Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cie_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N SER 1.A O.A no hydrogen 3.384 N/A ILE 4.A N SER 1.A O.B no hydrogen 3.385 N/A TRP 5.A N THR 56.A O no hydrogen 2.903 N/A GLN 6.A N VAL 21.A O no hydrogen 2.821 N/A LEU 7.A N HIS 58.A O.A no hydrogen 2.920 N/A LEU 7.A N HIS 58.A O.B no hydrogen 2.921 N/A ASP 8.A N VAL 19.A O no hydrogen 2.828 N/A THR 10.A N ILE 17.A O no hydrogen 2.968 N/A LEU 12.A N LYS 15.A O no hydrogen 3.026 N/A LYS 15.A N LEU 12.A O no hydrogen 2.840 N/A VAL 16.A N ILE 33.A O no hydrogen 3.170 N/A ILE 17.A N THR 10.A O no hydrogen 2.746 N/A LEU 18.A N GLU 31.A O no hydrogen 2.830 N/A VAL 19.A N ASP 8.A O no hydrogen 2.713 N/A ALA 20.A N GLU 29.A O no hydrogen 2.838 N/A VAL 21.A N GLN 6.A O no hydrogen 2.831 N/A HIS 22.A N TYR 27.A O no hydrogen 2.806 N/A HIS 22.A ND1 SER 25.A OG no hydrogen 2.800 N/A HIS 22.A NE2 PRO 2.A O no hydrogen 2.672 N/A VAL 23.A N ILE 4.A O no hydrogen 3.237 N/A SER 25.A N HIS 22.A O no hydrogen 3.170 N/A SER 25.A OG HIS 22.A ND1 no hydrogen 2.800 N/A SER 25.A OG HIS 22.A O no hydrogen 3.408 N/A GLY 26.A N HIS 22.A O no hydrogen 2.812 N/A TYR 27.A N SER 25.A OG no hydrogen 3.043 N/A TYR 27.A OH GLU 29.A OE2 no hydrogen 3.339 N/A ILE 28.A N ASN 128.A OD1 no hydrogen 2.981 N/A GLU 29.A N ALA 20.A O no hydrogen 3.058 N/A GLU 31.A N LEU 18.A O no hydrogen 2.932 N/A ILE 33.A N VAL 16.A O no hydrogen 2.867 N/A GLU 40.A N THR 37.A OG1 no hydrogen 3.045 N/A THR 41.A N THR 37.A O no hydrogen 3.011 N/A THR 41.A OG1 THR 37.A O no hydrogen 2.947 N/A THR 41.A OG1 ASN 64.A OD1 no hydrogen 3.124 N/A ALA 42.A N GLY 38.A O no hydrogen 2.791 N/A TYR 43.A N GLN 39.A O.A no hydrogen 3.095 N/A TYR 43.A N GLN 39.A O.B no hydrogen 3.101 N/A PHE 44.A N GLU 40.A O no hydrogen 3.003 N/A LEU 45.A N THR 41.A O no hydrogen 2.947 N/A LEU 46.A N ALA 42.A O no hydrogen 3.013 N/A LYS 47.A N TYR 43.A O no hydrogen 3.021 N/A LYS 47.A NZ.A GLU 31.A OE1.A no hydrogen 2.694 N/A LYS 47.A NZ.A GLU 31.A OE2.B no hydrogen 3.110 N/A LYS 47.A NZ.B GLU 31.A OE2.B no hydrogen 3.491 N/A LEU 48.A N PHE 44.A O no hydrogen 2.978 N/A ALA 49.A N LEU 45.A O no hydrogen 2.912 N/A GLY 50.A N LEU 46.A O no hydrogen 3.161 N/A GLY 50.A N LYS 47.A O no hydrogen 3.278 N/A ARG 51.A N LEU 48.A O no hydrogen 3.048 N/A ARG 51.A NH1 LYS 47.A O no hydrogen 2.953 N/A TRP 52.A N LEU 48.A O no hydrogen 2.970 N/A TRP 52.A NE1 TYR 27.A OH no hydrogen 3.110 N/A TRP 52.A NE1 GLU 29.A OE2 no hydrogen 2.986 N/A LYS 55.A N GLY 3.A O no hydrogen 2.914 N/A THR 56.A