Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7duu_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 2.A N GLU 1.A OE1 no hydrogen 2.552 N/A ARG 5.A N GLY 2.A O no hydrogen 3.229 N/A ARG 5.A NH2 ASP 30.A OD1 no hydrogen 3.560 N/A LYS 6.A NZ ASP 94.A OD1 no hydrogen 2.397 N/A LYS 6.A NZ ASP 94.A OD2 no hydrogen 2.977 N/A SER 8.A N TRP 28.A O no hydrogen 2.834 N/A LEU 10.A N GLN 26.A O no hydrogen 3.003 N/A HIS 12.A N ILE 24.A O no hydrogen 2.766 N/A VAL 17.A N VAL 99.A O no hydrogen 2.904 N/A SER 19.A N THR 101.A O no hydrogen 3.112 N/A GLU 20.A N MET 68.A O no hydrogen 2.964 N/A GLU 21.A N LYS 18.A O no hydrogen 3.067 N/A VAL 23.A N ILE 65.A O no hydrogen 3.165 N/A ILE 24.A N HIS 12.A O no hydrogen 3.090 N/A LEU 25.A N PHE 63.A O no hydrogen 2.740 N/A GLN 26.A N LEU 10.A O no hydrogen 2.797 N/A GLN 26.A NE2 ASN 62.A OD1 no hydrogen 2.949 N/A CYS 27.A N ALA 61.A O no hydrogen 3.101 N/A TRP 28.A N SER 8.A O no hydrogen 3.065 N/A SER 29.A N SER 59.A O no hydrogen 3.065 N/A VAL 31.A N SER 29.A OG no hydrogen 2.690 N/A PHE 33.A N VAL 31.A O no hydrogen 2.720 N/A HIS 35.A NE2 HIS 84.A ND1 no hydrogen 2.984 N/A PHE 36.A N LEU 50.A O no hydrogen 2.880 N/A LEU 37.A N TYR 79.A O no hydrogen 2.906 N/A LEU 38.A N LEU 48.A O no hydrogen 2.958 N/A HIS 39.A N ARG 77.A O no hydrogen 2.777 N/A HIS 39.A ND1 THR 47.A OG1 no hydrogen 2.898 N/A ARG 40.A N ASP 46.A O no hydrogen 2.967 N/A ARG 40.A NE TYR 76.A OH no hydrogen 3.048 N/A ARG 40.A NH1 TYR 44.A O no hydrogen 2.256 N/A GLU 41.A N THR 75.A O no hydrogen 3.103 N/A ASP 46.A N ARG 40.A O no hydrogen 3.100 N/A THR 47.A N ASP 46.A OD1 no hydrogen 2.681 N/A THR 47.A OG1 HIS 39.A ND1 no hydrogen 2.898 N/A LEU 48.A N LEU 38.A O no hydrogen 2.921 N/A HIS 49.A NE2 HIS 35.A ND1 no hydrogen 3.078 N/A LEU 50.A N PHE 36.A O no hydrogen 3.043 N/A GLY 52.A N GLU 34.A O no hydrogen 2.839 N/A GLU 53.A N LYS 60.A O no hydrogen 2.689 N/A HIS 54.A ND1 SER 59.A OG no hydrogen 2.762 N/A HIS 55.A N VAL 58.A O no hydrogen 3.029 N/A HIS 55.A NE2 GLU 53.A OE2 no hydrogen 2.954 N/A VAL 58.A N HIS 55.A O no hydrogen 3.418 N/A SER 59.A N SER 29.A O no hydrogen 2.909 N/A SER 59.A OG HIS 54.A ND1 no hydrogen 2.762 N/A LYS 60.A N GLU 53.A O no hydrogen 2.643 N/A ALA 61.A N CYS 27.A O no hydrogen 3.007 N/A PHE 63.A N LEU 25.A O no hydrogen 2.753 N/A ILE 65.A N VAL 23.A O no hydrogen 2.914 N/A