Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4u0f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLN 10.A O no hydrogen 2.759 N/A PRO 1.A N ASP 48.A OD2 no hydrogen 2.763 N/A ILE 2.A N GLY 43.A O no hydrogen 2.749 N/A VAL 3.A N VAL 8.A O no hydrogen 3.005 N/A ASN 5.A N GLN 6.A O no hydrogen 2.986 N/A VAL 8.A N VAL 3.A O no hydrogen 2.936 N/A GLN 10.A N PRO 1.A O no hydrogen 2.716 N/A SER 13.A OG THR 16.A OG1 no hydrogen 2.808 N/A THR 16.A N SER 13.A OG no hydrogen 3.109 N/A THR 16.A OG1 SER 13.A OG no hydrogen 2.808 N/A LEU 17.A N SER 13.A O no hydrogen 2.889 N/A ASN 18.A N PRO 14.A O no hydrogen 2.871 N/A ALA 19.A N ARG 15.A O no hydrogen 2.816 N/A TRP 20.A N THR 16.A O no hydrogen 3.162 N/A VAL 21.A N LEU 17.A O no hydrogen 3.314 N/A LYS 22.A N ASN 18.A O no hydrogen 2.937 N/A VAL 23.A N ALA 19.A O no hydrogen 2.994 N/A VAL 24.A N TRP 20.A O no hydrogen 3.110 N/A GLU 25.A N VAL 21.A O no hydrogen 3.080 N/A GLU 26.A N LYS 22.A O no hydrogen 2.857 N/A LYS 27.A N VAL 23.A O no hydrogen 2.804 N/A LYS 27.A NZ GLU 32.A OE2 no hydrogen 3.370 N/A ALA 28.A N VAL 24.A O no hydrogen 2.774 N/A SER 30.A N LYS 27.A O no hydrogen 3.015 N/A SER 30.A OG GLU 32.A OE1 no hydrogen 2.658 N/A SER 30.A OG GLU 32.A OE2 no hydrogen 3.427 N/A GLU 32.A N GLU 32.A OE1 no hydrogen 2.642 N/A VAL 33.A N SER 30.A O no hydrogen 3.053 N/A ILE 34.A N PRO 31.A O no hydrogen 3.197 N/A PHE 37.A N VAL 33.A O no hydrogen 2.951 N/A SER 38.A N ILE 34.A O no hydrogen 3.022 N/A ALA 39.A N PRO 35.A O no hydrogen 3.025 N/A LEU 40.A N MET 36.A O no hydrogen 2.898 N/A SER 41.A N PHE 37.A O no hydrogen 2.920 N/A SER 41.A OG PHE 37.A O no hydrogen 2.813 N/A SER 41.A OG SER 38.A O no hydrogen 3.271 N/A CYS 42.A N ALA 39.A O no hydrogen 3.238 N/A ALA 44.A N SER 41.A O no hydrogen 3.143 N/A THR 45.A N ASP 48.A OD2 no hydrogen 3.374 N/A GLN 47.A N GLN 108.A OE1 no hydrogen 3.158 N/A ASP 48.A N THR 45.A OG1 no hydrogen 3.101 N/A LEU 49.A N THR 45.A O no hydrogen 2.957 N/A ASN 50.A N PRO 46.A O no hydrogen 2.895 N/A ASN 50.A ND2 ALA 99.A O no hydrogen 2.846 N/A THR 51.A N GLN 47.A O no hydrogen 2.837 N/A THR 51.A OG1 GLN 47.A O no hydrogen 2.879 N/A MET 52.A N ASP 48.A O no hydrogen 2.916 N/A LEU 53.A N LEU 49.A O no hydrogen 3.100 N/A ASN 54.A N ASN 50.A O no hydrogen 2.811 N/A THR 55.A N THR 51.A O no hydrogen 3.095 N/A THR 55.A OG1 THR 51.A O no hydrogen 3.329 N/A THR 55.A OG1 MET 52.A O no hydrogen 2.707 N/A VAL 56.A N LEU 53.A O no hydrogen 3.374 N/A GLN 60.A NE2 VAL 56.A O no hydrogen 3.445 N/A GLN 60.A NE2 GLY 57.A O no hydrogen 3.436 N/A GLN 60.A NE2 GLY 58.A O no hydrogen 3.034 N/A MET 63.A N HIS 59.A O no hydrogen 2.918 N/A GLN 64.A N GLN 60.A O no hydrogen 2.957 N/A MET 65.A N ALA 61.A O no hydrogen 3.039 N/A LEU 66.A N ALA 62.A O no hydrogen 2.907 N/A LYS 67.A N MET 63.A O no hydrogen 3.105 N/A GLU 68.A N GLN 64.A O no hydrogen 3.157 N/A THR 69.A N MET 65.A O no hydrogen 3.068 N/A THR 69.A OG1 MET 65.A O no hydrogen 3.298 N/A ILE 70.A N LEU 66.A O no hydrogen 2.929 N/A ASN 