Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3esy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N VAL 29.A O no hydrogen 3.013 N/A ILE 3.A N VAL 29.A O no hydrogen 3.036 N/A GLY 4.A N TYR 48.A O no hydrogen 3.088 N/A LEU 5.A N THR 31.A O no hydrogen 2.948 N/A PHE 6.A N ILE 50.A O no hydrogen 2.752 N/A TYR 7.A N HIS 33.A O no hydrogen 2.933 N/A GLY 8.A N GLY 52.A O no hydrogen 3.093 N/A GLY 12.A N THR 9.A OG1 no hydrogen 3.023 N/A LYS 13.A NZ ASP 145.A OD1 no hydrogen 2.535 N/A THR 14.A OG1 THR 87.A OG1 no hydrogen 2.881 N/A SER 16.A N GLY 12.A O no hydrogen 3.159 N/A SER 16.A OG LYS 13.A O no hydrogen 3.507 N/A VAL 17.A N LYS 13.A O no hydrogen 3.316 N/A ALA 18.A N THR 14.A O no hydrogen 3.014 N/A GLU 19.A N LYS 15.A O no hydrogen 3.185 N/A ILE 20.A N SER 16.A O no hydrogen 3.248 N/A ILE 21.A N VAL 17.A O no hydrogen 2.953 N/A ARG 22.A N ALA 18.A O no hydrogen 2.858 N/A ASP 23.A N GLU 19.A O no hydrogen 2.989 N/A GLU 24.A N ILE 20.A O no hydrogen 3.054 N/A PHE 25.A N ILE 21.A O no hydrogen 3.030 N/A GLY 26.A N ARG 22.A O no hydrogen 2.920 N/A ASP 28.A N ASP 28.A OD1 no hydrogen 2.585 N/A VAL 29.A N GLY 26.A O no hydrogen 2.997 N/A VAL 30.A N GLY 26.A O no hydrogen 3.348 N/A THR 31.A N ILE 3.A O no hydrogen 2.964 N/A THR 31.A OG1 TYR 46.A OH no hydrogen 2.872 N/A HIS 33.A N LEU 5.A O no hydrogen 2.716 N/A HIS 33.A NE2 TYR 46.A OH no hydrogen 2.703 N/A VAL 35.A N TYR 7.A O no hydrogen 2.850 N/A SER 36.A N ASP 34.A OD1 no hydrogen 2.976 N/A SER 36.A OG ASP 34.A OD1 no hydrogen 2.708 N/A GLN 37.A N ASP 34.A O no hydrogen 2.920 N/A ALA 38.A N VAL 35.A O no hydrogen 3.320 N/A GLU 39.A N ASP 42.A OD2 no hydrogen 3.017 N/A ASP 42.A N GLU 39.A O no hydrogen 3.253 N/A LEU 43.A N VAL 40.A O no hydrogen 3.232 N/A ASN 44.A N THR 41.A O no hydrogen 3.187 N/A ASP 45.A N ASP 42.A O no hydrogen 3.044 N/A TYR 46.A OH THR 31.A OG1 no hydrogen 2.872 N/A TYR 46.A OH HIS 33.A NE2 no hydrogen 2.703 N/A LEU 49.A N LEU 81.A O no hydrogen 2.960 N/A ILE 50.A N GLY 4.A O no hydrogen 2.849 N/A ILE 51.A N ALA 83.A O no hydrogen 2.704 N/A GLY 52.A N PHE 6.A O no hydrogen 2.804 N/A CYS 53.A N PHE 85.A O no hydrogen 3.127 N/A CYS 53.A SG PRO 54.A O no hydrogen 3.524 N/A TRP 56.A N LYS 60.A O no hydrogen 2.828 N/A LYS 60.A N TRP 56.A O no hydrogen 2.869 N/A LYS 60.A NZ GLU 66.A OE1 no hydrogen 3.183 N/A GLN 62.A N PRO 54.A O no hydrogen 3.312 N/A GLN 62.A NE2 ASP 64.A OD2 no hydrogen 2.596 N/A TRP 65.A N GLN 62.A OE1 no hydrogen 3.334 N/A TRP 65.A NE1 GLY 52.A O no