Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ahi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ARG 208.A O no hydrogen 2.870 N/A ILE 3.A N VAL 210.A O no hydrogen 2.809 N/A ALA 5.A N VAL 212.A O no hydrogen 2.808 N/A LEU 6.A N HIS 39.A O no hydrogen 2.948 N/A ASN 7.A ND2 VAL 14.A O no hydrogen 3.380 N/A LEU 8.A N VAL 41.A O no hydrogen 2.931 N/A ILE 9.A N THR 12.A O no hydrogen 2.931 N/A ASP 10.A N THR 44.A OG1 no hydrogen 2.880 N/A GLY 11.A N GLN 53.A OE1 no hydrogen 2.748 N/A THR 12.A N ILE 9.A O no hydrogen 2.647 N/A VAL 13.A N GLY 20.A O no hydrogen 2.759 N/A VAL 14.A N ASN 7.A O no hydrogen 3.042 N/A ARG 15.A N ARG 17.A O no hydrogen 3.089 N/A TYR 19.A N VAL 13.A O no hydrogen 2.632 N/A GLY 20.A N ASP 18.A OD1 no hydrogen 2.783 N/A ARG 26.A NH2 TYR 19.A O no hydrogen 2.782 N/A LEU 27.A N PRO 23.A O no hydrogen 3.027 N/A GLN 28.A N LEU 24.A O no hydrogen 2.954 N/A GLN 28.A NE2 GLY 63.A O no hydrogen 2.808 N/A ASP 29.A N PRO 25.A O no hydrogen 3.043 N/A TYR 30.A N ARG 26.A O no hydrogen 2.941 N/A ALA 31.A N LEU 27.A O no hydrogen 2.951 N/A ALA 32.A N GLN 28.A O no hydrogen 2.812 N/A GLN 33.A N ASP 29.A O no hydrogen 3.086 N/A GLN 33.A NE2 ASP 29.A O no hydrogen 3.298 N/A GLY 34.A N ALA 31.A O no hydrogen 2.877 N/A ALA 35.A N TYR 30.A O no hydrogen 3.289 N/A LEU 38.A N PRO 67.A O no hydrogen 2.984 N/A HIS 39.A N PRO 4.A O no hydrogen 2.988 N/A LEU 40.A N GLN 69.A O no hydrogen 2.826 N/A VAL 41.A N LEU 6.A O no hydrogen 2.963 N/A ASP 42.A N GLY 71.A O no hydrogen 2.794 N/A LEU 43.A N LEU 8.A O no hydrogen 3.000 N/A THR 44.A OG1 ASP 10.A OD1 no hydrogen 3.445 N/A GLY 45.A N ASP 42.A OD1 no hydrogen 2.852 N/A ALA 46.A N ASP 42.A O no hydrogen 2.901 N/A LYS 47.A N LEU 43.A O no hydrogen 2.988 N/A ASP 48.A N THR 44.A O no hydrogen 2.787 N/A ALA 50.A N ASP 48.A OD1 no hydrogen 3.270 N/A LYS 51.A N ASP 48.A O no hydrogen 2.494 N/A ARG 52.A NH1 GLY 72.A O no hydrogen 2.900 N/A ARG 52.A NH2 GLY 73.A O no hydrogen 3.079 N/A GLN 53.A N ASP 42.A OD2 no hydrogen 2.904 N/A GLN 53.A NE2 LEU 8.A O no hydrogen 3.016 N/A GLN 53.A NE2 ASP 42.A OD1 no hydrogen 2.778 N/A ILE 57.A N GLN 53.A O no hydrogen 2.904 N/A LYS 58.A N ILE 54.A O no hydrogen 2.838 N/A THR 59.A N PRO 55.A O no hydrogen 3.348 N/A THR 59.A OG1.A PRO 55.A O no hydrogen 3.251 N/A THR 59.A OG1.B PRO 55.A O no hydrogen 3.500 N/A THR 59.A OG1.B LEU 56.A O no hydrogen 2.602 N/A LEU 60.A N LEU 56.A O no hydrogen 2.917 N/A VAL 61.A N ILE 57.A O no hydrogen 