Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3aa2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N GLU 62.A O no hydrogen 3.112 N/A GLU 4.A N ARG 25.A O no hydrogen 2.945 N/A ILE 5.A N ILE 64.A O no hydrogen 2.801 N/A PHE 6.A N ILE 23.A O no hydrogen 2.971 N/A THR 7.A N SER 66.A O no hydrogen 3.252 N/A ASP 8.A N GLY 21.A O no hydrogen 2.990 N/A GLY 9.A N ASP 8.A OD1 no hydrogen 2.844 N/A SER 10.A N GLY 19.A O no hydrogen 2.945 N/A CYS 11.A SG GLY 13.A O no hydrogen 3.523 N/A CYS 11.A SG GLY 16.A O no hydrogen 3.383 N/A CYS 11.A SG PRO 17.A O no hydrogen 3.411 N/A CYS 11.A SG THR 40.A O no hydrogen 3.247 N/A LEU 12.A N PRO 17.A O no hydrogen 2.872 N/A GLY 16.A N THR 40.A O no hydrogen 2.818 N/A GLY 18.A N TYR 37.A O no hydrogen 2.931 N/A GLY 19.A N SER 10.A O no hydrogen 2.801 N/A TYR 20.A N ALA 35.A O no hydrogen 3.014 N/A GLY 21.A N ASP 8.A O no hydrogen 2.991 N/A ALA 22.A N PHE 33.A O no hydrogen 2.745 N/A ILE 23.A N PHE 6.A O no hydrogen 2.828 N/A LEU 24.A N LYS 31.A O no hydrogen 2.690 N/A ARG 25.A N GLU 4.A O no hydrogen 2.856 N/A ARG 25.A NE GLU 4.A OE1 no hydrogen 2.844 N/A ARG 25.A NH1 GLU 30.A OE2 no hydrogen 2.863 N/A ARG 25.A NH1 GLU 127.A OE1 no hydrogen 3.009 N/A ARG 25.A NH2 GLU 4.A OE1 no hydrogen 3.171 N/A ARG 25.A NH2 GLU 4.A OE2 no hydrogen 3.472 N/A ARG 25.A NH2 GLU 127.A OE1 no hydrogen 3.205 N/A TYR 26.A N ARG 29.A O no hydrogen 2.873 N/A ARG 29.A N TYR 26.A O no hydrogen 2.882 N/A LYS 31.A N LEU 24.A O no hydrogen 2.729 N/A PHE 33.A N ALA 22.A O no hydrogen 2.859 N/A SER 34.A OG TYR 20.A O no hydrogen 2.810 N/A SER 34.A OG LEU 134.A O no hydrogen 3.205 N/A TYR 37.A N GLY 18.A O no hydrogen 2.628 N/A THR 38.A N LEU 144.A O no hydrogen 3.142 N/A THR 40.A N GLY 16.A O no hydrogen 2.853 N/A THR 40.A OG1 ASP 146.A OD1 no hydrogen 2.581 N/A ASN 42.A ND2 GLU 46.A OE2 no hydrogen 2.415 N/A ASN 43.A ND2 GLU 46.A OE2 no hydrogen 3.554 N/A ARG 44.A N THR 41.A OG1 no hydrogen 3.204 N/A ARG 44.A NE ASP 146.A OD1 no hydrogen 2.685 N/A ARG 44.A NE ASP 146.A OD2 no hydrogen 3.423 N/A ARG 44.A NH1 ASN 98.A OD1 no hydrogen 2.807 N/A ARG 44.A NH1 ASP 100.A OD1 no hydrogen 2.978 N/A ARG 44.A NH1 ASP 100.A OD2 no hydrogen 3.500 N/A ARG 44.A NH2 ASP 100.A OD2 no hydrogen 2.792 N/A ARG 44.A NH2 ASP 146.A OD2 no hydrogen 2.861 N/A MET 45.A N THR 41.A O no hydrogen 3.152 N/A GLU 46.A N ASN 42.A O no hydrogen 2.982 N/A LEU 47.A N ASN 43.A O no hydrogen 3.142 N/A MET 48.A N ARG 44.A O no hydrogen 2.796 N/A ALA 49.A N MET 45.A O no hydrogen 2.952 N/A ILE 51.A N LEU 47.A O no hydrogen 2.992 N/A VAL 52.A N MET 48.A O no hydrogen 3.008 N/A ALA 53.A N ALA 49.A O no hydrogen 3.263 N/A LEU 54.A N ILE 50.A O no hydrogen 3.008 N/A GLU 55.A N ILE 51.A O no hydrogen 2.877 N/A ALA 56.A N VAL 52.A O no hydrogen 3.085 N/A ALA 56.A N ALA 53.A O no hydrogen 3.164 N/A LEU 57.A N LEU 54.A O no hydrogen 2.981 N/A CYS 61.A N HIS 112.A ND1 no hydrogen 2.948 N/A CYS 61.A SG GLU 59.A O no hydrogen 3.288 N/A VAL 63.A N GLN 113.A O no hydrogen 2.833 N/A ILE 64.A N VAL 3.A O no hydrogen 3.031 N/A LEU 65.A N LYS 115.A O no hydrogen 2.949 N/A SER 66.A N ILE 5.A O no hydrogen 2.721 N/A SER 66.A OG ASN 128.A OD1 no hydrogen 3.331 N/A THR 67.A N GLU 117.A O no hydrogen 3.101 N/A SER 69.A N THR 