Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xgr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH ASP 101.A OD2 no hydrogen 2.602 N/A SER 7.A N ARG 161.A O no hydrogen 3.118 N/A ALA 9.A N THR 159.A O no hydrogen 3.003 N/A ASN 10.A ND2 ASP 152.A OD2 no hydrogen 3.344 N/A THR 11.A N LEU 157.A O no hydrogen 2.927 N/A THR 11.A OG1 LEU 157.A O no hydrogen 2.772 N/A HIS 12.A N ASN 10.A OD1 no hydrogen 2.767 N/A TYR 13.A N THR 11.A OG1 no hydrogen 2.999 N/A LYS 14.A NZ SER 154.A O no hydrogen 3.124 N/A ASN 15.A N GLY 155.A O no hydrogen 2.832 N/A VAL 17.A N LYS 14.A O no hydrogen 3.032 N/A SER 18.A N ASN 15.A O no hydrogen 3.130 N/A LYS 20.A N SER 18.A OG no hydrogen 2.976 N/A LYS 20.A NZ ASP 170.A OD2 no hydrogen 2.796 N/A LEU 22.A N ASP 127.A OD2 no hydrogen 2.868 N/A ASN 27.A N THR 25.A OG1 no hydrogen 3.111 N/A GLN 29.A N GLN 47.A O no hydrogen 3.066 N/A GLN 29.A NE2 PRO 23.A O no hydrogen 2.796 N/A GLN 29.A NE2 ASN 27.A O no hydrogen 3.637 N/A GLN 31.A N HIS 45.A O no hydrogen 2.744 N/A GLY 33.A N PHE 43.A O no hydrogen 2.800 N/A ASP 36.A N ARG 40.A O no hydrogen 2.935 N/A LEU 38.A N ASP 36.A OD1 no hydrogen 2.816 N/A ASN 39.A N ASP 36.A O no hydrogen 2.825 N/A ARG 40.A N ASP 36.A OD1 no hydrogen 2.926 N/A ARG 40.A NE ASP 36.A OD2 no hydrogen 2.946 N/A ARG 40.A NH1 GLY 136.A O no hydrogen 2.957 N/A ARG 40.A NH1 GLU 138.A O no hydrogen 2.862 N/A ARG 40.A NH2 ASP 36.A OD2 no hydrogen 3.029 N/A THR 42.A OG1 GLU 34.A O no hydrogen 2.724 N/A SER 44.A N VAL 130.A O no hydrogen 2.950 N/A SER 44.A OG ASN 83.A OD1 no hydrogen 2.803 N/A HIS 45.A N GLN 31.A O no hydrogen 2.899 N/A HIS 45.A NE2 LYS 20.A O no hydrogen 3.216 N/A ILE 46.A N TYR 128.A O no hydrogen 2.805 N/A GLN 47.A N GLN 29.A O no hydrogen 2.873 N/A GLN 47.A NE2 LEU 22.A O no hydrogen 3.072 N/A GLN 47.A NE2 ASP 127.A OD2 no hydrogen 2.828 N/A LEU 48.A N LEU 126.A O no hydrogen 2.948 N/A GLN 49.A NE2 ASP 123.A O no hydrogen 3.117 N/A ARG 51.A NH2 PRO 122.A O no hydrogen 3.162 N/A HIS 52.A N GLN 49.A O no hydrogen 2.884 N/A GLU 53.A N ASP 50.A O no hydrogen 3.155 N/A THR 54.A N GLN 73.A O.A no hydrogen 2.958 N/A THR 54.A N GLN 73.A O.B no hydrogen 2.719 N/A LYS 55.A NZ ASP 50.A OD1 no hydrogen 3.512 N/A LYS 55.A NZ ASP 50.A OD2 no hydrogen 3.399 N/A MET 64.A N GLY 193.A O no hydrogen 3.030 N/A GLY 67.A N VAL 85.A O no hydrogen 2.786 N/A HIS 68.A NE2 LEU 77.A O no hydrogen 2.969 N/A LEU 69.A N ASN 83.A O no hydrogen 2.824 N/A VAL 70.A N ASN 83.A OD1 no hydrogen 3.032 N/A GLY 71.A N GLU 111.A OE1 no hydrogen 2.881 N/A TYR 72.A OH ASP 56.A OD2 no hydrogen 2.587 N/A PHE 74.A N GLY 71.A O no hydrogen 2.993 N/A CYS 75.A N GLY 71.A O no hydrogen 3.250 N/A CYS 75.A SG VAL 70.A O no hydrogen 3.421 N/A CYS 75.A SG GLY 