2.886 N/A ALA 62.A N LYS 58.A O no hydrogen 2.987 N/A GLY 63.A N THR 59.A O no hydrogen 2.926 N/A GLY 63.A N LEU 60.A O no hydrogen 3.106 N/A VAL 64.A N VAL 61.A O no hydrogen 3.394 N/A GLN 69.A N LEU 38.A O no hydrogen 2.805 N/A GLN 69.A NE2 HIS 39.A ND1 no hydrogen 3.042 N/A GLN 69.A NE2 GLN 188.A OE1 no hydrogen 3.221 N/A VAL 70.A N ARG 90.A O no hydrogen 2.936 N/A GLY 71.A N LEU 40.A O no hydrogen 3.124 N/A ARG 75.A N ASP 79.A OD2 no hydrogen 2.746 N/A THR 76.A N ASP 79.A OD2 no hydrogen 2.853 N/A THR 76.A OG1 GLU 78.A OE1 no hydrogen 3.446 N/A ASP 79.A N THR 76.A OG1 no hydrogen 2.946 N/A VAL 80.A N THR 76.A O no hydrogen 3.234 N/A ALA 81.A N GLU 77.A O no hydrogen 3.031 N/A ALA 82.A N GLU 78.A O no hydrogen 2.944 N/A LEU 83.A N ASP 79.A O no hydrogen 3.063 N/A LEU 84.A N VAL 80.A O no hydrogen 2.895 N/A LYS 85.A N ALA 81.A O no hydrogen 2.921 N/A ALA 86.A N ALA 82.A O no hydrogen 3.017 N/A GLY 87.A N LEU 84.A O no hydrogen 2.915 N/A VAL 88.A N LEU 83.A O no hydrogen 3.202 N/A ALA 89.A N VAL 68.A O no hydrogen 3.014 N/A ARG 90.A N VAL 68.A O no hydrogen 3.448 N/A ARG 90.A NE GLN 69.A OE1 no hydrogen 3.118 N/A ARG 90.A NH2 GLN 69.A OE1 no hydrogen 2.716 N/A VAL 91.A N ALA 115.A O no hydrogen 2.666 N/A VAL 92.A N VAL 70.A O no hydrogen 2.762 N/A ILE 93.A N VAL 117.A O no hydrogen 2.820 N/A THR 96.A OG1 VAL 74.A O no hydrogen 2.824 N/A ALA 97.A N GLY 94.A O no hydrogen 3.026 N/A VAL 98.A N SER 95.A O no hydrogen 3.036 N/A LYS 99.A N SER 95.A O no hydrogen 2.822 N/A SER 100.A N THR 96.A O no hydrogen 2.849 N/A VAL 104.A N SER 100.A O no hydrogen 3.046 N/A LYS 105.A N PRO 101.A O no hydrogen 2.926 N/A LYS 105.A NZ THR 151.A O no hydrogen 3.349 N/A GLY 106.A N ASP 102.A O no hydrogen 3.342 N/A TRP 107.A N VAL 103.A O no hydrogen 3.244 N/A PHE 108.A N VAL 104.A O no hydrogen 3.079 N/A GLU 109.A N LYS 105.A O no hydrogen 3.118 N/A ARG 110.A N GLY 106.A O no hydrogen 3.047 N/A ARG 110.A NH1 GLU 77.A OE2 no hydrogen 2.572 N/A PHE 111.A N TRP 107.A O no hydrogen 2.778 N/A GLY 112.A N PHE 108.A O no hydrogen 2.920 N/A ALA 115.A N GLY 112.A O no hydrogen 3.049 N/A VAL 117.A N VAL 91.A O no hydrogen 2.815 N/A LEU 118.A N HIS 159.A O no hydrogen 3.016 N/A ALA 119.A N ILE 93.A O no hydrogen 2.824 N/A LEU 120.A N LEU 161.A O no hydrogen 2.646 N/A VAL 122.A N THR 163.A O no hydrogen 2.736 N/A ARG 123.A N GLN 131.A O no hydrogen 2.776 N/A ARG 123.A NH1 GLN 138.A O no hydrogen 2.864 N/A ARG 123.A NH1 ASN 140.A OD1 no hydrogen 