Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pdu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG THR 6.A OG1 no hydrogen 3.194 N/A THR 6.A N SER 3.A OG no hydrogen 3.288 N/A THR 6.A OG1 SER 3.A OG no hydrogen 3.194 N/A ALA 7.A N SER 3.A O no hydrogen 2.849 N/A LEU 8.A N LEU 4.A O no hydrogen 2.842 N/A VAL 9.A N ILE 5.A O no hydrogen 2.902 N/A ARG 10.A N THR 6.A O no hydrogen 2.976 N/A SER 11.A N ALA 7.A O no hydrogen 2.986 N/A SER 11.A OG ALA 7.A O no hydrogen 2.625 N/A HIS 12.A N LEU 8.A O no hydrogen 2.835 N/A VAL 13.A N VAL 9.A O no hydrogen 2.881 N/A ASP 14.A N ARG 10.A O no hydrogen 2.784 N/A THR 15.A N SER 11.A O no hydrogen 2.953 N/A THR 15.A N HIS 12.A O no hydrogen 3.032 N/A THR 15.A OG1 SER 11.A O no hydrogen 2.829 N/A THR 15.A OG1 HIS 12.A O no hydrogen 3.215 N/A THR 16.A N VAL 13.A O no hydrogen 3.210 N/A THR 16.A OG1 HIS 12.A O no hydrogen 2.651 N/A SER 20.A OG ASP 18.A OD2 no hydrogen 2.774 N/A CYS 21.A N ASP 18.A O no hydrogen 2.835 N/A CYS 21.A SG ASP 18.A OD1 no hydrogen 3.772 N/A CYS 21.A SG ASP 18.A OD2 no hydrogen 3.224 N/A LEU 22.A N PRO 19.A O no hydrogen 3.447 N/A ASP 23.A N GLY 102.A O no hydrogen 2.716 N/A SER 25.A N ASP 23.A OD1 no hydrogen 3.306 N/A SER 25.A OG ASP 23.A OD1 no hydrogen 3.125 N/A SER 25.A OG ASP 23.A OD2 no hydrogen 2.981 N/A TYR 27.A N TYR 24.A O no hydrogen 3.075 N/A SER 33.A N ASP 36.A OD2 no hydrogen 2.987 N/A ASP 36.A N SER 33.A OG no hydrogen 2.930 N/A LYS 37.A N SER 33.A O no hydrogen 3.050 N/A VAL 38.A N GLU 34.A O no hydrogen 3.253 N/A GLN 39.A N ALA 35.A O no hydrogen 2.978 N/A GLN 40.A N ASP 36.A O no hydrogen 2.799 N/A PHE 41.A N LYS 37.A O no hydrogen 3.218 N/A TYR 42.A N VAL 38.A O no hydrogen 2.930 N/A GLN 43.A N GLN 39.A O no hydrogen 3.031 N/A LEU 44.A N GLN 40.A O no hydrogen 2.869 N/A LEU 45.A N PHE 41.A O no hydrogen 2.846 N/A THR 46.A N TYR 42.A O no hydrogen 2.734 N/A THR 46.A OG1 TYR 42.A O no hydrogen 2.944 N/A THR 46.A OG1 GLN 43.A O no hydrogen 3.214 N/A SER 47.A N GLN 43.A O no hydrogen 2.999 N/A SER 47.A OG GLN 43.A O no hydrogen 2.907 N/A SER 47.A OG LEU 44.A O no hydrogen 3.509 N/A SER 48.A N LEU 44.A O no hydrogen 3.214 N/A SER 48.A OG LEU 44.A O no hydrogen 2.821 N/A VAL 49.A N LEU 45.A O no hydrogen 2.998 N/A ASP 50.A N THR 46.A O no hydrogen 2.995 N/A VAL 51.A N SER 47.A O no hydrogen 3.243 N/A ILE 52.A N SER 48.A O no hydrogen 2.838 N/A LYS 53.A N VAL 49.A O no hydrogen 2.751 N/A LYS 53.A NZ TYR 62.A OH no hydrogen 3.427 N/A GLN 54.A N ASP 50.A O no hydrogen 3.306 N/A GLN 54.A N VAL 51.A O no hydrogen 2.907 N/A