MET 68.A N GLU 21.A O no hydrogen 2.969 N/A LEU 72.A N MET 69.A O no hydrogen 2.911 N/A ALA 73.A N GLN 70.A O no hydrogen 3.158 N/A GLY 74.A N ILE 98.A O no hydrogen 2.930 N/A THR 75.A OG1 ASP 97.A OD1 no hydrogen 2.613 N/A THR 75.A OG1 TYR 182.A OH no hydrogen 2.950 N/A TYR 76.A N LEU 96.A O no hydrogen 2.782 N/A TYR 76.A OH LEU 72.A O no hydrogen 2.678 N/A ARG 77.A N HIS 39.A O no hydrogen 2.930 N/A ARG 77.A NE GLU 41.A OE1 no hydrogen 2.787 N/A ARG 77.A NH2 GLU 41.A OE1 no hydrogen 2.951 N/A ARG 77.A NH2 GLU 41.A OE2 no hydrogen 3.035 N/A CYS 78.A N SER 93.A OG no hydrogen 2.944 N/A CYS 78.A SG SER 8.A O no hydrogen 4.002 N/A TYR 79.A N LEU 37.A O no hydrogen 2.821 N/A GLY 80.A N SER 90.A OG no hydrogen 2.949 N/A SER 81.A N HIS 35.A O no hydrogen 2.963 N/A SER 81.A OG THR 83.A O no hydrogen 2.250 N/A VAL 82.A N GLN 88.A O no hydrogen 3.096 N/A THR 83.A N SER 81.A OG no hydrogen 3.176 N/A THR 83.A OG1 PRO 86.A O no hydrogen 2.867 N/A THR 83.A OG1 GLN 88.A OE1 no hydrogen 2.523 N/A GLN 88.A N THR 83.A OG1 no hydrogen 3.260 N/A SER 90.A N GLY 80.A O no hydrogen 2.789 N/A SER 90.A OG GLY 80.A O no hydrogen 3.408 N/A SER 90.A OG ALA 91.A O no hydrogen 3.126 N/A ALA 91.A N HIS 4.A O no hydrogen 2.792 N/A SER 93.A N CYS 78.A O no hydrogen 2.952 N/A SER 93.A OG ASP 94.A O no hydrogen 3.057 N/A LEU 96.A N TYR 76.A O no hydrogen 2.786 N/A ILE 98.A N GLY 74.A O no hydrogen 2.883 N/A VAL 99.A N PRO 15.A O no hydrogen 3.208 N/A ILE 100.A N TYR 182.A O no hydrogen 3.032 N/A THR 101.A N VAL 17.A O no hydrogen 2.998 N/A GLY 102.A N SER 185.A O no hydrogen 3.151 N/A LEU 103.A N TRP 184.A O no hydrogen 3.164 N/A LYS 106.A NZ ASP 189.A OD1 no hydrogen 3.100 N/A LYS 106.A NZ ASP 189.A OD2 no hydrogen 3.053 N/A SER 108.A N SER 128.A O no hydrogen 2.737 N/A SER 110.A N SER 126.A O no hydrogen 3.095 N/A GLN 112.A N THR 124.A O no hydrogen 2.642 N/A GLY 114.A N ALA 111.A O no hydrogen 3.275 N/A VAL 117.A N SER 194.A O no hydrogen 2.728 N/A LEU 118.A N GLU 121.A OE2 no hydrogen 3.276 N/A ALA 119.A N THR 196.A OXT no hydrogen 2.913 N/A GLY 120.A N ALA 165.A O no hydrogen 3.248 N/A GLU 121.A N LEU 118.A O no hydrogen 3.247 N/A LEU 125.A N PHE 160.A O no hydrogen 2.718 N/A SER 126.A N SER 110.A O no hydrogen 2.790 N/A SER 126.A OG ASP 159.A OD1 no hydrogen 2.587 N/A CYS 127.A N ALA 158.A O no hydrogen 2.828 N/A CYS 127.A SG SER 108.A