2.774 N/A ARG 123.A NH2 GLY 136.A O no hydrogen 2.935 N/A ARG 123.A NH2 GLN 138.A O no hydrogen 2.910 N/A ASP 125.A N THR 129.A O no hydrogen 2.949 N/A GLU 126.A N GLU 126.A OE1 no hydrogen 2.565 N/A HIS 127.A N ASP 125.A OD1 no hydrogen 2.891 N/A GLY 128.A N ASP 125.A O no hydrogen 3.049 N/A THR 129.A N ASP 125.A OD1 no hydrogen 2.964 N/A LYS 130.A NZ GLU 146.A OE2 no hydrogen 2.866 N/A LYS 130.A NZ GLU 177.A OE1 no hydrogen 2.949 N/A GLN 131.A N ARG 123.A O no hydrogen 2.732 N/A GLN 131.A NE2 ASP 125.A OD2 no hydrogen 2.397 N/A VAL 132.A N VAL 143.A O no hydrogen 2.878 N/A ALA 133.A N ASP 121.A O no hydrogen 2.899 N/A TRP 137.A N SER 135.A OG no hydrogen 3.349 N/A GLN 138.A N SER 135.A O no hydrogen 3.443 N/A GLN 138.A NE2 SER 135.A OG no hydrogen 2.933 N/A SER 141.A N.A VAL 132.A O no hydrogen 3.053 N/A SER 141.A N.B VAL 132.A O no hydrogen 3.063 N/A SER 141.A OG.B VAL 132.A O no hydrogen 2.854 N/A SER 144.A N GLN 147.A OE1 no hydrogen 2.917 N/A LEU 145.A N LYS 130.A O no hydrogen 2.871 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.794 N/A GLN 147.A N SER 144.A OG no hydrogen 3.044 N/A LEU 148.A N SER 144.A O no hydrogen 3.001 N/A VAL 149.A N LEU 145.A O no hydrogen 2.868 N/A GLU 150.A N GLU 146.A O no hydrogen 2.951 N/A THR 151.A N GLN 147.A O no hydrogen 3.201 N/A THR 151.A N LEU 148.A O no hydrogen 3.119 N/A THR 151.A OG1 GLN 147.A O no hydrogen 2.831 N/A TYR 152.A N VAL 149.A O no hydrogen 2.999 N/A TYR 152.A OH ALA 97.A O no hydrogen 2.447 N/A LEU 153.A N VAL 149.A O no hydrogen 3.023 N/A VAL 155.A N TYR 152.A O no hydrogen 3.026 N/A GLY 156.A N LEU 153.A O no hydrogen 2.991 N/A LEU 157.A N TYR 152.A O no hydrogen 3.401 N/A HIS 159.A NE2 GLN 114.A OE1 no hydrogen 3.057 N/A VAL 160.A N ALA 186.A O no hydrogen 3.314 N/A LEU 161.A N LEU 118.A O no hydrogen 2.662 N/A CYS 162.A N.A GLN 188.A O no hydrogen 2.789 N/A CYS 162.A N.B GLN 188.A O no hydrogen 2.755 N/A THR 163.A N LEU 120.A O no hydrogen 2.977 N/A ILE 165.A N VAL 122.A O no hydrogen 2.894 N/A ARG 166.A NH1 GLY 170.A O no hydrogen 2.220 N/A GLY 170.A N GLY 192.A O no hydrogen 2.593 N/A SER 171.A OG GLY 191.A O no hydrogen 2.969 N/A SER 173.A OG GLU 177.A OE2 no hydrogen 3.053 N/A TYR 175.A OH CYS 162.A O.A no hydrogen 2.553 N/A TYR 175.A OH CYS 162.A O.B no hydrogen 3.066 N/A GLU 176.A N VAL 172.A O no hydrogen 3.030 N/A GLU 177.A N SER 173.A O no hydrogen 3.165 N/A VAL 178.A N LEU 174.A O no hydrogen 3.173 N/A CYS 179.A N TYR 175.A O no