Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pkd_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A ND2 ASP 85.A OD1 no hydrogen 3.175 N/A HIS 5.A NE2 LYS 55.A O no hydrogen 2.725 N/A THR 6.A N ASN 4.A OD1 no hydrogen 2.797 N/A THR 6.A OG1 SER 86.A OG no hydrogen 2.546 N/A ILE 7.A N VAL 52.A O no hydrogen 2.937 N/A TYR 8.A N GLN 80.A O no hydrogen 2.607 N/A TYR 8.A OH GLN 49.A OE1 no hydrogen 2.677 N/A ILE 9.A N ALA 50.A O no hydrogen 2.862 N/A ASN 10.A N ARG 78.A O no hydrogen 2.954 N/A ASN 11.A ND2 PRO 76.A O no hydrogen 2.785 N/A LEU 12.A N GLY 48.A O no hydrogen 2.946 N/A ASN 13.A ND2 TYR 73.A O no hydrogen 2.988 N/A LYS 15.A N ASN 13.A OD1 no hydrogen 3.138 N/A LEU 21.A N LYS 17.A O no hydrogen 2.931 N/A LYS 22.A N LYS 18.A O no hydrogen 2.933 N/A LYS 23.A N ASP 19.A O no hydrogen 2.841 N/A SER 24.A N GLU 20.A O no hydrogen 2.868 N/A SER 24.A OG GLU 20.A O no hydrogen 3.172 N/A SER 24.A OG TYR 73.A OH no hydrogen 2.434 N/A LEU 25.A N LEU 21.A O no hydrogen 2.957 N/A TYR 26.A N LYS 22.A O no hydrogen 2.995 N/A ALA 27.A N LYS 23.A O no hydrogen 3.090 N/A ILE 28.A N SER 24.A O no hydrogen 3.211 N/A PHE 29.A N LEU 25.A O no hydrogen 2.891 N/A SER 30.A N TYR 26.A O no hydrogen 2.977 N/A SER 30.A OG TYR 26.A O no hydrogen 2.714 N/A SER 30.A OG ALA 27.A O no hydrogen 3.362 N/A GLN 31.A NE2 ILE 28.A O no hydrogen 3.059 N/A PHE 32.A N PHE 29.A O no hydrogen 3.363 N/A GLY 33.A N SER 30.A O no hydrogen 2.805 N/A GLN 34.A NE2 ILE 35.A O no hydrogen 3.649 N/A LEU 36.A N ILE 53.A O no hydrogen 2.787 N/A ASP 37.A N ILE 53.A O no hydrogen 3.442 N/A ILE 38.A N ASP 37.A OD1 no hydrogen 2.765 N/A LEU 39.A N PHE 51.A O no hydrogen 2.867 N/A SER 41.A OG SER 43.A OG no hydrogen 3.044 N/A ARG 42.A NH2 GLU 14.A O no hydrogen 3.078 N/A SER 43.A N SER 41.A OG no hydrogen 3.190 N/A SER 43.A OG SER 41.A OG no hydrogen 3.044 N/A MET 46.A N SER 43.A OG no hydrogen 3.413 N/A ARG 47.A N SER 43.A O no hydrogen 2.862 N/A ARG 47.A NE ARG 42.A O no hydrogen 3.252 N/A ARG 47.A NE SER 43.A O no hydrogen 2.853 N/A GLN 49.A N MET 46.A O no hydrogen 3.297 N/A GLN 49.A NE2 LYS 45.A O no hydrogen 2.790 N/A GLN 49.A NE2 ARG 47.A O no hydrogen 2.713 N/A ALA 50.A N ILE 9.A O no hydrogen 2.931 N/A PHE 51.A N LEU 39.A O no hydrogen 3.143 N/A VAL 52.A N ILE 7.A O no hydrogen 3.037 N/A ILE 53.A N ASP 37.A O no hydrogen 2.716 N/A PHE 54.A N HIS 5.A O no hydrogen 3.031 N/A LYS 55.A N GLN 34.A O no hydrogen 