Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mac_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A OG GLN 2.A O no hydrogen 3.137 N/A GLY 6.A N GLN 2.A O no hydrogen 2.907 N/A ILE 7.A N LEU 3.A O no hydrogen 3.103 N/A ILE 7.A N LEU 4.A O no hydrogen 2.872 N/A VAL 8.A N LEU 4.A O no hydrogen 2.959 N/A GLN 9.A N SER 5.A O no hydrogen 2.871 N/A GLN 10.A N GLY 6.A O no hydrogen 3.225 N/A GLN 10.A NE2 GLN 165.A OE1 no hydrogen 2.738 N/A GLN 11.A N ILE 7.A O no hydrogen 3.014 N/A GLN 11.A NE2 ILE 86.A O no hydrogen 3.013 N/A ASN 12.A N VAL 8.A O no hydrogen 3.094 N/A ASN 13.A N GLN 9.A O no hydrogen 3.214 N/A LEU 14.A N GLN 10.A O no hydrogen 2.844 N/A LEU 15.A N GLN 11.A O no hydrogen 3.033 N/A ARG 16.A N ASN 12.A O no hydrogen 3.052 N/A ARG 16.A NH1 ASN 12.A OD1 no hydrogen 3.422 N/A ALA 17.A N ASN 13.A O no hydrogen 3.028 N/A ILE 18.A N LEU 14.A O no hydrogen 3.025 N/A GLU 19.A N LEU 15.A O no hydrogen 2.908 N/A ALA 20.A N ARG 16.A O no hydrogen 3.054 N/A GLN 21.A N ALA 17.A O no hydrogen 2.907 N/A GLN 21.A NE2 ILE 172.A O no hydrogen 3.187 N/A GLN 22.A N ILE 18.A O no hydrogen 2.926 N/A HIS 23.A N GLU 19.A O no hydrogen 3.036 N/A LEU 24.A N ALA 20.A O no hydrogen 3.189 N/A LEU 25.A N GLN 21.A O no hydrogen 2.821 N/A GLN 26.A N GLN 22.A O no hydrogen 2.819 N/A LEU 27.A N HIS 23.A O no hydrogen 3.210 N/A THR 28.A N LEU 24.A O no hydrogen 3.001 N/A THR 28.A OG1 LEU 25.A O no hydrogen 2.592 N/A VAL 29.A N LEU 25.A O no hydrogen 2.880 N/A TRP 30.A N GLN 26.A O no hydrogen 2.842 N/A GLY 31.A N LEU 27.A O no hydrogen 2.870 N/A ILE 32.A N THR 28.A O no hydrogen 3.037 N/A LYS 33.A N VAL 29.A O no hydrogen 3.097 N/A LYS 33.A NZ ASN 52.A OD1 no hydrogen 3.356 N/A GLN 34.A N TRP 30.A O no hydrogen 2.980 N/A LEU 35.A N GLY 31.A O no hydrogen 2.990 N/A GLN 36.A N ILE 32.A O no hydrogen 2.677 N/A ALA 37.A N LYS 33.A O no hydrogen 3.162 N/A ARG 38.A N GLN 34.A O no hydrogen 3.325 N/A ILE 39.A N LEU 35.A O no hydrogen 2.922 N/A LEU 40.A N GLN 36.A O no hydrogen 2.893 N/A MET 45.A N THR 42.A O no hydrogen 3.191 N/A TRP 47.A NE1 LEU 106.A O no hydrogen 2.763 N/A ASP 48.A N TRP 44.A O no hydrogen 2.993 N/A ARG 49.A N MET 45.A O no hydrogen 3.065 N/A GLU 50.A N GLU 46.A O no hydrogen 3.053 N/A ILE 51.A N TRP 47.A O no hydrogen 2.877 N/A ASN 52.A N ASP 48.A O no hydrogen 3.141 N/A ASN 53.A N ARG 49.A O no hydrogen 2.824 N/A TYR 54.A N GLU 50.A O no hydrogen 2.978 N/A THR 55.A N ILE 51.A O no hydrogen 2.963 N/A THR 55.A OG1 ILE 51.A O no hydrogen 2.765 N/A SER 56.A N ASN 