Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2act_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A OH ASP 6.A OD1 no hydrogen 2.992 N/A VAL 5.A N TYR 168.A O no hydrogen 2.905 N/A TRP 7.A N VAL 166.A O no hydrogen 2.832 N/A TRP 7.A NE1 VAL 127.A O no hydrogen 2.821 N/A ARG 8.A N ASP 6.A OD2 no hydrogen 3.010 N/A ARG 8.A NE ASP 6.A OD1 no hydrogen 3.403 N/A ARG 8.A NE ASP 6.A OD2 no hydrogen 3.007 N/A ARG 8.A NH2 ASP 6.A OD1 no hydrogen 2.896 N/A SER 9.A N ASP 6.A O no hydrogen 2.989 N/A SER 9.A OG.A ASP 6.A O no hydrogen 2.835 N/A SER 9.A OG.B ASP 6.A O no hydrogen 3.391 N/A ALA 10.A N TRP 7.A O no hydrogen 3.116 N/A GLY 11.A N ARG 8.A O no hydrogen 3.271 N/A ALA 12.A N TRP 7.A O no hydrogen 3.277 N/A LYS 17.A NZ GLU 34.A OE2 no hydrogen 2.885 N/A LYS 17.A NZ SER 46.A OG no hydrogen 3.072 N/A LYS 17.A NZ LEU 47.A O no hydrogen 3.300 N/A LYS 17.A NZ GLU 49.A OE1 no hydrogen 2.778 N/A LYS 17.A NZ GLU 85.A OE2 no hydrogen 2.968 N/A GLN 19.A N SER 182.A O no hydrogen 2.734 N/A GLN 19.A NE2 CYS 22.A O no hydrogen 3.004 N/A GLY 23.A N CYS 64.A O no hydrogen 2.878 N/A TRP 25.A NE1 GLY 63.A O no hydrogen 3.041 N/A ALA 26.A N GLY 24.A O no hydrogen 2.917 N/A PHE 27.A N GLY 24.A O no hydrogen 3.311 N/A SER 28.A OG SER 133.A OG no hydrogen 3.077 N/A SER 28.A OG ILE 163.A O no hydrogen 2.864 N/A ALA 29.A N TRP 25.A O no hydrogen 3.087 N/A ILE 30.A N ALA 26.A O no hydrogen 2.891 N/A ALA 31.A N PHE 27.A O no hydrogen 2.913 N/A THR 32.A N SER 28.A O no hydrogen 3.267 N/A THR 32.A OG1 SER 28.A O no hydrogen 3.452 N/A THR 32.A OG1 ALA 29.A O no hydrogen 3.218 N/A THR 32.A OG1 SER 133.A OG no hydrogen 3.019 N/A VAL 33.A N ALA 29.A O no hydrogen 3.122 N/A GLU 34.A N ILE 30.A O no hydrogen 2.835 N/A GLY 35.A N ALA 31.A O no hydrogen 3.071 N/A ILE 36.A N THR 32.A O no hydrogen 2.940 N/A ASN 37.A N VAL 33.A O no hydrogen 2.945 N/A LYS 38.A N GLU 34.A O no hydrogen 3.090 N/A LYS 38.A NZ GLY 42.A O no hydrogen 2.749 N/A ILE 39.A N GLY 35.A O no hydrogen 3.010 N/A THR 40.A N ILE 36.A O no hydrogen 2.876 N/A THR 40.A OG1 ILE 36.A O no hydrogen 3.430 N/A SER 41.A N ASN 37.A O no hydrogen 2.771 N/A SER 41.A OG.A ASN 37.A O no hydrogen 2.751 N/A SER 41.A OG.B ASN 37.A OD1 no hydrogen 3.569 N/A GLY 42.A N LYS 38.A O no hydrogen 2.709 N/A SER 43.A N SER 41.A OG.A no hydrogen 3.285 N/A LEU 47.A N GLU 34.A OE2 no hydrogen 2.903 N/A SER 48.A N ASN 83.A O no hydrogen 3.122 