Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5td3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASP 44.A OD1 no hydrogen 3.038 N/A VAL 3.A N ASP 44.A OD2 no hydrogen 3.019 N/A PHE 4.A N ASP 44.A OD2 no hydrogen 2.923 N/A THR 6.A N VAL 3.A O no hydrogen 2.918 N/A THR 6.A OG1 VAL 3.A O no hydrogen 2.691 N/A VAL 9.A N THR 6.A OG1 no hydrogen 3.397 N/A GLN 10.A N THR 6.A O no hydrogen 3.070 N/A GLN 10.A NE2 PHE 4.A O no hydrogen 2.897 N/A ASP 11.A N ARG 7.A O no hydrogen 2.793 N/A LEU 12.A N GLU 8.A O no hydrogen 2.981 N/A LEU 13.A N VAL 9.A O no hydrogen 2.942 N/A LYS 14.A N GLN 10.A O no hydrogen 3.130 N/A ALA 15.A N ASP 11.A O no hydrogen 2.994 N/A ALA 16.A N LEU 12.A O no hydrogen 2.923 N/A SER 17.A N LEU 13.A O no hydrogen 3.229 N/A SER 17.A OG.A LEU 13.A O no hydrogen 3.005 N/A SER 17.A OG.B LEU 13.A O no hydrogen 2.888 N/A SER 17.A OG.B LYS 14.A O no hydrogen 3.458 N/A SER 18.A N ALA 15.A O no hydrogen 3.384 N/A SER 18.A OG LYS 14.A O no hydrogen 2.639 N/A ARG 27.A NH1 GLN 30.A OE1 no hydrogen 2.893 N/A THR 28.A N ASP 25.A OD2 no hydrogen 2.946 N/A THR 28.A OG1 ASP 25.A OD2 no hydrogen 2.744 N/A GLN 29.A N ASP 25.A O no hydrogen 2.917 N/A GLN 29.A NE2 THR 23.A O no hydrogen 3.233 N/A GLN 30.A N ALA 26.A O no hydrogen 2.875 N/A ILE 31.A N ARG 27.A O no hydrogen 3.026 N/A VAL 32.A N THR 28.A O no hydrogen 2.885 N/A LEU 33.A N GLN 29.A O no hydrogen 2.991 N/A ARG 34.A N GLN 30.A O no hydrogen 3.219 N/A ARG 34.A NE ASP 38.A OD2 no hydrogen 2.736 N/A LEU 35.A N ILE 31.A O no hydrogen 2.898 N/A LEU 36.A N VAL 32.A O no hydrogen 2.822 N/A GLY 37.A N LEU 33.A O no hydrogen 3.005 N/A ASP 38.A N ARG 34.A O no hydrogen 2.899 N/A LEU 39.A N LEU 35.A O no hydrogen 2.921 N/A PHE 40.A N LEU 36.A O no hydrogen 2.872 N/A LYS 41.A N GLY 37.A O no hydrogen 2.960 N/A LYS 41.A NZ ASP 45.A OD2 no hydrogen 2.821 N/A ALA 42.A N ASP 38.A O no hydrogen 2.892 N/A ILE 43.A N LEU 39.A O no hydrogen 2.956 N/A ASP 44.A N PHE 40.A O no hydrogen 3.062 N/A ASP 45.A N LYS 41.A O no hydrogen 2.774 N/A LEU 46.A N ALA 42.A O no hydrogen 2.820 N/A ILE 48.A N ILE 43.A O no hydrogen 2.962 N/A THR 49.A N GLU 52.A OE1 no hydrogen 2.890 N/A GLU 52.A N THR 49.A OG1 no hydrogen 3.060 N/A VAL 53.A N THR 49.A O no hydrogen 2.919 N/A TRP 54.A N PRO 50.A O no hydrogen 2.837 N/A ALA 55.A N ASP 51.A O no hydrogen 2.996 N/A GLY 56.A N GLU 52.A O no hydrogen 2.960 N/A VAL 57.A N VAL 53.A O no hydrogen 2.797 N/A ASN 58.A N TRP 54.A O no hydrogen 2.853 N/A TYR 59.A N ALA 55.A O no hydrogen 2.909 N/A TYR 59.A OH ALA 205.A O no hydrogen 2.794 N/A LEU 60.A N GLY 56.A O no hydrogen 2.990 N/A ASN 61.A N VAL 57.A O no hydrogen 3.133 N/A LYS 62.A N ASN 58.A O no hydrogen 