Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3esc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ASN 31.A OD1 no hydrogen 2.966 N/A ARG 4.A NE ASP 6.A OD1 no hydrogen 3.030 N/A ARG 4.A NH1 GLU 44.A OE2 no hydrogen 2.757 N/A ARG 4.A NH2 ASP 6.A OD2 no hydrogen 2.856 N/A ARG 4.A NH2 GLU 44.A OE2 no hydrogen 2.871 N/A ASP 6.A N ILE 54.A O no hydrogen 2.995 N/A LEU 7.A N GLN 55.A OE1 no hydrogen 3.033 N/A ILE 8.A N GLN 55.A OE1 no hydrogen 3.028 N/A ASN 9.A N ASP 5.A O no hydrogen 2.947 N/A GLY 10.A N LEU 7.A O no hydrogen 3.097 N/A ASN 11.A N SER 14.A OG.A no hydrogen 2.989 N/A ALA 13.A N ASN 11.A OD1 no hydrogen 2.954 N/A SER 14.A N ASN 11.A O no hydrogen 2.868 N/A SER 14.A OG.A ASN 11.A O no hydrogen 3.025 N/A SER 14.A OG.B ASN 11.A OD1 no hydrogen 3.347 N/A CYS 15.A SG ASN 11.A O no hydrogen 3.883 N/A CYS 15.A SG SER 12.A O no hydrogen 3.534 N/A CYS 15.A SG LYS 92.A O no hydrogen 3.210 N/A ILE 19.A N THR 97.A O no hydrogen 2.900 N/A PHE 20.A N TRP 53.A O no hydrogen 2.862 N/A ILE 21.A N ILE 99.A O no hydrogen 3.002 N/A TYR 22.A N GLN 55.A O no hydrogen 2.974 N/A ALA 23.A N GLY 101.A O no hydrogen 2.957 N/A ARG 24.A NE GLU 28.A O no hydrogen 2.950 N/A ARG 24.A NH1 TYR 61.A O no hydrogen 3.364 N/A ARG 24.A NH2 TYR 61.A O no hydrogen 3.165 N/A GLY 25.A N GLU 28.A OE1 no hydrogen 2.904 N/A SER 26.A OG GLN 105.A OE1 no hydrogen 3.000 N/A THR 27.A N ALA 63.A O no hydrogen 2.712 N/A GLU 28.A N GLY 25.A O no hydrogen 3.199 N/A ASN 31.A N THR 2.A O no hydrogen 2.922 N/A ASN 31.A ND2 ARG 4.A O no hydrogen 3.014 N/A LEU 32.A N THR 2.A O no hydrogen 2.764 N/A GLY 33.A N THR 29.A O no hydrogen 2.880 N/A THR 34.A N GLU 28.A OE1 no hydrogen 3.423 N/A THR 34.A OG1 GLU 28.A OE2 no hydrogen 2.618 N/A GLY 36.A N LEU 32.A O no hydrogen 3.167 N/A ILE 39.A N LEU 35.A O no hydrogen 3.214 N/A ALA 40.A N GLY 36.A O no hydrogen 2.950 N/A SER 41.A N PRO 37.A O no hydrogen 2.893 N/A SER 41.A OG.A PRO 37.A O no hydrogen 3.166 N/A SER 41.A OG.C PRO 37.A O no hydrogen 3.506 N/A SER 41.A OG.C SER 38.A O no hydrogen 2.996 N/A ASN 42.A N SER 38.A O no hydrogen 3.185 N/A ASN 42.A ND2 ARG 180.A O no hydrogen 2.966 N/A LEU 43.A N ILE 39.A O no hydrogen 2.943 N/A GLU 44.A N ALA 40.A O no hydrogen 2.859 N/A SER 45.A N SER 41.A O no hydrogen 2.971 N/A SER 45.A OG.B ASN 42.A O no hydrogen 2.705 N/A ALA 46.A N ASN 42.A O no hydrogen 3.185 N/A PHE 47.A N LEU 43.A O no