Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1f2a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N TYR 169.A O no hydrogen 2.913 N/A TRP 7.A N VAL 167.A O no hydrogen 2.999 N/A TRP 7.A NE1 LEU 129.A O no hydrogen 2.918 N/A ARG 8.A N ASP 6.A OD2 no hydrogen 3.157 N/A ARG 8.A NE ASP 6.A OD1 no hydrogen 3.370 N/A ARG 8.A NE ASP 6.A OD2 no hydrogen 3.027 N/A ARG 8.A NH2 ASP 6.A OD1 no hydrogen 2.943 N/A ALA 9.A N ASP 6.A O no hydrogen 2.987 N/A ARG 10.A N TRP 7.A O no hydrogen 3.206 N/A GLY 11.A N ARG 8.A O no hydrogen 3.256 N/A ALA 12.A N TRP 7.A O no hydrogen 3.213 N/A THR 14.A OG1 GLU 35.A OE1 no hydrogen 2.707 N/A LYS 17.A NZ GLU 35.A OE2 no hydrogen 2.737 N/A LYS 17.A NZ GLU 50.A OE1 no hydrogen 3.294 N/A LYS 17.A NZ GLU 50.A OE2 no hydrogen 2.828 N/A LYS 17.A NZ GLU 86.A OE2 no hydrogen 2.957 N/A GLN 19.A N SER 183.A O no hydrogen 3.044 N/A GLN 19.A NE2 CYS 22.A O no hydrogen 2.855 N/A GLY 20.A N ASP 18.A OD2 no hydrogen 2.936 N/A GLN 21.A N GLY 94B.A O no hydrogen 2.859 N/A CYS 22.A N GLN 19.A O no hydrogen 3.428 N/A GLY 23.A N CYS 63.A O no hydrogen 3.104 N/A SER 24.A OG TYR 91.A OH no hydrogen 2.755 N/A TRP 26.A NE1 GLY 62.A O no hydrogen 2.954 N/A ALA 27.A N SER 24.A O no hydrogen 2.901 N/A PHE 28.A N SER 24.A O no hydrogen 3.247 N/A SER 29.A N CYS 25.A O no hydrogen 2.917 N/A SER 29.A OG VAL 164.A O no hydrogen 2.696 N/A ALA 30.A N TRP 26.A O no hydrogen 3.023 N/A ILE 31.A N ALA 27.A O no hydrogen 2.911 N/A GLY 32.A N PHE 28.A O no hydrogen 2.812 N/A ASN 33.A N SER 29.A O no hydrogen 3.123 N/A ASN 33.A ND2 PRO 134.A O no hydrogen 2.767 N/A ASN 33.A ND2 SER 211.A OG no hydrogen 3.061 N/A VAL 34.A N ALA 30.A O no hydrogen 3.044 N/A GLU 35.A N ILE 31.A O no hydrogen 2.841 N/A CYS 36.A N GLY 32.A O no hydrogen 3.239 N/A CYS 36.A SG ALA 12.A O no hydrogen 3.224 N/A CYS 36.A SG GLY 32.A O no hydrogen 3.241 N/A GLN 37.A N ASN 33.A O no hydrogen 2.957 N/A GLN 37.A NE2 ASN 132.A O no hydrogen 2.969 N/A GLN 37.A NE2 PRO 134.A O no hydrogen 3.216 N/A TRP 38.A N VAL 34.A O no hydrogen 2.833 N/A PHE 39.A N GLU 35.A O no hydrogen 3.226 N/A LEU 40.A N CYS 36.A O no hydrogen 2.989 N/A ALA 41.A N GLN 37.A O no hydrogen 2.991 N/A ALA 41.A N TRP 38.A O no hydrogen 3.104 N/A GLY 42.A N PHE 39.A O no hydrogen 3.011 N/A THR 46.A OG1 PRO 44.A O no hydrogen 2.836 N/A ASN 47.A ND2 GLU 86.A OE2 no hydrogen 3.141 N/A LEU 48.A N GLU 35.A OE2 no hydrogen 2.797 N/A SER 49.A N TYR 84.A O no hydrogen 2.881 N/A SER 49.A OG TYR 89.A O no hydrogen 2.827 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.968 N/A GLN 