Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e3f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N GLU 26.A O no hydrogen 3.046 N/A TYR 4.A N GLU 26.A O no hydrogen 3.336 N/A LEU 5.A N HIS 59.A O no hydrogen 2.939 N/A TRP 6.A N PHE 28.A O no hydrogen 2.756 N/A ILE 7.A N ILE 61.A O no hydrogen 2.768 N/A GLY 8.A N HIS 30.A O no hydrogen 2.821 N/A CYS 9.A SG ASP 11.A OD2 no hydrogen 2.966 N/A CYS 9.A SG ASN 32.A O no hydrogen 4.018 N/A CYS 9.A SG HIS 65.A NE2 no hydrogen 3.522 N/A SER 10.A N ASN 32.A O no hydrogen 2.979 N/A SER 12.A OG ARG 13.A O no hydrogen 2.933 N/A ARG 13.A NH1 THR 66.A O no hydrogen 3.268 N/A ARG 13.A NH1 ASN 67.A O no hydrogen 3.535 N/A ARG 13.A NH2 THR 66.A O no hydrogen 3.058 N/A LYS 18.A N PRO 15.A O no hydrogen 2.926 N/A LEU 19.A N PRO 15.A O no hydrogen 3.150 N/A THR 20.A N ALA 16.A O no hydrogen 2.874 N/A THR 20.A OG1 ALA 16.A O no hydrogen 2.845 N/A THR 20.A OG1 LEU 22.A O no hydrogen 3.404 N/A LEU 22.A N THR 20.A OG1 no hydrogen 3.136 N/A PHE 28.A N TYR 4.A O no hydrogen 2.953 N/A HIS 30.A N TRP 6.A O no hydrogen 2.837 N/A ARG 31.A NH1 CYS 9.A O no hydrogen 3.103 N/A ASN 32.A N GLY 8.A O no hydrogen 3.343 N/A ASN 32.A ND2 HIS 30.A NE2 no hydrogen 2.969 N/A ASN 32.A ND2 GLN 36.A O no hydrogen 2.926 N/A ASN 35.A N ASN 32.A O no hydrogen 3.310 N/A ASN 35.A ND2 ASN 35.A O no hydrogen 3.060 N/A GLN 36.A N ASN 32.A OD1 no hydrogen 2.741 N/A VAL 37.A N GLN 121.A OE1 no hydrogen 2.807 N/A ASP 41.A N ILE 38.A O no hydrogen 3.132 N/A ASN 43.A N ASP 41.A OD1 no hydrogen 3.181 N/A CYS 44.A N ASP 41.A OD2 no hydrogen 3.081 N/A CYS 44.A SG GLN 36.A O no hydrogen 3.946 N/A LEU 45.A N ASP 41.A O no hydrogen 2.966 N/A SER 46.A N PHE 42.A O no hydrogen 2.970 N/A SER 46.A OG PHE 42.A O no hydrogen 2.928 N/A VAL 47.A N ASN 43.A O no hydrogen 3.241 N/A VAL 48.A N CYS 44.A O no hydrogen 3.026 N/A GLN 49.A N LEU 45.A O no hydrogen 2.878 N/A GLN 49.A NE2 ASP 53.A OD2 no hydrogen 2.818 N/A TYR 50.A N SER 46.A O no hydrogen 3.089 N/A ALA 51.A N VAL 47.A O no hydrogen 2.895 N/A VAL 52.A N VAL 48.A O no hydrogen 2.930 N/A ASP 53.A N GLN 49.A O no hydrogen 2.804 N/A VAL 54.A N TYR 50.A O no hydrogen 3.060 N/A LEU 55.A N TYR 50.A O no hydrogen 2.887 N/A LYS 56.A NZ ASP 53.A O no hydrogen 2.795 N/A ILE 57.A N ALA 51.A O no hydrogen 2.770 N/A ILE 60.A N SER 142.A O no hydrogen 3.002 N/A ILE 61.A N LEU 5.A O no hydrogen 2.805 N/A ILE 62.A N HIS 144.A O no hydrogen 2.876 N/A CYS 63.A N ILE 7.A O no hydrogen 2.837 N/A CYS 63.A SG GLY 64.A O no hydrogen 3.509 N/A GLY 64.A N TRP 146.A O no hydrogen 2.909 N/A THR 66.A N TYR 148.A O no hydrogen 2.926 N/A THR 66.A OG1 ASP 149.A OD1 no hydrogen 2.487 N/A CYS 68.A SG ASP 11.A OD2 no