PHE 55.A N VAL 51.A O no hydrogen 3.347 N/A ALA 56.A N ILE 52.A O no hydrogen 3.114 N/A GLU 57.A N LYS 53.A O no hydrogen 3.135 N/A LYS 58.A N PHE 55.A O no hydrogen 3.296 N/A ILE 59.A N ALA 56.A O no hydrogen 3.018 N/A TYR 62.A N ILE 59.A O no hydrogen 2.874 N/A TYR 62.A OH GLN 70.A O no hydrogen 2.972 N/A ASP 64.A N GLY 61.A O no hydrogen 3.238 N/A LEU 65.A N TYR 62.A O no hydrogen 2.986 N/A GLN 70.A N LEU 66.A O no hydrogen 2.979 N/A GLN 70.A NE2 LEU 65.A O no hydrogen 2.844 N/A GLU 71.A N PRO 67.A O no hydrogen 3.061 N/A LEU 72.A N GLU 68.A O no hydrogen 2.982 N/A LEU 73.A N ASP 69.A O no hydrogen 2.749 N/A PHE 74.A N GLN 70.A O no hydrogen 2.786 N/A GLN 75.A N GLU 71.A O no hydrogen 2.888 N/A GLN 75.A NE2 GLU 71.A OE1 no hydrogen 2.941 N/A SER 76.A N LEU 72.A O no hydrogen 3.012 N/A SER 76.A OG LEU 72.A O no hydrogen 2.893 N/A ALA 77.A N PHE 74.A O no hydrogen 3.167 N/A SER 78.A N PHE 74.A O no hydrogen 2.867 N/A SER 78.A OG GLN 75.A O no hydrogen 3.180 N/A LEU 81.A N ALA 77.A O no hydrogen 2.721 N/A PHE 82.A N SER 78.A O no hydrogen 2.918 N/A VAL 83.A N LEU 79.A O no hydrogen 2.859 N/A LEU 84.A N GLU 80.A O no hydrogen 2.714 N/A ARG 85.A N LEU 81.A O no hydrogen 2.923 N/A ARG 85.A NH2 THR 15.A OG1 no hydrogen 3.359 N/A LEU 86.A N PHE 82.A O no hydrogen 3.031 N/A ALA 87.A N VAL 83.A O no hydrogen 2.845 N/A TYR 88.A N LEU 84.A O no hydrogen 2.940 N/A TYR 88.A OH ILE 133.A O no hydrogen 2.623 N/A ARG 89.A N ARG 85.A O no hydrogen 3.115 N/A ARG 89.A NH2 PRO 17.A O no hydrogen 2.604 N/A ALA 90.A N LEU 86.A O no hydrogen 3.103 N/A LYS 96.A N ASP 94.A OD1 no hydrogen 2.643 N/A LEU 97.A N LEU 105.A O no hydrogen 2.872 N/A PHE 99.A N THR 103.A O no hydrogen 2.862 N/A CYS 100.A SG SER 48.A O no hydrogen 3.635 N/A ASN 101.A ND2 SER 47.A OG no hydrogen 2.757 N/A GLY 102.A N PHE 99.A O no hydrogen 2.620 N/A THR 103.A N ASN 101.A OD1 no hydrogen 2.981 N/A VAL 104.A N ASP 23.A O no hydrogen 3.133 N/A LEU 105.A N LEU 97.A O no hydrogen 3.083 N/A HIS 106.A N GLN 109.A OE1 no hydrogen 2.699 N/A HIS 106.A ND1 GLN 109.A OE1 no hydrogen 3.121 N/A ARG 107.A N THR 95.A O no hydrogen 2.729 N/A ARG 107.A NE LYS 96.A O no hydrogen 3.083 N/A ARG 107.A NH2 ARG 91.A O no hydrogen 2.762 N/A THR 108.A OG1 GLU 29.A OE1 no hydrogen 3.462 N/A GLN 109.A N HIS 106.A O no hydrogen 3.027 N/A GLN 109.A NE2 HIS 26.A O no hydrogen 3.156 N/A GLN 109.A NE2 TYR 27.A O no hydrogen 3.097 N/A GLN 109.A NE2 GLU 28.A O no hydrogen 3.662 N/A CYS 110.A N ARG 107.A O no hydrogen 3.119 N/A CYS 110.A SG HIS 106.A O no hydrogen 3.500 N/A LEU 111.A N