3.062 N/A LYS 62.A NZ ASP 66.A OD2 no hydrogen 2.838 N/A LYS 62.A NZ GLN 203.A O no hydrogen 3.257 N/A LEU 63.A N TYR 59.A O no hydrogen 2.787 N/A GLY 64.A N LEU 60.A O no hydrogen 3.095 N/A GLN 65.A N ASN 61.A O no hydrogen 2.911 N/A ASP 66.A N LYS 62.A O no hydrogen 2.864 N/A GLY 67.A N GLY 64.A O no hydrogen 2.862 N/A GLU 68.A N LEU 63.A O no hydrogen 3.067 N/A LEU 72.A N GLU 68.A O no hydrogen 2.942 N/A ALA 73.A N ALA 69.A O no hydrogen 2.938 N/A ALA 74.A N ALA 70.A O no hydrogen 3.176 N/A GLY 75.A N LEU 71.A O no hydrogen 2.931 N/A LEU 76.A N LEU 72.A O no hydrogen 2.872 N/A GLY 77.A N ALA 74.A O no hydrogen 3.050 N/A GLU 79.A N ALA 73.A O no hydrogen 3.072 N/A TYR 81.A N GLY 77.A O no hydrogen 2.816 N/A LEU 82.A N LEU 78.A O no hydrogen 3.096 N/A ASP 83.A N GLU 79.A O no hydrogen 3.440 N/A ILE 84.A N LYS 80.A O no hydrogen 2.988 N/A ARG 85.A N TYR 81.A O no hydrogen 3.016 N/A MET 86.A N LEU 82.A O no hydrogen 2.937 N/A ASP 87.A N ASP 83.A O no hydrogen 2.741 N/A ALA 88.A N ILE 84.A O no hydrogen 2.988 N/A ALA 89.A N ARG 85.A O no hydrogen 3.056 N/A ASP 90.A N MET 86.A O no hydrogen 2.990 N/A ALA 91.A N ASP 87.A O no hydrogen 2.909 N/A ALA 92.A N ALA 88.A O no hydrogen 2.983 N/A LEU 93.A N ALA 89.A O no hydrogen 3.048 N/A GLY 94.A N ALA 91.A O no hydrogen 3.226 N/A LEU 95.A N ASP 90.A O no hydrogen 2.938 N/A THR 99.A N VAL 287.A O no hydrogen 2.922 N/A THR 99.A OG1 VAL 287.A O no hydrogen 3.561 N/A ARG 101.A NH1 ASP 87.A OD1 no hydrogen 2.760 N/A ARG 101.A NH1 ASP 90.A OD2 no hydrogen 2.978 N/A ARG 101.A NH2 ASP 90.A OD2 no hydrogen 3.133 N/A ARG 101.A NH2 GLN 298.A OE1 no hydrogen 2.913 N/A THR 102.A N THR 236.A O no hydrogen 3.056 N/A THR 102.A OG1 ALA 254.A O no hydrogen 2.637 N/A GLY 105.A N GLU 79.A OE2 no hydrogen 2.930 N/A TYR 108.A OH GLU 152.A OE1 no hydrogen 2.708 N/A ALA 110.A N ALA 305.A O no hydrogen 2.878 N/A ARG 115.A N ALA 179.A O no hydrogen 2.901 N/A GLY 117.A N ARG 181.A O no hydrogen 2.831 N/A VAL 118.A N ASP 116.A O no hydrogen 2.817 N/A ALA 119.A N ALA 189.A O no hydrogen 2.908 N/A LYS 120.A NZ ASP 122.A O no hydrogen 3.141 N/A LYS 120.A NZ ASP 122.A OD1 no hydrogen 2.618 N/A ILE 121.A N ARG 191.A O no hydrogen 2.898 N/A LEU 123.A N ASN 175.A OD1 no hydrogen 2.893 N/A ASP 124.A N ASN 175.A OD1 no hydrogen 3.011 N/A GLY 128.A N ASP 126.A OD1 no hydrogen 3.170 N/A ALA 129.A N ASP 126.A O no hydrogen 3.209 N/A LEU 132.A N THR 192.A O no hydrogen 2.883 N/A VAL 133.A N GLN 280.A O no hydrogen 2.901 N/A ILE 134.A N PHE 190.A O no hydrogen 2.914 N/A HIS 135.A N ILE 282.A O no hydrogen 2.978 N/A HIS 135.A NE2 ASP 281.A OD2 no hydrogen 2.673 N/A GLY 136.A N TYR 188.A O no hydrogen 3.193 N/A THR 137.A