Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4p3f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ARG 118.A O no hydrogen 2.707 N/A LEU 5.A N THR 123.A OG1 no hydrogen 2.943 N/A LEU 8.A N GLU 126.A OE1 no hydrogen 2.933 N/A GLN 9.A NE2 GLU 13.A OE1 no hydrogen 2.968 N/A ILE 10.A N GLU 6.A O no hydrogen 2.948 N/A ILE 11.A N ILE 7.A O no hydrogen 2.910 N/A LYS 12.A N LEU 8.A O no hydrogen 2.922 N/A GLU 13.A N GLN 9.A O no hydrogen 3.052 N/A SER 14.A N ILE 10.A O no hydrogen 2.969 N/A SER 14.A OG ILE 10.A O no hydrogen 2.789 N/A GLN 15.A N ILE 11.A O no hydrogen 2.909 N/A GLN 15.A NE2 GLU 77.A OE1 no hydrogen 2.922 N/A GLN 16.A N LYS 12.A O no hydrogen 3.017 N/A GLN 17.A N GLU 13.A O no hydrogen 3.020 N/A HIS 18.A N SER 14.A O no hydrogen 2.965 N/A ARG 21.A N GLN 15.A O no hydrogen 3.185 N/A HIS 22.A N GLY 19.A O no hydrogen 3.161 N/A GLY 23.A N LEU 20.A O no hydrogen 3.288 N/A ASP 24.A N GLY 19.A O no hydrogen 2.898 N/A ARG 27.A N ASP 24.A OD1 no hydrogen 3.260 N/A TYR 28.A N ASP 24.A O no hydrogen 3.299 N/A TYR 28.A OH GLU 77.A OE1 no hydrogen 2.465 N/A ARG 29.A N PHE 25.A O no hydrogen 3.073 N/A ARG 29.A NH1 SER 81.A OG.B no hydrogen 3.429 N/A ARG 29.A NH1 GLN 85.A OE1 no hydrogen 3.049 N/A ARG 29.A NH2 GLN 85.A OE1 no hydrogen 2.726 N/A GLY 30.A N GLN 26.A O no hydrogen 2.954 N/A TYR 31.A N ARG 27.A O no hydrogen 3.034 N/A CYS 32.A N TYR 28.A O no hydrogen 2.924 N/A CYS 32.A SG TYR 28.A O no hydrogen 3.422 N/A SER 33.A N ARG 29.A O no hydrogen 2.864 N/A SER 33.A OG ARG 29.A O no hydrogen 3.233 N/A ARG 34.A N GLY 30.A O no hydrogen 2.832 N/A ARG 35.A N TYR 31.A O no hydrogen 2.921 N/A GLN 36.A N CYS 32.A O no hydrogen 2.886 N/A GLN 36.A NE2 LEU 71.A O no hydrogen 2.840 N/A GLN 36.A NE2 ASP 75.A OD1 no hydrogen 2.856 N/A ARG 37.A N SER 33.A O no hydrogen 2.928 N/A ARG 38.A N ARG 34.A O no hydrogen 3.115 N/A LEU 39.A N ARG 35.A O no hydrogen 2.913 N/A ARG 40.A N GLN 36.A O no hydrogen 2.780 N/A LYS 41.A N ARG 37.A O no hydrogen 3.078 N/A THR 42.A N ARG 38.A O no hydrogen 3.166 N/A THR 42.A OG1 ARG 38.A O no hydrogen 3.295 N/A LEU 43.A N LEU 39.A O no hydrogen 2.885 N/A ASN 44.A N ARG 40.A O no hydrogen 2.828 N/A PHE 45.A N LYS 41.A O no hydrogen 2.943 N/A LYS 46.A N THR 42.A O no hydrogen 2.970 N/A LYS 46.A NZ ASP 61.A O no hydrogen 2.973 N/A MET 47.A N LEU 43.A O no hydrogen 2.930 N/A GLY 48.A N ASN 44.A O no hydrogen 2.822 N/A ASN 49.A N LYS 46.A O no