ARG 107.A O no hydrogen 3.036 N/A SER 113.A OG CYS 110.A O no hydrogen 3.370 N/A PHE 114.A N CYS 110.A O no hydrogen 2.577 N/A GLY 115.A N LEU 111.A O no hydrogen 2.898 N/A TRP 117.A NE1 LEU 200.A O no hydrogen 2.948 N/A LEU 118.A N GLY 115.A O no hydrogen 3.192 N/A ASN 119.A ND2 GLU 116.A OE1 no hydrogen 3.035 N/A ASP 120.A N GLU 116.A O no hydrogen 3.461 N/A ILE 121.A N TRP 117.A O no hydrogen 2.989 N/A MET 122.A N LEU 118.A O no hydrogen 2.807 N/A GLU 123.A N ASN 119.A O no hydrogen 2.912 N/A PHE 124.A N ASP 120.A O no hydrogen 2.987 N/A SER 125.A N ILE 121.A O no hydrogen 2.819 N/A SER 125.A OG ALA 87.A O no hydrogen 2.631 N/A ARG 126.A N MET 122.A O no hydrogen 2.993 N/A SER 127.A N GLU 123.A O no hydrogen 3.192 N/A LEU 128.A N PHE 124.A O no hydrogen 2.958 N/A HIS 129.A N SER 125.A O no hydrogen 3.156 N/A HIS 129.A NE2 ALA 90.A O no hydrogen 2.986 N/A ASN 130.A N ARG 126.A O no hydrogen 2.942 N/A ASN 130.A N SER 127.A O no hydrogen 3.242 N/A LEU 131.A N SER 127.A O no hydrogen 3.317 N/A GLU 132.A N LEU 128.A O no hydrogen 3.070 N/A GLU 132.A N HIS 129.A O no hydrogen 3.156 N/A ALA 137.A N ASP 134.A OD1 no hydrogen 2.726 N/A PHE 138.A N ASP 134.A O no hydrogen 2.892 N/A ALA 139.A N ILE 135.A O no hydrogen 2.964 N/A CYS 140.A N SER 136.A O no hydrogen 3.344 N/A CYS 140.A SG SER 136.A O no hydrogen 3.386 N/A LEU 141.A N ALA 137.A O no hydrogen 2.926 N/A CYS 142.A N PHE 138.A O no hydrogen 2.831 N/A CYS 142.A SG PHE 138.A O no hydrogen 3.550 N/A ALA 143.A N ALA 139.A O no hydrogen 2.990 N/A LEU 144.A N CYS 140.A O no hydrogen 2.814 N/A THR 145.A N CYS 142.A O no hydrogen 2.855 N/A THR 145.A OG1 LEU 141.A O no hydrogen 2.818 N/A LEU 146.A N CYS 142.A O no hydrogen 3.177 N/A ILE 147.A N ALA 143.A O no hydrogen 2.755 N/A ARG 150.A NH2 GLU 80.A OE2 no hydrogen 2.984 N/A ARG 154.A N ASP 69.A OD1 no hydrogen 2.630 N/A ARG 154.A NH1 ARG 154.A O no hydrogen 3.567 N/A GLU 155.A N ASP 69.A OD2 no hydrogen 3.067 N/A LYS 158.A NZ ASP 64.A O no hydrogen 3.358 N/A VAL 159.A N GLU 155.A O no hydrogen 3.136 N/A GLU 160.A N PRO 156.A O no hydrogen 2.857 N/A GLN 161.A N LYS 157.A O no hydrogen 3.072 N/A LEU 162.A N LYS 158.A O no hydrogen 3.375 N/A GLN 163.A N VAL 159.A O no hydrogen 2.935 N/A GLN 163.A NE2 ILE 147.A O no hydrogen 3.008 N/A MET 164.A N GLU 160.A O no hydrogen 2.823 N/A LYS 165.A N GLN 161.A O no hydrogen 2.969 N/A ILE 166.A N LEU 162.A O no hydrogen 2.933 N/A ILE 167.A N GLN 163.A O no hydrogen 2.800 N/A GLY 168.A N MET 164.A O no hydrogen 2.769 N/A SER 169.A N LYS 165.A O no hydrogen 3.014 N/A LEU 170.A