Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jup_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N GLU 4.A OE1 no hydrogen 2.663 N/A ASN 5.A N THR 2.A O no hydrogen 3.035 N/A ARG 6.A N THR 2.A O no hydrogen 3.156 N/A ARG 6.A NH1 ASN 1.A O no hydrogen 2.989 N/A ALA 7.A N SER 3.A O no hydrogen 2.678 N/A GLN 8.A NE2 GLU 4.A O no hydrogen 3.332 N/A VAL 9.A N ASN 5.A O no hydrogen 3.003 N/A ALA 10.A N ARG 6.A O no hydrogen 3.050 N/A ALA 11.A N ALA 7.A O no hydrogen 3.280 N/A ARG 12.A N GLN 8.A O no hydrogen 2.777 N/A ARG 12.A NE THR 86.A O no hydrogen 3.254 N/A ARG 12.A NH2 THR 86.A O no hydrogen 2.898 N/A GLN 13.A N VAL 9.A O no hydrogen 2.913 N/A HIS 14.A N ALA 10.A O no hydrogen 3.009 N/A HIS 14.A NE2 GLY 125.A O no hydrogen 3.125 N/A ASN 15.A N ALA 11.A O no hydrogen 2.827 N/A ASN 15.A ND2 PRO 89.A O no hydrogen 3.226 N/A ASN 15.A ND2 ASN 90.A OD1 no hydrogen 2.682 N/A ARG 16.A N ARG 12.A O no hydrogen 2.849 N/A ARG 16.A NH1 GLU 85.A OE2 no hydrogen 3.227 N/A LYS 17.A N GLN 13.A O no hydrogen 3.238 N/A ILE 18.A N HIS 14.A O no hydrogen 3.158 N/A VAL 19.A N ASN 15.A O no hydrogen 2.946 N/A GLU 20.A N ARG 16.A O no hydrogen 2.904 N/A GLN 21.A N LYS 17.A O no hydrogen 2.969 N/A TYR 22.A N ILE 18.A O no hydrogen 2.824 N/A MET 23.A N VAL 19.A O no hydrogen 2.824 N/A HIS 24.A N GLU 20.A O no hydrogen 2.969 N/A HIS 24.A N GLN 21.A O no hydrogen 3.206 N/A THR 25.A N TYR 22.A O no hydrogen 3.140 N/A THR 25.A OG1 GLN 21.A O no hydrogen 2.695 N/A THR 25.A OG1 TYR 22.A O no hydrogen 3.422 N/A ARG 26.A NH2 TRP 78.A O no hydrogen 3.336 N/A ARG 30.A N GLY 27.A O no hydrogen 2.857 N/A ARG 30.A NH1 PHE 73.A O no hydrogen 2.792 N/A ARG 30.A NH2 SER 69.A OG.A no hydrogen 2.916 N/A ARG 30.A NH2 PHE 73.A O no hydrogen 3.005 N/A LEU 31.A N GLU 28.A O no hydrogen 2.942 N/A LYS 32.A N ALA 29.A O no hydrogen 3.185 N/A ARG 33.A N ARG 30.A O no hydrogen 3.367 N/A LEU 35.A N LYS 32.A O no hydrogen 3.064 N/A LEU 36.A N ARG 33.A O no hydrogen 2.879 N/A PHE 37.A N HIS 34.A O no hydrogen 3.162 N/A THR 38.A N ILE 127.A O no hydrogen 2.986 N/A THR 38.A OG1 ASP 40.A OD2 no hydrogen 2.885 N/A THR 38.A OG1 ILE 127.A O no hydrogen 3.544 N/A GLY 41.A N THR 38.A O no hydrogen 2.909 N/A VAL 42.A N LYS 128.A O no hydrogen 3.014 N/A GLY 43.A N ILE 56.A O no hydrogen 3.030 N/A LEU 45.A N ILE 54.A O no hydrogen 3.010 N/A TRP 46.A N GLU 132.A O no hydrogen 2.960 N/A THR 47.A OG1 MET 134.A O no hydrogen 3.115 N/A THR 48.A OG1 SER 50.A OG no hydrogen 2.912 N/A THR 48.A OG1 GLN 52.A O no hydrogen 2.619 N/A SER 50.A OG THR 48.A OG1 no hydrogen 2.912 N/A GLY 51.A N THR 48.A O no hydrogen 3.212 N/A GLN 52.A N SER 50.A OG no hydrogen 3.003 N/A ILE 54.A N LEU 45.A O no hydrogen 2.768 N/A ILE 56.A N GLY 43.A O no hydrogen 2.618 N/A GLY 58.A N GLY 41.A O no hydrogen 2.659 N/A ARG 59.A N GLU 39.A O no hydrogen 2.954 N/A ARG 59.A NE PHE 37.A O no hydrogen 2.867 N/A ARG 59.A NH2 PHE 37.A O no hydrogen 2.613 N/A LEU 62.A N GLY 58.A O no hydrogen 2.934 N/A GLY 63.A N ARG 59.A O no hydrogen 2.952 N/A GLU 64.A N GLU 60.A O no hydrogen 3.065 N/A HIS 65.A N LYS 61.A O no hydrogen 2.738 N/A ALA 66.A N LEU 62.A O no hydrogen 3.083 N/A VAL 67.A N GLU 64.A O no hydrogen 3.247 N/A SER 69.A N HIS 65.A O no hydrogen 3.003 N/A SER 69.A OG.B HIS 