Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a8r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N THR 1.A O no hydrogen 2.271 N/A ALA 6.A N LYS 2.A O no hydrogen 2.967 N/A VAL 7.A N SER 3.A O no hydrogen 3.168 N/A ALA 8.A N SER 4.A O no hydrogen 3.368 N/A LEU 9.A N ALA 5.A O no hydrogen 2.897 N/A LYS 10.A N ALA 6.A O no hydrogen 2.940 N/A GLY 11.A N VAL 7.A O no hydrogen 3.325 N/A LEU 12.A N ALA 8.A O no hydrogen 3.262 N/A GLN 13.A N LEU 9.A O no hydrogen 2.953 N/A PHE 14.A N LYS 10.A O no hydrogen 3.024 N/A VAL 15.A N GLY 11.A O no hydrogen 3.240 N/A THR 16.A N LEU 12.A O no hydrogen 3.117 N/A THR 16.A OG1 LEU 12.A O no hydrogen 2.843 N/A ALA 17.A N GLN 13.A O no hydrogen 2.871 N/A LYS 18.A N PHE 14.A O no hydrogen 2.986 N/A VAL 19.A N VAL 15.A O no hydrogen 3.180 N/A GLY 20.A N THR 16.A O no hydrogen 3.431 N/A ASN 21.A ND2 ASN 21.A O no hydrogen 2.246 N/A VAL 27.A N GLY 23.A O no hydrogen 3.318 N/A GLU 28.A N TRP 24.A O no hydrogen 2.914 N/A LYS 29.A N ALA 25.A O no hydrogen 3.015 N/A ARG 30.A N ALA 26.A O no hydrogen 2.870 N/A ARG 30.A NE LYS 47.A O no hydrogen 2.938 N/A ARG 30.A NE CYS 48.A O no hydrogen 3.078 N/A ARG 30.A NH2 ASP 22.A OD2 no hydrogen 2.707 N/A ARG 30.A NH2 CYS 48.A O no hydrogen 2.961 N/A PHE 31.A N VAL 27.A O no hydrogen 2.854 N/A ASN 32.A N GLU 28.A O no hydrogen 3.027 N/A GLN 33.A N LYS 29.A O no hydrogen 3.353 N/A LEU 34.A N ARG 30.A O no hydrogen 2.902 N/A LEU 34.A N PHE 31.A O no hydrogen 2.737 N/A GLN 35.A N PHE 31.A O no hydrogen 2.731 N/A VAL 36.A N VAL 39.A O no hydrogen 2.879 N/A VAL 39.A N VAL 36.A O no hydrogen 3.147 N/A LEU 40.A N LEU 76.A O no hydrogen 2.714 N/A ARG 42.A N GLN 74.A O no hydrogen 2.983 N/A ARG 42.A NE ASP 63.A OD1 no hydrogen 2.865 N/A ARG 42.A NH2 ASP 63.A OD2 no hydrogen 3.012 N/A ARG 44.A N LEU 41.A O no hydrogen 2.857 N/A ARG 44.A NH1 LEU 34.A O no hydrogen 2.672 N/A PHE 45.A N ARG 42.A O no hydrogen 3.142 N/A CYS 48.A N ARG 44.A O no hydrogen 3.008 N/A CYS 48.A SG VAL 27.A O no hydrogen 3.607 N/A ILE 49.A N PHE 45.A O no hydrogen 2.929 N/A GLY 50.A N GLY 46.A O no hydrogen 2.803 N/A MET 51.A N GLY 46.A O no hydrogen 3.241 N/A ASP 52.A N LYS 18.A O no hydrogen 2.752 N/A PHE 57.A N SER 54.A OG no hydrogen 3.051 N/A ALA 58.A N SER 54.A O no hydrogen 3.076 N/A VAL 59.A N ASP 55.A O no hydrogen 3.139 N/A GLN 60.A N GLU 56.A O no hydrogen 3.054 N/A MET 61.A N PHE 57.A O no hydrogen 2.991 N/A PHE 62.A N ALA 58.A O no hydrogen 2.890 N/A ASP 63.A N VAL 59.A O no