67.A OG1 no hydrogen 3.176 N/A SER 69.A OG GLU 46.A OE1 no hydrogen 2.477 N/A VAL 72.A N SER 69.A OG no hydrogen 3.111 N/A ARG 73.A N SER 69.A O no hydrogen 3.085 N/A GLN 74.A N GLN 70.A O no hydrogen 2.885 N/A GLY 75.A N TYR 71.A O no hydrogen 3.079 N/A ILE 76.A N VAL 72.A O no hydrogen 2.904 N/A THR 77.A N ARG 73.A O no hydrogen 2.831 N/A THR 77.A OG1 ARG 73.A O no hydrogen 2.664 N/A GLN 78.A N GLN 74.A O no hydrogen 2.683 N/A TRP 79.A N GLN 74.A O no hydrogen 3.050 N/A ILE 80.A N GLY 75.A O no hydrogen 2.808 N/A TRP 83.A N TRP 79.A O no hydrogen 2.820 N/A LYS 84.A N ILE 80.A O no hydrogen 3.034 N/A LYS 84.A NZ ASP 106.A OD1 no hydrogen 2.988 N/A LYS 84.A NZ ASP 106.A OD2 no hydrogen 2.935 N/A ARG 86.A N ASN 82.A O no hydrogen 3.019 N/A ARG 86.A N TRP 83.A O no hydrogen 3.206 N/A GLY 87.A N LYS 84.A O no hydrogen 3.181 N/A TRP 88.A N TRP 83.A O no hydrogen 2.676 N/A THR 90.A N LYS 94.A O no hydrogen 2.918 N/A THR 90.A OG1 ASP 92.A OD2 no hydrogen 2.613 N/A THR 90.A OG1 LYS 94.A O no hydrogen 3.283 N/A LYS 93.A N THR 90.A O no hydrogen 2.723 N/A LYS 94.A N ASP 92.A OD2 no hydrogen 3.027 N/A VAL 96.A N TRP 88.A O no hydrogen 3.070 N/A ASN 98.A ND2 TYR 71.A OH no hydrogen 3.112 N/A VAL 99.A N VAL 96.A O no hydrogen 3.073 N/A TRP 102.A N ASN 98.A O no hydrogen 2.896 N/A TRP 102.A NE1 TYR 71.A OH no hydrogen 2.981 N/A GLN 103.A N VAL 99.A O no hydrogen 2.828 N/A ARG 104.A N ASP 100.A O no hydrogen 3.129 N/A ARG 104.A NE GLU 55.A OE2 no hydrogen 2.883 N/A ARG 104.A NH2 GLU 55.A OE1 no hydrogen 2.710 N/A LEU 105.A N LEU 101.A O no hydrogen 2.844 N/A ASP 106.A N TRP 102.A O no hydrogen 2.960 N/A ALA 107.A N GLN 103.A O no hydrogen 3.116 N/A ALA 108.A N ARG 104.A O no hydrogen 3.402 N/A LEU 109.A N LEU 105.A O no hydrogen 2.865 N/A GLY 110.A N ASP 106.A O no hydrogen 3.100 N/A GLN 111.A N ALA 108.A O no hydrogen 3.298 N/A HIS 112.A N LEU 109.A O no hydrogen 3.431 N/A GLN 113.A N CYS 61.A O no hydrogen 2.976 N/A LYS 115.A N VAL 63.A O no hydrogen 2.876 N/A GLU 117.A N LEU 65.A O no hydrogen 2.664 N/A VAL 119.A N THR 67.A O no hydrogen 2.972 N/A LYS 120.A NZ TRP 118.A O no hydrogen 3.553 N/A HIS 125.A N HIS 122.A O no hydrogen 2.813 N/A GLU 127.A N GLU 127.A OE2 no hydrogen 2.800 N/A ASN 128.A ND2 SER 66.A O no hydrogen 3.279 N/A GLU 129.A N HIS 125.A O no hydrogen 3.042 N/A ARG 130.A N PRO 126.A O no hydrogen 2.964 N/A CYS 131.A N GLU 127.A O no hydrogen 2.959 N/A CYS 131.A SG PHE 6.A O no hydrogen 3.427 N/A CYS 131.A SG GLY 21.A O no hydrogen 3.558 N/A CYS 131.A SG GLU 127.A O no hydrogen 3.342 N/A ASP 132.A N ASN 128.A O no hydrogen 3.048 N/A GLU 133.A N GLU 129.A O no hydrogen 3.172 N/A LEU 134.A N ARG 130.A O no hydrogen 2.972 N/A ALA 135.A N CYS 131.A O no hydrogen 2.801 N/A ARG 136.A N ASP 132.A O no hydrogen 2.786 N/A ARG 136.A NE ASP 132.A OD2 no hydrogen 3.153 N/A ALA 137.A N GLU 133.A O no hydrogen 2.884 N/A ALA 138.A N LEU 134.A O no hydrogen 3.037 N/A ALA 139.A N ALA 135.A O no hydrogen 2.942 N/A MET 140.A N ALA 137.A O no hydrogen 3.190 N/A ASN 141.A N ALA 138.A O no hydrogen 3.064 N/A THR 143.A N GLY 36.A O no hydrogen 2.951 N/A LEU 144.A N GLY 36.A O no hydrogen 2.985 N/A GLY 148.A N ASP 146.A OD2 no hydrogen 3.369 N/A TYR 149.A N ASP 146.A O no hydrogen 3.003 N/A