Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xty_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N GLU 21.A OE2 no hydrogen 2.991 N/A HIS 3.A N LYS 22.A O no hydrogen 2.761 N/A HIS 3.A NE2 GLU 21.A OE1 no hydrogen 2.644 N/A ALA 5.A N GLU 24.A O no hydrogen 2.996 N/A LEU 6.A N SER 26.A OG no hydrogen 2.848 N/A LEU 8.A N THR 27.A O no hydrogen 2.942 N/A GLY 10.A N PHE 29.A O no hydrogen 2.893 N/A ILE 13.A N ASP 32.A O no hydrogen 2.942 N/A ARG 15.A NE GLY 35.A O no hydrogen 3.398 N/A ARG 17.A N ASP 14.A O no hydrogen 3.051 N/A ARG 17.A NH1 GLU 11.A OE1 no hydrogen 3.042 N/A THR 19.A OG1 ASP 37.A O no hydrogen 2.701 N/A GLY 20.A N THR 41.A OG1 no hydrogen 3.168 N/A GLU 21.A N PHE 18.A O no hydrogen 2.899 N/A LYS 22.A N GLY 1.A O no hydrogen 3.010 N/A ILE 23.A N GLU 42.A O no hydrogen 2.816 N/A GLU 24.A N HIS 3.A O no hydrogen 2.945 N/A ASN 25.A N ILE 44.A O no hydrogen 2.867 N/A SER 26.A OG GLU 24.A O no hydrogen 2.805 N/A THR 27.A N LEU 6.A O no hydrogen 2.871 N/A THR 27.A OG1 LEU 6.A O no hydrogen 3.386 N/A PHE 28.A N GLN 47.A O no hydrogen 2.835 N/A PHE 29.A N LEU 8.A O no hydrogen 2.916 N/A CYS 31.A SG PHE 29.A O no hydrogen 3.502 N/A ASP 32.A N GLU 11.A O no hydrogen 2.887 N/A PHE 33.A N ASN 58.A O no hydrogen 2.623 N/A SER 34.A N ASP 32.A OD1 no hydrogen 2.857 N/A SER 34.A OG ASP 32.A OD1 no hydrogen 2.533 N/A SER 34.A OG ASP 32.A OD2 no hydrogen 3.469 N/A GLY 35.A N SER 60.A O no hydrogen 2.988 N/A ALA 36.A N PHE 33.A O no hydrogen 2.971 N/A ASP 37.A N ARG 15.A O no hydrogen 2.756 N/A LEU 38.A N MET 63.A O no hydrogen 2.774 N/A SER 39.A N ASP 37.A OD1 no hydrogen 3.026 N/A SER 39.A OG ASP 37.A OD1 no hydrogen 2.807 N/A GLY 40.A N LYS 65.A O no hydrogen 2.905 N/A THR 41.A N LEU 38.A O no hydrogen 2.915 N/A THR 41.A OG1 PHE 18.A O no hydrogen 2.734 N/A GLU 42.A N GLU 21.A O no hydrogen 2.827 N/A PHE 43.A N ILE 68.A O no hydrogen 2.764 N/A ILE 44.A N ILE 23.A O no hydrogen 2.828 N/A GLY 45.A N LYS 70.A O no hydrogen 2.884 N/A CYS 46.A SG ILE 23.A O no hydrogen 3.644 N/A CYS 46.A SG ILE 44.A O no hydrogen 3.553 N/A GLN 47.A N SER 26.A O no hydrogen 2.960 N/A PHE 48.A N ASP 73.A O no hydrogen 2.846 N/A ASP 50.A N LYS 55.A O no hydrogen 2.951 N/A GLU 52.A N ASP 50.A OD1 no hydrogen 3.222 N/A SER 53.A N ASP 50.A OD2 no hydrogen 3.432 N/A SER 53.A OG ASP 50.A OD2 no hydrogen 2.669 N/A GLN 54.A N ASP 50.A O no hydrogen 2.541 N/A LYS 55.A N SER 53.A OG no hydrogen 3.320 N/A CYS 57.A SG PHE 28.A O no hydrogen 