Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w12_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE GLU 186.A OE2 no hydrogen 2.952 N/A ARG 1.A NH1 ASN 183.A OD1 no hydrogen 3.559 N/A ARG 1.A NH2 ASN 183.A OD1 no hydrogen 2.751 N/A ARG 1.A NH2 GLU 186.A OE1 no hydrogen 2.847 N/A ARG 5.A N ASP 47.A O no hydrogen 2.958 N/A ARG 5.A NH1 SER 3.A O no hydrogen 2.952 N/A ARG 5.A NH1 SER 3.A OG no hydrogen 2.778 N/A TYR 6.A N ILE 197.A O no hydrogen 2.845 N/A ILE 7.A N HIS 49.A O no hydrogen 2.711 N/A GLU 8.A N ASP 92.A OD2 no hydrogen 2.861 N/A LEU 9.A N.A PRO 51.A O no hydrogen 2.889 N/A LEU 9.A N.B PRO 51.A O no hydrogen 2.875 N/A ALA 10.A N HIS 93.A O no hydrogen 2.954 N/A VAL 11.A N ASN 54.A O no hydrogen 2.913 N/A VAL 12.A N GLN 95.A O no hydrogen 2.873 N/A ALA 13.A N GLU 56.A O no hydrogen 2.821 N/A ASP 14.A N LEU 97.A O no hydrogen 2.939 N/A HIS 15.A N ASP 62.A OD1 no hydrogen 2.741 N/A HIS 15.A ND1 TRP 58.A O no hydrogen 2.868 N/A ILE 17.A N ASP 14.A OD1 no hydrogen 2.983 N/A PHE 18.A N ASP 14.A O no hydrogen 3.041 N/A THR 19.A N HIS 15.A O no hydrogen 2.888 N/A THR 19.A OG1 HIS 15.A O no hydrogen 3.516 N/A THR 19.A OG1 GLY 16.A O no hydrogen 3.205 N/A LYS 20.A N GLY 16.A O no hydrogen 2.878 N/A LYS 20.A NZ ASP 127.A OD2 no hydrogen 2.861 N/A TYR 21.A N ILE 17.A O no hydrogen 3.047 N/A TYR 21.A OH ASP 127.A OD2 no hydrogen 2.582 N/A ASN 22.A N THR 19.A O no hydrogen 2.930 N/A SER 23.A N PHE 18.A O no hydrogen 2.831 N/A ASN 24.A N TYR 21.A O no hydrogen 2.984 N/A THR 27.A N ASN 24.A OD1 no hydrogen 3.278 N/A ILE 28.A N ASN 24.A O no hydrogen 3.216 N/A ARG 29.A N LEU 25.A O no hydrogen 2.812 N/A THR 30.A N ASN 26.A O no hydrogen 2.948 N/A THR 30.A OG1 ASN 26.A O no hydrogen 2.817 N/A ARG 31.A N THR 27.A O no hydrogen 2.976 N/A ARG 31.A NE ASP 127.A OD1 no hydrogen 3.035 N/A ARG 31.A NH1 LYS 130.A O no hydrogen 2.932 N/A ARG 31.A NH2 ASP 127.A OD1 no hydrogen 2.827 N/A ARG 31.A NH2 SER 129.A O no hydrogen 2.692 N/A ARG 31.A NH2 LYS 130.A O no hydrogen 3.562 N/A VAL 32.A N ILE 28.A O no hydrogen 2.886 N/A HIS 33.A N ARG 29.A O no hydrogen 2.814 N/A GLU 34.A N THR 30.A O no hydrogen 2.945 N/A MET 35.A N ARG 31.A O no hydrogen 2.891 N/A LEU 36.A N.A VAL 32.A O no hydrogen 2.859 N/A LEU 36.A N.B VAL 32.A O no hydrogen 2.833 N/A ASN 37.A N HIS 33.A O no hydrogen 2.974 N/A THR 38.A N GLU 34.A O no hydrogen 3.012 N/A THR 38.A OG1 GLU 34.A O no hydrogen 3.143 N/A VAL 39.A N MET 35.A O no hydrogen 2.773 N/A ASN 