hydrogen 2.823 N/A SER 64.A N GLN 60.A O no hydrogen 2.956 N/A SER 64.A N MET 61.A O no hydrogen 3.018 N/A SER 64.A OG GLN 60.A O no hydrogen 3.407 N/A SER 64.A OG MET 61.A O no hydrogen 2.538 N/A LEU 65.A N MET 61.A O no hydrogen 3.135 N/A ALA 66.A N PHE 62.A O no hydrogen 2.941 N/A ARG 67.A N ASP 63.A O no hydrogen 2.839 N/A LYS 68.A N SER 64.A O no hydrogen 3.295 N/A LYS 68.A NZ GLN 87.A OE1 no hydrogen 2.763 N/A ARG 69.A N ALA 66.A O no hydrogen 2.852 N/A ARG 69.A NE ASP 83.A OD1 no hydrogen 2.964 N/A ARG 69.A NH1 LEU 65.A O no hydrogen 2.775 N/A ARG 69.A NH1 GLN 87.A OE1 no hydrogen 3.337 N/A ARG 69.A NH2 ASP 83.A OD1 no hydrogen 3.169 N/A ARG 69.A NH2 GLN 87.A OE1 no hydrogen 2.890 N/A GLY 70.A N ARG 67.A O no hydrogen 3.156 N/A ILE 71.A N ALA 66.A O no hydrogen 2.937 N/A LYS 73.A NZ VAL 75.A O no hydrogen 2.831 N/A LYS 73.A NZ GLU 80.A OE1 no hydrogen 3.365 N/A LYS 73.A NZ GLU 80.A OE2 no hydrogen 2.525 N/A LEU 76.A N LEU 40.A O no hydrogen 2.900 N/A THR 77.A N GLU 80.A OE2 no hydrogen 2.907 N/A LYS 78.A NZ GLU 28.A OE1 no hydrogen 3.542 N/A LYS 78.A NZ GLU 28.A OE2 no hydrogen 3.261 N/A LYS 78.A NZ ASN 32.A OD1 no hydrogen 2.994 N/A GLU 80.A N THR 77.A OG1 no hydrogen 3.250 N/A LEU 81.A N THR 77.A O no hydrogen 3.011 N/A LYS 82.A N LYS 78.A O no hydrogen 2.877 N/A ASP 83.A N ASP 79.A O no hydrogen 3.020 N/A PHE 84.A N GLU 80.A O no hydrogen 3.003 N/A TYR 85.A N LEU 81.A O no hydrogen 2.745 N/A TYR 85.A OH ASP 22.A O no hydrogen 2.660 N/A GLU 86.A N LYS 82.A O no hydrogen 2.802 N/A GLN 87.A N ASP 83.A O no hydrogen 3.257 N/A GLN 87.A NE2 THR 99.A OG1 no hydrogen 2.851 N/A LEU 88.A N PHE 84.A O no hydrogen 3.159 N/A THR 89.A N TYR 85.A O no hydrogen 2.897 N/A THR 89.A OG1 TYR 85.A OH no hydrogen 3.030 N/A ASP 90.A N GLU 86.A O no hydrogen 3.184 N/A GLY 92.A N ASP 90.A OD2 no hydrogen 3.047 N/A ASN 95.A ND2 GLN 87.A O no hydrogen 2.626 N/A ASN 95.A ND2 ASP 90.A O no hydrogen 2.865 N/A ARG 96.A N GLY 92.A O no hydrogen 2.989 N/A ARG 96.A NE THR 16.A OG1 no hydrogen 3.408 N/A ARG 96.A NH1 GLN 91.A O no hydrogen 2.459 N/A LEU 97.A N PHE 93.A O no hydrogen 2.893 N/A ARG 98.A N ASP 94.A O no hydrogen 3.058 N/A ARG 98.A NH2 ASP 102.A OD1 no hydrogen 3.545 N/A THR 99.A N ASN 95.A O no hydrogen 2.982 N/A THR 99.A OG1 ASN 95.A O no hydrogen 3.258 N/A PHE 100.A N ARG 96.A O no hydrogen 3.007 N/A PHE 101.A N LEU 97.A O no hydrogen 2.943 N/A ASP 102.A N ARG 98.A O no hydrogen 2.857 N/A MET 103.A N THR 99.A O no hydrogen 2.960 N/A VAL 