N/A SER 48.A OG TYR 88.A O no hydrogen 2.639 N/A GLU 49.A N GLU 49.A OE2 no hydrogen 2.962 N/A GLN 50.A NE2 ASP 54.A OD2 no hydrogen 2.811 N/A GLN 50.A NE2 GLN 93.A O no hydrogen 2.793 N/A GLU 51.A N SER 48.A OG no hydrogen 2.984 N/A ILE 53.A N GLU 49.A O no hydrogen 3.047 N/A ASP 54.A N GLN 50.A O no hydrogen 2.875 N/A CYS 55.A N GLU 51.A O no hydrogen 2.811 N/A GLY 56.A N LEU 52.A O no hydrogen 2.939 N/A ARG 57.A NH1.B GLY 95.A O no hydrogen 3.281 N/A THR 58.A N THR 61.A O no hydrogen 2.857 N/A THR 61.A N THR 58.A O no hydrogen 2.719 N/A THR 61.A OG1 ASP 71.A OD2 no hydrogen 2.568 N/A ARG 62.A N GLY 66.A O no hydrogen 2.832 N/A ARG 62.A NE GLN 59.A O no hydrogen 2.890 N/A ARG 62.A NH1 GLN 59.A O no hydrogen 3.098 N/A CYS 64.A N ASP 94.A OD1 no hydrogen 2.871 N/A CYS 64.A SG ASP 94.A OD1 no hydrogen 3.844 N/A ASP 65.A N ARG 62.A O no hydrogen 3.044 N/A GLY 66.A N GLY 63.A O no hydrogen 3.068 N/A TYR 68.A N THR 61.A OG1 no hydrogen 2.892 N/A ASP 71.A N TYR 68.A O no hydrogen 2.951 N/A GLY 72.A N TYR 68.A O no hydrogen 3.366 N/A GLY 72.A N ILE 69.A O no hydrogen 2.841 N/A PHE 73.A N ILE 69.A O no hydrogen 3.231 N/A GLN 74.A N THR 70.A O no hydrogen 2.870 N/A PHE 75.A N ASP 71.A O no hydrogen 2.963 N/A ILE 76.A N GLY 72.A O no hydrogen 3.295 N/A ILE 77.A N PHE 73.A O no hydrogen 2.979 N/A ASN 78.A N GLN 74.A O no hydrogen 2.809 N/A ASP 79.A N PHE 75.A O no hydrogen 2.777 N/A GLY 80.A N ILE 76.A O no hydrogen 3.024 N/A GLY 80.A N ILE 77.A O no hydrogen 3.265 N/A GLY 81.A N ILE 76.A O no hydrogen 2.989 N/A ILE 82.A N VAL 107.A O no hydrogen 2.921 N/A ASN 83.A N GLU 51.A OE1 no hydrogen 3.010 N/A ASN 83.A ND2 LEU 101.A O no hydrogen 3.017 N/A ASN 83.A ND2 GLN 104.A OE1 no hydrogen 2.946 N/A THR 84.A N ASN 83.A OD1 no hydrogen 2.785 N/A GLU 85.A N SER 46.A O no hydrogen 2.897 N/A ASN 87.A N THR 84.A OG1 no hydrogen 3.071 N/A ASN 87.A ND2 ASN 83.A OD1 no hydrogen 2.853 N/A TYR 88.A N THR 84.A O no hydrogen 2.955 N/A TYR 88.A OH ASP 54.A OD1 no hydrogen 2.719 N/A TYR 90.A OH GLN 19.A O no hydrogen 2.639 N/A THR 91.A N GLN 50.A OE1 no hydrogen 2.787 N/A GLN 93.A NE2 THR 91.A O no hydrogen 3.283 N/A GLY 95.A N ASP 54.A OD2 no hydrogen 2.758 N/A ASP 98.A N TYR 88.A OH no hydrogen 2.954 N/A LEU 101.A N ASP 98.A OD1 no hydrogen 3.152 N/A GLN 102.A N ASP 98.A O no hydrogen 2.674 N/A ASP 103.A N VAL 99.A O no hydrogen 2.891 N/A GLN 104.A N LEU 101.A O no hydrogen 3.323 