hydrogen 3.279 N/A ASN 49.A ND2 PHE 45.A O no hydrogen 3.232 N/A ARG 50.A N MET 47.A O no hydrogen 3.378 N/A ARG 50.A NH1 MET 47.A O no hydrogen 2.686 N/A LYS 52.A N ASN 49.A O no hydrogen 2.962 N/A ASP 61.A N THR 64.A OG1 no hydrogen 2.875 N/A LEU 63.A N ASP 61.A OD1 no hydrogen 2.896 N/A THR 64.A N ASP 61.A O no hydrogen 3.192 N/A THR 64.A OG1 ASP 61.A O no hydrogen 3.131 N/A ASN 66.A ND2 SER 4.A O no hydrogen 2.738 N/A ARG 67.A N ASP 65.A OD1 no hydrogen 3.052 N/A LEU 70.A N ASN 66.A O no hydrogen 2.973 N/A LEU 71.A N ARG 67.A O no hydrogen 2.981 N/A VAL 72.A N TYR 68.A O no hydrogen 3.156 N/A LEU 73.A N LEU 69.A O no hydrogen 2.945 N/A MET 74.A N LEU 70.A O no hydrogen 2.973 N/A ASP 75.A N LEU 71.A O no hydrogen 3.424 N/A ALA 76.A N VAL 72.A O no hydrogen 3.328 N/A GLU 77.A N LEU 73.A O no hydrogen 2.983 N/A ARG 78.A N MET 74.A O no hydrogen 2.966 N/A ARG 78.A NH1 ASP 75.A OD1 no hydrogen 2.957 N/A ARG 78.A NH2 SER 33.A OG no hydrogen 3.107 N/A ARG 78.A NH2 GLN 36.A OE1 no hydrogen 2.496 N/A ALA 79.A N ASP 75.A O no hydrogen 3.156 N/A TRP 80.A N ALA 76.A O no hydrogen 2.860 N/A SER 81.A N GLU 77.A O no hydrogen 2.939 N/A SER 81.A OG.A PHE 25.A O no hydrogen 2.937 N/A SER 81.A OG.B ARG 78.A O no hydrogen 2.493 N/A TYR 82.A N ARG 78.A O no hydrogen 3.138 N/A ALA 83.A N ALA 79.A O no hydrogen 3.069 N/A MET 84.A N TRP 80.A O no hydrogen 2.799 N/A GLN 85.A N SER 81.A O no hydrogen 2.895 N/A GLN 85.A NE2 GLU 89.A OE2 no hydrogen 3.006 N/A LEU 86.A N TYR 82.A O no hydrogen 3.096 N/A LYS 87.A N ALA 83.A O no hydrogen 2.909 N/A LYS 87.A NZ GLU 141.A OE2 no hydrogen 3.169 N/A GLN 88.A N MET 84.A O no hydrogen 3.312 N/A GLU 89.A N GLN 85.A O no hydrogen 2.822 N/A LEU 96.A N LYS 92.A O no hydrogen 2.899 N/A LEU 97.A N ARG 93.A O no hydrogen 2.925 N/A SER 98.A N PHE 94.A O no hydrogen 2.823 N/A SER 98.A OG PHE 94.A O no hydrogen 3.000 N/A ARG 99.A N HIS 95.A O no hydrogen 2.962 N/A LEU 100.A N LEU 96.A O no hydrogen 2.983 N/A ARG 101.A N LEU 97.A O no hydrogen 2.877 N/A LYS 102.A N SER 98.A O no hydrogen 3.060 N/A LYS 102.A NZ HIS 106.A NE2 no hydrogen 3.264 N/A ALA 103.A N ARG 99.A O no hydrogen 3.049 N/A VAL 104.A N LEU 100.A O no hydrogen 3.020 N/A LYS 105.A N ARG 101.A O no hydrogen 2.960 N/A HIS 106.A N LYS 102.A O no hydrogen 3.099 N/A ALA 107.A N ALA 103.A O no hydrogen 2.971 N/A GLU 108.A N VAL 104.A O no hydrogen 2.790 N/A GLU 109.A N LYS 105.A O no hydrogen 3.064 N/A