71.A N LYS 67.A O no hydrogen 2.754 N/A GLU 72.A N GLU 68.A O no hydrogen 3.013 N/A GLU 73.A N THR 69.A O no hydrogen 3.022 N/A ALA 74.A N ILE 70.A O no hydrogen 2.842 N/A ALA 75.A N ASN 71.A O no hydrogen 2.970 N/A GLU 76.A N GLU 72.A O no hydrogen 3.184 N/A TRP 77.A N GLU 73.A O no hydrogen 2.947 N/A TRP 77.A NE1 PRO 93.A O no hydrogen 3.020 N/A ASP 78.A N ALA 74.A O no hydrogen 3.015 N/A ARG 79.A N ALA 75.A O no hydrogen 2.958 N/A ARG 79.A NE GLU 76.A OE1 no hydrogen 3.080 N/A ARG 79.A NE GLU 76.A OE2 no hydrogen 3.473 N/A ARG 79.A NH2 GLU 76.A OE2 no hydrogen 2.939 N/A LEU 80.A N GLU 76.A O no hydrogen 2.982 N/A HIS 81.A N TRP 77.A O no hydrogen 2.741 N/A HIS 84.A N GLU 92.A OE1 no hydrogen 3.107 N/A GLN 89.A N ALA 86.A O no hydrogen 3.252 N/A GLN 89.A NE2 PRO 87.A O no hydrogen 3.181 N/A ARG 91.A NE GLU 107.A OE2 no hydrogen 2.890 N/A ARG 91.A NH1 ASP 97.A OD1 no hydrogen 3.554 N/A ARG 91.A NH1 ASP 97.A OD2 no hydrogen 2.719 N/A ARG 91.A NH2 ASP 97.A OD1 no hydrogen 2.944 N/A ARG 91.A NH2 GLU 107.A OE1 no hydrogen 2.968 N/A ARG 91.A NH2 GLU 107.A OE2 no hydrogen 3.504 N/A ARG 94.A N ASP 97.A OD2 no hydrogen 2.949 N/A GLY 95.A N ASP 78.A OD1 no hydrogen 2.748 N/A SER 96.A OG THR 102.A OG1 no hydrogen 2.686 N/A ILE 98.A N ARG 94.A O no hydrogen 3.195 N/A ALA 99.A N GLY 95.A O no hydrogen 3.169 N/A GLY 100.A N ASP 97.A O no hydrogen 3.151 N/A THR 101.A N SER 96.A O no hydrogen 2.840 N/A THR 102.A N SER 96.A O no hydrogen 3.246 N/A THR 102.A OG1 SER 96.A OG no hydrogen 2.686 N/A THR 102.A OG1 ASP 97.A OD1 no hydrogen 2.625 N/A SER 103.A OG ASP 97.A O no hydrogen 2.674 N/A THR 104.A N GLU 107.A OE1 no hydrogen 2.983 N/A GLU 107.A N THR 104.A OG1 no hydrogen 3.097 N/A GLN 108.A N THR 104.A O no hydrogen 3.083 N/A GLN 108.A NE2 SER 103.A O no hydrogen 3.462 N/A GLN 108.A NE2 SER 103.A OG no hydrogen 2.779 N/A ILE 109.A N LEU 105.A O no hydrogen 2.722 N/A GLY 110.A N GLN 106.A O no hydrogen 2.705 N/A TRP 111.A N GLU 107.A O no hydrogen 2.948 N/A TRP 111.A NE1 ARG 91.A O no hydrogen 2.763 N/A MET 112.A N GLN 108.A O no hydrogen 3.137 N/A THR 113.A N ILE 109.A O no hydrogen 3.190 N/A THR 113.A OG1 ILE 109.A O no hydrogen 2.696 N/A HIS 114.A ND1 PRO 116.A O no hydrogen 2.673 N/A ILE 118.A N TRP 111.A O no hydrogen 2.994 N/A VAL 120.A N ILE 118.A O no hydrogen 2.778 N/A ILE 123.A N PRO 119.A O no hydrogen 3.043 N/A TYR 124.A N VAL 120.A O no hydrogen 3.105 N/A TYR 124.A OH ASN 50.A OD1 no hydrogen 2.572 N/A LYS 125.A N GLY 121.A O no hydrogen 2.958 N/A LYS 125.A NZ SER 38.A O no hydrogen 3.208 N/A LYS 125.A NZ SER 41.A O no hydrogen 2.744 N/A LYS 125.A NZ SER 41.A OG no hydrogen 3.244 N/A ARG 126.A N GLU 122.A O no hydrogen 3.003 N/A TRP 127.A N ILE 123.A O no hydrogen 3.246 N/A ILE 128.A N TYR 124.A O no hydrogen 2.951 N/A ILE 129.A N LYS 125.A O no hydrogen 2.892 N/A LEU 130.A N ARG 126.A O no hydrogen 2.945 N/A GLY 131.A N TRP 127.A O no hydrogen 3.084 N/A LEU 132.A N ILE 128.A O no hydrogen 2.755 N/A ASN 133.A N ILE 129.A O no hydrogen 2.873 N/A LYS 