Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5f44_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N LEU 82.A O no hydrogen 2.832 N/A GLN 4.A NE2 ALA 121.A O no hydrogen 2.847 N/A ASN 5.A ND2 ASN 128.A OD1 no hydrogen 3.665 N/A VAL 6.A N GLN 80.A O no hydrogen 2.876 N/A VAL 7.A N VAL 129.A O no hydrogen 2.785 N/A LEU 8.A N LEU 78.A O no hydrogen 2.817 N/A THR 9.A N VAL 131.A O no hydrogen 2.958 N/A LYS 10.A N GLY 76.A O no hydrogen 2.819 N/A TYR 11.A OH TRP 28.A O no hydrogen 2.591 N/A GLY 12.A N LYS 34.A O no hydrogen 2.780 N/A VAL 17.A N ASP 14.A O no hydrogen 3.066 N/A ARG 22.A NH1 ILE 20.A O no hydrogen 2.869 N/A ALA 23.A N GLN 26.A OE1 no hydrogen 2.787 N/A THR 24.A OG1 LYS 122.A O no hydrogen 2.528 N/A GLN 26.A N ALA 23.A O no hydrogen 3.092 N/A TRP 28.A N TYR 132.A OH no hydrogen 2.874 N/A TRP 28.A NE1 ASP 31.A OD1.B no hydrogen 2.846 N/A THR 29.A OG1 ASP 31.A OD1.C no hydrogen 3.165 N/A ASP 31.A OD1.B ASP 31.A O no hydrogen 2.611 N/A ASP 31.A OD1.B ASP 31.A OD2.B no hydrogen 2.172 N/A ASP 31.A OD1.C THR 29.A OG1 no hydrogen 3.165 N/A ASP 31.A OD1.C ASP 31.A OD2.C no hydrogen 2.192 N/A ASP 31.A OD2.B ASP 31.A OD1.B no hydrogen 2.172 N/A ASP 31.A OD2.C ASP 31.A OD1.C no hydrogen 2.192 N/A ALA 33.A N GLY 30.A O no hydrogen 2.754 N/A LYS 34.A N GLY 12.A O no hydrogen 2.915 N/A LEU 36.A N LYS 10.A O no hydrogen 2.795 N/A GLY 38.A N THR 72.A O no hydrogen 2.840 N/A VAL 39.A N THR 72.A OG1 no hydrogen 2.927 N/A ASP 40.A N ASN 104.A O no hydrogen 3.027 N/A PHE 41.A N GLY 70.A O no hydrogen 2.868 N/A THR 42.A N HIS 101.A O no hydrogen 2.833 N/A ILE 43.A N ALA 68.A O no hydrogen 2.761 N/A TYR 44.A N LEU 99.A O no hydrogen 2.781 N/A ASN 45.A N PRO 65.A O no hydrogen 2.841 N/A ASN 45.A ND2 SER 86.A OG no hydrogen 2.921 N/A VAL 46.A N VAL 97.A O no hydrogen 2.888 N/A THR 47.A N ASN 45.A OD1 no hydrogen 3.064 N/A THR 47.A OG1 ASN 45.A OD1 no hydrogen 2.738 N/A THR 47.A OG1 VAL 97.A O no hydrogen 3.524 N/A ASN 49.A ND2 SER 60.A O no hydrogen 3.063 N/A ASN 49.A ND2 ASP 62.A O no hydrogen 3.061 N/A TYR 50.A N VAL 46.A O no hydrogen 2.820 N/A TRP 51.A N THR 47.A O no hydrogen 2.880 N/A TRP 51.A NE1 ALA 95.A O no hydrogen 2.941 N/A ALA 52.A N ALA 48.A O no hydrogen 3.043 N/A SER 53.A N TYR 50.A O no hydrogen 3.109 N/A SER 53.A OG ASP 56.A OD2 no hydrogen 2.761 N/A ASP 56.A N SER 53.A O no hydrogen 2.893 N/A TYR 57.A N PRO 54.A O no hydrogen 2.980 N/A TYR 57.A OH SER 60.A O no hydrogen 2.688 N/A ASP 62.A N SER 60.A OG no hydrogen 3.195 N/A SER 63.A OG ASP 62.A O no hydrogen 2.497 N/A ALA 64.A N PHE 61.A O no hydrogen 2.977 N/A ALA 67.A N ILE 43.A O no hydrogen 2.670 N/A ALA 68.A N ILE 43.A O no hydrogen 3.207 N/A GLY 70.A N PHE 41.A O no hydrogen 2.956 N/A THR 71.A OG1 ASP 40.A