3.061 N/A CYS 57.A SG PHE 48.A O no hydrogen 3.461 N/A ASN 58.A N CYS 31.A O no hydrogen 3.077 N/A PHE 59.A N ASP 78.A O no hydrogen 2.669 N/A SER 60.A N ASN 58.A OD1 no hydrogen 2.884 N/A SER 60.A OG ASN 58.A OD1 no hydrogen 2.813 N/A ARG 61.A N ARG 80.A O no hydrogen 2.860 N/A ALA 62.A N PHE 59.A O no hydrogen 2.987 N/A MET 63.A N ALA 36.A O no hydrogen 2.838 N/A LEU 64.A N SER 83.A O no hydrogen 2.706 N/A ASP 66.A N LEU 85.A O no hydrogen 3.160 N/A ALA 67.A N LEU 64.A O no hydrogen 2.850 N/A ILE 68.A N THR 41.A O no hydrogen 2.809 N/A PHE 69.A N GLU 88.A O no hydrogen 2.748 N/A LYS 70.A N PHE 43.A O no hydrogen 2.842 N/A SER 71.A N ARG 90.A O no hydrogen 2.976 N/A CYS 72.A SG PHE 43.A O no hydrogen 3.336 N/A CYS 72.A SG LYS 70.A O no hydrogen 3.516 N/A ASP 73.A N CYS 46.A O no hydrogen 2.890 N/A LEU 74.A N ARG 93.A O no hydrogen 2.639 N/A SER 75.A N ASP 73.A OD2 no hydrogen 2.878 N/A SER 75.A OG ASP 73.A OD2 no hydrogen 2.625 N/A MET 76.A N GLN 95.A O no hydrogen 2.863 N/A ALA 77.A N LEU 74.A O no hydrogen 2.999 N/A ASP 78.A N CYS 57.A O no hydrogen 3.034 N/A PHE 79.A N ASP 98.A O no hydrogen 2.762 N/A ARG 80.A N ASP 78.A OD1 no hydrogen 3.030 N/A ARG 80.A NE ASP 78.A OD1 no hydrogen 2.957 N/A ARG 80.A NE ASP 78.A OD2 no hydrogen 3.375 N/A ARG 80.A NH2 ASP 78.A OD2 no hydrogen 2.932 N/A ASN 81.A N ARG 100.A O no hydrogen 3.242 N/A SER 82.A N PHE 79.A O no hydrogen 3.139 N/A SER 82.A OG PHE 79.A O no hydrogen 2.686 N/A SER 83.A N ALA 62.A O no hydrogen 2.910 N/A ALA 84.A N SER 103.A O no hydrogen 2.720 N/A GLY 86.A N SER 108.A O no hydrogen 2.783 N/A ILE 87.A N ALA 84.A O no hydrogen 3.018 N/A GLU 88.A N ALA 67.A O no hydrogen 2.908 N/A ILE 89.A N TYR 110.A O no hydrogen 2.854 N/A ARG 90.A N PHE 69.A O no hydrogen 2.835 N/A ARG 90.A NE GLU 88.A OE1 no hydrogen 3.078 N/A ARG 90.A NH1 THR 112.A OG1 no hydrogen 2.814 N/A ARG 90.A NH2 GLU 88.A OE1 no hydrogen 3.529 N/A HIS 91.A N THR 112.A O no hydrogen 2.978 N/A CYS 92.A N THR 114.A OG1 no hydrogen 3.331 N/A CYS 92.A SG PHE 69.A O no hydrogen 3.334 N/A CYS 92.A SG ARG 90.A O no hydrogen 3.510 N/A ARG 93.A N CYS 72.A O no hydrogen 3.054 N/A ALA 94.A N ASN 115.A O no hydrogen 2.772 N/A GLY 96.A N SER 117.A O no hydrogen 2.935 N/A ALA 97.A N ALA 94.A O no hydrogen 3.059 N/A ASP 98.A N ALA 77.A O no hydrogen 2.878 N/A PHE 99.A N ASN 120.A O no hydrogen 2.836 N/A ARG 100.A N ASP 98.A OD1 no hydrogen 3.219 N/A ARG 100.A NE ASP 98.A OD1 no hydrogen 2.978 N/A ARG 100.A