hydrogen 2.950 N/A LYS 49.A NZ GLU 44.A OE1 no hydrogen 3.358 N/A LYS 49.A NZ GLU 44.A OE2 no hydrogen 3.342 N/A GLY 51.A N GLY 48.A O no hydrogen 2.915 N/A TRP 53.A N VAL 18.A O no hydrogen 2.840 N/A ILE 54.A N ASP 6.A OD2 no hydrogen 2.821 N/A GLN 55.A N PHE 20.A O no hydrogen 2.867 N/A GLN 55.A NE2 ASP 5.A OD1 no hydrogen 2.880 N/A GLN 55.A NE2 GLY 56.A O no hydrogen 2.897 N/A GLY 56.A N ARG 4.A O no hydrogen 2.961 N/A VAL 57.A N TYR 22.A O no hydrogen 2.844 N/A ALA 60.A N GLU 81.A OE1 no hydrogen 2.890 N/A TYR 61.A N GLY 58.A O no hydrogen 2.869 N/A TYR 61.A OH ARG 24.A O no hydrogen 2.752 N/A ARG 62.A NE.A GLY 59.A O no hydrogen 2.786 N/A ARG 62.A NE.B GLY 59.A O no hydrogen 3.055 N/A ARG 62.A NH2.B GLY 59.A O no hydrogen 3.043 N/A ASP 67.A N THR 64.A O no hydrogen 3.201 N/A ASP 67.A N THR 64.A OG1 no hydrogen 3.239 N/A ASN 68.A N LEU 65.A O no hydrogen 3.119 N/A ASN 68.A ND2 SER 26.A OG no hydrogen 2.967 N/A ASN 68.A ND2 LEU 65.A O no hydrogen 2.843 N/A ALA 69.A N GLY 66.A O no hydrogen 3.066 N/A LEU 70.A N ASP 67.A O no hydrogen 3.068 N/A ARG 72.A NH1 ASP 116.A OD2 no hydrogen 2.841 N/A ARG 72.A NH2 GLU 115.A OE1 no hydrogen 2.914 N/A ARG 72.A NH2 ASP 116.A OD1 no hydrogen 2.921 N/A ARG 72.A NH2 ASP 116.A OD2 no hydrogen 3.564 N/A GLY 73.A N LEU 70.A O no hydrogen 2.849 N/A ALA 78.A N SER 75.A OG no hydrogen 2.984 N/A ILE 79.A N SER 75.A O no hydrogen 3.157 N/A ARG 80.A N SER 76.A O no hydrogen 2.892 N/A ARG 80.A NH2 SER 76.A OG.B no hydrogen 3.365 N/A GLU 81.A N ALA 77.A O no hydrogen 3.038 N/A MET 82.A N ALA 78.A O no hydrogen 2.966 N/A LEU 83.A N ILE 79.A O no hydrogen 2.907 N/A GLY 84.A N ARG 80.A O no hydrogen 2.929 N/A LEU 85.A N GLU 81.A O no hydrogen 3.060 N/A PHE 86.A N MET 82.A O no hydrogen 3.004 N/A GLN 87.A N LEU 83.A O no hydrogen 2.941 N/A GLN 88.A N GLY 84.A O no hydrogen 2.827 N/A ALA 89.A N LEU 85.A O no hydrogen 2.961 N/A ASN 90.A N PHE 86.A O no hydrogen 3.023 N/A THR 91.A N GLN 87.A O no hydrogen 2.848 N/A THR 91.A OG1 GLN 87.A O no hydrogen 2.987 N/A LYS 92.A N GLN 88.A O no hydrogen 2.798 N/A LYS 92.A NZ.A LEU 7.A O no hydrogen 2.912 N/A LYS 92.A NZ.A GLY 10.A O no hydrogen 2.749 N/A LYS 92.A NZ.A GLN 88.A OE1 no hydrogen 2.914 N/A LYS 92.A NZ.B LEU 7.A O no hydrogen 3.101 N/A LYS 92.A NZ.B GLY 10.A O no hydrogen 3.191 N/A LYS 92.A NZ.B GLN 88.A OE1 no hydrogen 2.556 N/A CYS 93.A N ALA 89.A O no hydrogen 2.874 