Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2x52_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE TYR 20.A O no hydrogen 3.063 N/A ARG 1.A NE GLY 21.A O no hydrogen 3.362 N/A ARG 1.A NH1 TYR 20.A O no hydrogen 2.721 N/A CYS 2.A N GLY 21.A O no hydrogen 3.154 N/A GLY 3.A N MET 9.A O no hydrogen 2.776 N/A GLU 4.A N GLN 35.A OE1 no hydrogen 2.795 N/A GLN 5.A NE2 GLN 19.A O no hydrogen 3.188 N/A GLY 6.A N GLY 3.A O no hydrogen 2.951 N/A GLY 8.A N GLY 3.A O no hydrogen 2.797 N/A MET 9.A N GLY 6.A O no hydrogen 2.847 N/A LEU 15.A N PRO 12.A O no hydrogen 3.048 N/A CYS 16.A N GLY 24.A O no hydrogen 2.796 N/A CYS 17.A N ASN 36.A O no hydrogen 3.015 N/A CYS 17.A SG SER 18.A O no hydrogen 3.783 N/A SER 18.A N TYR 22.A O no hydrogen 2.897 N/A SER 18.A OG TYR 22.A O no hydrogen 3.477 N/A TYR 20.A N SER 18.A OG no hydrogen 3.173 N/A GLY 21.A N SER 18.A O no hydrogen 2.895 N/A TYR 22.A N SER 18.A OG no hydrogen 3.248 N/A GLY 24.A N CYS 16.A O no hydrogen 2.941 N/A TYR 29.A N GLY 26.A O no hydrogen 2.940 N/A CYS 30.A N GLY 26.A O no hydrogen 2.712 N/A CYS 30.A SG ALA 38.A O no hydrogen 3.573 N/A GLY 31.A N GLY 27.A O no hydrogen 2.878 N/A CYS 34.A N GLY 31.A O no hydrogen 3.078 N/A CYS 34.A SG CYS 17.A O no hydrogen 3.984 N/A CYS 34.A SG ASN 36.A O no hydrogen 3.320 N/A GLN 35.A N CYS 17.A O no hydrogen 2.711 N/A GLN 35.A NE2 GLN 5.A OE1 no hydrogen 2.930 N/A GLN 35.A NE2 SER 18.A O no hydrogen 2.813 N/A ASN 36.A ND2 MET 9.A O no hydrogen 3.353 N/A GLY 37.A N ASN 56.A OD1 no hydrogen 2.885 N/A ALA 38.A N ASN 14.A O no hydrogen 2.984 N/A TRP 40.A N CYS 30.A O no hydrogen 2.828 N/A SER 42.A OG CYS 66.A O no hydrogen 3.315 N/A LYS 43.A NZ CYS 34.A O no hydrogen 2.797 N/A ARG 44.A NE GLY 64.A O no hydrogen 2.917 N/A ARG 44.A NH2 TYR 63.A O no hydrogen 3.119 N/A CYS 45.A N GLY 64.A O no hydrogen 2.890 N/A GLY 46.A N LYS 52.A O no hydrogen 2.891 N/A SER 47.A N GLN 78.A OE1 no hydrogen 2.867 N/A SER 47.A OG GLN 78.A OE1 no hydrogen 3.535 N/A GLN 48.A N GLN 48.A OE1 no hydrogen 2.799 N/A GLN 48.A NE2 GLN 62.A O no hydrogen 3.075 N/A ALA 49.A N GLY 46.A O no hydrogen 2.843 N/A GLY 51.A N GLY 46.A O no hydrogen 2.786 N/A LYS 52.A N ALA 49.A O no hydrogen 3.270 N/A ASN 56.A N GLU 10.A OE1 no hydrogen 3.004 N/A ASN 56.A N GLU 10.A OE2 no hydrogen 3.189 N/A HIS 58.A N PRO 55.A O no hydrogen 3.322 N/A HIS 58.A NE2 ASN 14.A OD1 no hydrogen 2.783 N/A CYS 59.A N GLY 67.A O no