N/A GLN 104.A NE2 TYR 106.A OH no hydrogen 2.541 N/A LYS 105.A NZ ASP 79.A O no hydrogen 3.056 N/A TYR 106.A N ILE 82.A O no hydrogen 2.924 N/A VAL 107.A N ILE 82.A O no hydrogen 3.284 N/A ASP 110.A N VAL 215.A O no hydrogen 2.785 N/A THR 111.A N VAL 215.A O no hydrogen 3.174 N/A GLU 113.A N TYR 213.A O no hydrogen 2.846 N/A VAL 115.A N PRO 211.A O no hydrogen 2.962 N/A ASN 118.A N ALA 208.A O no hydrogen 2.872 N/A ALA 122.A N ASN 119.A OD1 no hydrogen 3.173 N/A LEU 123.A N ASN 119.A O no hydrogen 3.054 N/A GLN 124.A N GLU 120.A O no hydrogen 2.790 N/A THR 125.A N TRP 121.A O no hydrogen 3.030 N/A THR 125.A OG1 TRP 121.A O no hydrogen 2.966 N/A ALA 126.A N ALA 122.A O no hydrogen 3.052 N/A VAL 127.A N LEU 123.A O no hydrogen 2.943 N/A THR 128.A N GLN 124.A O no hydrogen 3.052 N/A THR 128.A N THR 125.A O no hydrogen 3.242 N/A THR 128.A OG1.A GLN 124.A O no hydrogen 2.851 N/A THR 128.A OG1.A TYR 168.A OH no hydrogen 3.015 N/A THR 128.A OG1.B THR 125.A O no hydrogen 2.845 N/A TYR 129.A N ALA 126.A O no hydrogen 2.959 N/A GLN 130.A N ALA 126.A O no hydrogen 3.271 N/A GLN 130.A NE2 PRO 214.A O no hydrogen 2.876 N/A VAL 132.A N ILE 165.A O no hydrogen 3.220 N/A SER 133.A N SER 212.A O no hydrogen 2.861 N/A SER 133.A OG SER 28.A O no hydrogen 3.008 N/A SER 133.A OG SER 28.A OG no hydrogen 3.077 N/A SER 133.A OG THR 32.A OG1 no hydrogen 3.019 N/A VAL 134.A N ILE 163.A O no hydrogen 2.993 N/A LEU 136.A N HIS 161.A O no hydrogen 2.811 N/A ASP 137.A N CYS 205.A O no hydrogen 2.761 N/A ALA 138.A N ASP 160.A OD1 no hydrogen 2.935 N/A ALA 139.A N ASP 137.A OD2 no hydrogen 3.088 N/A LYS 144.A N GLY 140.A O no hydrogen 3.103 N/A LYS 144.A NZ ALA 139.A O no hydrogen 3.506 N/A GLN 145.A N ASP 141.A O no hydrogen 2.663 N/A GLN 145.A NE2 ASP 141.A O no hydrogen 3.579 N/A TYR 146.A N PHE 143.A O no hydrogen 3.279 N/A TYR 146.A OH GLY 149.A O no hydrogen 2.489 N/A GLY 149.A N GLU 189.A OE2 no hydrogen 2.899 N/A PHE 151.A N ARG 194.A O no hydrogen 2.731 N/A ASP 160.A N LEU 136.A O no hydrogen 2.882 N/A HIS 161.A N LEU 136.A O no hydrogen 2.926 N/A HIS 161.A NE2 ASN 181.A OD1 no hydrogen 2.791 N/A ILE 163.A N VAL 134.A O no hydrogen 2.762 N/A VAL 164.A N LYS 180.A O no hydrogen 3.163 N/A ILE 165.A N VAL 132.A O no hydrogen 2.732 N/A VAL 166.A N ILE 178.A O no hydrogen 2.810 N/A TYR 168.A N VAL 5.A O no hydrogen 2.845 N/A TYR 168.A OH PRO 2.A O no hydrogen 3.208 N/A TYR 168.A