N ASP 285.A OD1 no hydrogen 3.035 N/A THR 137.A OG1.B ASP 285.A OD1 no hydrogen 3.500 N/A VAL 138.A N GLY 186.A O no hydrogen 2.805 N/A LYS 139.A N PHE 286.A O no hydrogen 2.855 N/A ASP 140.A N LYS 144.A O no hydrogen 2.915 N/A ASP 142.A N ASP 140.A OD1 no hydrogen 2.878 N/A GLY 143.A N ASP 140.A O no hydrogen 2.951 N/A LYS 144.A N ASP 140.A OD1 no hydrogen 3.004 N/A VAL 146.A N VAL 138.A O no hydrogen 2.874 N/A GLY 148.A N THR 182.A O no hydrogen 2.957 N/A ALA 149.A N THR 182.A OG1 no hydrogen 3.035 N/A LEU 150.A N THR 228.A O no hydrogen 2.833 N/A VAL 151.A N VAL 180.A O no hydrogen 2.821 N/A GLU 152.A N PHE 226.A O no hydrogen 2.773 N/A CYS 153.A N GLY 178.A O no hydrogen 2.827 N/A CYS 153.A SG HIS 224.A O no hydrogen 4.022 N/A TRP 154.A N HIS 224.A O no hydrogen 3.184 N/A HIS 155.A N LEU 176.A O no hydrogen 3.318 N/A HIS 155.A ND1 ALA 156.A O no hydrogen 2.820 N/A HIS 155.A NE2 THR 192.A OG1 no hydrogen 2.740 N/A ASN 157.A N PHE 161.A O no hydrogen 2.892 N/A SER 158.A N ASP 126.A OD2 no hydrogen 2.896 N/A SER 158.A OG ASP 126.A OD1 no hydrogen 2.614 N/A SER 158.A OG ASP 126.A OD2 no hydrogen 3.138 N/A HIS 159.A N ASN 157.A OD1 no hydrogen 2.897 N/A GLY 160.A N ASN 157.A O no hydrogen 2.978 N/A PHE 161.A N ASN 157.A OD1 no hydrogen 3.034 N/A TYR 162.A OH HIS 224.A NE2 no hydrogen 3.101 N/A SER 163.A OG ASN 175.A O no hydrogen 2.737 N/A PHE 165.A N TYR 162.A O no hydrogen 3.013 N/A THR 168.A N ASP 166.A OD1 no hydrogen 2.814 N/A THR 168.A OG1 ASP 166.A OD1 no hydrogen 2.610 N/A GLY 169.A N ASP 166.A O no hydrogen 3.032 N/A GLN 171.A NE2 PHE 161.A O no hydrogen 3.119 N/A GLN 171.A NE2 ASP 166.A OD2 no hydrogen 2.949 N/A ARG 172.A N ASP 124.A OD2 no hydrogen 2.794 N/A ARG 172.A NE ASP 124.A OD1 no hydrogen 2.797 N/A ARG 172.A NH2 ASP 124.A OD1 no hydrogen 3.268 N/A PHE 174.A N HIS 164.A NE2 no hydrogen 2.911 N/A ASN 175.A N ARG 172.A O no hydrogen 3.091 N/A ASN 175.A ND2 GLN 171.A OE1 no hydrogen 2.845 N/A LEU 176.A N ILE 121.A O no hydrogen 2.831 N/A ARG 177.A N PHE 174.A O no hydrogen 3.062 N/A ARG 177.A NE SER 163.A O no hydrogen 3.333 N/A ARG 177.A NE SER 163.A OG no hydrogen 2.886 N/A ARG 177.A NH1 LEU 107.A O no hydrogen 2.905 N/A ARG 177.A NH2 LEU 107.A O no hydrogen 2.967 N/A ARG 177.A NH2 SER 163.A O no hydrogen 2.859 N/A GLY 178.A N CYS 153.A O no hydrogen 3.056 N/A ALA 179.A N PRO 113.A O no hydrogen 2.884 N/A VAL 180.A N VAL 151.A O no hydrogen 2.835 N/A ARG 181.A N ARG 115.A O no hydrogen 2.775 N/A ARG 181.A NE.B ASP 116.A OD1 no hydrogen 3.443 N/A ARG 181.A NH1.A GLY 148.A O no hydrogen 3.387 N/A THR 182.A N ALA 149.A O no hydrogen 2.934 N/A THR 182.A OG1 VAL 146.A O no hydrogen 2.789 N/A GLY 186.A N GLY 