71.A O no hydrogen 3.699 N/A GLY 76.A N TYR 72.A O no hydrogen 2.570 N/A ARG 82.A N GLU 80.A OE2 no hydrogen 2.842 N/A ARG 82.A NH1 GLU 80.A OE2 no hydrogen 2.812 N/A ASN 83.A N GLU 80.A O no hydrogen 2.963 N/A ASN 83.A ND2 VAL 70.A O no hydrogen 3.048 N/A LEU 84.A N PRO 81.A O no hydrogen 3.198 N/A VAL 85.A N GLY 67.A O no hydrogen 3.037 N/A MET 87.A N ASN 65.A O no hydrogen 3.008 N/A THR 88.A N ASN 181.A OD1 no hydrogen 3.035 N/A THR 88.A OG1 SER 182.A O no hydrogen 2.841 N/A TRP 90.A NE1 GLU 105.A OE1 no hydrogen 2.852 N/A LEU 91.A N THR 88.A OG1 no hydrogen 2.934 N/A ASN 92.A N THR 88.A O no hydrogen 2.940 N/A THR 93.A N ALA 89.A O no hydrogen 2.900 N/A THR 93.A OG1 ALA 89.A O no hydrogen 3.552 N/A THR 93.A OG1 GLY 98.A O no hydrogen 2.827 N/A GLY 94.A N TRP 90.A O no hydrogen 2.727 N/A ASN 100.A N THR 93.A O no hydrogen 2.802 N/A SER 102.A N ASN 100.A OD1 no hydrogen 3.064 N/A SER 102.A OG.B ASN 100.A OD1 no hydrogen 2.722 N/A ASN 103.A N ASN 100.A O no hydrogen 3.246 N/A ASN 103.A ND2 GLY 94.A O no hydrogen 2.803 N/A GLU 105.A N ASN 103.A OD1 no hydrogen 2.977 N/A GLY 106.A N ASN 103.A O no hydrogen 3.064 N/A MET 107.A N.A LEU 91.A O no hydrogen 2.708 N/A MET 107.A N.B LEU 91.A O no hydrogen 2.703 N/A TYR 109.A OH LEU 162.A O no hydrogen 2.955 N/A TYR 110.A N MET 107.A O.A no hydrogen 2.952 N/A TYR 110.A N MET 107.A O.B no hydrogen 3.059 N/A TYR 110.A OH PRO 104.A O no hydrogen 2.613 N/A TYR 110.A OH SER 164.A OG no hydrogen 2.951 N/A GLU 111.A N MET 107.A O.A no hydrogen 3.028 N/A GLU 111.A N MET 107.A O.B no hydrogen 3.046 N/A ASN 112.A N LEU 108.A O no hydrogen 2.892 N/A ARG 113.A N TYR 109.A O no hydrogen 3.433 N/A ARG 113.A NH1 ASP 101.A O no hydrogen 2.744 N/A ARG 113.A NH1 TYR 109.A O no hydrogen 3.032 N/A LEU 114.A N TYR 110.A O no hydrogen 2.848 N/A ASP 115.A N GLU 111.A O no hydrogen 2.861 N/A SER 116.A N ASN 112.A O no hydrogen 2.969 N/A SER 116.A OG.A ARG 1.A O no hydrogen 2.513 N/A SER 116.A OG.B ARG 113.A O no hydrogen 2.874 N/A TRP 117.A N ARG 113.A O no hydrogen 3.004 N/A LEU 118.A N LEU 114.A O no hydrogen 2.832 N/A ALA 119.A N ASP 115.A O no hydrogen 2.890 N/A LEU 120.A N SER 116.A O no hydrogen 3.001 N/A HIS 121.A N LEU 118.A O no hydrogen 3.106 N/A HIS 121.A ND1 TRP 117.A O no hydrogen 2.856 N/A PHE 124.A N HIS 121.A O no hydrogen 2.866 N/A TRP 125.A N ILE 151.A O no hydrogen 2.866 N/A LEU 126.A N LEU 48.A O no hydrogen 2.820 N/A ASP 127.A N VAL 149.A O no hydrogen 2.890 N/A TYR 128.A N ILE 46.A O no hydrogen 2.857 N/A TYR 128.A OH GLU 111.A OE1 no hydrogen 2.639 N/A LYS 129.A N GLN 147.A O no hydrogen 2.871 N/A VAL 130.A N SER 44.A O no hydrogen 2.808 N/A THR 131.A N GLU 145.A O.A no hydrogen 2.872 N/A THR 131.A N GLU 145.A O.B no hydrogen 2.861 