Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4u0a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLN 13.A O no hydrogen 2.899 N/A PRO 1.A N ASP 51.A OD2 no hydrogen 2.738 N/A ILE 2.A N GLY 46.A O no hydrogen 2.838 N/A VAL 3.A N VAL 11.A O no hydrogen 2.966 N/A ASN 5.A N GLN 9.A O no hydrogen 3.275 N/A GLY 8.A N ASN 5.A O no hydrogen 2.961 N/A GLN 9.A N ASN 5.A OD1 no hydrogen 2.800 N/A VAL 11.A N VAL 3.A O no hydrogen 2.858 N/A GLN 13.A N PRO 1.A O no hydrogen 2.716 N/A SER 16.A OG THR 19.A OG1 no hydrogen 2.836 N/A THR 19.A N SER 16.A OG no hydrogen 3.313 N/A THR 19.A OG1 SER 16.A OG no hydrogen 2.836 N/A LEU 20.A N SER 16.A O no hydrogen 3.036 N/A ASN 21.A N PRO 17.A O no hydrogen 2.953 N/A ALA 22.A N ARG 18.A O no hydrogen 2.909 N/A TRP 23.A N THR 19.A O no hydrogen 3.178 N/A VAL 24.A N LEU 20.A O no hydrogen 3.241 N/A LYS 25.A N ASN 21.A O no hydrogen 2.882 N/A LYS 25.A NZ GLU 28.A OE1 no hydrogen 3.432 N/A VAL 26.A N ALA 22.A O no hydrogen 2.957 N/A VAL 27.A N TRP 23.A O no hydrogen 3.208 N/A GLU 28.A N VAL 24.A O no hydrogen 3.086 N/A GLU 29.A N LYS 25.A O no hydrogen 2.991 N/A LYS 30.A N VAL 26.A O no hydrogen 2.811 N/A LYS 30.A NZ GLU 35.A OE2 no hydrogen 2.953 N/A ALA 31.A N VAL 27.A O no hydrogen 2.838 N/A SER 33.A N LYS 30.A O no hydrogen 3.120 N/A SER 33.A OG LYS 30.A O no hydrogen 2.871 N/A GLU 35.A N GLU 35.A OE1 no hydrogen 2.762 N/A VAL 36.A N SER 33.A O no hydrogen 2.996 N/A ILE 37.A N PRO 34.A O no hydrogen 3.147 N/A PHE 40.A N VAL 36.A O no hydrogen 2.937 N/A SER 41.A N ILE 37.A O no hydrogen 2.924 N/A ALA 42.A N PRO 38.A O no hydrogen 2.962 N/A LEU 43.A N MET 39.A O no hydrogen 2.857 N/A SER 44.A N PHE 40.A O no hydrogen 2.975 N/A SER 44.A OG PHE 40.A O no hydrogen 2.774 N/A SER 44.A OG SER 41.A O no hydrogen 3.171 N/A CYS 45.A N ALA 42.A O no hydrogen 3.351 N/A ALA 47.A N SER 44.A O no hydrogen 3.120 N/A THR 48.A N ASP 51.A OD2 no hydrogen 3.216 N/A GLN 50.A N GLN 109.A OE1 no hydrogen 3.059 N/A ASP 51.A N THR 48.A OG1 no hydrogen 3.081 N/A LEU 52.A N THR 48.A O no hydrogen 3.011 N/A ASN 53.A N PRO 49.A O no hydrogen 2.867 N/A ASN 53.A ND2 ALA 100.A O no hydrogen 2.847 N/A THR 54.A N GLN 50.A O no hydrogen 2.882 N/A THR 54.A OG1 GLN 50.A O no hydrogen 3.106 N/A MET 55.A N ASP 51.A O no hydrogen 2.988 N/A LEU 56.A N LEU 52.A O no hydrogen 3.030 N/A ASN 57.A N ASN 53.A O no hydrogen 2.834 N/A THR 58.A N THR 54.A O no hydrogen 3.002 N/A THR 58.A OG1 THR 54.A O no hydrogen 3.442 N/A THR 58.A OG1 MET 55.A O no hydrogen 2.781 N/A VAL 59.A N LEU 56.A O no hydrogen 3.395 N/A GLN 63.A NE2 GLY 61.A O no hydrogen 2.876 N/A MET 66.A N HIS 62.A O no hydrogen 3.069 N/A GLN 67.A N GLN 63.A O no hydrogen 2.927 N/A MET 68.A N ALA 64.A O no hydrogen 3.023 N/A LEU 69.A N ALA 65.A O no hydrogen 2.856 N/A LYS 70.A N MET 66.A O no hydrogen 3.045 N/A GLU 71.A N GLN 67.A O no hydrogen 3.137 N/A THR 72.A N MET 68.A O no hydrogen 3.069 N/A THR 72.A OG1 MET 68.A O no hydrogen 3.305 N/A ILE 73.A N LEU 69.A O no hydrogen 2.952 N/A ASN 74.A N LYS 70.A O