OD1 no hydrogen 2.758 N/A THR 72.A N VAL 39.A O no hydrogen 3.002 N/A THR 72.A OG1 LEU 36.A O no hydrogen 2.701 N/A ASN 73.A N GLN 77.A O no hydrogen 2.776 N/A LYS 75.A N ASN 73.A OD1 no hydrogen 2.882 N/A GLY 76.A N ASN 73.A O no hydrogen 2.804 N/A GLN 77.A N ASN 73.A OD1 no hydrogen 2.959 N/A GLN 77.A NE2 THR 9.A OG1 no hydrogen 2.951 N/A LEU 78.A N LEU 8.A O no hydrogen 2.981 N/A GLN 80.A N VAL 6.A O no hydrogen 2.878 N/A GLN 80.A NE2 ALA 81.A O no hydrogen 2.975 N/A LEU 82.A N GLN 4.A O no hydrogen 2.770 N/A ILE 84.A N THR 2.A O no hydrogen 3.087 N/A SER 86.A N ARG 94.A O no hydrogen 2.930 N/A LYS 87.A NZ GLY 91.A O no hydrogen 3.047 N/A LYS 87.A NZ THR 93.A OG1 no hydrogen 2.971 N/A ASP 88.A N LYS 92.A O no hydrogen 2.821 N/A SER 90.A N ASP 88.A OD1 no hydrogen 2.915 N/A SER 90.A OG.A ASP 88.A OD1 no hydrogen 2.714 N/A GLY 91.A N ASP 88.A O no hydrogen 2.969 N/A LYS 92.A N ASP 88.A OD1 no hydrogen 2.910 N/A ARG 94.A N SER 86.A O no hydrogen 2.739 N/A ARG 94.A NE ASP 88.A OD2 no hydrogen 2.879 N/A ARG 94.A NH2 ASP 88.A OD2 no hydrogen 3.240 N/A ALA 96.A N ILE 84.A O no hydrogen 2.928 N/A VAL 97.A N THR 47.A OG1 no hydrogen 2.949 N/A TYR 98.A N LEU 117.A O no hydrogen 3.043 N/A TYR 98.A OH PRO 83.A O no hydrogen 2.584 N/A LEU 99.A N TYR 44.A O no hydrogen 2.811 N/A PHE 100.A N PHE 115.A O no hydrogen 2.737 N/A HIS 101.A N THR 42.A O no hydrogen 2.856 N/A HIS 101.A ND1 ASP 114.A OD1 no hydrogen 2.770 N/A THR 103.A N ASP 40.A O no hydrogen 2.842 N/A ASN 104.A N ASP 40.A O no hydrogen 3.417 N/A ASN 104.A ND2 ASP 40.A OD2 no hydrogen 3.372 N/A ASN 104.A ND2 LYS 176.A O no hydrogen 2.933 N/A ARG 106.A NH1 GLN 37.A O no hydrogen 2.802 N/A ARG 106.A NH1 GLN 37.A OE1 no hydrogen 3.240 N/A ARG 106.A NH2 LEU 191.A O no hydrogen 3.188 N/A ALA 107.A N ASN 194.A OD1 no hydrogen 3.018 N/A TYR 109.A N ARG 106.A O no hydrogen 3.043 N/A ASN 110.A N VAL 136.A O no hydrogen 2.819 N/A ASN 110.A ND2 VAL 136.A O no hydrogen 3.051 N/A THR 111.A OG1 SER 112.A O no hydrogen 3.535 N/A SER 112.A N GLU 102.A OE2 no hydrogen 3.124 N/A SER 112.A OG GLU 102.A OE2 no hydrogen 2.392 N/A PHE 115.A N PHE 100.A O no hydrogen 3.354 N/A LEU 117.A N TYR 98.A O no hydrogen 3.064 N/A LEU 119.A N ALA 96.A O no hydrogen 2.928 N/A ALA 121.A N GLN 4.A OE1 no hydrogen 2.833 N/A LYS 122.A NZ ASP 25.A OD2 no hydrogen 2.518 N/A ALA 124.A N ASN 128.A O no hydrogen 2.783 N/A GLY 127.A N ALA 124.A O no hydrogen 2.943 N/A ASN 128.A N ASP 126.A OD1 no hydrogen 2.927 N/A ASN 128.A ND2 TYR 130.A OH no hydrogen 3.325 N/A VAL 129.A N ASN 5.A O no hydrogen 2.875 N/A TYR 130.A N THR 24.A O no hydrogen 2.920 N/A TYR 130.A OH ASP 126.A OD2 no hydrogen 2.482 N/A VAL 131.A N VAL 7.A O no hydrogen 2.938 N/A TYR 132.A OH GLN 26.A O no hydrogen 