hydrogen 3.125 N/A GLU 66.A N GLN 62.A O no hydrogen 2.880 N/A GLY 67.A N SER 63.A O no hydrogen 3.007 N/A LEU 68.A N ASP 64.A O no hydrogen 3.397 N/A TYR 69.A N TRP 65.A O no hydrogen 2.872 N/A SER 70.A OG GLY 67.A O no hydrogen 2.960 N/A GLU 71.A N LEU 68.A O no hydrogen 2.990 N/A LEU 72.A N TYR 69.A O no hydrogen 3.114 N/A ASP 74.A N GLU 71.A O no hydrogen 2.889 N/A VAL 75.A N LEU 72.A O no hydrogen 3.257 N/A PHE 77.A N ARG 111.A O no hydrogen 2.634 N/A ASN 78.A N ASP 76.A OD1 no hydrogen 3.153 N/A LYS 80.A N PHE 77.A O no hydrogen 3.060 N/A LYS 80.A NZ TYR 46.A O no hydrogen 2.552 N/A LYS 80.A NZ GLN 47.A OE1 no hydrogen 2.819 N/A LEU 81.A N GLN 47.A O no hydrogen 3.053 N/A VAL 82.A N LYS 114.A O no hydrogen 2.838 N/A ALA 83.A N LEU 49.A O no hydrogen 2.893 N/A PHE 85.A N ILE 51.A O no hydrogen 2.816 N/A GLY 86.A N LEU 140.A O no hydrogen 3.005 N/A THR 87.A OG1 THR 14.A OG1 no hydrogen 2.881 N/A GLN 90.A N ASP 143.A OD2 no hydrogen 3.256 N/A GLN 90.A NE2 ASP 143.A OD2 no hydrogen 2.803 N/A GLN 90.A NE2 GLN 147.A OE1 no hydrogen 3.064 N/A ILE 91.A N ASP 89.A OD1 no hydrogen 3.154 N/A GLY 92.A N ASP 89.A OD1 no hydrogen 3.060 N/A TYR 93.A N ASP 89.A O no hydrogen 3.006 N/A ASN 96.A N TYR 93.A O no hydrogen 2.979 N/A ASN 96.A ND2 ASP 99.A OD2 no hydrogen 3.018 N/A PHE 97.A N ASP 128.A O no hydrogen 3.072 N/A GLN 98.A NE2 GLY 86.A O no hydrogen 3.359 N/A ASP 99.A N ASN 96.A O no hydrogen 3.384 N/A ALA 100.A N THR 55.A OG1 no hydrogen 3.275 N/A ILE 103.A N ASP 99.A O no hydrogen 2.823 N/A LEU 104.A N ALA 100.A O no hydrogen 2.918 N/A GLU 105.A N ILE 101.A O no hydrogen 2.884 N/A GLU 106.A N GLY 102.A O no hydrogen 3.056 N/A LYS 107.A N ILE 103.A O no hydrogen 3.532 N/A LYS 107.A NZ ASP 73.A OD1 no hydrogen 2.851 N/A LYS 107.A NZ GLN 110.A OE1 no hydrogen 3.195 N/A ILE 108.A N LEU 104.A O no hydrogen 2.886 N/A SER 109.A N GLU 105.A O no hydrogen 2.859 N/A SER 109.A OG GLU 105.A O no hydrogen 2.675 N/A SER 109.A OG GLU 106.A O no hydrogen 3.052 N/A GLN 110.A N GLU 106.A O no hydrogen 3.185 N/A GLN 110.A N LYS 107.A O no hydrogen 3.107 N/A ARG 111.A N LYS 107.A O no hydrogen 2.998 N/A ARG 111.A N ILE 108.A O no hydrogen 3.089 N/A GLY 113.A N ILE 108.A O no hydrogen 2.988 N/A LYS 114.A N LYS 80.A O no hydrogen 2.894 N/A THR 115.A OG1 GLU 105.A OE2 no hydrogen 2.463 N/A VAL 116.A N VAL 82.A O no hydrogen 3.072 N/A GLY 117.A N GLU 165.A OE1 no hydrogen 3.133 N/A TRP 119.A N PHE 137.A O no hydrogen 3.008 N/A TRP 119.A NE1 TYR 124.A OH no hydrogen 3.063 N/A