hydrogen 2.830 N/A CYS 59.A SG PRO 81.A O no hydrogen 3.202 N/A CYS 60.A N GLY 79.A O no hydrogen 2.851 N/A CYS 60.A SG SER 61.A O no hydrogen 3.795 N/A SER 61.A N HIS 65.A O no hydrogen 3.100 N/A SER 61.A OG HIS 65.A O no hydrogen 3.476 N/A TYR 63.A N SER 61.A OG no hydrogen 3.088 N/A GLY 64.A N SER 61.A O no hydrogen 2.965 N/A HIS 65.A N SER 61.A OG no hydrogen 3.257 N/A CYS 66.A N LYS 43.A O no hydrogen 3.073 N/A CYS 66.A SG LYS 43.A O no hydrogen 3.592 N/A GLY 67.A N CYS 59.A O no hydrogen 3.002 N/A GLU 71.A N GLU 71.A OE1 no hydrogen 2.727 N/A TYR 72.A N GLY 69.A O no hydrogen 2.980 N/A CYS 73.A N GLY 69.A O no hydrogen 2.820 N/A CYS 73.A SG PRO 81.A O no hydrogen 3.747 N/A GLY 74.A N ALA 70.A O no hydrogen 2.872 N/A CYS 77.A N GLY 74.A O no hydrogen 3.052 N/A CYS 77.A SG CYS 60.A O no hydrogen 3.637 N/A CYS 77.A SG TYR 72.A O no hydrogen 3.443 N/A CYS 77.A SG GLY 79.A O no hydrogen 3.244 N/A GLN 78.A N CYS 60.A O no hydrogen 2.581 N/A GLN 78.A NE2 GLN 48.A OE1 no hydrogen 2.755 N/A GLN 78.A NE2 SER 61.A O no hydrogen 3.053 N/A CYS 82.A N GLY 80.A O no hydrogen 2.705 N/A CYS 82.A SG GLY 79.A O no hydrogen 3.438 N/A CYS 82.A SG GLY 80.A O no hydrogen 3.783 N/A ARG 83.A N CYS 73.A O no hydrogen 2.824 N/A LYS 87.A NZ TYR 108.A OH no hydrogen 3.031 N/A CYS 88.A N GLY 107.A O no hydrogen 2.971 N/A GLY 89.A N LYS 95.A O no hydrogen 2.773 N/A SER 90.A N GLN 121.A OE1 no hydrogen 2.759 N/A SER 90.A OG GLN 91.A OE1 no hydrogen 3.525 N/A SER 90.A OG GLN 121.A OE1 no hydrogen 3.324 N/A GLN 91.A N GLN 91.A OE1 no hydrogen 2.813 N/A GLN 91.A NE2 GLN 105.A O no hydrogen 2.985 N/A ALA 92.A N GLY 89.A O no hydrogen 2.867 N/A GLY 94.A N GLY 89.A O no hydrogen 2.660 N/A LYS 95.A N ALA 92.A O no hydrogen 3.339 N/A CYS 97.A N ASN 122.A OD1 no hydrogen 3.437 N/A CYS 97.A SG CYS 102.A O no hydrogen 3.762 N/A LEU 101.A N PRO 98.A O no hydrogen 2.963 N/A CYS 102.A N GLY 110.A O no hydrogen 2.950 N/A CYS 103.A N ASN 122.A O no hydrogen 2.956 N/A CYS 103.A SG SER 104.A O no hydrogen 3.981 N/A SER 104.A N TYR 108.A O no hydrogen 2.972 N/A SER 104.A OG TYR 108.A O no hydrogen 3.531 N/A TRP 106.A N SER 104.A OG no hydrogen 3.174 N/A GLY 107.A N SER 104.A O no hydrogen 2.855 N/A TYR 108.A N SER 104.A OG no hydrogen 3.360 N/A CYS 109.A N ILE 86.A O no hydrogen 2.810 N/A CYS 109.A SG ILE 86.A O no hydrogen 3.825 N/A GLY 110.A N CYS 102.A O no hydrogen 3.106 N/A SER 113.A OG GLU 114.A OE1 