hydrogen 3.041 N/A CYS 179.A SG TYR 175.A O no hydrogen 3.175 N/A ALA 180.A N GLU 176.A O no hydrogen 3.149 N/A ARG 181.A N GLU 177.A O no hydrogen 3.038 N/A ARG 181.A NE GLU 150.A OE2 no hydrogen 3.364 N/A ARG 181.A NE TYR 182.A OH no hydrogen 2.929 N/A ARG 181.A NH2 GLU 150.A OE2 no hydrogen 3.133 N/A TYR 182.A N VAL 178.A O no hydrogen 3.061 N/A TYR 182.A OH GLU 150.A OE2 no hydrogen 2.442 N/A GLN 184.A N GLN 184.A OE1 no hydrogen 2.717 N/A ILE 185.A N TYR 182.A O no hydrogen 2.975 N/A ALA 186.A N LYS 158.A O no hydrogen 2.795 N/A GLN 188.A N VAL 160.A O no hydrogen 2.668 N/A GLN 188.A NE2 GLN 69.A OE1 no hydrogen 2.977 N/A SER 189.A N GLY 209.A O no hydrogen 2.892 N/A SER 190.A N CYS 162.A O.A no hydrogen 3.387 N/A SER 190.A N CYS 162.A O.B no hydrogen 2.895 N/A GLY 194.A N ASP 198.A OD2 no hydrogen 2.506 N/A ASP 195.A N ASP 198.A OD2 no hydrogen 2.859 N/A ASP 198.A N ASP 195.A O no hydrogen 2.882 N/A ASP 198.A N ASP 195.A OD1 no hydrogen 2.871 N/A ALA 200.A N ILE 196.A O no hydrogen 3.184 N/A ALA 201.A N ASP 197.A O no hydrogen 3.029 N/A LEU 202.A N ILE 199.A O no hydrogen 3.119 N/A ARG 203.A N.B ALA 200.A O no hydrogen 3.272 N/A ARG 203.A NH1.B CYS 229.A O no hydrogen 3.272 N/A THR 205.A N LEU 202.A O no hydrogen 3.242 N/A THR 205.A OG1 LEU 202.A O no hydrogen 2.717 N/A VAL 207.A N THR 205.A OG1 no hydrogen 3.275 N/A ARG 208.A N PHE 187.A O no hydrogen 2.862 N/A GLY 209.A N PHE 187.A O no hydrogen 3.244 N/A VAL 210.A N MET 1.A O no hydrogen 2.900 N/A ILE 211.A N SER 189.A O no hydrogen 2.770 N/A VAL 212.A N ILE 3.A O no hydrogen 2.920 N/A LEU 216.A N GLY 213.A O no hydrogen 3.177 N/A LEU 217.A N GLY 213.A O no hydrogen 3.430 N/A GLU 218.A N ARG 214.A O no hydrogen 2.913 N/A GLY 219.A N LEU 216.A O no hydrogen 3.203 N/A LYS 220.A N ALA 215.A O no hydrogen 3.058 N/A LYS 220.A NZ GLY 194.A O no hydrogen 3.039 N/A THR 222.A N GLU 225.A OE1 no hydrogen 3.027 N/A THR 222.A OG1 GLU 225.A OE1 no hydrogen 3.530 N/A LYS 224.A N GLN 33.A OE1 no hydrogen 3.021 N/A GLU 225.A N THR 222.A OG1 no hydrogen 3.124 N/A ALA 226.A N THR 222.A O no hydrogen 2.868 N/A ILE 227.A N VAL 223.A O no hydrogen 2.847 N/A GLN 228.A N LYS 224.A O no hydrogen 2.935 N/A GLN 228.A NE2 LYS 224.A O no hydrogen 3.689 N/A CYS 229.A N GLU 225.A O no hydrogen 2.921 N/A CYS 229.A SG ILE 196.A O no hydrogen 3.591 N/A TRP 230.A N ALA 226.A O no hydrogen 2.906 N/A GLN 231.A N ILE 227.A O no hydrogen 2.918 N/A ASN 232.A N CYS 229.A O no hydrogen 2.980 N/A