 2.898 N/A VAL 115.A N HIS 13.A O no hydrogen 2.902 N/A LYS 116.A N THR 101.A O no hydrogen 2.892 N/A LEU 117.A N GLU 15.A O no hydrogen 3.042 N/A HIS 118.A N THR 99.A O no hydrogen 2.949 N/A GLY 119.A N SER 17.A O no hydrogen 2.734 N/A THR 120.A N VAL 97.A O no hydrogen 2.939 N/A ASN 121.A ND2 GLY 95.A O no hydrogen 3.045 N/A PHE 122.A N ASN 19.A OD1 no hydrogen 3.246 N/A GLY 126.A N PRO 123.A O no hydrogen 3.099 N/A GLN 130.A N GLY 126.A O no hydrogen 2.977 N/A GLN 130.A NE2 SER 124.A O no hydrogen 2.903 N/A LYS 131.A N VAL 128.A O no hydrogen 3.282 N/A LYS 132.A N PRO 127.A O no hydrogen 2.918 N/A THR 133.A OG1 ASP 55.A OD2 no hydrogen 2.589 N/A MET 134.A N.A LYS 159.A O no hydrogen 2.777 N/A MET 134.A N.B LYS 159.A O no hydrogen 2.758 N/A GLY 135.A N ASP 55.A OD2 no hydrogen 3.022 N/A TRP 136.A NE1 ASP 55.A O no hydrogen 2.850 N/A GLU 137.A N ARG 157.A O no hydrogen 2.894 N/A SER 139.A N TYR 190.A O no hydrogen 3.054 N/A SER 140.A OG ASN 189.A OD1 no hydrogen 2.863 N/A GLU 141.A N ALA 188.A O no hydrogen 2.804 N/A ARG 142.A N GLU 153.A O no hydrogen 2.856 N/A ARG 142.A NH2 ASN 187.A OD1 no hydrogen 3.047 N/A MET 143.A N TYR 186.A O no hydrogen 2.800 N/A TYR 144.A N LYS 151.A O no hydrogen 2.896 N/A TYR 144.A OH GLU 153.A OE1 no hydrogen 2.617 N/A GLU 146.A N ALA 149.A O no hydrogen 2.897 N/A ALA 149.A N GLU 146.A O no hydrogen 2.925 N/A LEU 150.A N TYR 174.A O no hydrogen 2.976 N/A LYS 151.A N TYR 144.A O no hydrogen 2.803 N/A LYS 151.A NZ GLU 146.A OE1 no hydrogen 2.808 N/A LYS 151.A NZ ASP 147.A OD2 no hydrogen 3.407 N/A GLY 152.A N THR 172.A O no hydrogen 2.859 N/A GLU 153.A N ARG 142.A O no hydrogen 2.905 N/A ILE 154.A N VAL 170.A O no hydrogen 3.027 N/A LEU 156.A N ALA 168.A O no hydrogen 2.851 N/A LEU 158.A N TYR 166.A O no hydrogen 2.872 N/A LYS 159.A N GLY 135.A O no hydrogen 2.858 N/A LEU 160.A N GLY 164.A O no hydrogen 3.003 N/A LYS 161.A N LYS 132.A O no hydrogen 2.761 N/A GLY 163.A N LEU 160.A O no hydrogen 3.113 N/A HIS 165.A NE2.A GLU 137.A OE2 no hydrogen 2.671 N/A TYR 166.A N LEU 158.A O no hydrogen 2.825 N/A TYR 166.A OH ASP 94.A OD1 no hydrogen 3.357 N/A TYR 166.A OH ASP 94.A OD2 no hydrogen 2.577 N/A ASP 167.A N GLU 93.A OE1 no hydrogen 2.738 N/A ALA 168.A N LEU 156.A O no hydrogen 2.932 N/A GLU 169.A N ASN 91.A O no hydrogen 2.963 N/A VAL 170.A N ILE 154.A O no hydrogen 2.827 N/A LYS 171.A N VAL 89.A O no hydrogen 2.960 N/A THR 172.A N GLY 152.A O no hydrogen 2.913 N/A THR 173.A N GLU 87.A O no hydrogen 2.942 N/A TYR 174.A N LEU 150.A O no hydrogen 2.763 N/A TYR 174.A OH GLU 141.A OE2 no hydrogen 2.645 N/A LYS 175.A N LYS 85.A O no hydrogen 2.776 N/A ALA 176.A N TYR 75.A OH no hydrogen 2.905 N/A LYS 177.A N GLY 83.A O no hydrogen 2.933 N/A LYS 177.A NZ GLU 82.A O no hydrogen 2.980 N/A LYS 177.A NZ ASP 103.A OD2 no hydrogen 2.843 N/A LYS 177.A NZ SER 104.A O no hydrogen 3.012 N/A LYS 178.A NZ PHE 80.A O no hydrogen 3.552 N/A GLN 181.A NE2 LEU 182.A O no hydrogen 2.989 N/A TYR 186.A N MET 143.A O no hydrogen 2.920 N/A TYR 186.A OH HIS 68.A NE2 no hydrogen 2.827 N/A ASN 187.A N ARG 213.A O no hydrogen 2.811 N/A ALA 188.A N GLU 141.A O no hydrogen 2.813 N/A ASN 189.A N GLU 211.A O no hydrogen 2.872 N/A TYR 190.A N SER 139.A O no hydrogen 2.833 N/A LYS 191.A N ARG 209.A O no hydrogen 3.120 N/A LYS 191.A NZ ASP 193.A OD1 no hydrogen 2.718 N/A ASP 193.A N TYR 207.A O no hydrogen 2.756 N/A THR 195.A N GLU 205.A O no hydrogen 2.879 N/A THR 195.A OG1 GLU 205.A O no hydrogen 3.341 N/A SER 196.A N GLU 205.A O no hydrogen 3.438 N/A SER 196.A OG GLU 205.A OE1 no hydrogen 2.725 N/A HIS 197.A ND1 ASN 198.A O no hydrogen 3.056 N/A ASN 198.A N ILE 203.A O no hydrogen 3.153 N/A ASN 198.A ND2 THR 202.A OG1 no hydrogen 3.228 N/A TYR 201.A N ASN 198.A O no hydrogen 3.127 N/A THR 202.A N ASP 200.A OD2 no hydrogen 3.092 N/A THR 202.A OG1 ASP 200.A OD1 no hydrogen 3.566 N/A THR 202.A OG1 ASP 200.A OD2 no hydrogen 2.617 N/A ILE 203.A N ASN 198.A OD1 no hydrogen 2.888 N/A VAL 204.A N LEU 42.A O no hydrogen 2.935 N/A GLU 205.A N SER 196.A O no hydrogen 2.951 N/A GLN 206.A N ALA 40.A O no hydrogen 2.880 N/A GLN 206.A NE2 SER 58.A O no hydrogen 3.150 N/A TYR 207.A N ASP 193.A O no hydrogen 2.875 N/A GLU 208.A N GLN 38.A O no hydrogen 2.942 N/A ARG 209.A N LYS 191.A O no hydrogen 3.101 N/A CYS 210.A N GLY 36.A O no hydrogen 2.787 N/A CYS 210.A SG.A ASN 189.A O no hydrogen 3.573 N/A CYS 210.A SG.B GLU 208.A OE2 no hydrogen 2.898 N/A GLU 211.A N ASN 189.A O no hydrogen 3.056 N/A GLY 212.A N LYS 67.A O no hydrogen 2.808 N/A ARG 213.A N ASN 187.A O no hydrogen 2.784 N/A