Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pmq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ILE 195.A O no hydrogen 3.526 N/A LEU 2.A N ILE 195.A O no hydrogen 2.846 N/A GLY 3.A N SER 1.A OG no hydrogen 3.060 N/A LEU 5.A N ASN 193.A O no hydrogen 2.841 N/A LEU 6.A N GLY 25.A O no hydrogen 3.060 N/A ASP 7.A N ASP 191.A O no hydrogen 3.044 N/A ALA 15.A N ASP 52.A OD2 no hydrogen 2.816 N/A GLN 17.A N PRO 14.A O no hydrogen 2.883 N/A ILE 18.A N PRO 14.A O no hydrogen 3.258 N/A ARG 19.A N ALA 15.A O no hydrogen 2.916 N/A ALA 20.A N SER 16.A O no hydrogen 2.901 N/A ALA 21.A N GLN 17.A O no hydrogen 2.982 N/A ALA 21.A N ILE 18.A O no hydrogen 3.156 N/A GLY 22.A N ARG 19.A O no hydrogen 2.951 N/A ALA 23.A N ILE 18.A O no hydrogen 3.431 N/A VAL 24.A N THR 4.A O no hydrogen 2.780 N/A ALA 26.A N LYS 59.A O no hydrogen 2.968 N/A ILE 27.A N LEU 6.A O no hydrogen 2.869 N/A ARG 28.A N VAL 61.A O no hydrogen 2.762 N/A ARG 28.A NE GLU 49.A OE2 no hydrogen 2.677 N/A ARG 28.A NH1 GLY 42.A O no hydrogen 2.919 N/A ARG 28.A NH2 GLY 42.A O no hydrogen 2.863 N/A ARG 28.A NH2 GLU 49.A OE1 no hydrogen 2.807 N/A ARG 28.A NH2 GLU 49.A OE2 no hydrogen 3.425 N/A VAL 30.A N CYS 63.A O no hydrogen 2.853 N/A ARG 33.A NH1 LYS 43.A O no hydrogen 2.956 N/A ARG 34.A NH1 TYR 66.A O no hydrogen 2.871 N/A GLY 37.A N ARG 34.A O no hydrogen 2.778 N/A MET 40.A N GLY 37.A O no hydrogen 2.860 N/A LEU 41.A N TRP 39.A O no hydrogen 2.906 N/A GLY 42.A N ALA 9.A O no hydrogen 2.804 N/A LYS 43.A N MET 40.A O no hydrogen 2.873 N/A LYS 43.A NZ GLN 65.A O no hydrogen 2.871 N/A ILE 45.A N TYR 29.A O no hydrogen 2.817 N/A GLN 46.A NE2 PRO 44.A O no hydrogen 3.307 N/A ALA 50.A N GLN 46.A O no hydrogen 3.109 N/A ARG 51.A N LEU 47.A O no hydrogen 2.887 N/A ASP 52.A N SER 48.A O no hydrogen 3.057 N/A LEU 53.A N GLU 49.A O no hydrogen 2.881 N/A SER 54.A N ALA 50.A O no hydrogen 2.963 N/A SER 54.A OG.A ALA 50.A O no hydrogen 3.385 N/A SER 54.A OG.B ALA 50.A O no hydrogen 3.005 N/A SER 54.A OG.B ARG 51.A O no hydrogen 3.312 N/A GLY 55.A N ARG 51.A O no hydrogen 2.845 N/A ASN 56.A N ASP 52.A O no hydrogen 3.216 N/A ASN 56.A N LEU 53.A O no hydrogen 3.130 N/A ASN 56.A ND2 ASP 52.A O no hydrogen 2.830 N/A GLY 57.A N SER 54.A O no hydrogen 2.972 N/A LEU 58.A N LEU 53.A O no hydrogen 2.944 N/A LYS 59.A N VAL 24.A O no hydrogen 2.808 N/A LYS 59.A NZ ALA 204.A O no