LEU 110.A N HIS 106.A O no hydrogen 3.050 N/A GLU 111.A N ALA 107.A O no hydrogen 2.830 N/A ARG 112.A N GLU 108.A O no hydrogen 2.898 N/A LEU 113.A N GLU 109.A O no hydrogen 2.960 N/A CYS 114.A N LEU 110.A O no hydrogen 2.959 N/A CYS 114.A SG LEU 110.A O no hydrogen 3.305 N/A GLU 115.A N ARG 112.A O no hydrogen 3.119 N/A SER 116.A N LEU 113.A O no hydrogen 3.237 N/A ASN 117.A N ASN 117.A OD1 no hydrogen 2.366 N/A ARG 118.A N SER 116.A OG no hydrogen 3.045 N/A ARG 118.A NH1 ASP 61.A OD1 no hydrogen 2.919 N/A ARG 118.A NH1 ASP 61.A OD2 no hydrogen 3.349 N/A ARG 118.A NH2 ASP 61.A OD2 no hydrogen 2.898 N/A VAL 119.A N SER 116.A O no hydrogen 3.201 N/A ASP 120.A N LEU 3.A O no hydrogen 2.966 N/A LYS 122.A NZ GLN 170.A OE1 no hydrogen 2.902 N/A THR 123.A N ASP 120.A OD1 no hydrogen 2.837 N/A THR 123.A OG1 ASP 120.A OD1 no hydrogen 2.628 N/A LYS 124.A N ASP 120.A O no hydrogen 3.077 N/A LYS 124.A NZ CYS 114.A O no hydrogen 2.921 N/A LYS 124.A NZ SER 116.A O no hydrogen 2.993 N/A LEU 125.A N ALA 121.A O no hydrogen 3.154 N/A GLU 126.A N LYS 122.A O no hydrogen 2.932 N/A ALA 127.A N THR 123.A O no hydrogen 2.880 N/A GLN 128.A N LYS 124.A O no hydrogen 2.965 N/A ALA 129.A N LEU 125.A O no hydrogen 2.894 N/A TYR 130.A N GLU 126.A O no hydrogen 2.952 N/A TYR 130.A OH GLU 77.A OE2 no hydrogen 2.639 N/A THR 131.A N ALA 127.A O no hydrogen 3.049 N/A THR 131.A OG1 ALA 107.A O no hydrogen 3.291 N/A THR 131.A OG1 GLU 111.A OE1 no hydrogen 2.905 N/A THR 131.A OG1 ALA 127.A O no hydrogen 3.139 N/A ALA 132.A N GLN 128.A O no hydrogen 2.966 N/A TYR 133.A N ALA 129.A O no hydrogen 2.994 N/A TYR 133.A OH GLU 180.A OE2 no hydrogen 2.618 N/A LEU 134.A N TYR 130.A O no hydrogen 3.020 N/A SER 135.A N THR 131.A O no hydrogen 2.807 N/A SER 135.A OG.A THR 131.A O no hydrogen 2.948 N/A GLY 136.A N ALA 132.A O no hydrogen 2.822 N/A MET 137.A N TYR 133.A O no hydrogen 3.018 N/A LEU 138.A N LEU 134.A O no hydrogen 2.966 N/A ARG 139.A N.A SER 135.A O no hydrogen 3.025 N/A ARG 139.A N.B SER 135.A O no hydrogen 3.021 N/A ARG 139.A NH1.B ALA 147.A O no hydrogen 2.868 N/A PHE 140.A N GLY 136.A O no hydrogen 2.810 N/A GLU 141.A N MET 137.A O no hydrogen 2.986 N/A HIS 142.A N LEU 138.A O no hydrogen 3.021 N/A HIS 142.A ND1 GLU 144.A OE1 no hydrogen 2.873 N/A GLN 143.A N PHE 140.A O no hydrogen 3.078 N/A GLU 144.A N ARG 139.A O.A no hydrogen 2.868 N/A GLU 144.A N ARG 139.A O.B no hydrogen 2.837 N/A ALA 148.A