65.A NE2 no hydrogen 3.405 N/A SER 69.A OG.B HIS 65.A O no hydrogen 3.180 N/A LEU 70.A N ALA 66.A O no hydrogen 2.913 N/A GLN 71.A N VAL 67.A O no hydrogen 3.194 N/A CYS 72.A N TRP 68.A O no hydrogen 2.905 N/A CYS 72.A SG TRP 68.A O no hydrogen 3.550 N/A CYS 72.A SG VAL 103.A O no hydrogen 3.586 N/A PHE 73.A N SER 69.A O no hydrogen 2.765 N/A VAL 77.A N GLU 99.A O no hydrogen 3.221 N/A THR 79.A N ARG 97.A O no hydrogen 2.914 N/A GLN 82.A N GLU 95.A O no hydrogen 2.851 N/A PHE 84.A N TRP 93.A O no hydrogen 2.649 N/A THR 86.A OG1 ASP 88.A O no hydrogen 3.017 N/A THR 86.A OG1 TRP 91.A O no hydrogen 2.771 N/A GLN 87.A N GLN 87.A OE1 no hydrogen 2.712 N/A ASP 88.A N THR 86.A OG1 no hydrogen 3.162 N/A ASN 90.A N ASP 88.A OD1 no hydrogen 2.872 N/A TRP 91.A N ASP 88.A O no hydrogen 3.182 N/A TRP 91.A NE1 SER 119.A OG no hydrogen 3.017 N/A PHE 92.A N PHE 120.A O no hydrogen 2.866 N/A TRP 93.A N PHE 84.A O no hydrogen 2.995 N/A VAL 94.A N HIS 118.A O no hydrogen 2.876 N/A GLU 95.A N GLN 82.A O no hydrogen 3.009 N/A CYS 96.A N PHE 116.A O no hydrogen 2.995 N/A CYS 96.A SG ARG 97.A O no hydrogen 3.612 N/A ARG 97.A N THR 79.A O no hydrogen 2.867 N/A GLY 98.A N ASN 114.A O no hydrogen 3.171 N/A GLU 99.A N VAL 77.A O no hydrogen 3.110 N/A GLY 100.A N TYR 112.A O no hydrogen 2.939 N/A ALA 101.A N ASP 75.A OD1 no hydrogen 2.821 N/A ILE 102.A N GLY 110.A O no hydrogen 2.958 N/A VAL 103.A N CYS 72.A O no hydrogen 2.753 N/A TYR 107.A N PHE 104.A O no hydrogen 3.371 N/A GLY 110.A N ILE 102.A O no hydrogen 2.915 N/A GLN 111.A NE2 GLU 99.A OE2 no hydrogen 3.393 N/A TYR 112.A N GLY 100.A O no hydrogen 2.908 N/A TYR 112.A OH ASN 114.A OD1 no hydrogen 3.002 N/A ASN 114.A N GLY 98.A O no hydrogen 3.170 N/A HIS 115.A NE2.A GLU 95.A OE2 no hydrogen 2.614 N/A HIS 115.A NE2.B GLU 95.A OE2 no hydrogen 2.737 N/A PHE 116.A N CYS 96.A O no hydrogen 2.868 N/A LEU 117.A N PHE 133.A O no hydrogen 2.871 N/A HIS 118.A N VAL 94.A O no hydrogen 2.831 N/A HIS 118.A ND1 GLN 130.A OE1 no hydrogen 3.223 N/A SER 119.A N ARG 131.A O no hydrogen 2.859 N/A PHE 120.A N PHE 92.A O no hydrogen 2.829 N/A ARG 121.A N GLU 129.A O no hydrogen 2.879 N/A PHE 122.A N ASN 90.A O no hydrogen 2.850 N/A GLU 123.A N LEU 126.A O no hydrogen 2.953 N/A LEU 126.A N GLU 123.A O no hydrogen 3.007 N/A ILE 127.A N LEU 36.A O no hydrogen 2.818 N/A LYS 128.A N ARG 121.A O no hydrogen 2.732 N/A GLU 129.A N ARG 121.A O no hydrogen 3.058 N/A GLN 130.A N VAL 42.A O no hydrogen 2.786 N/A ARG 131.A N SER 119.A O no hydrogen 2.937 N/A ARG 131.A NH2 SER 119.A OG no hydrogen 3.114 N/A GLU 132.A N GLY 44.A O no hydrogen 3.013 N/A PHE 133.A N LEU 117.A O no hydrogen 2.804 N/A MET 134.A N THR 47.A OG1 no hydrogen 2.784 N/A CYS 137.A N ASN 135.A OD1 no hydrogen 3.072 N/A GLU 138.A N ASN 135.A O no hydrogen 3.131 N/A PHE 140.A N PRO 136.A O no hydrogen 2.975 N/A ARG 141.A N CYS 137.A O no hydrogen 3.131 N/A ARG 141.A NH1 GLU 138.A OE2 no hydrogen 2.467 N/A SER 142.A N GLU 138.A O no hydrogen 3.188 N/A SER 142.A OG GLN 139.A O no hydrogen 2.751 N/A LEU 143.A N GLN 139.A O no hydrogen 3.273 N/A LEU 143.A N PHE 140.A O no hydrogen 3.003 N/A GLY 144.A N ARG 141.A O no hydrogen 3.066 N/A ILE 145.A N PHE 140.A O no hydrogen 2.901 N/A LEU 155.A N ARG 152.A O no hydrogen 3.207 N/A