52.A O no hydrogen 3.051 N/A SER 56.A OG ASN 52.A O no hydrogen 3.122 N/A LEU 57.A N ASN 53.A O no hydrogen 3.169 N/A ILE 58.A N TYR 54.A O no hydrogen 2.950 N/A HIS 59.A N THR 55.A O no hydrogen 3.060 N/A SER 60.A N SER 56.A O no hydrogen 2.886 N/A LEU 61.A N LEU 57.A O no hydrogen 2.912 N/A ILE 62.A N ILE 58.A O no hydrogen 2.873 N/A GLU 63.A N HIS 59.A O no hydrogen 3.064 N/A GLU 64.A N SER 60.A O no hydrogen 2.873 N/A SER 65.A N LEU 61.A O no hydrogen 2.816 N/A SER 65.A OG LEU 61.A O no hydrogen 2.694 N/A GLN 66.A N ILE 62.A O no hydrogen 2.971 N/A GLN 66.A NE2 GLU 19.A OE2 no hydrogen 2.769 N/A ASN 67.A N GLU 63.A O no hydrogen 3.014 N/A GLN 68.A N GLU 64.A O no hydrogen 2.968 N/A GLN 68.A NE2 GLN 68.A O no hydrogen 3.392 N/A GLN 68.A NE2 ASN 72.A OD1 no hydrogen 2.895 N/A GLN 69.A N SER 65.A O no hydrogen 2.863 N/A GLN 69.A NE2 VAL 8.A O no hydrogen 3.008 N/A GLN 69.A NE2 GLU 73.A OE2 no hydrogen 2.696 N/A GLU 70.A N GLN 66.A O no hydrogen 3.200 N/A LYS 71.A N ASN 67.A O no hydrogen 3.210 N/A ASN 72.A N GLN 68.A O no hydrogen 2.861 N/A ASN 72.A ND2 GLY 85.A O no hydrogen 3.207 N/A GLU 73.A N GLN 69.A O no hydrogen 2.909 N/A GLN 74.A N GLU 70.A O no hydrogen 2.852 N/A GLU 75.A N LYS 71.A O no hydrogen 2.905 N/A LEU 76.A N ASN 72.A O no hydrogen 3.177 N/A LEU 77.A N GLU 73.A O no hydrogen 3.008 N/A GLU 78.A N GLN 74.A O no hydrogen 2.779 N/A GLY 79.A N LEU 76.A O no hydrogen 2.999 N/A SER 84.A N GLY 80.A O no hydrogen 3.223 N/A GLY 85.A N GLN 81.A O no hydrogen 2.964 N/A ILE 86.A N LEU 82.A O no hydrogen 2.792 N/A VAL 87.A N LEU 83.A O no hydrogen 2.993 N/A GLN 88.A N SER 84.A O no hydrogen 2.896 N/A GLN 88.A NE2 ASN 92.A OD1 no hydrogen 3.004 N/A GLN 89.A N GLY 85.A O no hydrogen 2.790 N/A GLN 89.A NE2 SER 65.A O no hydrogen 3.189 N/A GLN 89.A NE2 GLN 69.A OE1 no hydrogen 3.380 N/A GLN 90.A N ILE 86.A O no hydrogen 3.111 N/A GLN 90.A NE2 ILE 161.A O no hydrogen 2.846 N/A ASN 91.A N VAL 87.A O no hydrogen 3.157 N/A ASN 92.A N GLN 88.A O no hydrogen 3.073 N/A ASN 92.A ND2 GLN 89.A OE1 no hydrogen 3.222 N/A LEU 93.A N GLN 89.A O no hydrogen 3.245 N/A LEU 94.A N GLN 90.A O no hydrogen 2.868 N/A ARG 95.A N ASN 91.A O no hydrogen 2.905 N/A ALA 96.A N ASN 92.A O no hydrogen 3.030 N/A ILE 97.A N LEU 93.A O no hydrogen 2.955 N/A GLU 98.A N LEU 94.A O no hydrogen 2.929 N/A ALA 99.A N ARG 95.A O no hydrogen 2.955 N/A GLN 100.A N ALA 96.A O no hydrogen 2.849 N/A GLN 100.A NE2 ILE 18.A O no hydrogen 3.182 N/A GLN 100.A NE2 GLN 22.A OE1 no hydrogen 3.177 N/A GLN 101.A N