N/A ILE 133.A N GLN 143.A O no hydrogen 2.888 N/A TYR 134.A OH ALA 41.A O no hydrogen 2.669 N/A GLU 138.A N SER 135.A O no hydrogen 3.071 N/A VAL 139.A N TYR 190.A O no hydrogen 2.943 N/A VAL 140.A N TYR 190.A O no hydrogen 3.054 N/A ARG 142.A N ILE 133.A O no hydrogen 2.970 N/A ARG 142.A NE GLU 138.A OE1 no hydrogen 2.807 N/A ARG 142.A NH2 GLU 138.A OE2 no hydrogen 2.822 N/A GLN 143.A NE2 GLU 180.A OE2 no hydrogen 2.930 N/A ILE 144.A N LEU 179.A O no hydrogen 2.834 N/A GLU 145.A N.A THR 131.A O no hydrogen 2.780 N/A GLU 145.A N.B THR 131.A O no hydrogen 2.806 N/A LEU 146.A N VAL 177.A O no hydrogen 2.805 N/A GLN 147.A N LYS 129.A O no hydrogen 2.823 N/A GLN 147.A NE2 LYS 20.A O no hydrogen 3.042 N/A TYR 148.A N THR 175.A O no hydrogen 2.832 N/A TYR 148.A OH GLU 167.A OE2 no hydrogen 2.566 N/A VAL 149.A N ASP 127.A O no hydrogen 3.096 N/A GLY 150.A N LEU 158.A O no hydrogen 2.819 N/A ILE 151.A N TRP 125.A O no hydrogen 2.828 N/A ASP 152.A N GLU 156.A O no hydrogen 3.028 N/A SER 154.A OG ASP 152.A OD1 no hydrogen 3.189 N/A GLY 155.A N ASP 152.A O no hydrogen 2.859 N/A GLU 156.A N ASP 152.A OD1 no hydrogen 3.024 N/A LEU 157.A N TYR 13.A O no hydrogen 2.819 N/A LEU 158.A N GLY 150.A O no hydrogen 2.784 N/A THR 159.A N ALA 9.A O no hydrogen 2.892 N/A THR 159.A OG1 GLY 173.A O no hydrogen 2.809 N/A ARG 161.A N SER 7.A O no hydrogen 2.810 N/A LEU 162.A N GLU 167.A OE2 no hydrogen 2.911 N/A SER 164.A N GLU 167.A OE1 no hydrogen 3.075 N/A SER 164.A OG TYR 110.A OH no hydrogen 2.951 N/A LYS 166.A N SER 164.A OG no hydrogen 3.027 N/A GLU 167.A N SER 164.A O no hydrogen 3.450 N/A SER 168.A N THR 176.A O no hydrogen 2.968 N/A ASP 170.A N VAL 174.A O no hydrogen 2.917 N/A ASN 172.A N ASP 170.A OD1 no hydrogen 2.844 N/A GLY 173.A N ASP 170.A O no hydrogen 3.100 N/A VAL 174.A N ASP 170.A OD1 no hydrogen 2.879 N/A THR 175.A N TYR 148.A O no hydrogen 3.012 N/A THR 176.A N SER 168.A O no hydrogen 2.771 N/A VAL 177.A N LEU 146.A O no hydrogen 2.790 N/A LEU 179.A N ILE 144.A O no hydrogen 2.891 N/A ASN 181.A N ARG 142.A O no hydrogen 2.842 N/A ASN 181.A ND2 ALA 86.A O no hydrogen 2.927 N/A ASN 181.A ND2 PRO 141.A O no hydrogen 2.906 N/A ILE 186.A N ALA 183.A O no hydrogen 3.360 N/A ASN 187.A N THR 196.A O no hydrogen 2.805 N/A ASP 189.A N THR 194.A O no hydrogen 2.900 N/A TYR 190.A OH ASN 181.A O no hydrogen 2.663 N/A LEU 191.A N ASP 189.A OD1 no hydrogen 2.886 N/A ASN 192.A N ASP 189.A OD1 no hydrogen 3.005 N/A ASN 192.A ND2 ASP 189.A OD1 no hydrogen 3.475 N/A ASN 192.A ND2 ASP 189.A OD2 no hydrogen 2.544 N/A GLY 193.A N ASP 189.A O no hydrogen 2.677 N/A THR 194.A N ASP 189.A O no hydrogen 3.396 N/A ALA 195.A N TRP 62.A O no hydrogen 2.816 N/A THR 196.A N ASN 187.A O no hydrogen 2.990 N/A