no hydrogen 2.881 N/A GLU 75.A N GLU 71.A O no hydrogen 2.967 N/A GLU 76.A N THR 72.A O no hydrogen 2.938 N/A ALA 77.A N ILE 73.A O no hydrogen 2.831 N/A ALA 78.A N ASN 74.A O no hydrogen 2.959 N/A GLU 79.A N GLU 75.A O no hydrogen 3.125 N/A TRP 80.A N GLU 76.A O no hydrogen 3.018 N/A TRP 80.A NE1 PRO 94.A O no hydrogen 3.104 N/A ASP 81.A N ALA 77.A O no hydrogen 3.059 N/A ARG 82.A N ALA 78.A O no hydrogen 2.998 N/A ARG 82.A NE GLU 79.A OE1 no hydrogen 3.216 N/A ARG 82.A NH2 GLU 79.A OE2 no hydrogen 2.723 N/A LEU 83.A N GLU 79.A O no hydrogen 2.974 N/A HIS 84.A N TRP 80.A O no hydrogen 2.795 N/A HIS 84.A ND1 TRP 80.A O no hydrogen 3.097 N/A GLN 90.A N ALA 87.A O no hydrogen 3.285 N/A ARG 92.A NE GLU 108.A OE2 no hydrogen 2.978 N/A ARG 92.A NH1 ASP 98.A OD1 no hydrogen 3.481 N/A ARG 92.A NH1 ASP 98.A OD2 no hydrogen 2.935 N/A ARG 92.A NH2 ASP 98.A OD1 no hydrogen 2.951 N/A ARG 92.A NH2 GLU 108.A OE1 no hydrogen 3.131 N/A ARG 92.A NH2 GLU 108.A OE2 no hydrogen 3.401 N/A ARG 95.A N ASP 98.A OD2 no hydrogen 2.827 N/A GLY 96.A N ASP 81.A OD1 no hydrogen 2.809 N/A SER 97.A OG THR 103.A OG1 no hydrogen 2.638 N/A ILE 99.A N ARG 95.A O no hydrogen 3.089 N/A ALA 100.A N GLY 96.A O no hydrogen 2.975 N/A GLY 101.A N ASP 98.A O no hydrogen 3.112 N/A THR 102.A N SER 97.A O no hydrogen 2.884 N/A THR 102.A OG1 SER 97.A O no hydrogen 2.927 N/A THR 103.A N SER 97.A O no hydrogen 3.322 N/A THR 103.A OG1 SER 97.A OG no hydrogen 2.638 N/A THR 103.A OG1 ASP 98.A OD1 no hydrogen 2.576 N/A SER 104.A OG ASP 98.A O no hydrogen 2.686 N/A THR 105.A N GLU 108.A OE1 no hydrogen 2.990 N/A GLU 108.A N THR 105.A OG1 no hydrogen 3.254 N/A GLN 109.A N THR 105.A O no hydrogen 3.018 N/A GLN 109.A NE2 SER 104.A O no hydrogen 3.378 N/A GLN 109.A NE2 SER 104.A OG no hydrogen 3.082 N/A ILE 110.A N LEU 106.A O no hydrogen 2.949 N/A GLY 111.A N GLN 107.A O no hydrogen 2.885 N/A TRP 112.A N GLU 108.A O no hydrogen 3.002 N/A TRP 112.A NE1 ARG 92.A O no hydrogen 2.905 N/A MET 113.A N GLN 109.A O no hydrogen 2.984 N/A THR 114.A N ILE 110.A O no hydrogen 2.901 N/A THR 114.A OG1 ILE 110.A O no hydrogen 2.677 N/A HIS 115.A ND1 PRO 117.A O no hydrogen 3.038 N/A ILE 119.A N TRP 112.A O no hydrogen 2.762 N/A VAL 121.A N ILE 119.A O no hydrogen 2.777 N/A ILE 124.A N PRO 120.A O no hydrogen 3.018 N/A TYR 125.A N VAL 121.A O no hydrogen 3.009 N/A TYR 125.A OH ASN 53.A OD1 no hydrogen 2.515 N/A LYS 126.A N GLY 122.A O no hydrogen 3.034 N/A LYS 126.A NZ SER 41.A O no hydrogen 3.193 N/A LYS 126.A NZ SER 44.A O no hydrogen 2.886 N/A LYS 126.A NZ SER 44.A OG no hydrogen 3.205 N/A ARG 127.A N GLU 123.A O no hydrogen 3.021 N/A TRP 128.A N ILE 124.A O no hydrogen 3.224 N/A ILE 129.A N TYR 125.A O no hydrogen 2.950 N/A ILE 130.A N LYS 126.A O no hydrogen 2.790 N/A LEU 131.A N ARG 127.A O no hydrogen 2.967 N/A GLY 132.A N TRP 128.A O no hydrogen 3.047 N/A LEU 133.A N ILE 129.A O no hydrogen 2.819 N/A ASN 134.A N ILE 130.A O no hydrogen 3.004 N/A LYS 135.A N LEU 131.A O no hydrogen 3.322 N/A ILE 136.A N GLY 132.A O no hydrogen 