40.A N LEU 36.A O.A no hydrogen 2.969 N/A ASN 40.A N LEU 36.A O.B no hydrogen 2.808 N/A GLY 41.A N ASN 37.A O no hydrogen 2.981 N/A PHE 42.A N THR 38.A O no hydrogen 2.959 N/A TYR 43.A N VAL 39.A O no hydrogen 3.033 N/A TYR 43.A N ASN 40.A O no hydrogen 3.172 N/A TYR 43.A OH ALA 140.A O no hydrogen 2.762 N/A ARG 44.A N GLY 41.A O no hydrogen 3.331 N/A ARG 44.A NE GLY 41.A O no hydrogen 3.113 N/A VAL 46.A N TYR 43.A O no hydrogen 3.135 N/A ASP 47.A N ARG 44.A O no hydrogen 2.953 N/A VAL 48.A N TYR 43.A O no hydrogen 3.173 N/A HIS 49.A N ARG 5.A O no hydrogen 2.858 N/A HIS 49.A NE2 ASP 47.A OD1 no hydrogen 2.779 N/A ALA 53.A N LEU 9.A O.A no hydrogen 2.890 N/A ALA 53.A N LEU 9.A O.B no hydrogen 2.617 N/A ASN 54.A N LEU 9.A O.B no hydrogen 3.387 N/A GLU 56.A N VAL 11.A O no hydrogen 2.892 N/A TRP 58.A N ALA 13.A O no hydrogen 2.846 N/A TRP 58.A NE1 GLU 56.A OE2 no hydrogen 2.866 N/A SER 59.A N VAL 57.A O no hydrogen 2.884 N/A GLN 67.A N THR 73.A OG1 no hydrogen 2.757 N/A LYS 72.A N ASP 69.A OD1 no hydrogen 3.145 N/A THR 73.A N ASP 69.A O no hydrogen 3.059 N/A THR 73.A OG1 GLN 67.A O no hydrogen 2.705 N/A THR 73.A OG1 ASP 69.A O no hydrogen 3.497 N/A LEU 74.A N SER 70.A O no hydrogen 2.813 N/A LYS 75.A N SER 71.A O no hydrogen 3.056 N/A LYS 75.A NZ GLU 79.A OE2 no hydrogen 2.734 N/A SER 76.A N LYS 72.A O no hydrogen 2.882 N/A SER 76.A OG LYS 72.A O no hydrogen 3.142 N/A PHE 77.A N THR 73.A O no hydrogen 2.783 N/A GLY 78.A N LEU 74.A O no hydrogen 2.947 N/A GLU 79.A N LYS 75.A O no hydrogen 2.995 N/A TRP 80.A N SER 76.A O no hydrogen 2.933 N/A ARG 81.A N PHE 77.A O no hydrogen 2.736 N/A ARG 81.A NE HIS 91.A NE2 no hydrogen 2.888 N/A ARG 81.A NH1 PRO 118.A O no hydrogen 2.858 N/A GLU 82.A N GLY 78.A O no hydrogen 3.074 N/A ARG 83.A N GLU 79.A O no hydrogen 2.968 N/A ARG 83.A NE ASP 84.A OD2 no hydrogen 3.528 N/A ASP 84.A N TRP 80.A O no hydrogen 2.722 N/A LEU 85.A N TRP 80.A O no hydrogen 3.199 N/A LEU 86.A N ARG 81.A O no hydrogen 2.826 N/A ARG 88.A N LEU 85.A O no hydrogen 2.862 N/A ARG 88.A NE ASP 84.A O no hydrogen 3.302 N/A ARG 88.A NH1 GLU 56.A OE1 no hydrogen 3.187 N/A ARG 88.A NH1 GLU 56.A OE2 no hydrogen 3.018 N/A ARG 88.A NH2 GLU 56.A OE1 no hydrogen 2.719 N/A ILE 89.A N LEU 85.A O no hydrogen 2.840 N/A HIS 91.A ND1 ILE 89.A O no hydrogen 2.760 N/A ASP 92.A N GLU 8.A O no hydrogen 2.748 N/A HIS 93.A N GLU 8.A O no hydrogen 3.268 N/A ALA 94.A N SER 121.A O no hydrogen 3.032 N/A GLN 95.A N ALA 10.A O no hydrogen 