O no hydrogen 3.873 N/A SER 128.A N SER 108.A O no hydrogen 2.946 N/A SER 129.A N PHE 156.A O no hydrogen 2.972 N/A SER 131.A N SER 129.A OG no hydrogen 3.157 N/A SER 131.A OG GLU 105.A OE2 no hydrogen 2.698 N/A TYR 133.A N SER 131.A O no hydrogen 2.894 N/A TYR 133.A OH GLU 105.A O no hydrogen 2.627 N/A ASP 134.A N SER 176.A O no hydrogen 2.855 N/A MET 135.A N SER 176.A O no hydrogen 3.042 N/A TYR 136.A N PHE 146.A O no hydrogen 2.859 N/A TYR 136.A OH PHE 156.A O no hydrogen 2.785 N/A HIS 137.A N PHE 174.A O no hydrogen 2.659 N/A LEU 138.A N ARG 144.A O no hydrogen 2.808 N/A SER 139.A N ARG 172.A O no hydrogen 3.092 N/A GLU 141.A N THR 170.A O no hydrogen 3.134 N/A PHE 146.A N TYR 136.A O no hydrogen 3.052 N/A ALA 148.A N ASP 134.A O no hydrogen 2.761 N/A GLY 149.A N GLN 157.A O no hydrogen 2.839 N/A VAL 152.A N THR 155.A O no hydrogen 3.370 N/A THR 155.A N VAL 152.A O no hydrogen 3.286 N/A THR 155.A OG1 VAL 152.A O no hydrogen 3.319 N/A PHE 156.A N SER 129.A O no hydrogen 2.756 N/A ALA 158.A N CYS 127.A O no hydrogen 2.840 N/A PHE 160.A N LEU 125.A O no hydrogen 2.595 N/A LEU 162.A N VAL 123.A O no hydrogen 2.659 N/A ALA 165.A N GLU 121.A O no hydrogen 3.046 N/A HIS 167.A ND1 HIS 167.A O no hydrogen 3.158 N/A GLY 169.A N VAL 193.A O no hydrogen 3.357 N/A TYR 171.A N LEU 191.A O no hydrogen 2.745 N/A ARG 172.A N SER 139.A O no hydrogen 3.111 N/A ARG 172.A NE SER 187.A OG no hydrogen 2.999 N/A ARG 172.A NH1 GLU 141.A OE1 no hydrogen 2.940 N/A CYS 173.A SG HIS 137.A O no hydrogen 3.506 N/A PHE 174.A N HIS 137.A O no hydrogen 2.903 N/A GLY 175.A N SER 185.A OG no hydrogen 2.852 N/A ARG 178.A N ASP 134.A OD2 no hydrogen 2.779 N/A SER 180.A N PHE 177.A O no hydrogen 3.028 N/A SER 180.A OG ASP 179.A OD1 no hydrogen 2.835 N/A GLU 183.A N SER 180.A O no hydrogen 3.226 N/A TRP 184.A N ILE 100.A O no hydrogen 2.799 N/A TRP 184.A NE1 PRO 181.A O no hydrogen 3.017 N/A SER 185.A N GLY 175.A O no hydrogen 2.843 N/A SER 185.A OG ASN 186.A O no hydrogen 2.825 N/A ASN 186.A N TYR 104.A O no hydrogen 2.812 N/A SER 187.A OG SER 188.A O no hydrogen 2.785 N/A SER 188.A N CYS 173.A O no hydrogen 2.785 N/A SER 188.A OG ASP 189.A O no hydrogen 3.356 N/A LEU 191.A N TYR 171.A O no hydrogen 2.757 N/A VAL 193.A N GLY 169.A O no hydrogen 2.812 N/A SER 194.A N PRO 115.A O no hydrogen 2.919 N/A THR 196.A N VAL 117.A O no hydrogen 2.782 N/A