183.A O no hydrogen 2.986 N/A THR 187.A N ASP 185.A OD1 no hydrogen 2.986 N/A THR 187.A OG1 ASP 185.A OD1 no hydrogen 2.727 N/A THR 187.A OG1 ASP 185.A OD2 no hydrogen 3.330 N/A TYR 188.A N GLY 136.A O no hydrogen 3.040 N/A TYR 188.A OH PHE 284.A O no hydrogen 2.654 N/A ALA 189.A N GLY 117.A O no hydrogen 2.979 N/A PHE 190.A N ILE 134.A O no hydrogen 2.697 N/A ARG 191.A N ALA 119.A O no hydrogen 2.680 N/A THR 192.A N LEU 132.A O no hydrogen 2.827 N/A THR 192.A OG1 HIS 155.A NE2 no hydrogen 2.740 N/A LEU 193.A N THR 192.A OG1 no hydrogen 2.670 N/A MET 194.A N GLY 130.A O no hydrogen 2.847 N/A CYS 200.A N GLY 217.A O no hydrogen 2.942 N/A CYS 200.A SG GLY 217.A O no hydrogen 3.588 N/A GLY 204.A N PRO 201.A O no hydrogen 2.919 N/A ALA 205.A N ASP 66.A OD2 no hydrogen 2.883 N/A THR 206.A N GLU 68.A OE1 no hydrogen 2.902 N/A THR 206.A OG1 GLU 68.A OE1 no hydrogen 2.783 N/A GLN 207.A NE2 ASP 211.A OD1 no hydrogen 2.775 N/A GLN 207.A NE2 ARG 215.A O no hydrogen 3.622 N/A GLN 208.A N GLY 204.A O no hydrogen 2.977 N/A LEU 209.A N ALA 205.A O no hydrogen 3.097 N/A LEU 210.A N THR 206.A O no hydrogen 2.951 N/A ASP 211.A N GLN 207.A O no hydrogen 2.783 N/A ARG 212.A N GLN 208.A O no hydrogen 3.166 N/A LEU 213.A N LEU 209.A O no hydrogen 2.944 N/A GLY 214.A N ASP 211.A O no hydrogen 3.108 N/A ARG 215.A N LEU 210.A O no hydrogen 2.848 N/A ARG 215.A NH1 GLY 75.A O no hydrogen 2.780 N/A ARG 215.A NH2 GLY 75.A O no hydrogen 3.011 N/A ARG 215.A NH2 PHE 251.A O no hydrogen 2.929 N/A HIS 216.A NE2 ASP 249.A OD2 no hydrogen 3.076 N/A ASN 218.A N HIS 216.A ND1 no hydrogen 2.941 N/A ARG 219.A N TYR 198.A O no hydrogen 2.732 N/A ARG 219.A NE ASP 250.A OD1 no hydrogen 2.894 N/A ARG 219.A NE ASP 250.A OD2 no hydrogen 3.348 N/A ARG 219.A NH2 ASP 250.A OD2 no hydrogen 2.814 N/A ALA 221.A N ASP 244.A OD2 no hydrogen 2.904 N/A HIS 222.A ND1 PRO 220.A O no hydrogen 2.691 N/A VAL 223.A N PHE 239.A O no hydrogen 2.988 N/A HIS 224.A N TRP 154.A O no hydrogen 2.947 N/A PHE 225.A N THR 237.A O no hydrogen 2.920 N/A PHE 226.A N GLU 152.A O no hydrogen 3.093 N/A VAL 227.A N LEU 235.A O no hydrogen 2.906 N/A THR 228.A N LEU 150.A O no hydrogen 3.041 N/A SER 229.A OG ASP 230.A O no hydrogen 3.426 N/A SER 229.A OG HIS 232.A ND1 no hydrogen 2.862 N/A HIS 232.A N SER 229.A O no hydrogen 2.908 N/A HIS 232.A ND1 SER 229.A OG no hydrogen 2.862 N/A ARG 233.A N THR 289.A O no hydrogen 2.858 N/A ARG 233.A NE THR 289.A OG1 no hydrogen 2.831 N/A ARG 233.A NH1 ASP 90.A OD1 no hydrogen 2.853 N/A ARG 233.A NH1 ASP 90.A OD2 no hydrogen 3.509 N/A ARG 233.A NH1 ASN 297.A OD1 no hydrogen 2.912 N/A ARG 233.A NH2 ASP 90.A OD2 no hydrogen 2.825 N/A ARG 233.A NH2 THR 289.A OG1 no hydrogen 