2.933 N/A GLN 95.A NE2 HIS 93.A NE2 no hydrogen 3.463 N/A GLN 95.A NE2 MET 139.A O no hydrogen 3.030 N/A LEU 96.A N GLY 123.A O no hydrogen 3.027 N/A LEU 97.A N VAL 12.A O no hydrogen 2.710 N/A THR 98.A N VAL 125.A O no hydrogen 2.858 N/A THR 98.A OG1 ASP 14.A OD2 no hydrogen 2.517 N/A ALA 99.A N ASP 14.A OD1 no hydrogen 3.298 N/A VAL 100.A N THR 98.A OG1 no hydrogen 2.879 N/A ASP 103.A N LYS 68.A O no hydrogen 2.778 N/A THR 106.A N ASP 103.A O no hydrogen 3.138 N/A THR 106.A OG1 ASP 103.A O no hydrogen 3.147 N/A ARG 109.A N VAL 124.A O no hydrogen 2.851 N/A ARG 109.A NH1 SER 70.A OG no hydrogen 3.134 N/A ARG 109.A NH1 SER 71.A OG no hydrogen 2.742 N/A GLY 113.A N HIS 145.A O no hydrogen 2.816 N/A MET 115.A N ASN 146.A O no hydrogen 3.065 N/A CYS 116.A N SER 121.A OG no hydrogen 2.943 N/A ASP 117.A N GLY 114.A O no hydrogen 2.895 N/A ARG 119.A N ASP 117.A OD2 no hydrogen 3.133 N/A ARG 119.A NE GLU 82.A OE1 no hydrogen 2.848 N/A HIS 120.A N ASP 117.A OD2 no hydrogen 2.919 N/A SER 121.A N ASP 117.A O no hydrogen 2.982 N/A SER 121.A OG ASP 92.A O no hydrogen 2.653 N/A SER 121.A OG ASN 146.A OD1 no hydrogen 3.363 N/A GLY 123.A N ALA 94.A O no hydrogen 3.039 N/A VAL 124.A N ARG 109.A O no hydrogen 2.831 N/A VAL 125.A N LEU 96.A O no hydrogen 2.703 N/A ARG 126.A N ILE 107.A O no hydrogen 2.787 N/A ARG 126.A NH1 VAL 100.A O no hydrogen 3.176 N/A ASP 127.A N THR 98.A O no hydrogen 2.856 N/A HIS 128.A NE2 TRP 134.A O no hydrogen 2.986 N/A HIS 128.A NE2 THR 138.A OG1 no hydrogen 2.929 N/A SER 129.A OG.A ASN 131.A O no hydrogen 2.876 N/A SER 129.A OG.B HIS 128.A ND1 no hydrogen 2.828 N/A ASN 132.A ND2 GLU 34.A OE1 no hydrogen 2.911 N/A LEU 133.A N ASN 131.A OD1 no hydrogen 3.003 N/A TRP 134.A N ASN 131.A O no hydrogen 3.142 N/A TRP 134.A NE1 VAL 172.A O no hydrogen 2.843 N/A ALA 136.A N ASN 132.A O no hydrogen 2.846 N/A VAL 137.A N LEU 133.A O no hydrogen 2.960 N/A THR 138.A N TRP 134.A O no hydrogen 3.335 N/A THR 138.A OG1 HIS 128.A NE2 no hydrogen 2.929 N/A THR 138.A OG1 TRP 134.A O no hydrogen 3.114 N/A MET 139.A N VAL 135.A O no hydrogen 2.869 N/A ALA 140.A N ALA 136.A O no hydrogen 2.862 N/A HIS 141.A N VAL 137.A O no hydrogen 2.813 N/A HIS 141.A ND1 ILE 164.A O no hydrogen 2.771 N/A GLU 142.A N THR 138.A O no hydrogen 2.894 N/A LEU 143.A N MET 139.A O no hydrogen 2.978 N/A GLY 144.A N ALA 140.A O no hydrogen 2.862 N/A HIS 145.A N HIS 141.A O no hydrogen 3.072 N/A HIS 145.A ND1 ILE 149.A O no hydrogen 3.047 N/A ASN 