NH2 ASP 98.A OD2 no hydrogen 2.810 N/A ALA 102.A N PHE 99.A O no hydrogen 2.934 N/A SER 103.A N SER 82.A O no hydrogen 2.901 N/A MET 105.A N SER 103.A OG no hydrogen 3.334 N/A CYS 107.A SG VAL 125.A O no hydrogen 3.623 N/A SER 108.A N PHE 104.A O no hydrogen 2.870 N/A TYR 110.A N ILE 87.A O no hydrogen 2.932 N/A ILE 111.A N GLU 130.A O no hydrogen 2.878 N/A THR 112.A N ILE 89.A O no hydrogen 2.881 N/A ASN 113.A N TRP 132.A O no hydrogen 3.170 N/A ASN 113.A ND2 GLU 133.A OE1 no hydrogen 2.841 N/A THR 114.A N ASN 134.A OD1 no hydrogen 2.892 N/A THR 114.A OG1 ILE 89.A O no hydrogen 3.443 N/A THR 114.A OG1 THR 112.A O no hydrogen 2.822 N/A ASN 115.A N CYS 92.A O no hydrogen 2.909 N/A ASN 115.A ND2 SER 117.A OG no hydrogen 2.669 N/A LEU 116.A N ARG 135.A O no hydrogen 2.663 N/A TYR 118.A N ILE 137.A O no hydrogen 2.909 N/A ALA 119.A N LEU 116.A O no hydrogen 2.950 N/A ASN 120.A N ALA 97.A O no hydrogen 2.790 N/A PHE 121.A N GLN 140.A O no hydrogen 2.721 N/A SER 122.A N ASN 120.A OD1 no hydrogen 3.005 N/A SER 122.A OG ASN 120.A OD1 no hydrogen 2.799 N/A LYS 123.A N LEU 142.A O no hydrogen 2.873 N/A VAL 124.A N PHE 121.A O no hydrogen 3.019 N/A LEU 126.A N THR 145.A O no hydrogen 2.847 N/A LYS 128.A N SER 147.A O no hydrogen 2.927 N/A CYS 129.A N SER 149.A OG no hydrogen 2.814 N/A CYS 129.A SG GLU 127.A O no hydrogen 3.495 N/A GLU 130.A N ALA 109.A O no hydrogen 2.975 N/A LEU 131.A N ASP 150.A O no hydrogen 2.893 N/A TRP 132.A NE1 GLU 130.A OE2 no hydrogen 3.085 N/A GLU 133.A N SER 152.A O no hydrogen 2.680 N/A ASN 134.A ND2 ILE 111.A O no hydrogen 2.904 N/A ARG 135.A N THR 114.A O no hydrogen 3.023 N/A TRP 136.A N GLU 155.A O no hydrogen 2.981 N/A GLY 138.A N THR 158.A O no hydrogen 2.955 N/A ALA 139.A N TRP 136.A O no hydrogen 2.999 N/A GLN 140.A N ALA 119.A O no hydrogen 2.840 N/A GLY 143.A N ALA 163.A O no hydrogen 2.873 N/A ALA 144.A N VAL 141.A O no hydrogen 2.990 N/A THR 145.A N VAL 124.A O no hydrogen 2.888 N/A PHE 146.A N ASN 165.A O no hydrogen 2.825 N/A SER 147.A N THR 145.A OG1 no hydrogen 3.171 N/A SER 147.A OG THR 167.A O no hydrogen 2.863 N/A SER 147.A OG THR 167.A OG1 no hydrogen 3.141 N/A GLY 148.A N THR 167.A O no hydrogen 2.998 N/A SER 149.A N PHE 146.A O no hydrogen 2.897 N/A SER 149.A OG LEU 126.A O no hydrogen 2.742 N/A SER 149.A OG PHE 146.A O no hydrogen 3.142 N/A ASP 150.A N CYS 129.A O no hydrogen 3.018 N/A LEU 151.A N ASP 170.A O no hydrogen 2.824 N/A SER 152.A N ASP 150.A OD1 no hydrogen 2.946 