N/A ALA 96.A N CYS 93.A O no hydrogen 2.956 N/A THR 97.A N ASP 17.A O no hydrogen 2.873 N/A LEU 98.A N LYS 124.A O no hydrogen 2.978 N/A ILE 99.A N ILE 19.A O no hydrogen 2.903 N/A ALA 100.A N GLY 127.A O no hydrogen 3.081 N/A GLY 101.A N ILE 21.A O no hydrogen 3.083 N/A GLY 102.A N VAL 129.A O no hydrogen 3.047 N/A TYR 103.A N ALA 23.A O no hydrogen 3.108 N/A TYR 103.A OH HIS 172.A O no hydrogen 2.771 N/A SER 104.A N PHE 131.A O no hydrogen 2.903 N/A SER 104.A OG HIS 172.A NE2 no hydrogen 2.988 N/A GLN 105.A NE2 THR 74.A OG1 no hydrogen 2.760 N/A GLY 106.A N TYR 103.A O no hydrogen 2.802 N/A ALA 107.A N SER 104.A O no hydrogen 2.858 N/A ALA 108.A N SER 104.A O no hydrogen 3.157 N/A LEU 109.A N GLN 105.A O no hydrogen 2.853 N/A ALA 110.A N GLY 106.A O no hydrogen 2.881 N/A ALA 111.A N ALA 107.A O no hydrogen 2.941 N/A ALA 112.A N ALA 108.A O no hydrogen 2.918 N/A SER 113.A N LEU 109.A O no hydrogen 2.885 N/A SER 113.A OG.A LEU 109.A O no hydrogen 2.928 N/A SER 113.A OG.B LEU 109.A O no hydrogen 2.831 N/A SER 113.A OG.B ALA 110.A O no hydrogen 2.957 N/A ILE 114.A N ALA 110.A O no hydrogen 2.962 N/A GLU 115.A N ALA 111.A O no hydrogen 2.975 N/A ASP 116.A N ALA 112.A O no hydrogen 3.054 N/A ASP 116.A N SER 113.A O no hydrogen 3.094 N/A LEU 117.A N ILE 114.A O no hydrogen 3.320 N/A ILE 121.A N ASP 118.A OD1 no hydrogen 3.055 N/A ARG 122.A N ASP 118.A O no hydrogen 2.971 N/A ARG 122.A NE ILE 114.A O no hydrogen 2.866 N/A ARG 122.A NH1 ILE 114.A O no hydrogen 3.421 N/A ARG 122.A NH1 GLU 115.A O no hydrogen 3.083 N/A ASP 123.A N SER 119.A O no hydrogen 2.865 N/A LYS 124.A N ILE 121.A O no hydrogen 2.918 N/A LYS 124.A NZ ASN 90.A OD1 no hydrogen 2.499 N/A LYS 124.A NZ PRO 94.A O no hydrogen 2.964 N/A ILE 125.A N ARG 122.A O no hydrogen 2.964 N/A ALA 126.A N LEU 98.A O no hydrogen 2.809 N/A THR 128.A N ARG 150.A O no hydrogen 2.911 N/A THR 128.A OG1 TYR 146.A OH no hydrogen 3.156 N/A VAL 129.A N ALA 100.A O no hydrogen 3.013 N/A LEU 130.A N LYS 152.A O no hydrogen 2.923 N/A PHE 131.A N GLY 102.A O no hydrogen 2.932 N/A GLY 132.A N PHE 154.A O no hydrogen 2.863 N/A TYR 133.A OH ARG 142.A O no hydrogen 2.688 N/A ASN 136.A N TYR 133.A O no hydrogen 2.984 N/A ASN 136.A ND2 CYS 162.A O no hydrogen 3.023 N/A GLN 138.A N GLN 138.A OE1 no hydrogen 2.757 N/A ASN 139.A N LYS 135.A O no hydrogen 2.841 N/A ASN 139.A ND2 TYR 133.A OH no hydrogen 3.005 N/A ARG 