51.A NE2 GLN 51.A O no hydrogen 3.511 N/A GLN 51.A NE2 SER 55.A OG no hydrogen 2.846 N/A GLN 51.A NE2 SER 93A.A OG no hydrogen 2.944 N/A MET 52.A N SER 49.A OG no hydrogen 2.957 N/A VAL 54.A N GLU 50.A O no hydrogen 3.010 N/A SER 55.A N GLN 51.A O no hydrogen 2.847 N/A SER 55.A OG SER 98.A OG no hydrogen 3.235 N/A SER 55.A OG PRO 99.A O no hydrogen 2.812 N/A CYS 56.A N MET 52.A O no hydrogen 2.787 N/A CYS 56.A SG TYR 89.A OH no hydrogen 3.788 N/A ASP 57.A N LEU 53.A O no hydrogen 2.939 N/A LYS 58.A NZ SER 55.A O no hydrogen 2.784 N/A THR 59.A N ASP 57.A OD1 no hydrogen 3.004 N/A THR 59.A OG1 ASP 57.A OD1 no hydrogen 2.728 N/A ASP 60.A N ASP 57.A O no hydrogen 3.314 N/A SER 61.A N GLY 65.A O no hydrogen 2.851 N/A SER 64.A N SER 61.A O no hydrogen 2.807 N/A GLY 65.A N GLY 62.A O no hydrogen 3.352 N/A LEU 67.A N ASP 60.A OD1 no hydrogen 2.834 N/A ASN 70.A ND2 THR 59.A O no hydrogen 3.299 N/A ASN 70.A ND2 ASP 60.A OD1 no hydrogen 3.358 N/A ALA 71.A N LEU 67.A O no hydrogen 2.980 N/A PHE 72.A N MET 68.A O no hydrogen 2.917 N/A GLU 73.A N ASN 69.A O no hydrogen 3.143 N/A TRP 74.A N ASN 70.A O no hydrogen 2.825 N/A ILE 75.A N ALA 71.A O no hydrogen 3.097 N/A VAL 76.A N PHE 72.A O no hydrogen 3.344 N/A GLN 77.A N GLU 73.A O no hydrogen 2.773 N/A GLN 77.A NE2 GLU 73.A OE1 no hydrogen 3.283 N/A GLU 78.A N TRP 74.A O no hydrogen 2.722 N/A ALA 82.A N ASN 79A.A O no hydrogen 3.050 N/A VAL 83.A N ALA 110.A O no hydrogen 2.850 N/A THR 85.A N THR 107.A O no hydrogen 2.926 N/A THR 85.A OG1 ASP 87.A OD1.A no hydrogen 2.946 N/A THR 85.A OG1 SER 88.A OG no hydrogen 2.795 N/A GLU 86.A N ASN 47.A O no hydrogen 2.903 N/A SER 88.A N THR 85.A OG1 no hydrogen 3.276 N/A SER 88.A OG THR 85.A O no hydrogen 3.066 N/A SER 88.A OG THR 85.A OG1 no hydrogen 2.795 N/A SER 88.A OG THR 107.A O no hydrogen 3.481 N/A TYR 89.A N THR 85.A O no hydrogen 3.219 N/A TYR 89.A N GLU 86.A O no hydrogen 3.264 N/A TYR 91.A OH GLN 19.A O no hydrogen 2.655 N/A TYR 91.A OH SER 24.A OG no hydrogen 2.755 N/A ALA 92.A N GLN 51.A OE1 no hydrogen 2.816 N/A GLY 96.A N SER 93A.A O no hydrogen 2.913 N/A SER 98.A OG SER 55.A OG no hydrogen 3.235 N/A SER 98.A OG PRO 99.A O no hydrogen 3.488 N/A THR 102.A N TYR 89.A OH no hydrogen 3.385 N/A THR 102.A OG1 HIS 106.A NE2 no hydrogen 2.845 N/A HIS 106.A ND1 SER 88.A O no hydrogen 2.828 N/A HIS 106.A NE2 THR 102.A O no hydrogen 2.980 N/A HIS 106.A NE2 THR 102.A OG1 no hydrogen 2.845 N/A THR 107.A N SER 88.A OG no hydrogen 2.986 N/A GLY 109.A N VAL 83.A O no hydrogen 2.809 N/A ALA 110.A N VAL 83.A O no hydrogen 3.093 N/A ILE 