ASP 122.A N SER 120.A OG no hydrogen 3.191 N/A TYR 124.A N THR 121.A O no hydrogen 3.266 N/A TYR 124.A OH ALA 141.A O no hydrogen 2.529 N/A ASP 125.A N GLN 90.A OE1 no hydrogen 2.782 N/A ASN 127.A N ALA 94.A O no hydrogen 2.645 N/A ASN 127.A ND2 ASP 95.A OD1 no hydrogen 3.047 N/A ASP 128.A N ALA 94.A O no hydrogen 2.762 N/A SER 129.A N ASP 128.A OD1 no hydrogen 2.904 N/A SER 129.A OG PHE 97.A O no hydrogen 2.467 N/A LYS 130.A N ASP 99.A OD1 no hydrogen 2.894 N/A ALA 131.A N SER 129.A OG no hydrogen 3.084 N/A ARG 133.A N LYS 136.A O no hydrogen 2.859 N/A ARG 133.A NE GLU 105.A OE1 no hydrogen 2.881 N/A ARG 133.A NH1 LYS 130.A O no hydrogen 2.982 N/A ARG 133.A NH1 LEU 132.A O no hydrogen 2.720 N/A ARG 133.A NH2 GLY 102.A O no hydrogen 2.935 N/A ARG 133.A NH2 GLU 105.A OE1 no hydrogen 2.930 N/A LYS 136.A N ARG 133.A O no hydrogen 2.993 N/A PHE 137.A N TRP 119.A O no hydrogen 2.791 N/A VAL 138.A N ALA 131.A O no hydrogen 2.863 N/A LEU 142.A N GLY 86.A O no hydrogen 2.880 N/A ASP 145.A N ASP 143.A OD1 no hydrogen 3.239 N/A ASN 146.A N ASP 143.A OD1 no hydrogen 3.090 N/A ASN 146.A ND2 ASP 89.A OD1 no hydrogen 2.696 N/A ASN 146.A ND2 ASP 143.A OD2 no hydrogen 3.041 N/A GLN 147.A N ASP 143.A O no hydrogen 2.918 N/A GLN 147.A NE2 GLY 123.A O no hydrogen 2.884 N/A LEU 150.A N GLN 147.A O no hydrogen 2.887 N/A THR 151.A N SER 148.A O no hydrogen 3.306 N/A THR 151.A OG1 GLU 144.A OE2 no hydrogen 2.605 N/A THR 151.A OG1 SER 148.A O no hydrogen 3.468 N/A ARG 154.A N LEU 150.A O no hydrogen 3.088 N/A ARG 154.A NH1 GLN 147.A OE1 no hydrogen 3.302 N/A ARG 154.A NH2 GLN 147.A OE1 no hydrogen 2.551 N/A ILE 155.A N THR 151.A O no hydrogen 3.028 N/A LYS 156.A N ASP 152.A O no hydrogen 3.145 N/A SER 157.A N ASP 153.A O no hydrogen 3.026 N/A SER 157.A OG ASP 153.A O no hydrogen 2.960 N/A TRP 158.A N ARG 154.A O no hydrogen 2.939 N/A TRP 158.A NE1 GLY 117.A O no hydrogen 2.840 N/A VAL 159.A N ILE 155.A O no hydrogen 2.722 N/A ALA 160.A N LYS 156.A O no hydrogen 3.248 N/A GLN 161.A N SER 157.A O no hydrogen 2.990 N/A GLN 161.A NE2 TYR 118.A O no hydrogen 3.157 N/A GLN 161.A NE2 GLU 165.A OE2 no hydrogen 2.975 N/A LEU 162.A N TRP 158.A O no hydrogen 2.699 N/A LYS 163.A N VAL 159.A O no hydrogen 2.647 N/A LYS 163.A NZ GLU 24.A O no hydrogen 2.819 N/A SER 164.A N ALA 160.A O no hydrogen 3.427 N/A GLU 165.A N GLN 161.A O no hydrogen 3.035 N/A PHE 166.A N LEU 162.A O no hydrogen 2.739 N/A GLY 167.A N LYS 163.A O no hydrogen 3.034 N/A LEU 168.A N LYS 163.A O no hydrogen 2.791 N/A