3.002 N/A SER 59.A N GLU 56.A O no hydrogen 3.225 N/A SER 59.A OG PHE 32.A O no hydrogen 2.883 N/A ALA 60.A N GLU 56.A O no hydrogen 3.373 N/A THR 61.A N VAL 57.A O no hydrogen 2.824 N/A THR 61.A OG1 VAL 57.A O no hydrogen 3.233 N/A THR 61.A OG1 TYR 81.A OH no hydrogen 2.844 N/A ASN 62.A N SER 58.A O no hydrogen 2.966 N/A ALA 63.A N SER 59.A O no hydrogen 2.657 N/A LEU 64.A N ALA 60.A O no hydrogen 2.823 N/A ARG 65.A N THR 61.A O no hydrogen 3.079 N/A SER 66.A N ASN 62.A O no hydrogen 3.087 N/A SER 66.A OG ASN 62.A O no hydrogen 2.710 N/A MET 67.A N ALA 63.A O no hydrogen 2.929 N/A GLN 68.A N LEU 64.A O no hydrogen 3.247 N/A GLN 68.A NE2 ILE 79.A O no hydrogen 2.755 N/A GLY 69.A N MET 77.A O no hydrogen 2.954 N/A PHE 70.A N MET 67.A O no hydrogen 2.741 N/A PHE 72.A N LYS 75.A O no hydrogen 2.792 N/A TYR 73.A OH SER 24.A OG no hydrogen 2.434 N/A MET 77.A N PHE 70.A O no hydrogen 2.907 N/A ARG 78.A N ASN 10.A O no hydrogen 3.173 N/A ILE 79.A N GLN 68.A OE1 no hydrogen 2.947 N/A GLN 80.A N TYR 8.A O no hydrogen 2.840 N/A TYR 81.A OH THR 61.A OG1 no hydrogen 2.844 N/A ALA 82.A N THR 6.A O no hydrogen 2.942 N/A SER 86.A OG THR 6.A OG1 no hydrogen 2.546 N/A ALA 90.A N SER 86.A O no hydrogen 2.989 N/A LYS 91.A N ASP 87.A O no hydrogen 2.909 N/A MET 92.A N ILE 88.A O no hydrogen 3.347 N/A LYS 93.A N ILE 89.A O no hydrogen 2.937 N/A LYS 93.A NZ ASP 85.A OD2 no hydrogen 2.439 N/A GLY 94.A N LYS 91.A O no hydrogen 3.246 N/A THR 95.A N ALA 90.A O no hydrogen 2.710 N/A THR 95.A OG1 ALA 90.A O no hydrogen 2.806 N/A THR 100.A N GLU 103.A OE1 no hydrogen 3.050 N/A GLU 102.A N THR 100.A OG1 no hydrogen 3.177 N/A GLU 103.A N THR 100.A O no hydrogen 3.223 N/A GLU 103.A N THR 100.A OG1 no hydrogen 3.045 N/A ARG 104.A N THR 100.A O no hydrogen 2.847 N/A MET 105.A N ARG 101.A O no hydrogen 3.238 N/A GLU 106.A N GLU 102.A O no hydrogen 3.398 N/A ARG 107.A N GLU 103.A O no hydrogen 3.022 N/A LYS 108.A N ARG 104.A O no hydrogen 3.173 N/A ARG 109.A N MET 105.A O no hydrogen 3.275 N/A ARG 110.A N GLU 106.A O no hydrogen 3.221 N/A GLU 111.A N ARG 107.A O no hydrogen 3.144 N/A GLU 111.A N LYS 108.A O no hydrogen 3.296 N/A LYS 112.A N LYS 108.A O no hydrogen 3.134 N/A ILE 113.A N ARG 109.A O no hydrogen 3.060 N/A GLU 114.A N ARG 110.A O no hydrogen 3.289 N/A ARG 115.A N GLU 111.A O no hydrogen 2.814 N/A ARG 116.A N LYS 112.A O no hydrogen 2.761 N/A ARG 116.A NH1 GLU 119.A OE1 no hydrogen 2.761 