112.A N GLY 81C.A O no hydrogen 3.029 N/A THR 113.A N VAL 213.A O no hydrogen 2.857 N/A THR 113.A OG1 VAL 213.A O no hydrogen 3.296 N/A GLY 114.A N VAL 213.A O no hydrogen 3.451 N/A HIS 115.A NE2 GLU 117.A OE1 no hydrogen 3.137 N/A VAL 116.A N SER 211.A O no hydrogen 2.907 N/A LEU 118.A N ALA 209.A O no hydrogen 2.900 N/A GLN 120.A NE2 GLU 207.A O no hydrogen 3.044 N/A GLN 124.A N ASP 121.A OD1 no hydrogen 3.027 N/A ILE 125.A N ASP 121.A O no hydrogen 2.863 N/A ALA 126.A N GLU 122.A O no hydrogen 2.898 N/A ALA 127.A N ALA 123.A O no hydrogen 3.043 N/A TRP 128.A N GLN 124.A O no hydrogen 3.146 N/A LEU 129.A N ILE 125.A O no hydrogen 2.917 N/A ALA 130.A N ALA 126.A O no hydrogen 2.932 N/A VAL 131.A N TRP 128.A O no hydrogen 3.275 N/A ASN 132.A N TRP 128.A O no hydrogen 2.787 N/A GLY 133.A N LEU 129.A O no hydrogen 2.958 N/A VAL 135.A N LEU 166.A O no hydrogen 3.151 N/A ALA 136.A N SER 210.A O no hydrogen 2.796 N/A VAL 137.A N VAL 164.A O no hydrogen 3.119 N/A VAL 139.A N HIS 162.A O no hydrogen 2.878 N/A ASP 140.A N CYS 203.A O no hydrogen 2.799 N/A ALA 141.A N ASP 161.A OD2 no hydrogen 2.966 N/A SER 142.A N ASP 140.A OD2 no hydrogen 2.983 N/A SER 142.A OG ASP 140.A OD2 no hydrogen 2.741 N/A TRP 144.A N ALA 141.A O no hydrogen 3.219 N/A THR 146.A OG1 SER 143.A O no hydrogen 3.497 N/A TYR 147.A N TRP 144.A O no hydrogen 3.296 N/A TYR 147.A OH GLY 150.A O no hydrogen 2.671 N/A GLY 150.A N GLU 190.A OE2 no hydrogen 2.772 N/A MET 152.A N ARG 195.A O no hydrogen 2.922 N/A CYS 155.A SG ASP 140.A O no hydrogen 3.997 N/A CYS 155.A SG VAL 156.A O no hydrogen 3.713 N/A VAL 156.A N SER 143.A OG no hydrogen 2.992 N/A SER 157.A OG CYS 155.A O no hydrogen 2.942 N/A GLU 158.A N.A ASP 140.A OD1 no hydrogen 2.853 N/A GLU 158.A N.B ASP 140.A OD1 no hydrogen 2.850 N/A ASP 161.A N VAL 139.A O no hydrogen 3.021 N/A HIS 162.A N VAL 139.A O no hydrogen 3.127 N/A HIS 162.A NE2 ASN 182.A OD1 no hydrogen 2.832 N/A VAL 164.A N VAL 137.A O no hydrogen 2.900 N/A LEU 165.A N LYS 181.A O no hydrogen 3.284 N/A LEU 166.A N VAL 135.A O no hydrogen 2.857 N/A VAL 167.A N ILE 179.A O no hydrogen 2.943 N/A TYR 169.A N VAL 5.A O no hydrogen 2.805 N/A TYR 169.A OH PRO 2.A O no hydrogen 2.732 N/A ASN 170.A N.A TYR 177.A O no hydrogen 2.995 N/A ASN 170.A N.B TYR 177.A O no hydrogen 2.996 N/A ASN 170.A ND2.A TYR 177.A OH no hydrogen 3.223 N/A ASN 170.A ND2.B TYR 177.A OH no hydrogen 3.219 N/A TYR 177.A N ASN 170.A O.A no hydrogen 3.126 N/A TYR 177.A N ASN 170.A O.B no hydrogen 3.123 N/A TRP 178.A N ILE 196.A O no hydrogen 2.787 N/A TRP 178.A NE1 GLU 