3.129 N/A LYS 234.A N ASP 296.A OD2 no hydrogen 2.814 N/A LEU 235.A N VAL 227.A O no hydrogen 2.925 N/A THR 237.A N PHE 225.A O no hydrogen 2.974 N/A THR 237.A OG1 PRO 100.A O no hydrogen 2.877 N/A THR 237.A OG1 GLN 238.A O no hydrogen 3.418 N/A GLN 238.A N THR 237.A OG1 no hydrogen 2.771 N/A GLN 238.A NE2.B ILE 103.A O no hydrogen 2.789 N/A PHE 239.A N VAL 223.A O no hydrogen 3.012 N/A ASN 240.A N LEU 259.A O no hydrogen 2.927 N/A ASN 240.A ND2 GLN 238.A OE1.A no hydrogen 2.954 N/A ILE 241.A N ALA 221.A O no hydrogen 3.001 N/A ASP 244.A N ILE 241.A O no hydrogen 3.305 N/A LEU 246.A N ASP 244.A OD1 no hydrogen 2.894 N/A ILE 247.A N ASP 244.A O no hydrogen 3.059 N/A ASP 249.A N LEU 246.A O no hydrogen 2.843 N/A PHE 251.A N ASN 218.A O no hydrogen 3.017 N/A ALA 252.A N ASP 250.A OD1 no hydrogen 3.099 N/A TYR 253.A N ASP 250.A O no hydrogen 3.144 N/A ALA 254.A N ASP 250.A OD2 no hydrogen 3.098 N/A THR 255.A OG1 ILE 247.A O no hydrogen 2.647 N/A ARG 256.A NH1 ASP 87.A OD2 no hydrogen 2.810 N/A ARG 256.A NH1 ARG 101.A O no hydrogen 2.854 N/A ARG 256.A NH2 ASP 87.A OD2 no hydrogen 3.016 N/A GLU 258.A N GLU 258.A OE1 no hydrogen 2.741 N/A LEU 259.A N ARG 256.A O no hydrogen 2.941 N/A VAL 263.A N GLU 242.A OE1 no hydrogen 3.054 N/A THR 264.A N ASP 281.A O no hydrogen 3.096 N/A THR 264.A OG1 ASP 281.A O no hydrogen 3.463 N/A THR 265.A OG1 GLN 280.A OE1 no hydrogen 2.967 N/A LYS 266.A N TYR 279.A O no hydrogen 2.913 N/A LYS 266.A NZ ASP 281.A OD2 no hydrogen 3.071 N/A GLY 268.A N ASP 277.A OD1 no hydrogen 2.729 N/A GLY 269.A N ASP 277.A O no hydrogen 2.743 N/A LEU 272.A N GLY 269.A O no hydrogen 3.010 N/A GLY 273.A N ALA 270.A O no hydrogen 2.932 N/A LEU 274.A N GLY 269.A O no hydrogen 3.027 N/A LYS 275.A NZ ALA 129.A O no hydrogen 2.709 N/A TYR 279.A N LYS 266.A O no hydrogen 2.995 N/A GLN 280.A N PRO 131.A O no hydrogen 3.065 N/A ASP 281.A N THR 264.A O no hydrogen 2.809 N/A ILE 282.A N VAL 133.A O no hydrogen 2.907 N/A PHE 284.A N HIS 135.A O no hydrogen 2.784 N/A PHE 286.A N THR 137.A O no hydrogen 2.942 N/A VAL 287.A N THR 99.A OG1 no hydrogen 2.754 N/A LEU 288.A N LYS 139.A O no hydrogen 2.874 N/A ARG 291.A N GLY 231.A O no hydrogen 3.169 N/A ARG 291.A NH1.B GLY 294.A O no hydrogen 3.295 N/A GLN 298.A N ASP 296.A OD1 no hydrogen 3.100 N/A GLN 298.A NE2 LYS 234.A O no hydrogen 2.913 N/A GLN 298.A NE2 ASP 296.A OD1 no hydrogen 2.839 N/A GLN 298.A NE2 ASP 296.A OD2 no hydrogen 3.432 N/A ARG 302.A NH1 GLU 79.A OE2 no hydrogen 2.988 N/A ARG 304.A NE GLU 104.A OE2 no hydrogen 2.848 N/A ARG 304.A NH1 VAL 300.A O no hydrogen 3.061 N/A ARG 304.A NH2 GLU 104.A OE1 no hydrogen 2.802 N/A ARG 304.A NH2 VAL 300.A O no hydrogen 2.907 N/A