N/A GLN 117.A N ILE 113.A O no hydrogen 2.982 N/A GLN 118.A N GLU 114.A O no hydrogen 3.073 N/A GLU 119.A N ARG 115.A O no hydrogen 3.050 N/A VAL 120.A N ARG 116.A O no hydrogen 2.933 N/A GLU 121.A N GLN 117.A O no hydrogen 2.956 N/A THR 122.A N GLN 118.A O no hydrogen 3.093 N/A THR 122.A OG1 GLN 118.A O no hydrogen 2.634 N/A GLU 123.A N GLU 119.A O no hydrogen 3.005 N/A LEU 124.A N VAL 120.A O no hydrogen 3.005 N/A MET 126.A N GLU 123.A O no hydrogen 2.764 N/A TRP 127.A N LEU 124.A O no hydrogen 3.189 N/A ASN 131.A N ASP 128.A O no hydrogen 3.005 N/A ASP 132.A N PRO 129.A O no hydrogen 3.296 N/A ASN 134.A N ASP 132.A OD1 no hydrogen 3.244 N/A ALA 135.A N ASP 132.A O no hydrogen 3.238 N/A GLN 136.A NE2 PRO 133.A O no hydrogen 3.053 N/A ASP 138.A N GLU 188.A OE2 no hydrogen 2.906 N/A PHE 140.A N ASP 138.A OD1 no hydrogen 2.887 N/A LYS 141.A N ASP 138.A O no hydrogen 2.904 N/A LYS 141.A NZ GLU 190.A O no hydrogen 2.883 N/A THR 142.A N ALA 139.A O no hydrogen 2.972 N/A THR 142.A OG1 ASP 138.A O no hydrogen 2.621 N/A LEU 143.A N ILE 187.A O no hydrogen 2.776 N/A PHE 144.A N ASP 215.A O no hydrogen 2.750 N/A VAL 145.A N ALA 185.A O no hydrogen 2.884 N/A ALA 146.A N LEU 213.A O no hydrogen 2.898 N/A VAL 148.A N GLY 183.A O no hydrogen 2.890 N/A ASN 149.A ND2 ASP 208.A O no hydrogen 2.899 N/A ASP 151.A N ASN 149.A OD1 no hydrogen 2.713 N/A THR 152.A N ASN 149.A O no hydrogen 3.138 N/A THR 152.A OG1 ASP 208.A OD2 no hydrogen 2.471 N/A LYS 156.A N THR 153.A OG1 no hydrogen 2.975 N/A LEU 157.A N THR 153.A O no hydrogen 3.224 N/A ARG 158.A N GLU 154.A O no hydrogen 2.834 N/A ARG 158.A NE GLU 154.A OE2 no hydrogen 3.399 N/A ARG 158.A NH2 GLU 154.A OE2 no hydrogen 3.424 N/A ARG 159.A N SER 155.A O no hydrogen 2.783 N/A GLU 160.A N LYS 156.A O no hydrogen 2.885 N/A PHE 161.A N LEU 157.A O no hydrogen 3.147 N/A GLU 162.A N ARG 158.A O no hydrogen 2.947 N/A GLY 165.A N GLU 162.A O no hydrogen 2.896 N/A LYS 168.A N GLU 188.A O no hydrogen 2.715 N/A ARG 169.A N GLU 188.A O no hydrogen 3.139 N/A ARG 169.A NH1 ASN 134.A O no hydrogen 3.017 N/A ARG 169.A NH2 ASN 134.A O no hydrogen 3.130 N/A HIS 171.A N PHE 186.A O no hydrogen 2.900 N/A VAL 173.A N TYR 184.A O no hydrogen 2.951 N/A SER 175.A N LYS 180.A O no hydrogen 2.943 N/A SER 175.A OG SER 178.A OG no hydrogen 3.166 N/A ARG 177.A N SER 175.A OG no hydrogen 2.951 N/A SER 178.A N SER 175.A OG no hydrogen 3.286 N/A SER 178.A OG SER 175.A OG