hydrogen 3.690 N/A CYS 68.A SG HIS 65.A NE2 no hydrogen 3.174 N/A HIS 72.A N CYS 68.A O no hydrogen 3.004 N/A ALA 73.A N GLY 69.A O no hydrogen 2.876 N/A ALA 74.A N GLY 70.A O no hydrogen 2.679 N/A MET 75.A N ILE 71.A O no hydrogen 3.252 N/A ALA 76.A N HIS 72.A O no hydrogen 3.255 N/A LEU 80.A N ASN 84.A OD1 no hydrogen 3.030 N/A ASN 84.A N GLY 81.A O no hydrogen 2.967 N/A ASN 85.A N LEU 82.A O no hydrogen 2.846 N/A ASN 85.A ND2 LEU 82.A O no hydrogen 3.009 N/A TRP 86.A NE1 VAL 33.A O no hydrogen 2.836 N/A LEU 87.A N ILE 83.A O no hydrogen 3.039 N/A ARG 91.A N LEU 87.A O no hydrogen 3.125 N/A ARG 91.A NH1 ALA 74.A O no hydrogen 2.780 N/A ASP 92.A N LEU 88.A O no hydrogen 2.978 N/A ILE 93.A N HIS 89.A O no hydrogen 3.396 N/A TRP 94.A N ILE 90.A O no hydrogen 2.897 N/A PHE 95.A N ARG 91.A O no hydrogen 2.911 N/A LYS 96.A N ASP 92.A O no hydrogen 2.806 N/A LYS 96.A NZ GLU 120.A OE1 no hydrogen 2.961 N/A LYS 96.A NZ GLU 120.A OE2 no hydrogen 3.250 N/A HIS 97.A N ILE 93.A O no hydrogen 3.039 N/A HIS 97.A NE2 GLU 120.A OE2 no hydrogen 3.014 N/A GLY 98.A N PHE 95.A O no hydrogen 3.133 N/A LEU 101.A N HIS 97.A O no hydrogen 2.977 N/A GLY 102.A N GLY 98.A O no hydrogen 2.691 N/A LYS 103.A N HIS 99.A O no hydrogen 3.233 N/A LYS 103.A N LEU 100.A O no hydrogen 2.995 N/A LEU 104.A N LEU 101.A O no hydrogen 3.115 N/A LYS 108.A N SER 105.A O no hydrogen 2.698 N/A ARG 109.A N PRO 106.A O no hydrogen 3.389 N/A ARG 109.A NE LEU 101.A O no hydrogen 2.859 N/A ARG 109.A NH2 LEU 104.A O no hydrogen 2.659 N/A MET 112.A N LYS 108.A O no hydrogen 3.396 N/A LEU 113.A N ARG 109.A O no hydrogen 2.980 N/A THR 114.A N ALA 110.A O no hydrogen 3.051 N/A THR 114.A OG1 ALA 110.A O no hydrogen 2.568 N/A LYS 115.A N ASP 111.A O no hydrogen 3.320 N/A LYS 115.A NZ ASP 111.A O no hydrogen 3.330 N/A ILE 116.A N MET 112.A O no hydrogen 2.806 N/A ASN 117.A N LEU 113.A O no hydrogen 2.802 N/A ASN 117.A ND2 ALA 34.A O no hydrogen 2.958 N/A VAL 118.A N THR 114.A O no hydrogen 3.346 N/A ALA 119.A N LYS 115.A O no hydrogen 3.235 N/A GLU 120.A N ILE 116.A O no hydrogen 2.861 N/A GLN 121.A N ASN 117.A O no hydrogen 2.733 N/A GLN 121.A NE2 ASN 117.A OD1 no hydrogen 2.719 N/A VAL 122.A N VAL 118.A O no hydrogen 2.908 N/A TYR 123.A N ALA 119.A O no hydrogen 3.102 N/A TYR 123.A OH GLU 169.A OE2 no hydrogen 2.241 N/A ASN 124.A N GLU 120.A O no hydrogen 2.928 N/A ASN 124.A ND2 VAL 37.A O no hydrogen 2.915 N/A ASN 124.A ND2 GLN 121.A OE1 no hydrogen 3.385 N/A LEU 125.A N GLN 121.A O no hydrogen 2.817 N/A GLY 126.A N VAL 122.A O no hydrogen 3.046 N/A ARG 127.A N ASN 124.A O no hydrogen 3.087 N/A THR 128.A N ASN 124.A O no hydrogen 3.203 N/A THR 128.A N LEU 125.A O no hydrogen 3.418 