no hydrogen 3.543 N/A GLU 114.A N GLU 114.A OE1 no hydrogen 2.797 N/A PHE 115.A N GLY 112.A O no hydrogen 2.885 N/A CYS 116.A N GLY 112.A O no hydrogen 2.754 N/A CYS 116.A SG ALA 124.A O no hydrogen 3.661 N/A GLY 117.A N SER 113.A O no hydrogen 2.852 N/A CYS 120.A N GLY 117.A O no hydrogen 2.944 N/A CYS 120.A SG CYS 103.A O no hydrogen 3.908 N/A CYS 120.A SG PHE 115.A O no hydrogen 3.395 N/A CYS 120.A SG ASN 122.A O no hydrogen 3.419 N/A GLN 121.A N CYS 103.A O no hydrogen 2.672 N/A GLN 121.A NE2 GLN 91.A OE1 no hydrogen 2.833 N/A GLN 121.A NE2 SER 104.A O no hydrogen 2.975 N/A ASN 122.A ND2 LYS 95.A O no hydrogen 3.574 N/A GLY 123.A N ASN 142.A OD1 no hydrogen 2.863 N/A ALA 124.A N ASN 100.A O no hydrogen 2.934 N/A CYS 125.A N GLY 123.A O no hydrogen 2.740 N/A CYS 125.A SG ASN 122.A O no hydrogen 3.348 N/A CYS 125.A SG GLY 123.A O no hydrogen 3.796 N/A SER 126.A N CYS 116.A O no hydrogen 2.751 N/A SER 126.A OG CYS 116.A O no hydrogen 3.337 N/A CYS 131.A N GLY 150.A O no hydrogen 3.054 N/A GLY 132.A N ARG 138.A O no hydrogen 2.923 N/A LYS 133.A N GLN 164.A OE1 no hydrogen 2.685 N/A ALA 135.A N GLY 132.A O no hydrogen 2.895 N/A GLY 137.A N GLY 132.A O no hydrogen 2.775 N/A ARG 138.A N ALA 135.A O no hydrogen 3.387 N/A THR 141.A OG1 ASN 142.A OD1 no hydrogen 2.808 N/A TYR 144.A N THR 141.A O no hydrogen 2.980 N/A TYR 144.A OH ASN 100.A OD1 no hydrogen 2.667 N/A CYS 145.A N GLY 153.A O no hydrogen 2.925 N/A CYS 146.A N SER 165.A O no hydrogen 2.977 N/A CYS 146.A SG SER 147.A O no hydrogen 3.739 N/A SER 147.A N SER 151.A O no hydrogen 2.906 N/A SER 147.A OG SER 151.A O no hydrogen 3.384 N/A TRP 149.A N SER 147.A OG no hydrogen 3.217 N/A GLY 150.A N SER 147.A O no hydrogen 2.879 N/A SER 151.A N SER 147.A OG no hydrogen 3.276 N/A GLY 153.A N CYS 145.A O no hydrogen 2.860 N/A TYR 158.A N GLY 155.A O no hydrogen 3.096 N/A CYS 159.A N GLY 155.A O no hydrogen 2.832 N/A CYS 159.A SG GLY 167.A O no hydrogen 3.961 N/A GLY 160.A N PRO 156.A O no hydrogen 2.941 N/A CYS 163.A N GLY 160.A O no hydrogen 3.222 N/A CYS 163.A SG CYS 146.A O no hydrogen 3.772 N/A CYS 163.A SG TYR 158.A O no hydrogen 3.291 N/A CYS 163.A SG SER 165.A O no hydrogen 3.322 N/A GLN 164.A N CYS 146.A O no hydrogen 2.795 N/A GLN 164.A NE2 SER 147.A O no hydrogen 2.983 N/A GLY 167.A N ASN 143.A O no hydrogen 3.038 N/A CYS 168.A SG SER 165.A O no hydrogen 3.224 N/A ASP 169.A N CYS 159.A O no hydrogen 2.864 N/A