3.183 N/A VAL 137.A N LEU 133.A O no hydrogen 2.938 N/A ARG 138.A N ASN 134.A O no hydrogen 3.047 N/A MET 139.A N LYS 135.A O no hydrogen 2.836 N/A TYR 140.A N ILE 136.A O no hydrogen 2.890 N/A SER 141.A N ARG 138.A O no hydrogen 3.401 N/A SER 141.A OG GLU 170.A OE2 no hydrogen 2.724 N/A LEU 146.A N SER 144.A OG no hydrogen 3.177 N/A ASP 147.A N SER 144.A O no hydrogen 3.067 N/A ILE 148.A N ILE 145.A O no hydrogen 3.221 N/A GLN 150.A N ASN 181.A O no hydrogen 2.896 N/A GLN 150.A NE2 GLU 154.A O no hydrogen 3.024 N/A GLY 151.A N GLU 154.A OE1 no hydrogen 3.016 N/A GLU 154.A N GLY 151.A O no hydrogen 3.223 N/A TYR 159.A N PRO 155.A O no hydrogen 3.176 N/A TYR 159.A OH LEU 178.A O no hydrogen 2.595 N/A VAL 160.A N PHE 156.A O no hydrogen 2.858 N/A ASP 161.A N ARG 157.A O no hydrogen 3.021 N/A ARG 162.A N ASP 158.A O no hydrogen 3.150 N/A ARG 162.A NE GLU 154.A OE2 no hydrogen 2.799 N/A ARG 162.A NH2 ARG 149.A O no hydrogen 2.799 N/A ARG 162.A NH2 GLU 154.A OE1 no hydrogen 2.943 N/A ARG 162.A NH2 GLU 154.A OE2 no hydrogen 3.483 N/A PHE 163.A N TYR 159.A O no hydrogen 2.829 N/A TYR 164.A N VAL 160.A O no hydrogen 2.993 N/A LYS 165.A N ASP 161.A O no hydrogen 2.974 N/A THR 166.A N ARG 162.A O no hydrogen 2.963 N/A THR 166.A OG1 ARG 162.A O no hydrogen 2.949 N/A LEU 167.A N PHE 163.A O no hydrogen 3.015 N/A ARG 168.A N TYR 164.A O no hydrogen 3.120 N/A ALA 169.A N LYS 165.A O no hydrogen 3.250 N/A GLU 170.A N THR 166.A O no hydrogen 2.941 N/A GLN 171.A N LEU 167.A O no hydrogen 3.051 N/A ALA 172.A N ALA 169.A O no hydrogen 3.375 N/A LEU 178.A N THR 174.A O no hydrogen 2.934 N/A GLN 180.A N THR 176.A O no hydrogen 2.992 N/A ASN 181.A N LEU 177.A O no hydrogen 2.874 N/A ASN 181.A ND2 ILE 148.A O no hydrogen 3.026 N/A ALA 182.A N VAL 179.A O no hydrogen 3.189 N/A ASN 183.A N GLN 150.A OE1 no hydrogen 2.841 N/A ASN 183.A ND2 GLY 151.A O no hydrogen 2.911 N/A CYS 186.A N ASN 183.A OD1 no hydrogen 3.097 N/A CYS 186.A SG.B GLN 150.A OE1 no hydrogen 3.633 N/A CYS 186.A SG.B ASN 183.A OD1 no hydrogen 3.688 N/A LYS 187.A N ASN 183.A O no hydrogen 2.850 N/A LYS 187.A NZ GLN 180.A O no hydrogen 2.950 N/A LYS 187.A NZ GLN 180.A OE1 no hydrogen 3.254 N/A THR 188.A N PRO 184.A O no hydrogen 3.007 N/A THR 188.A OG1 PRO 184.A O no hydrogen 2.849 N/A ILE 189.A N ASP 185.A O no hydrogen 3.318 N/A LEU 190.A N CYS 186.A O no hydrogen 2.703 N/A LYS 191.A N LYS 187.A O no hydrogen 2.770 N/A ALA 192.A N THR 188.A O no hydrogen 3.088 N/A LEU 193.A N ILE 189.A O no hydrogen 2.964 N/A GLY 194.A N LEU 190.A O no hydrogen 3.067 N/A THR 198.A N GLU 201.A OE1 no hydrogen 3.121 N/A GLU 201.A N THR 198.A OG1 no hydrogen 3.087 N/A MET 202.A N THR 198.A O no hydrogen 2.972 N/A MET 203.A N LEU 199.A O no hydrogen 2.834 N/A THR 204.A N GLU 200.A O no hydrogen 2.909 N/A THR 204.A OG1 GLU 200.A O no hydrogen 2.871 N/A ALA 205.A N GLU 201.A O no hydrogen 3.005 N/A CYS 206.A N MET 202.A O no hydrogen 3.084 N/A CYS 206.A SG CYS 186.A O no hydrogen 3.544 N/A GLN 207.A N THR 204.A O no hydrogen 3.338 N/A