140.A N LEU 137.A O no hydrogen 3.127 N/A GLY 141.A N ASN 136.A O no hydrogen 2.806 N/A ARG 142.A N ASN 139.A O no hydrogen 3.051 N/A ARG 142.A NH2 TYR 146.A O no hydrogen 2.964 N/A ASN 145.A ND2 GLU 115.A O no hydrogen 2.990 N/A TYR 146.A N ILE 143.A O no hydrogen 3.084 N/A TYR 146.A OH ILE 125.A O no hydrogen 2.769 N/A TYR 146.A OH THR 128.A OG1 no hydrogen 3.156 N/A ARG 150.A N PRO 147.A O no hydrogen 3.069 N/A ARG 150.A NH1 ASP 123.A O no hydrogen 2.824 N/A ARG 150.A NH1 ILE 125.A O no hydrogen 2.969 N/A THR 151.A N ALA 148.A O no hydrogen 2.973 N/A THR 151.A OG1 PRO 147.A O no hydrogen 2.884 N/A LYS 152.A N THR 128.A O no hydrogen 2.973 N/A PHE 154.A N LEU 130.A O no hydrogen 2.724 N/A LYS 156.A N TYR 175.A OH no hydrogen 2.919 N/A ASP 159.A N LYS 156.A O no hydrogen 2.892 N/A VAL 161.A N ASP 159.A OD1 no hydrogen 3.144 N/A CYS 162.A N ASP 159.A O no hydrogen 2.974 N/A THR 163.A N LEU 160.A O no hydrogen 3.146 N/A THR 163.A OG1 LEU 160.A O no hydrogen 3.273 N/A SER 165.A N LEU 160.A O no hydrogen 3.076 N/A ILE 167.A N SER 165.A OG no hydrogen 3.047 N/A HIS 172.A N ALA 169.A O no hydrogen 2.926 N/A HIS 172.A ND1 ASP 159.A OD2 no hydrogen 2.826 N/A HIS 172.A NE2 SER 104.A OG no hydrogen 2.988 N/A LEU 173.A N ALA 170.A O no hydrogen 2.933 N/A ALA 174.A N PRO 171.A O no hydrogen 3.257 N/A TYR 175.A OH ASP 159.A OD2 no hydrogen 2.641 N/A ALA 179.A N TYR 175.A O no hydrogen 2.969 N/A ARG 180.A N GLY 176.A O no hydrogen 3.069 N/A ARG 180.A N PRO 177.A O no hydrogen 3.190 N/A ARG 180.A NE.B SER 38.A OG no hydrogen 3.029 N/A ARG 180.A NH2.B SER 38.A OG no hydrogen 2.849 N/A GLY 181.A N ASP 178.A O no hydrogen 3.241 N/A ALA 183.A N ASP 178.A O no hydrogen 2.927 N/A GLU 185.A N GLY 181.A O no hydrogen 2.977 N/A PHE 186.A N PRO 182.A O no hydrogen 2.985 N/A LEU 187.A N ALA 183.A O no hydrogen 3.110 N/A ILE 188.A N PRO 184.A O no hydrogen 2.782 N/A GLU 189.A N GLU 185.A O no hydrogen 2.953 N/A LYS 190.A N PHE 186.A O no hydrogen 3.077 N/A LYS 190.A NZ ASP 149.A O no hydrogen 2.923 N/A VAL 191.A N LEU 187.A O no hydrogen 2.950 N/A ARG 192.A N ILE 188.A O no hydrogen 2.796 N/A ALA 193.A N GLU 189.A O no hydrogen 2.962 N/A VAL 194.A N LYS 190.A O no hydrogen 3.232 N/A VAL 194.A N VAL 191.A O no hydrogen 3.110 N/A ARG 195.A N VAL 191.A O no hydrogen 2.901 N/A ARG 195.A NH1 ASP 95.A O no hydrogen 3.012 N/A ARG 195.A NH1 THR 97.A OG1 no hydrogen 2.802 N/A