Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3aa3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N GLU 64.A O no hydrogen 2.760 N/A GLU 6.A N ARG 27.A O no hydrogen 3.123 N/A ILE 7.A N ILE 66.A O no hydrogen 2.947 N/A PHE 8.A N ILE 25.A O no hydrogen 3.039 N/A THR 9.A N SER 68.A O no hydrogen 3.065 N/A ASP 10.A N GLY 23.A O no hydrogen 3.144 N/A GLY 11.A N ASP 10.A OD2 no hydrogen 2.894 N/A SER 12.A N GLY 21.A O no hydrogen 2.850 N/A CYS 13.A SG GLY 15.A O no hydrogen 3.513 N/A CYS 13.A SG GLY 18.A O no hydrogen 3.445 N/A CYS 13.A SG PRO 19.A O no hydrogen 3.595 N/A CYS 13.A SG THR 42.A O no hydrogen 3.289 N/A GLY 18.A N THR 42.A O no hydrogen 2.901 N/A GLY 20.A N TYR 39.A O no hydrogen 2.907 N/A GLY 21.A N SER 12.A O no hydrogen 2.886 N/A TYR 22.A N ALA 37.A O no hydrogen 3.125 N/A GLY 23.A N ASP 10.A O no hydrogen 3.056 N/A ALA 24.A N PHE 35.A O no hydrogen 2.948 N/A ILE 25.A N PHE 8.A O no hydrogen 2.905 N/A LEU 26.A N LYS 33.A O no hydrogen 2.833 N/A ARG 27.A N GLU 6.A O no hydrogen 2.760 N/A ARG 27.A NE GLU 6.A OE2 no hydrogen 2.801 N/A ARG 27.A NH1 GLU 32.A OE2 no hydrogen 2.434 N/A ARG 27.A NH2 GLU 6.A OE2 no hydrogen 3.056 N/A ARG 27.A NH2 GLU 129.A OE1 no hydrogen 2.371 N/A TYR 28.A N ARG 31.A O no hydrogen 2.900 N/A TYR 28.A OH GLU 61.A OE1 no hydrogen 2.568 N/A ARG 31.A N TYR 28.A O no hydrogen 2.941 N/A LYS 33.A N LEU 26.A O no hydrogen 2.878 N/A PHE 35.A N ALA 24.A O no hydrogen 2.928 N/A SER 36.A OG TYR 22.A O no hydrogen 2.935 N/A SER 36.A OG LEU 136.A O no hydrogen 3.425 N/A TYR 39.A N GLY 20.A O no hydrogen 2.667 N/A THR 40.A N LEU 146.A O no hydrogen 3.067 N/A THR 42.A N GLY 18.A O no hydrogen 2.701 N/A THR 42.A OG1 ASP 148.A OD1 no hydrogen 2.537 N/A ASN 44.A ND2 GLU 48.A OE2 no hydrogen 3.299 N/A ARG 46.A N THR 43.A OG1 no hydrogen 3.199 N/A ARG 46.A NE ASP 148.A OD1 no hydrogen 2.805 N/A ARG 46.A NE ASP 148.A OD2 no hydrogen 3.423 N/A ARG 46.A NH1 ASN 100.A OD1 no hydrogen 2.954 N/A ARG 46.A NH1 ASP 102.A OD1 no hydrogen 2.943 N/A ARG 46.A NH2 ASP 102.A OD2 no hydrogen 2.841 N/A ARG 46.A NH2 ASP 148.A OD2 no hydrogen 2.895 N/A MET 47.A N THR 43.A O no hydrogen 3.117 N/A GLU 48.A N ASN 44.A O no hydrogen 3.071 N/A LEU 49.A N ASN 45.A O no hydrogen 3.099 N/A MET 50.A N ARG 46.A O no hydrogen 2.889 N/A ALA 51.A N MET 47.A O no hydrogen 3.067 N/A ILE 53.A N LEU 49.A O no hydrogen 3.107 N/A VAL 54.A N MET 50.A O no hydrogen 2.967 N/A ALA 55.A N ALA 51.A O no hydrogen 3.311 N/A LEU 56.A N LEU 52.A O no hydrogen 2.872 N/A GLU 57.A N ILE 53.A O no hydrogen 2.818 N/A ALA 58.A N VAL 54.A O no hydrogen 3.183 N/A LEU 59.A N LEU 56.A O no hydrogen 2.983 N/A LYS 60.A N TYR 28.A OH no hydrogen 3.026 N/A HIS 62.A NE2 GLN 113.A OE1 no hydrogen 2.875 N/A CYS 63.A N HIS 114.A ND1 no hydrogen 2.870 N/A CYS 63.A SG GLU 61.A O no hydrogen 3.302 N/A CYS 63.A SG HIS 62.A O no hydrogen 3.367 N/A VAL 65.A N GLN 115.A O no hydrogen 2.946 N/A ILE 66.A N VAL 5.A O no hydrogen 2.950 N/A LEU 67.A N LYS 117.A O no hydrogen 2.744 N/A SER 68.A N ILE 7.A O no hydrogen 2.838 N/A SER 68.A OG GLU 119.A OE1 no hydrogen 2.602 N/A THR 69.A N GLU 119.A O no hydrogen 3.200 N/A SER 71.A N THR 69.A OG1 no hydrogen 3.326 N/A SER 71.A OG GLU 48.A OE1 no hydrogen 2.477 N/A VAL 74.A N SER 71.A OG no hydrogen 3.002 N/A ARG 75.A N SER 71.A O no hydrogen 3.107 N/A