N/A THR 128.A OG1 LEU 125.A O no hydrogen 2.833 N/A VAL 131.A N THR 128.A OG1 no hydrogen 3.204 N/A LYS 132.A N THR 128.A O no hydrogen 3.179 N/A SER 133.A N SER 129.A O no hydrogen 2.986 N/A SER 133.A OG SER 129.A O no hydrogen 2.700 N/A ALA 134.A N ILE 130.A O no hydrogen 3.084 N/A TRP 135.A N VAL 131.A O no hydrogen 2.968 N/A TRP 135.A NE1 LEU 141.A O no hydrogen 2.944 N/A GLU 136.A N LYS 132.A O no hydrogen 2.717 N/A ARG 137.A N SER 133.A O no hydrogen 2.864 N/A ARG 137.A NH2 ASP 53.A OD1 no hydrogen 2.923 N/A ARG 137.A NH2 GLN 139.A OE1 no hydrogen 2.867 N/A GLY 138.A N TRP 135.A O no hydrogen 2.780 N/A GLN 139.A N ALA 134.A O no hydrogen 2.889 N/A GLN 139.A NE2 VAL 52.A O no hydrogen 2.903 N/A SER 142.A N GLU 58.A O no hydrogen 2.976 N/A LEU 143.A N ALA 162.A O no hydrogen 2.808 N/A HIS 144.A N ILE 60.A O no hydrogen 2.899 N/A GLY 145.A N VAL 160.A O no hydrogen 3.149 N/A TRP 146.A N ILE 62.A O no hydrogen 3.028 N/A TYR 148.A N GLY 64.A O no hydrogen 2.914 N/A ASP 149.A N GLY 153.A O no hydrogen 2.845 N/A ASN 151.A N ASP 149.A OD2 no hydrogen 3.115 N/A ASP 152.A N ASP 149.A OD2 no hydrogen 2.754 N/A GLY 153.A N ASP 149.A O no hydrogen 2.824 N/A LEU 155.A N VAL 147.A O no hydrogen 3.279 N/A GLN 158.A N LEU 155.A O no hydrogen 2.846 N/A MET 161.A N SER 171.A OG no hydrogen 2.907 N/A ALA 162.A N LEU 143.A O no hydrogen 2.968 N/A THR 163.A N THR 167.A OG1 no hydrogen 2.908 N/A SER 164.A OG GLU 166.A OE1 no hydrogen 3.116 N/A SER 164.A OG THR 167.A OG1 no hydrogen 2.790 N/A ARG 165.A NE ARG 165.A O no hydrogen 3.123 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.369 N/A THR 167.A N SER 164.A OG no hydrogen 3.029 N/A THR 167.A OG1 SER 164.A O no hydrogen 2.815 N/A THR 167.A OG1 SER 164.A OG no hydrogen 2.790 N/A LEU 168.A N SER 164.A O no hydrogen 2.738 N/A GLU 169.A N ARG 165.A O no hydrogen 3.139 N/A ILE 170.A N GLU 166.A O no hydrogen 3.306 N/A SER 171.A N THR 167.A O no hydrogen 2.933 N/A SER 171.A OG MET 161.A O no hydrogen 3.105 N/A TYR 172.A N LEU 168.A O no hydrogen 2.930 N/A TYR 172.A OH GLU 120.A OE2 no hydrogen 2.414 N/A ARG 173.A N GLU 169.A O no hydrogen 2.814 N/A ARG 173.A NE GLU 169.A OE1 no hydrogen 3.263 N/A ARG 173.A NH2 TYR 123.A OH no hydrogen 3.397 N/A ASN 174.A N ILE 170.A O no hydrogen 3.000 N/A ALA 175.A N SER 171.A O no hydrogen 3.050 N/A ILE 176.A N TYR 172.A O no hydrogen 3.012 N/A ALA 177.A N ARG 173.A O no hydrogen 2.911 N/A ARG 178.A N ASN 174.A O no hydrogen 2.701 N/A LEU 179.A N ALA 175.A O no hydrogen 3.021 N/A SER 180.A N ILE 176.A O no hydrogen 3.140 N/A SER 180.A N ALA 177.A O no hydrogen 3.185 N/A SER 180.A OG ILE 176.A O no hydrogen 2.620 N/A ILE 181.A N ARG 178.A O no hydrogen 3.063 N/A