104.A N PHE 100.A O no hydrogen 3.015 N/A ASP 105.A N PHE 101.A O no hydrogen 2.793 N/A LYS 106.A N GLU 116.A OE1 no hydrogen 3.237 N/A LYS 106.A NZ MET 103.A O no hydrogen 2.992 N/A ASN 107.A ND2 ASP 109.A OD2 no hydrogen 3.183 N/A ALA 108.A N ASP 105.A O no hydrogen 2.948 N/A ASP 109.A N ASP 105.A OD1 no hydrogen 3.382 N/A GLY 110.A N ASP 105.A OD2 no hydrogen 2.810 N/A ARG 111.A N ASP 109.A OD1 no hydrogen 3.040 N/A THR 113.A N GLU 116.A OE2 no hydrogen 2.896 N/A THR 113.A OG1 GLU 116.A OE2 no hydrogen 3.466 N/A GLU 116.A N THR 113.A OG1 no hydrogen 3.149 N/A VAL 117.A N THR 113.A O no hydrogen 2.903 N/A LYS 118.A N ALA 114.A O no hydrogen 2.899 N/A ILE 121.A N VAL 117.A O no hydrogen 3.227 N/A ALA 122.A N LYS 118.A O no hydrogen 2.890 N/A LEU 123.A N GLU 119.A O no hydrogen 3.069 N/A SER 124.A N ILE 120.A O no hydrogen 2.757 N/A SER 124.A OG ILE 120.A O no hydrogen 3.125 N/A SER 124.A OG ILE 121.A O no hydrogen 2.930 N/A ALA 125.A N ILE 121.A O no hydrogen 2.882 N/A SER 126.A N ALA 122.A O no hydrogen 2.751 N/A SER 126.A OG ALA 122.A O no hydrogen 3.104 N/A ALA 127.A N LEU 123.A O no hydrogen 2.882 N/A LYS 129.A N SER 126.A O no hydrogen 3.101 N/A LEU 130.A N ALA 127.A O no hydrogen 3.330 N/A ILE 133.A N LYS 129.A O no hydrogen 2.614 N/A LYS 134.A N LEU 130.A O no hydrogen 2.754 N/A GLU 135.A N SER 131.A O no hydrogen 2.841 N/A ARG 136.A N LYS 132.A O no hydrogen 3.282 N/A ALA 137.A N ILE 133.A O no hydrogen 2.827 N/A ASP 138.A N LYS 134.A O no hydrogen 3.442 N/A GLU 139.A N GLU 135.A O no hydrogen 3.332 N/A TYR 140.A N ARG 136.A O no hydrogen 3.017 N/A THR 141.A N ALA 137.A O no hydrogen 2.696 N/A THR 141.A OG1 ALA 137.A O no hydrogen 3.104 N/A ALA 142.A N ASP 138.A O no hydrogen 2.987 N/A LEU 143.A N TYR 140.A O no hydrogen 2.764 N/A ILE 144.A N TYR 140.A O no hydrogen 2.645 N/A MET 145.A N THR 141.A O no hydrogen 2.822 N/A GLU 147.A N ILE 144.A O no hydrogen 3.321 N/A LEU 148.A N ILE 144.A O no hydrogen 2.741 N/A ASP 149.A N MET 145.A O no hydrogen 2.637 N/A ASN 152.A N ASP 149.A O no hydrogen 2.758 N/A LEU 153.A N ASP 149.A OD1 no hydrogen 2.841 N/A GLY 154.A N ASP 149.A OD2 no hydrogen 2.537 N/A TYR 155.A N ASP 149.A OD2 no hydrogen 2.872 N/A GLU 157.A N ASP 160.A OD2 no hydrogen 2.710 N/A LEU 161.A N GLU 157.A O no hydrogen 3.264 N/A GLU 162.A N MET 158.A O no hydrogen 2.742 N/A ALA 163.A N GLU 159.A O no hydrogen 2.867 N/A LEU 164.A N ASP 160.A O no hydrogen 3.008 N/A LEU 165.A N LEU 161.A O no hydrogen 3.055 N/A