N ILE 166.A O no hydrogen 2.991 N/A ARG 171.A N ILE 167.A O no hydrogen 2.722 N/A ASP 172.A N GLY 168.A O no hydrogen 2.870 N/A HIS 173.A N SER 169.A O no hydrogen 3.077 N/A HIS 173.A NE2 ASP 134.A OD2 no hydrogen 3.074 N/A VAL 174.A N LEU 170.A O no hydrogen 2.968 N/A THR 175.A N ARG 171.A O no hydrogen 2.997 N/A THR 175.A OG1 ARG 171.A O no hydrogen 3.042 N/A TYR 176.A N ASP 172.A O no hydrogen 3.353 N/A ASN 177.A N VAL 174.A O no hydrogen 3.276 N/A ALA 180.A N ASN 177.A O no hydrogen 2.998 N/A ALA 180.A N ASN 177.A OD1 no hydrogen 2.846 N/A GLN 181.A N ASN 177.A O no hydrogen 3.342 N/A GLN 181.A NE2 VAL 174.A O no hydrogen 2.898 N/A LYS 183.A N ALA 180.A O no hydrogen 3.079 N/A LYS 183.A NZ LEU 131.A O no hydrogen 3.395 N/A TYR 186.A OH GLU 132.A O no hydrogen 2.449 N/A SER 188.A N HIS 185.A ND1 no hydrogen 2.972 N/A ARG 189.A N HIS 185.A O no hydrogen 3.223 N/A LEU 190.A N TYR 186.A O no hydrogen 2.827 N/A LEU 191.A N PHE 187.A O no hydrogen 3.118 N/A GLY 192.A N SER 188.A O no hydrogen 2.999 N/A LYS 193.A N LEU 190.A O no hydrogen 2.933 N/A LYS 193.A NZ SER 127.A O no hydrogen 3.204 N/A LEU 194.A N LEU 191.A O no hydrogen 3.031 N/A LEU 197.A N LYS 193.A O no hydrogen 3.052 N/A ARG 198.A N LEU 194.A O no hydrogen 2.888 N/A ARG 198.A NE GLU 80.A OE1 no hydrogen 2.874 N/A SER 199.A N PRO 195.A O no hydrogen 3.001 N/A SER 199.A OG PRO 195.A O no hydrogen 3.347 N/A LEU 200.A N GLU 196.A O no hydrogen 2.697 N/A SER 201.A N LEU 197.A O no hydrogen 2.765 N/A VAL 202.A N ARG 198.A O no hydrogen 2.980 N/A GLN 203.A N SER 199.A O no hydrogen 3.270 N/A GLN 203.A NE2 ASP 120.A OD2 no hydrogen 2.534 N/A GLY 204.A N SER 201.A O no hydrogen 2.772 N/A LEU 205.A N SER 201.A O no hydrogen 3.098 N/A GLN 206.A N VAL 202.A O no hydrogen 3.258 N/A ARG 207.A N GLN 203.A O no hydrogen 3.328 N/A ARG 207.A NE SER 113.A O no hydrogen 2.666 N/A ARG 207.A NH2 ARG 112.A O no hydrogen 3.560 N/A ARG 207.A NH2 SER 113.A O no hydrogen 3.565 N/A ILE 208.A N GLY 204.A O no hydrogen 2.785 N/A PHE 209.A N LEU 205.A O no hydrogen 2.631 N/A TYR 210.A N GLN 206.A O no hydrogen 2.932 N/A LEU 211.A N ARG 207.A O no hydrogen 3.086 N/A LYS 212.A N ILE 208.A O no hydrogen 2.948 N/A LEU 213.A N PHE 209.A O no hydrogen 3.079 N/A GLU 214.A N TYR 210.A O no hydrogen 3.019 N/A ASP 215.A N LEU 211.A O no hydrogen 3.098 N/A GLU 224.A N PRO 220.A O no hydrogen 3.040 N/A ASN 225.A N ALA 221.A O no hydrogen 2.730 N/A MET 226.A N ILE 223.A O no hydrogen 3.309 N/A PHE 227.A N GLU 224.A O no hydrogen 3.057 N/A VAL 228.A N ASN 225.A O no hydrogen 3.046 N/A