ILE 97.A O no hydrogen 2.901 N/A HIS 102.A N GLU 98.A O no hydrogen 3.096 N/A HIS 102.A NE2 GLU 50.A OE2 no hydrogen 2.978 N/A LEU 103.A N ALA 99.A O no hydrogen 3.025 N/A LEU 104.A N GLN 100.A O no hydrogen 2.763 N/A GLN 105.A N GLN 101.A O no hydrogen 2.963 N/A LEU 106.A N HIS 102.A O no hydrogen 2.972 N/A THR 107.A N LEU 103.A O no hydrogen 2.991 N/A THR 107.A OG1 LEU 104.A O no hydrogen 2.544 N/A VAL 108.A N LEU 104.A O no hydrogen 2.833 N/A TRP 109.A N GLN 105.A O no hydrogen 2.997 N/A GLY 110.A N LEU 106.A O no hydrogen 2.946 N/A ILE 111.A N THR 107.A O no hydrogen 2.903 N/A LYS 112.A N VAL 108.A O no hydrogen 2.936 N/A LYS 112.A NZ ASP 124.A OD1 no hydrogen 3.047 N/A GLN 113.A N TRP 109.A O no hydrogen 3.025 N/A LEU 114.A N GLY 110.A O no hydrogen 3.123 N/A GLN 115.A N ILE 111.A O no hydrogen 2.890 N/A ALA 116.A N LYS 112.A O no hydrogen 3.163 N/A ARG 117.A N LEU 114.A O no hydrogen 3.219 N/A ARG 117.A NH1 ALA 116.A O no hydrogen 3.065 N/A TRP 123.A NE1 LEU 181.A O no hydrogen 2.923 N/A ASP 124.A N TRP 120.A O no hydrogen 2.819 N/A ARG 125.A N MET 121.A O no hydrogen 3.050 N/A GLU 126.A N GLU 122.A O no hydrogen 3.079 N/A ILE 127.A N TRP 123.A O no hydrogen 2.871 N/A ASN 128.A N ASP 124.A O no hydrogen 2.915 N/A ASN 129.A N ARG 125.A O no hydrogen 3.029 N/A TYR 130.A N GLU 126.A O no hydrogen 3.087 N/A THR 131.A N ILE 127.A O no hydrogen 2.835 N/A THR 131.A OG1 ILE 127.A O no hydrogen 2.914 N/A SER 132.A N ASN 128.A O no hydrogen 2.856 N/A SER 132.A OG ASN 128.A O no hydrogen 3.072 N/A LEU 133.A N ASN 129.A O no hydrogen 3.101 N/A ILE 134.A N TYR 130.A O no hydrogen 2.946 N/A HIS 135.A N THR 131.A O no hydrogen 2.962 N/A SER 136.A N SER 132.A O no hydrogen 3.180 N/A LEU 137.A N LEU 133.A O no hydrogen 2.865 N/A ILE 138.A N ILE 134.A O no hydrogen 2.748 N/A GLU 139.A N HIS 135.A O no hydrogen 3.036 N/A GLU 140.A N SER 136.A O no hydrogen 3.013 N/A SER 141.A N LEU 137.A O no hydrogen 2.940 N/A SER 141.A OG LEU 137.A O no hydrogen 2.889 N/A GLN 142.A N ILE 138.A O no hydrogen 2.892 N/A GLN 142.A NE2 GLU 98.A OE2 no hydrogen 2.656 N/A ASN 143.A N GLU 139.A O no hydrogen 3.129 N/A GLN 144.A N GLU 140.A O no hydrogen 3.034 N/A GLN 144.A NE2 GLN 144.A O no hydrogen 3.445 N/A GLN 144.A NE2 ASN 148.A OD1 no hydrogen 3.039 N/A GLN 145.A N SER 141.A O no hydrogen 2.982 N/A GLN 145.A NE2 VAL 87.A O no hydrogen 2.958 N/A GLN 145.A NE2 GLU 149.A OE2 no hydrogen 3.077 N/A GLU 146.A N GLN 142.A O no hydrogen 3.038 N/A LYS 147.A N ASN 143.A O no hydrogen 2.980 N/A ASN 148.A