hydrogen 2.829 N/A LYS 59.A NZ ALA 204.A OXT no hydrogen 3.440 N/A VAL 61.A N ALA 26.A O no hydrogen 3.054 N/A SER 62.A OG HIS 92.A ND1 no hydrogen 2.705 N/A CYS 63.A N ARG 28.A O no hydrogen 2.906 N/A TYR 64.A N TYR 104.A O no hydrogen 2.759 N/A TYR 64.A OH HIS 84.A ND1 no hydrogen 2.691 N/A GLN 65.A N SER 31.A OG no hydrogen 2.834 N/A GLN 65.A NE2 GLY 67.A O no hydrogen 3.086 N/A GLN 65.A NE2 ASP 108.A OD2 no hydrogen 2.884 N/A TYR 66.A N ASP 73.A OD2 no hydrogen 2.969 N/A GLY 67.A N ASP 73.A OD1 no hydrogen 2.794 N/A LYS 68.A N THR 71.A OG1 no hydrogen 3.151 N/A LYS 68.A NZ ASP 108.A OD2 no hydrogen 2.886 N/A THR 71.A N LYS 68.A O no hydrogen 3.022 N/A THR 71.A OG1 LYS 68.A O no hydrogen 3.034 N/A ALA 72.A N GLY 69.A O no hydrogen 2.941 N/A TRP 74.A NE1 ASP 109.A OD2 no hydrogen 2.870 N/A LEU 75.A N ALA 72.A O no hydrogen 3.255 N/A GLY 77.A N TRP 74.A O no hydrogen 3.105 N/A ALA 80.A N GLY 76.A O no hydrogen 3.344 N/A GLY 81.A N GLY 77.A O no hydrogen 2.874 N/A VAL 82.A N ALA 78.A O no hydrogen 3.173 N/A GLN 83.A N SER 79.A O no hydrogen 3.461 N/A HIS 84.A N ALA 80.A O no hydrogen 2.975 N/A HIS 84.A ND1 TYR 64.A OH no hydrogen 2.691 N/A ALA 85.A N GLY 81.A O no hydrogen 2.819 N/A ARG 86.A N VAL 82.A O no hydrogen 2.993 N/A ARG 87.A N GLN 83.A O no hydrogen 3.320 N/A ARG 87.A NE ASP 32.A OD1 no hydrogen 3.418 N/A ARG 87.A NE ASP 32.A OD2 no hydrogen 2.794 N/A ARG 87.A NH1 GLU 90.A OE1 no hydrogen 2.836 N/A ARG 87.A NH2 ASP 32.A OD1 no hydrogen 2.882 N/A GLY 88.A N HIS 84.A O no hydrogen 2.897 N/A SER 89.A N ALA 85.A O no hydrogen 2.928 N/A GLU 90.A N ARG 86.A O no hydrogen 3.012 N/A LEU 91.A N ARG 87.A O no hydrogen 2.874 N/A HIS 92.A N GLY 88.A O no hydrogen 2.811 N/A HIS 92.A ND1 SER 62.A OG no hydrogen 2.705 N/A HIS 92.A NE2 PRO 98.A O no hydrogen 2.755 N/A ALA 93.A N SER 89.A O no hydrogen 2.978 N/A ALA 94.A N GLU 90.A O no hydrogen 2.944 N/A ALA 95.A N LEU 91.A O no hydrogen 3.145 N/A ALA 95.A N HIS 92.A O no hydrogen 3.190 N/A GLY 96.A N ALA 93.A O no hydrogen 2.963 N/A GLY 97.A N HIS 92.A O no hydrogen 2.882 N/A ALA 101.A N PRO 98.A O no hydrogen 3.054 N/A ILE 103.A N ARG 135.A O no hydrogen 2.894 N/A TYR 104.A N SER 62.A O no hydrogen 2.881 N/A TYR 104.A OH PHE 200.A O no hydrogen 2.666 N/A ALA 105.A N GLY 137.A O no hydrogen 2.843 N/A SER 106.A N TYR 64.A O no hydrogen 2.978 N/A SER 106.A OG.A TYR 64.A