N GLY 3.A O no hydrogen 3.059 N/A VAL 57.A N LYS 80.A O no hydrogen 2.972 N/A HIS 58.A N.A TRP 5.A O no hydrogen 2.842 N/A HIS 58.A N.B TRP 5.A O no hydrogen 2.840 N/A HIS 58.A ND1.A ASP 83.A O no hydrogen 2.704 N/A THR 59.A N GLU 82.A O no hydrogen 2.932 N/A THR 59.A OG1.A GLU 82.A O no hydrogen 2.924 N/A THR 59.A OG1.B GLU 82.A O no hydrogen 2.924 N/A ASN 61.A ND2 GLU 36.A OE1.A no hydrogen 2.993 N/A ASN 61.A ND2 GLU 36.A OE1.B no hydrogen 2.992 N/A ASN 64.A N ASN 61.A OD1 no hydrogen 2.941 N/A ASN 64.A ND2 THR 41.A OG1 no hydrogen 3.083 N/A ASN 64.A ND2 ASP 60.A OD1 no hydrogen 2.933 N/A PHE 65.A N ASN 61.A O no hydrogen 3.132 N/A THR 66.A N GLY 62.A O no hydrogen 2.910 N/A THR 66.A OG1 GLY 62.A O no hydrogen 2.702 N/A SER 67.A N SER 63.A O no hydrogen 2.890 N/A THR 69.A OG1.B SER 67.A OG no hydrogen 2.744 N/A VAL 70.A N SER 67.A OG no hydrogen 3.140 N/A LYS 71.A N SER 67.A O no hydrogen 2.931 N/A LYS 71.A NZ PHE 65.A O no hydrogen 2.908 N/A LYS 71.A NZ GLN 81.A OE1 no hydrogen 3.137 N/A ALA 72.A N THR 68.A O.A no hydrogen 2.828 N/A ALA 72.A N THR 68.A O.B no hydrogen 2.828 N/A ALA 73.A N THR 69.A O.A no hydrogen 3.026 N/A ALA 73.A N THR 69.A O.B no hydrogen 3.034 N/A CYS 74.A N VAL 70.A O no hydrogen 2.950 N/A CYS 74.A SG VAL 70.A O no hydrogen 3.460 N/A TRP 75.A N LYS 71.A O no hydrogen 2.885 N/A TRP 76.A N ALA 72.A O no hydrogen 2.860 N/A ALA 77.A N ALA 73.A O no hydrogen 2.925 N/A GLY 78.A N TRP 75.A O no hydrogen 3.272 N/A ILE 79.A N CYS 74.A O no hydrogen 2.804 N/A LYS 80.A N LYS 55.A O no hydrogen 2.818 N/A GLN 81.A NE2 PHE 65.A O no hydrogen 3.186 N/A GLU 82.A N VAL 57.A O no hydrogen 2.868 N/A ILE 85.A N ASP 83.A OD1 no hydrogen 3.255 N/A TYR 87.A N ILE 85.A O no hydrogen 2.766 N/A GLN 90.A N ASN 88.A OD1 no hydrogen 3.419 N/A SER 91.A N ASN 88.A O no hydrogen 3.148 N/A SER 91.A OG ASN 88.A O no hydrogen 3.089 N/A GLN 92.A NE2 PRO 89.A O no hydrogen 3.222 N/A VAL 94.A N GLN 90.A O no hydrogen 3.291 N/A ILE 95.A N SER 91.A O no hydrogen 3.023 N/A GLU 96.A N GLN 92.A O no hydrogen 2.885 N/A SER 97.A N GLY 93.A O no hydrogen 2.857 N/A SER 97.A OG GLY 93.A O no hydrogen 2.833 N/A MET 98.A N.A VAL 94.A O no hydrogen 2.936 N/A MET 98.A N.B VAL 94.A O no hydrogen 2.935 N/A ASN 99.A N ILE 95.A O no hydrogen 2.940 N/A ASN 99.A ND2 ASP 8.A OD1 no hydrogen 3.092 N/A LYS 100.A N GLU 96.A O no hydrogen 3.052 N/A GLU 101.A N SER 97.A O no hydrogen 2.910 N/A LEU 102.A N.A MET 98.A O.A no hydrogen 2.811 N/A LEU 102.A N.A MET 98.A O.B no hydrogen 2.811 N/A LEU 102.A N.B MET 98.A O.A no hydrogen 