N GLN 144.A O no hydrogen 2.761 N/A GLU 149.A N GLN 145.A O no hydrogen 2.849 N/A GLN 150.A N GLU 146.A O no hydrogen 2.925 N/A GLU 151.A N LYS 147.A O no hydrogen 3.032 N/A LEU 152.A N ASN 148.A O no hydrogen 3.055 N/A LEU 153.A N GLU 149.A O no hydrogen 3.173 N/A GLU 154.A N GLN 150.A O no hydrogen 3.472 N/A SER 159.A N GLY 155.A O no hydrogen 3.524 N/A SER 159.A OG GLY 155.A O no hydrogen 2.948 N/A GLY 160.A N GLN 156.A O no hydrogen 3.003 N/A ILE 161.A N LEU 157.A O no hydrogen 2.752 N/A VAL 162.A N LEU 158.A O no hydrogen 2.878 N/A GLN 163.A N SER 159.A O no hydrogen 2.843 N/A GLN 163.A NE2 ASN 167.A OD1 no hydrogen 3.447 N/A GLN 164.A N GLY 160.A O no hydrogen 2.817 N/A GLN 164.A NE2 SER 141.A O no hydrogen 2.969 N/A GLN 164.A NE2 GLN 145.A OE1 no hydrogen 2.918 N/A GLN 165.A N ILE 161.A O no hydrogen 3.165 N/A ASN 166.A N VAL 162.A O no hydrogen 3.369 N/A ASN 167.A N GLN 163.A O no hydrogen 3.123 N/A ASN 167.A ND2 GLN 164.A OE1 no hydrogen 3.038 N/A LEU 168.A N GLN 164.A O no hydrogen 3.104 N/A LEU 169.A N GLN 165.A O no hydrogen 3.152 N/A ARG 170.A N ASN 166.A O no hydrogen 2.981 N/A ARG 170.A NH2 GLU 173.A OE1 no hydrogen 2.684 N/A ALA 171.A N ASN 167.A O no hydrogen 3.001 N/A ILE 172.A N LEU 168.A O no hydrogen 3.002 N/A GLU 173.A N LEU 169.A O no hydrogen 3.006 N/A ALA 174.A N ARG 170.A O no hydrogen 3.039 N/A GLN 175.A N ALA 171.A O no hydrogen 2.882 N/A GLN 175.A NE2 ILE 97.A O no hydrogen 2.917 N/A GLN 175.A NE2 GLN 101.A OE1 no hydrogen 2.995 N/A GLN 176.A N ILE 172.A O no hydrogen 2.905 N/A HIS 177.A N GLU 173.A O no hydrogen 3.485 N/A HIS 177.A ND1 GLU 173.A O no hydrogen 3.102 N/A LEU 178.A N ALA 174.A O no hydrogen 3.168 N/A LEU 179.A N GLN 175.A O no hydrogen 2.811 N/A GLN 180.A N GLN 176.A O no hydrogen 3.061 N/A LEU 181.A N HIS 177.A O no hydrogen 3.083 N/A THR 182.A N LEU 178.A O no hydrogen 3.158 N/A THR 182.A OG1 LEU 179.A O no hydrogen 3.043 N/A VAL 183.A N LEU 179.A O no hydrogen 2.935 N/A TRP 184.A N GLN 180.A O no hydrogen 2.993 N/A GLY 185.A N LEU 181.A O no hydrogen 2.949 N/A ILE 186.A N THR 182.A O no hydrogen 2.985 N/A LYS 187.A N VAL 183.A O no hydrogen 3.076 N/A GLN 188.A N TRP 184.A O no hydrogen 2.931 N/A GLN 188.A NE2 TRP 184.A O no hydrogen 3.341 N/A LEU 189.A N GLY 185.A O no hydrogen 2.992 N/A GLN 190.A N ILE 186.A O no hydrogen 2.898 N/A ALA 191.A N LYS 187.A O no hydrogen 3.310 N/A ARG 192.A N LEU 189.A O no hydrogen 3.148 N/A ARG 192.A NH1 GLN 188.A O no hydrogen 3.263 N/A ILE 193.A N GLN 190.A O no hydrogen 3.267 N/A