O no hydrogen 2.760 N/A SER 106.A OG.B GLN 65.A OE1 no hydrogen 3.149 N/A ILE 107.A N TYR 139.A O no hydrogen 2.833 N/A SER 112.A N GLN 115.A OE1 no hydrogen 3.037 N/A GLN 115.A N SER 112.A OG no hydrogen 3.049 N/A TYR 116.A N SER 112.A O no hydrogen 2.973 N/A TYR 116.A OH ASP 151.A OD2 no hydrogen 2.684 N/A LYS 117.A N TYR 113.A O no hydrogen 2.875 N/A ASN 118.A N GLU 114.A O no hydrogen 2.951 N/A ASN 118.A ND2 GLU 114.A OE2 no hydrogen 2.789 N/A GLN 119.A N GLN 115.A O no hydrogen 2.867 N/A GLN 119.A NE2 LEU 75.A O no hydrogen 2.872 N/A ILE 120.A N GLN 115.A O no hydrogen 3.132 N/A VAL 121.A N TYR 116.A O no hydrogen 2.778 N/A TYR 123.A N GLN 119.A O no hydrogen 3.017 N/A LEU 124.A N ILE 120.A O no hydrogen 2.801 N/A ARG 125.A N VAL 121.A O no hydrogen 2.843 N/A SER 126.A N PRO 122.A O no hydrogen 2.955 N/A SER 126.A OG ALA 78.A O no hydrogen 2.649 N/A SER 126.A OG PRO 122.A O no hydrogen 3.344 N/A TRP 127.A N TYR 123.A O no hydrogen 3.163 N/A TRP 127.A NE1 TYR 123.A OH no hydrogen 3.033 N/A GLU 128.A N LEU 124.A O no hydrogen 2.983 N/A SER 129.A N ARG 125.A O no hydrogen 2.858 N/A VAL 130.A N SER 126.A O no hydrogen 2.998 N/A VAL 130.A N TRP 127.A O no hydrogen 3.088 N/A ILE 131.A N TRP 127.A O no hydrogen 2.954 N/A HIS 133.A ND1 GLU 128.A OE2 no hydrogen 2.733 N/A ARG 135.A N GLY 132.A O no hydrogen 3.043 N/A ARG 135.A NE ALA 101.A O no hydrogen 2.842 N/A ARG 135.A NH2 ALA 101.A O no hydrogen 3.019 N/A THR 136.A N HIS 133.A O no hydrogen 3.130 N/A THR 136.A OG1 GLY 132.A O no hydrogen 2.864 N/A GLY 137.A N ILE 103.A O no hydrogen 2.815 N/A VAL 138.A N TYR 156.A O no hydrogen 2.804 N/A TYR 139.A N ALA 105.A O no hydrogen 2.947 N/A TYR 139.A OH GLN 177.A OE1 no hydrogen 2.667 N/A ALA 140.A N TRP 158.A O no hydrogen 3.044 N/A ASN 141.A ND2 TRP 162.A O no hydrogen 2.973 N/A SER 142.A N SER 164.A OG no hydrogen 2.778 N/A SER 142.A OG SER 164.A OG no hydrogen 3.274 N/A THR 144.A N ASN 141.A OD1 no hydrogen 2.787 N/A THR 144.A OG1 ASN 141.A OD1 no hydrogen 2.964 N/A ILE 145.A N ASN 141.A O no hydrogen 2.950 N/A ASP 146.A N SER 142.A O no hydrogen 2.930 N/A TRP 147.A N LYS 143.A O no hydrogen 3.070 N/A ALA 148.A N THR 144.A O no hydrogen 2.952 N/A VAL 149.A N ILE 145.A O no hydrogen 2.804 N/A ASN 150.A N ASP 146.A O no hydrogen 2.889 N/A ASP 151.A N TRP 147.A O no hydrogen 2.994 N/A GLY 152.A N VAL 149.A O no hydrogen 