no hydrogen 3.166 N/A GLY 179.A N SER 175.A O no hydrogen 2.874 N/A ARG 182.A N VAL 173.A O no hydrogen 2.768 N/A ALA 185.A N VAL 145.A O no hydrogen 2.781 N/A PHE 186.A N HIS 171.A O no hydrogen 2.993 N/A ILE 187.A N LEU 143.A O no hydrogen 2.990 N/A GLU 188.A N ARG 169.A O no hydrogen 2.824 N/A TYR 189.A N LYS 141.A O no hydrogen 2.803 N/A TYR 189.A OH PHE 161.A O no hydrogen 2.706 N/A GLU 190.A N PRO 166.A O no hydrogen 3.115 N/A HIS 191.A ND1 ASP 194.A OD2 no hydrogen 3.258 N/A ASP 194.A N HIS 191.A O no hydrogen 3.020 N/A MET 195.A N HIS 191.A O no hydrogen 3.362 N/A HIS 196.A N GLU 192.A O no hydrogen 3.029 N/A SER 197.A N ARG 193.A O no hydrogen 3.126 N/A ALA 198.A N ASP 194.A O no hydrogen 2.970 N/A TYR 199.A N MET 195.A O no hydrogen 2.921 N/A LYS 200.A N HIS 196.A O no hydrogen 3.117 N/A HIS 201.A N SER 197.A O no hydrogen 3.094 N/A HIS 201.A N ALA 198.A O no hydrogen 3.261 N/A HIS 201.A ND1 SER 197.A O no hydrogen 3.114 N/A ALA 202.A N ALA 198.A O no hydrogen 2.779 N/A GLY 204.A N VAL 212.A O no hydrogen 2.924 N/A LYS 205.A N ALA 202.A O no hydrogen 2.856 N/A LYS 205.A NZ GLU 160.A OE1 no hydrogen 2.708 N/A ILE 207.A N ARG 210.A O no hydrogen 3.158 N/A ARG 210.A N ILE 207.A O no hydrogen 3.103 N/A VAL 212.A N LYS 205.A O no hydrogen 2.864 N/A LEU 213.A N ALA 146.A O no hydrogen 2.954 N/A VAL 214.A N ASP 203.A OD1 no hydrogen 3.086 N/A ASP 215.A N PHE 144.A O no hydrogen 2.803 N/A VAL 216.A N ASP 215.A OD1 no hydrogen 2.760 N/A GLU 217.A N THR 142.A O no hydrogen 3.252 N/A ARG 218.A NE ASP 215.A OD2 no hydrogen 2.992 N/A ARG 218.A NH2 ASP 215.A OD1 no hydrogen 2.980 N/A ARG 220.A NE GLU 217.A OE2 no hydrogen 2.615 N/A ARG 220.A NH1 GLY 137.A O no hydrogen 3.325 N/A ARG 220.A NH2 GLN 136.A O no hydrogen 3.291 N/A ARG 220.A NH2 GLU 217.A OE1 no hydrogen 2.882 N/A ARG 220.A NH2 GLU 217.A OE2 no hydrogen 3.409 N/A THR 221.A N ARG 218.A O no hydrogen 3.252 N/A THR 221.A OG1 GLU 217.A O no hydrogen 2.703 N/A VAL 222.A N ARG 218.A O no hydrogen 3.070 N/A TRP 225.A N VAL 222.A O no hydrogen 3.160 N/A ARG 226.A NE GLY 224.A O no hydrogen 3.075 N/A ARG 226.A NE TRP 225.A O no hydrogen 3.112 N/A ARG 228.A NH2 LEU 234.A O no hydrogen 2.986 N/A ARG 228.A NH2 GLY 235.A O no hydrogen 3.150 N/A LEU 230.A N PRO 227.A O no hydrogen 3.036 N/A GLY 231.A N ARG 228.A O no hydrogen 2.969 N/A GLY 232.A N PRO 227.A O no hydrogen 3.076 N/A GLY 233.A N ARG 226.A O no hydrogen 3.002 N/A