122.A OE1 no hydrogen 2.868 N/A ILE 179.A N GLY 168.A O no hydrogen 2.879 N/A ILE 180.A N ILE 194.A O no hydrogen 2.870 N/A LYS 181.A N LEU 165.A O no hydrogen 2.813 N/A LYS 181.A NZ THR 14.A O no hydrogen 2.911 N/A LYS 181.A NZ ALA 15.A O no hydrogen 3.207 N/A ASN 182.A N GLY 192.A O no hydrogen 3.129 N/A SER 183.A N ASN 182.A OD1 no hydrogen 2.874 N/A SER 183.A OG GLN 19.A OE1 no hydrogen 2.758 N/A THR 185.A N LYS 17.A O no hydrogen 3.087 N/A THR 185.A OG1 TRP 184.A O no hydrogen 2.501 N/A GLN 187.A N THR 185.A OG1 no hydrogen 3.181 N/A TRP 188.A NE1 TRP 144.A O no hydrogen 2.921 N/A GLU 190.A N TYR 193.A O no hydrogen 2.837 N/A GLY 192.A N TRP 188.A O no hydrogen 2.754 N/A TYR 193.A N GLU 190.A O no hydrogen 3.064 N/A ILE 194.A N ILE 180.A O no hydrogen 2.986 N/A ARG 195.A N TYR 147.A OH no hydrogen 3.388 N/A ARG 195.A NH1 GLU 190.A OE1 no hydrogen 3.326 N/A ARG 195.A NH1 GLU 190.A OE2 no hydrogen 2.860 N/A ILE 196.A N TRP 178.A O no hydrogen 3.240 N/A ALA 197.A N MET 152.A O no hydrogen 2.916 N/A LYS 198.A N PRO 176.A O no hydrogen 2.835 N/A LYS 198.A NZ ASP 171A.A OD1 no hydrogen 3.263 N/A LYS 198.A NZ ASP 171A.A OD2 no hydrogen 2.858 N/A GLY 199.A N GLU 122.A OE1 no hydrogen 2.961 N/A SER 200.A OG GLN 202.A OE1 no hydrogen 2.761 N/A ASN 201.A N GLU 122.A OE2 no hydrogen 2.778 N/A ASN 201.A ND2 GLU 207.A OE1 no hydrogen 3.069 N/A CYS 203.A N SER 157.A OG no hydrogen 2.840 N/A LEU 204.A N ASN 201.A O no hydrogen 3.086 N/A VAL 205.A N GLN 202.A O no hydrogen 3.221 N/A LYS 206.A N ASN 201.A OD1 no hydrogen 3.160 N/A LYS 206.A NZ GLN 120.A O no hydrogen 3.385 N/A LYS 206.A NZ GLU 207.A OE1 no hydrogen 3.274 N/A GLU 207.A N LEU 204.A O no hydrogen 3.103 N/A SER 210.A N ALA 136.A O no hydrogen 2.828 N/A SER 210.A OG ASN 69.A OD1 no hydrogen 2.913 N/A SER 211.A N VAL 116.A O no hydrogen 3.050 N/A SER 211.A OG ALA 212.A O no hydrogen 2.957 N/A ALA 212.A N ASN 33.A OD1 no hydrogen 2.793 N/A VAL 213.A N GLY 114.A O no hydrogen 2.868 N/A GLY 215.A N THR 113.A OG1 no hydrogen 3.355 N/A ASN 79A.A N TRP 74.A O no hydrogen 3.200 N/A ASN 79A.A N ILE 75.A O no hydrogen 3.118 N/A SER 93A.A OG GLN 51.A OE1 no hydrogen 3.004 N/A GLN 159A.A N.A ASP 140.A OD1 no hydrogen 2.952 N/A GLN 159A.A N.B ASP 140.A OD1 no hydrogen 2.954 N/A ASP 171A.A N ALA 3.A O no hydrogen 2.800 N/A SER 172B.A N ASN 170.A OD1.A no hydrogen 3.074 N/A SER 172B.A N ASN 170.A OD1.B no hydrogen 3.075 N/A SER 172B.A OG ASN 170.A OD1.A no hydrogen 2.817 N/A SER 172B.A OG ASN 170.A OD1.B no hydrogen 2.819 N/A GLY 81C.A N ILE 75.A O no hydrogen 2.785 N/A