OH THR 128.A OG1.A no hydrogen 3.015 N/A GLY 169.A N TYR 176.A O no hydrogen 3.073 N/A THR 170.A OG1 ASP 175.A OD1 no hydrogen 2.540 N/A GLU 171.A N VAL 174.A O no hydrogen 2.867 N/A VAL 174.A N GLU 171.A O no hydrogen 2.961 N/A TYR 176.A N GLY 169.A O no hydrogen 2.991 N/A TRP 177.A N ILE 195.A O no hydrogen 2.838 N/A TRP 177.A NE1 GLU 120.A OE2 no hydrogen 3.005 N/A ILE 178.A N GLY 167.A O no hydrogen 2.906 N/A VAL 179.A N MET 193.A O no hydrogen 2.763 N/A LYS 180.A N VAL 164.A O no hydrogen 2.766 N/A LYS 180.A NZ VAL 14.A O no hydrogen 2.701 N/A ASN 181.A N GLY 191.A O no hydrogen 3.353 N/A SER 182.A N ASN 181.A OD1 no hydrogen 2.707 N/A SER 182.A OG GLN 19.A OE1 no hydrogen 2.656 N/A ASP 184.A N LYS 17.A O no hydrogen 3.112 N/A THR 185.A N ASP 184.A OD2 no hydrogen 2.813 N/A THR 185.A OG1 ASP 184.A OD2 no hydrogen 3.514 N/A TRP 187.A N ASP 184.A O no hydrogen 3.501 N/A TRP 187.A NE1 PHE 143.A O no hydrogen 3.266 N/A GLY 188.A N TYR 146.A O no hydrogen 3.141 N/A GLU 189.A N TYR 192.A O no hydrogen 2.596 N/A GLU 190.A N GLY 188.A O no hydrogen 3.013 N/A GLY 191.A N TRP 187.A O no hydrogen 2.734 N/A TYR 192.A N GLU 189.A O no hydrogen 3.185 N/A MET 193.A N VAL 179.A O no hydrogen 2.970 N/A ARG 194.A N TYR 146.A OH no hydrogen 3.149 N/A ARG 194.A NE GLU 189.A OE1 no hydrogen 2.862 N/A ARG 194.A NH1 GLU 189.A OE2 no hydrogen 2.926 N/A ARG 194.A NH2 GLU 171.A OE2 no hydrogen 3.323 N/A ILE 195.A N TRP 177.A O no hydrogen 2.998 N/A LEU 196.A N PHE 151.A O no hydrogen 2.878 N/A ARG 197.A N ASP 175.A O no hydrogen 2.856 N/A ARG 197.A NE TYR 176.A O no hydrogen 2.857 N/A ARG 197.A NH1 GLY 169.A O no hydrogen 2.970 N/A ASN 198.A N GLU 120.A OE2 no hydrogen 2.971 N/A ASN 198.A ND2 ASP 175.A OD2 no hydrogen 3.148 N/A VAL 199.A N GLU 120.A OE1 no hydrogen 2.895 N/A GLY 200.A N GLU 120.A OE1 no hydrogen 3.132 N/A GLY 203.A N GLY 200.A O no hydrogen 2.967 N/A THR 204.A OG1 LEU 196.A O no hydrogen 2.833 N/A GLY 206.A N GLY 203.A O no hydrogen 3.097 N/A ILE 207.A N THR 204.A O no hydrogen 3.165 N/A ALA 208.A N ALA 202.A O no hydrogen 2.811 N/A THR 209.A N GLY 206.A O no hydrogen 2.895 N/A THR 209.A OG1 ASN 118.A OD1 no hydrogen 2.768 N/A SER 212.A N SER 133.A O no hydrogen 2.924 N/A TYR 213.A N GLU 113.A O no hydrogen 2.999 N/A VAL 215.A N THR 111.A O no hydrogen 2.816 N/A LYS 216.A NZ THR 108.A O no hydrogen 2.912 N/A TYR 217.A N ASP 110.A OD1 no hydrogen 2.806 N/A