3.040 N/A LEU 153.A N ALA 148.A O no hydrogen 2.836 N/A GLY 154.A N GLU 128.A OE2 no hydrogen 2.834 N/A SER 155.A N THR 136.A O no hydrogen 2.790 N/A SER 155.A OG HIS 133.A O no hydrogen 2.780 N/A TYR 156.A N THR 136.A O no hydrogen 3.363 N/A PHE 157.A N HIS 174.A ND1 no hydrogen 2.987 N/A TRP 158.A N VAL 138.A O no hydrogen 2.843 N/A TRP 158.A NE1 ASN 193.A OD1 no hydrogen 2.806 N/A GLN 159.A N LEU 175.A O no hydrogen 2.900 N/A GLN 159.A NE2 ASN 161.A OD1 no hydrogen 3.320 N/A GLN 159.A NE2 TYR 168.A O no hydrogen 2.857 N/A HIS 160.A N ALA 140.A O no hydrogen 2.916 N/A HIS 160.A NE2 ILE 107.A O no hydrogen 2.943 N/A TRP 162.A N HIS 160.A ND1 no hydrogen 3.140 N/A SER 164.A N ASN 161.A O no hydrogen 3.388 N/A SER 164.A OG SER 142.A OG no hydrogen 3.274 N/A SER 164.A OG HIS 160.A O no hydrogen 2.752 N/A TYR 168.A N PRO 165.A O no hydrogen 3.195 N/A THR 169.A OG1 HIS 176.A ND1 no hydrogen 3.105 N/A HIS 170.A N GLN 159.A OE1 no hydrogen 2.781 N/A HIS 170.A NE2 ASP 146.A OD1 no hydrogen 2.645 N/A ALA 172.A N HIS 170.A ND1 no hydrogen 2.896 N/A ALA 173.A N HIS 170.A O no hydrogen 3.075 N/A HIS 174.A N PHE 157.A O no hydrogen 2.792 N/A LEU 175.A N PHE 157.A O no hydrogen 3.296 N/A HIS 176.A N GLN 194.A O no hydrogen 2.884 N/A HIS 176.A NE2 ASN 161.A OD1 no hydrogen 2.759 N/A GLN 177.A N GLN 159.A O no hydrogen 2.766 N/A GLN 177.A NE2 ASP 7.A OD2 no hydrogen 3.036 N/A VAL 178.A N VAL 192.A O no hydrogen 2.882 N/A GLU 179.A N VAL 192.A O no hydrogen 3.360 N/A ASP 181.A N ASP 191.A OD1 no hydrogen 2.931 N/A LYS 182.A NZ ILE 180.A O no hydrogen 3.191 N/A VAL 185.A N VAL 188.A O no hydrogen 2.782 N/A VAL 188.A N VAL 185.A O no hydrogen 2.966 N/A VAL 190.A N ARG 183.A O no hydrogen 2.883 N/A ASP 191.A N ASP 7.A O no hydrogen 2.888 N/A VAL 192.A N GLU 179.A O no hydrogen 2.870 N/A ASN 193.A N LEU 5.A O no hydrogen 2.847 N/A ASN 193.A ND2 LEU 5.A O no hydrogen 3.037 N/A ASN 193.A ND2 ASP 7.A OD2 no hydrogen 2.807 N/A GLN 194.A N HIS 176.A O no hydrogen 2.797 N/A ILE 195.A N GLY 3.A O no hydrogen 2.911 N/A LEU 196.A N HIS 174.A O no hydrogen 2.836 N/A LYS 197.A NZ PRO 171.A O no hydrogen 2.945 N/A PHE 200.A N GLN 202.A OE1 no hydrogen 2.912 N/A GLN 202.A N GLN 202.A OE1 no hydrogen 2.782 N/A GLN 202.A NE2 PRO 198.A O no hydrogen 3.106 N/A TRP 203.A N ILE 60.A O no hydrogen 2.817 N/A TRP 203.A NE1 SER 62.A OG no hydrogen 2.921 N/A