146.A N GLU 142.A O no hydrogen 3.184 N/A ASN 146.A ND2 TYR 111.A O no hydrogen 2.882 N/A ASN 146.A ND2 HIS 120.A O no hydrogen 2.787 N/A LEU 147.A N LEU 143.A O no hydrogen 3.020 N/A LEU 147.A N GLY 144.A O no hydrogen 2.946 N/A GLY 148.A N HIS 145.A O no hydrogen 2.833 N/A ILE 149.A N GLY 144.A O no hydrogen 2.990 N/A HIS 150.A N GLN 184.A OE1 no hydrogen 2.759 N/A ASP 152.A N MET 165.A O no hydrogen 2.976 N/A CYS 156.A N THR 153.A O no hydrogen 3.068 N/A CYS 156.A SG THR 153.A OG1 no hydrogen 3.664 N/A SER 157.A N ASP 179.A OD1 no hydrogen 2.882 N/A CYS 158.A SG ALA 160.A O.B no hydrogen 3.875 N/A CYS 158.A SG LYS 161.A O.A no hydrogen 3.332 N/A GLY 159.A N.B GLU 176.A OE2.B no hydrogen 2.319 N/A LYS 161.A N.A CYS 158.A O.A no hydrogen 3.424 N/A LYS 161.A N.B SER 174.A OG.A no hydrogen 3.022 N/A LYS 161.A NZ.A GLU 176.A OE2.A no hydrogen 3.099 N/A SER 162.A N SER 174.A O no hydrogen 3.163 N/A ILE 164.A N GLU 176.A O no hydrogen 2.865 N/A ALA 166.A N CYS 163.A O no hydrogen 3.109 N/A VAL 172.A N TYR 175.A OH no hydrogen 2.909 N/A TYR 175.A OH SER 170.A O no hydrogen 2.504 N/A TYR 175.A OH VAL 172.A O no hydrogen 3.267 N/A GLU 176.A N SER 162.A O no hydrogen 3.134 N/A SER 178.A OG ASP 152.A OD1 no hydrogen 2.615 N/A SER 178.A OG SER 181.A OG no hydrogen 3.158 N/A ASP 179.A N SER 157.A O no hydrogen 3.015 N/A CYS 180.A N ASP 179.A OD1 no hydrogen 2.815 N/A CYS 180.A SG ASP 179.A OD1 no hydrogen 3.756 N/A SER 181.A N SER 178.A OG no hydrogen 2.896 N/A SER 181.A OG ASP 152.A OD1 no hydrogen 3.454 N/A SER 181.A OG SER 178.A OG no hydrogen 3.158 N/A GLN 182.A N SER 178.A O no hydrogen 2.982 N/A GLN 182.A NE2 PHE 177.A O no hydrogen 3.201 N/A ASN 183.A N ASP 179.A O no hydrogen 2.955 N/A GLN 184.A N CYS 180.A O no hydrogen 2.811 N/A TYR 185.A N SER 181.A O no hydrogen 2.874 N/A GLU 186.A N GLN 182.A O no hydrogen 2.944 N/A THR 187.A N ASN 183.A O no hydrogen 2.852 N/A THR 187.A OG1 ASN 183.A O no hydrogen 3.111 N/A TYR 188.A N GLN 184.A O no hydrogen 2.816 N/A LEU 189.A N TYR 185.A O no hydrogen 2.892 N/A THR 190.A N GLU 186.A O no hydrogen 2.862 N/A THR 190.A OG1 GLU 186.A O no hydrogen 2.952 N/A ASN 191.A N THR 187.A O no hydrogen 2.937 N/A HIS 192.A N TYR 188.A O no hydrogen 2.895 N/A HIS 192.A ND1 TYR 188.A O no hydrogen 2.799 N/A ASN 193.A N LEU 189.A O no hydrogen 2.728 N/A ASN 193.A ND2 THR 190.A O no hydrogen 3.251 N/A CYS 196.A SG ASP 92.A OD1 no hydrogen 3.550 N/A LEU 198.A N GLN 195.A O no hydrogen 3.173 N/A