2.813 N/A LEU 102.A N.B MET 98.A O.B no hydrogen 2.813 N/A LYS 103.A N ASN 99.A O no hydrogen 2.935 N/A LYS 103.A NZ THR 10.A OG1 no hydrogen 3.182 N/A LYS 103.A NZ HIS 11.A O no hydrogen 3.150 N/A LYS 104.A N LYS 100.A O no hydrogen 2.973 N/A ILE 105.A N GLU 101.A O no hydrogen 3.020 N/A ILE 106.A N LEU 102.A O.A no hydrogen 2.883 N/A ILE 106.A N LEU 102.A O.B no hydrogen 2.888 N/A GLY 107.A N LYS 103.A O no hydrogen 2.981 N/A GLN 108.A N LYS 104.A O no hydrogen 3.009 N/A VAL 109.A N ILE 105.A O no hydrogen 3.040 N/A VAL 109.A N ILE 106.A O no hydrogen 3.218 N/A ARG 110.A NE GLU 13.A OE2 no hydrogen 2.661 N/A ARG 110.A NH1 ARG 110.A O no hydrogen 3.157 N/A ARG 110.A NH2 GLU 13.A OE1 no hydrogen 3.222 N/A GLN 112.A N VAL 109.A O no hydrogen 2.743 N/A ALA 113.A N ARG 110.A O no hydrogen 3.313 N/A THR 118.A N HIS 115.A O no hydrogen 3.107 N/A ALA 119.A N HIS 115.A O no hydrogen 3.386 N/A VAL 120.A N LEU 116.A O no hydrogen 2.843 N/A GLN 121.A N LYS 117.A O no hydrogen 3.026 N/A GLN 121.A NE2 ALA 30.A O no hydrogen 2.886 N/A MET 122.A N THR 118.A O no hydrogen 2.890 N/A ALA 123.A N ALA 119.A O no hydrogen 2.899 N/A VAL 124.A N VAL 120.A O no hydrogen 2.888 N/A PHE 125.A N GLN 121.A O no hydrogen 3.011 N/A ILE 126.A N MET 122.A O no hydrogen 2.929 N/A HIS 127.A N ALA 123.A O no hydrogen 2.821 N/A HIS 127.A ND1 GLU 101.A OE2 no hydrogen 2.969 N/A HIS 127.A NE2 GLY 26.A O no hydrogen 2.651 N/A ASN 128.A N VAL 124.A O no hydrogen 2.926 N/A ASN 128.A ND2 ILE 28.A O no hydrogen 2.906 N/A HIS 129.A N PHE 125.A O no hydrogen 3.066 N/A HIS 129.A ND1 PHE 125.A O no hydrogen 2.743 N/A ARG 131.A NH1 GLU 136.A OE1 no hydrogen 3.220 N/A ARG 131.A NH1 GLU 136.A OE2 no hydrogen 3.548 N/A ARG 131.A NH2 GLU 136.A OE2 no hydrogen 3.503 N/A SER 133.A N GLU 136.A OE1 no hydrogen 3.139 N/A SER 133.A OG ASN 128.A O no hydrogen 3.538 N/A GLY 135.A N ASN 128.A O no hydrogen 3.039 N/A GLU 136.A N SER 133.A OG no hydrogen 3.158 N/A ARG 137.A N SER 133.A O no hydrogen 2.898 N/A ARG 137.A NE SER 25.A O no hydrogen 2.931 N/A ARG 137.A NH2 SER 25.A O no hydrogen 2.893 N/A ILE 138.A N ALA 134.A O no hydrogen 2.983 N/A VAL 139.A N GLY 135.A O no hydrogen 3.434 N/A ASP 140.A N GLU 136.A O no hydrogen 3.059 N/A ILE 141.A N ARG 137.A O no hydrogen 2.905 N/A ILE 142.A N ILE 138.A O no hydrogen 2.992 N/A ALA 143.A N VAL 139.A O no hydrogen 2.856 N/A THR 144.A N ASP 140.A O no hydrogen 2.969 N/A THR 144.A OG1 ASP 140.A O no hydrogen 2.765 N/A ASP 145.A N ILE 141.A O no hydrogen 3.102 N/A ILE 146.A N ILE 142.A O no hydrogen 2.888 N/A