N/A SER 152.A OG ASP 150.A OD1 no hydrogen 2.765 N/A GLY 153.A N THR 172.A O no hydrogen 3.020 N/A GLY 154.A N SER 174.A OG no hydrogen 3.051 N/A GLU 155.A N ASN 134.A O no hydrogen 3.030 N/A PHE 156.A N GLU 175.A O no hydrogen 2.866 N/A SER 157.A OG GLU 155.A OE1 no hydrogen 2.663 N/A TRP 161.A NE1 LEU 176.A O no hydrogen 2.839 N/A GLU 162.A N ASP 160.A OD1 no hydrogen 2.990 N/A ALA 163.A N ASP 160.A O no hydrogen 3.031 N/A ASN 165.A N ALA 144.A O no hydrogen 2.960 N/A THR 167.A N ASN 165.A OD1 no hydrogen 2.931 N/A THR 167.A OG1 SER 147.A OG no hydrogen 3.141 N/A THR 167.A OG1 ASN 165.A OD1 no hydrogen 2.716 N/A HIS 168.A N GLN 187.A O no hydrogen 2.773 N/A CYS 169.A N PHE 166.A O no hydrogen 3.195 N/A CYS 169.A SG PHE 146.A O no hydrogen 3.147 N/A CYS 169.A SG PHE 166.A O no hydrogen 3.238 N/A CYS 169.A SG THR 167.A O no hydrogen 3.898 N/A ASP 170.A N SER 149.A O no hydrogen 3.023 N/A LEU 171.A N LYS 190.A O no hydrogen 2.891 N/A THR 172.A N ASP 170.A OD1 no hydrogen 2.958 N/A THR 172.A OG1 ASP 170.A OD1 no hydrogen 2.675 N/A ASN 173.A N ASP 192.A OD2 no hydrogen 2.786 N/A SER 174.A OG LEU 171.A O no hydrogen 2.862 N/A SER 174.A OG THR 172.A O no hydrogen 2.986 N/A GLU 175.A N GLY 154.A O no hydrogen 2.933 N/A GLY 177.A N GLU 175.A OE2 no hydrogen 2.865 N/A LEU 179.A N LEU 176.A O no hydrogen 3.183 N/A ARG 182.A N ASP 180.A OD2 no hydrogen 2.851 N/A ARG 182.A NE ASP 180.A OD2 no hydrogen 2.939 N/A ARG 182.A NH2 ASP 180.A OD1 no hydrogen 2.974 N/A ARG 182.A NH2 ARG 202.A O no hydrogen 3.234 N/A GLY 183.A N ASP 180.A O no hydrogen 3.158 N/A GLN 187.A N ASP 185.A OD1 no hydrogen 3.037 N/A VAL 189.A N LEU 186.A O no hydrogen 3.014 N/A LYS 190.A N CYS 169.A O no hydrogen 2.966 N/A ASP 192.A N GLN 195.A OE1 no hydrogen 2.872 N/A GLN 195.A N ASP 192.A OD1 no hydrogen 2.771 N/A GLN 195.A NE2 LEU 171.A O no hydrogen 2.811 N/A GLN 195.A NE2 SER 174.A O no hydrogen 3.075 N/A ALA 196.A N ASP 192.A O no hydrogen 2.947 N/A SER 197.A N ASN 193.A O no hydrogen 2.992 N/A LEU 198.A N TYR 194.A O no hydrogen 3.129 N/A LEU 199.A N GLN 195.A O no hydrogen 2.837 N/A MET 200.A N ALA 196.A O no hydrogen 2.912 N/A GLU 201.A N SER 197.A O no hydrogen 2.910 N/A ARG 202.A N LEU 198.A O no hydrogen 3.270 N/A ARG 202.A N LEU 199.A O no hydrogen 3.247 N/A ARG 202.A NE ASP 180.A OD1 no hydrogen 2.715 N/A LEU 203.A N MET 200.A O no hydrogen 2.811 N/A GLY 204.A N GLU 201.A O no hydrogen 2.755 N/A ILE 205.A N MET 200.A O no hydrogen 3.131 N/A