N GLU 144.A O no hydrogen 2.789 N/A ILE 149.A N TRP 145.A O no hydrogen 2.923 N/A GLU 150.A N LYS 146.A O no hydrogen 3.074 N/A ALA 151.A N ALA 147.A O no hydrogen 3.162 N/A PHE 152.A N ALA 148.A O no hydrogen 2.849 N/A ASN 153.A N ILE 149.A O no hydrogen 2.836 N/A LYS 154.A N GLU 150.A O no hydrogen 3.083 N/A CYS 155.A N ALA 151.A O no hydrogen 2.957 N/A CYS 155.A SG ALA 129.A O no hydrogen 3.615 N/A LYS 156.A N PHE 152.A O no hydrogen 2.794 N/A THR 157.A N ASN 153.A O no hydrogen 2.890 N/A THR 157.A OG1 ASN 153.A O no hydrogen 2.914 N/A ILE 158.A N LYS 154.A O no hydrogen 3.058 N/A TYR 159.A N CYS 155.A O no hydrogen 2.936 N/A GLU 160.A N LYS 156.A O no hydrogen 2.890 N/A LYS 161.A N THR 157.A O no hydrogen 3.003 N/A LEU 162.A N ILE 158.A O no hydrogen 2.914 N/A ALA 163.A N TYR 159.A O no hydrogen 2.826 N/A SER 164.A N GLU 160.A O no hydrogen 2.879 N/A SER 164.A OG GLU 160.A O no hydrogen 3.093 N/A SER 164.A OG GLU 160.A OE2 no hydrogen 2.786 N/A ALA 165.A N LEU 162.A O no hydrogen 3.176 N/A GLN 170.A N THR 167.A OG1 no hydrogen 3.073 N/A GLN 170.A NE2 THR 167.A OG1 no hydrogen 2.957 N/A ALA 171.A N THR 167.A O no hydrogen 3.077 N/A VAL 172.A N GLU 169.A O no hydrogen 3.395 N/A TYR 174.A OH GLU 126.A OE2 no hydrogen 2.522 N/A ASN 175.A N ALA 171.A O no hydrogen 2.794 N/A GLN 176.A N VAL 172.A O no hydrogen 2.955 N/A ARG 177.A N LEU 173.A O no hydrogen 3.163 N/A ARG 177.A N TYR 174.A O no hydrogen 3.160 N/A ARG 177.A NH1 GLU 180.A OE1 no hydrogen 2.785 N/A VAL 178.A N TYR 174.A O no hydrogen 3.122 N/A GLU 179.A N ASN 175.A O no hydrogen 2.950 N/A GLU 180.A N GLN 176.A O no hydrogen 3.070 N/A GLU 180.A N ARG 177.A O no hydrogen 3.209 N/A ILE 181.A N VAL 178.A O no hydrogen 3.318 N/A SER 182.A N VAL 178.A O no hydrogen 3.214 N/A SER 182.A N GLU 179.A O no hydrogen 3.371 N/A SER 182.A OG VAL 178.A O no hydrogen 2.996 N/A ILE 185.A N ILE 181.A O no hydrogen 3.072 N/A ARG 186.A N SER 182.A O no hydrogen 2.970 N/A TYR 187.A N PRO 183.A O no hydrogen 2.960 N/A CYS 188.A N ASN 184.A O no hydrogen 2.935 N/A CYS 188.A SG TRP 145.A O no hydrogen 3.820 N/A CYS 188.A SG ASN 184.A O no hydrogen 3.411 N/A ALA 189.A N ILE 185.A O no hydrogen 2.979 N/A TYR 190.A N ARG 186.A O no hydrogen 3.089 N/A ASN 191.A N TYR 187.A O no hydrogen 3.105 N/A ASN 191.A ND2 TYR 187.A O no hydrogen 2.833 N/A ILE 192.A N CYS 188.A O no hydrogen 2.908 N/A GLY 193.A N ALA 189.A O no hydrogen 2.779 N/A