GLN 76.A N GLN 72.A O no hydrogen 2.847 N/A GLN 76.A NE2 GLN 80.A OE1 no hydrogen 3.377 N/A GLY 77.A N TYR 73.A O no hydrogen 2.956 N/A ILE 78.A N VAL 74.A O no hydrogen 2.899 N/A THR 79.A N ARG 75.A O no hydrogen 2.870 N/A THR 79.A OG1 ARG 75.A O no hydrogen 2.632 N/A GLN 80.A N GLN 76.A O no hydrogen 2.753 N/A TRP 81.A N GLN 76.A O no hydrogen 3.154 N/A TRP 81.A N GLY 77.A O no hydrogen 2.931 N/A ILE 82.A N GLY 77.A O no hydrogen 2.891 N/A TRP 85.A N TRP 81.A O no hydrogen 2.901 N/A LYS 86.A N ILE 82.A O no hydrogen 2.810 N/A LYS 86.A NZ ASP 108.A OD2 no hydrogen 3.003 N/A LYS 87.A N HIS 83.A O no hydrogen 3.349 N/A ARG 88.A N ASN 84.A O no hydrogen 3.232 N/A ARG 88.A N TRP 85.A O no hydrogen 3.011 N/A GLY 89.A N LYS 86.A O no hydrogen 3.001 N/A TRP 90.A N TRP 85.A O no hydrogen 2.714 N/A THR 92.A N LYS 96.A O no hydrogen 2.901 N/A THR 92.A OG1 ASP 94.A OD2 no hydrogen 2.370 N/A THR 92.A OG1 LYS 96.A O no hydrogen 3.440 N/A LYS 95.A N THR 92.A O no hydrogen 2.918 N/A LYS 96.A N ASP 94.A OD2 no hydrogen 3.242 N/A VAL 98.A N TRP 90.A O no hydrogen 3.008 N/A ASN 100.A ND2 TYR 73.A OH no hydrogen 2.746 N/A VAL 101.A N VAL 98.A O no hydrogen 3.156 N/A TRP 104.A N ASN 100.A O no hydrogen 2.834 N/A TRP 104.A NE1 TYR 73.A OH no hydrogen 2.983 N/A GLN 105.A N VAL 101.A O no hydrogen 2.935 N/A ARG 106.A N ASP 102.A O no hydrogen 3.210 N/A ARG 106.A NE GLU 57.A OE2 no hydrogen 2.731 N/A ARG 106.A NH2 GLU 57.A OE1 no hydrogen 2.663 N/A ARG 106.A NH2 GLU 57.A OE2 no hydrogen 3.528 N/A LEU 107.A N LEU 103.A O no hydrogen 2.823 N/A ASP 108.A N TRP 104.A O no hydrogen 2.827 N/A ALA 109.A N GLN 105.A O no hydrogen 2.859 N/A ALA 110.A N ARG 106.A O no hydrogen 3.246 N/A LEU 111.A N LEU 107.A O no hydrogen 2.772 N/A GLY 112.A N ASP 108.A O no hydrogen 2.986 N/A GLN 113.A N ALA 110.A O no hydrogen 3.255 N/A HIS 114.A N LEU 111.A O no hydrogen 3.094 N/A GLN 115.A N CYS 63.A O no hydrogen 2.979 N/A LYS 117.A N VAL 65.A O no hydrogen 2.919 N/A GLU 119.A N LEU 67.A O no hydrogen 2.758 N/A VAL 121.A N THR 69.A O no hydrogen 3.255 N/A ALA 125.A N LYS 122.A O no hydrogen 3.335 N/A HIS 127.A N ASN 130.A OD1 no hydrogen 3.265 N/A GLU 129.A N GLU 129.A OE2 no hydrogen 2.875 N/A ASN 130.A ND2 SER 68.A O no hydrogen 3.530 N/A ASN 130.A ND2 SER 68.A OG no hydrogen 3.067 N/A GLU 131.A N HIS 127.A O no hydrogen 3.107 N/A ARG 132.A N PRO 128.A O no hydrogen 3.148 N/A ARG 132.A NH1 THR 34.A OG1 no hydrogen 3.170 N/A CYS 133.A N GLU 129.A O no hydrogen 3.126 N/A CYS 133.A SG PHE 8.A O no hydrogen 3.317 N/A CYS 133.A SG GLU 129.A O no hydrogen 3.335 N/A ASP 134.A N ASN 130.A O no hydrogen 3.071 N/A GLU 135.A N GLU 131.A O no hydrogen 3.161 N/A LEU 136.A N ARG 132.A O no hydrogen 2.926 N/A ALA 137.A N CYS 133.A O no hydrogen 2.884 N/A ARG 138.A N ASP 134.A O no hydrogen 3.073 N/A ARG 138.A NE ASP 134.A OD1 no hydrogen 2.989 N/A ARG 138.A NH2 ASP 134.A OD2 no hydrogen 3.180 N/A ALA 139.A N GLU 135.A O no hydrogen 3.032 N/A ALA 140.A N LEU 136.A O no hydrogen 2.818 N/A ALA 141.A N ALA 137.A O no hydrogen 2.952 N/A MET 142.A N ALA 139.A O no hydrogen 3.191 N/A ASN 143.A N ALA 140.A O no hydrogen 2.994 N/A THR 145.A N GLY 38.A O no hydrogen 3.053 N/A LEU 146.A N GLY 38.A O no hydrogen 3.024 N/A TYR 151.A N ASP 148.A O no hydrogen 3.347 N/A GLN 152.A NE2 GLU 154.A O no hydrogen 3.553 N/A