134.A N LEU 130.A O no hydrogen 3.421 N/A LYS 134.A NZ THR 69.A OG1 no hydrogen 2.929 N/A ILE 135.A N GLY 131.A O no hydrogen 3.314 N/A VAL 136.A N LEU 132.A O no hydrogen 2.930 N/A ARG 137.A N ASN 133.A O no hydrogen 3.104 N/A MET 138.A N LYS 134.A O no hydrogen 3.247 N/A TYR 139.A N ILE 135.A O no hydrogen 2.861 N/A SER 140.A OG GLU 169.A OE2 no hydrogen 2.998 N/A THR 142.A OG1 THR 165.A OG1 no hydrogen 3.111 N/A LEU 145.A N SER 143.A OG no hydrogen 3.159 N/A ASP 146.A N SER 143.A O no hydrogen 3.191 N/A ILE 147.A N ILE 144.A O no hydrogen 3.292 N/A GLN 149.A N ASN 175.A O no hydrogen 2.844 N/A GLN 149.A NE2 GLU 153.A O no hydrogen 2.987 N/A GLY 150.A N GLU 153.A OE1 no hydrogen 3.084 N/A GLU 153.A N GLY 150.A O no hydrogen 2.986 N/A TYR 158.A N PRO 154.A O no hydrogen 3.250 N/A TYR 158.A OH LEU 172.A O no hydrogen 2.580 N/A VAL 159.A N PHE 155.A O no hydrogen 3.022 N/A ASP 160.A N ARG 156.A O no hydrogen 2.968 N/A ARG 161.A N ASP 157.A O no hydrogen 3.169 N/A ARG 161.A NE GLU 153.A OE2 no hydrogen 2.903 N/A ARG 161.A NH2 ARG 148.A O no hydrogen 2.815 N/A ARG 161.A NH2 GLU 153.A OE1 no hydrogen 3.007 N/A ARG 161.A NH2 GLU 153.A OE2 no hydrogen 3.435 N/A PHE 162.A N TYR 158.A O no hydrogen 2.846 N/A TYR 163.A N VAL 159.A O no hydrogen 2.951 N/A LYS 164.A N ASP 160.A O no hydrogen 3.107 N/A THR 165.A N ARG 161.A O no hydrogen 2.979 N/A THR 165.A OG1 THR 142.A OG1 no hydrogen 3.111 N/A THR 165.A OG1 ARG 161.A O no hydrogen 2.984 N/A LEU 166.A N PHE 162.A O no hydrogen 3.051 N/A ARG 167.A N TYR 163.A O no hydrogen 2.981 N/A ALA 168.A N LYS 164.A O no hydrogen 3.301 N/A GLU 169.A N THR 165.A O no hydrogen 2.970 N/A GLN 174.A N THR 170.A O no hydrogen 3.309 N/A ASN 175.A N LEU 171.A O no hydrogen 3.029 N/A ASN 175.A ND2 ILE 147.A O no hydrogen 2.940 N/A ALA 176.A N VAL 173.A O no hydrogen 3.079 N/A ASN 177.A N GLN 149.A OE1 no hydrogen 2.939 N/A ASN 177.A ND2 GLY 150.A O no hydrogen 3.099 N/A CYS 180.A N ASN 177.A OD1 no hydrogen 3.084 N/A LYS 181.A N ASN 177.A O no hydrogen 2.839 N/A LYS 181.A NZ GLN 174.A O no hydrogen 2.830 N/A LYS 181.A NZ GLN 174.A OE1 no hydrogen 3.535 N/A THR 182.A N PRO 178.A O no hydrogen 3.146 N/A THR 182.A OG1 PRO 178.A O no hydrogen 2.972 N/A ILE 183.A N ASP 179.A O no hydrogen 3.468 N/A LEU 184.A N CYS 180.A O no hydrogen 2.974 N/A LYS 185.A N LYS 181.A O no hydrogen 3.021 N/A ALA 186.A N THR 182.A O no hydrogen 3.190 N/A LEU 187.A N LEU 184.A O no hydrogen 3.190 N/A GLY 188.A N LYS 185.A O no hydrogen 3.169 N/A THR 192.A N GLU 195.A OE1 no hydrogen 2.831 N/A THR 192.A OG1 GLU 195.A OE1 no hydrogen 3.185 N/A GLU 195.A N THR 192.A OG1 no hydrogen 3.344 N/A MET 196.A N THR 192.A O no hydrogen 2.952 N/A MET 197.A N LEU 193.A O no hydrogen 2.764 N/A THR 198.A N GLU 194.A O no hydrogen 2.958 N/A THR 198.A OG1 GLU 194.A O no hydrogen 2.788 N/A ALA 199.A N GLU 195.A O no hydrogen 2.844 N/A CYS 200.A N MET 196.A O no hydrogen 3.087 N/A CYS 200.A SG CYS 180.A O no hydrogen 3.438 N/A GLN 201.A N THR 198.A O no hydrogen 3.177 N/A