2.675 N/A LYS 134.A NZ ALA 19.A O no hydrogen 2.754 N/A LYS 134.A NZ ASP 21.A OD1 no hydrogen 2.791 N/A LYS 138.A N GLY 108.A O no hydrogen 2.873 N/A TYR 141.A N PHE 221.A O no hydrogen 3.085 N/A GLU 142.A N ASN 251.A OD1 no hydrogen 2.851 N/A ARG 143.A N LEU 218.A O no hydrogen 2.945 N/A ARG 143.A NE LYS 248.A O no hydrogen 3.310 N/A ARG 143.A NH1 THR 144.A O no hydrogen 2.943 N/A ARG 143.A NH1 SER 254.A OG no hydrogen 2.930 N/A ARG 143.A NH2 SER 254.A OG no hydrogen 3.091 N/A THR 144.A N SER 252.A O no hydrogen 3.038 N/A PHE 145.A N PHE 216.A O no hydrogen 2.775 N/A VAL 146.A N SER 254.A O no hydrogen 2.934 N/A LYS 147.A N GLY 214.A O no hydrogen 2.708 N/A LYS 148.A N ILE 256.A O no hydrogen 2.933 N/A LYS 148.A NZ ASP 255.A OD2 no hydrogen 3.017 N/A ASP 149.A N GLU 154.A O no hydrogen 2.884 N/A ALA 150.A N ASP 258.A O no hydrogen 2.755 N/A GLU 151.A N ASP 149.A OD1 no hydrogen 2.809 N/A THR 152.A N ASP 149.A OD1 no hydrogen 3.085 N/A LYS 153.A N ASP 149.A O no hydrogen 2.689 N/A LYS 153.A NZ ALA 150.A O no hydrogen 2.947 N/A GLU 154.A N THR 152.A OG1 no hydrogen 3.067 N/A LEU 156.A N LYS 147.A O no hydrogen 2.877 N/A GLY 158.A N SER 210.A O no hydrogen 2.808 N/A ALA 159.A N SER 210.A OG no hydrogen 2.931 N/A GLY 160.A N ASN 234.A O no hydrogen 2.819 N/A PHE 161.A N PHE 208.A O no hydrogen 2.676 N/A LYS 162.A N VAL 231.A O no hydrogen 2.800 N/A LYS 162.A NZ GLU 202.A O no hydrogen 2.896 N/A SER 164.A N THR 229.A O no hydrogen 2.890 N/A ASN 165.A N LYS 169.A O no hydrogen 2.871 N/A GLY 168.A N ASN 165.A O no hydrogen 2.917 N/A LYS 169.A N ASN 165.A OD1 no hydrogen 2.976 N/A PHE 170.A N VAL 200.A O no hydrogen 2.752 N/A LEU 171.A N ILE 163.A O no hydrogen 2.780 N/A LYS 172.A N THR 198.A O no hydrogen 2.716 N/A LYS 172.A NZ SER 180.A OG no hydrogen 2.773 N/A LEU 173.A N THR 206.A OG1 no hydrogen 2.923 N/A THR 174.A N ARG 196.A O no hydrogen 2.889 N/A THR 174.A OG1 ASP 175.A O no hydrogen 2.906 N/A ASP 175.A N GLN 179.A O no hydrogen 2.835 N/A LYS 176.A NZ GLY 38.A O no hydrogen 3.391 N/A LYS 176.A NZ ASP 40.A OD1 no hydrogen 2.526 N/A LYS 176.A NZ ASP 40.A OD2 no hydrogen 3.116 N/A ASP 177.A N ASP 175.A OD1 no hydrogen 2.841 N/A GLY 178.A N ASP 175.A O no hydrogen 2.958 N/A GLN 179.A N ASP 175.A OD1 no hydrogen 2.845 N/A GLN 179.A NE2 ASP 177.A O no hydrogen 3.357 N/A GLY 186.A N THR 209.A O no hydrogen 2.736 N/A ILE 188.A N GLY 217.A O no hydrogen 2.717 N/A VAL 190.A N ILE 188.A O no hydrogen 3.014 N/A LEU 191.A N ASN 219.A OD1 no hydrogen 2.957 N/A ALA 192.A N ASP 189.A OD1 no hydrogen 2.903 N/A ASN 193.A N ASP 189.A O no hydrogen 3.103 N/A ASN 193.A ND2 ASP 189.A O no hydrogen 2.797 N/A ASN 194.A N LEU 191.A O no hydrogen 3.407 N/A TYR 195.A N VAL 190.A O no hydrogen 3.000 N/A ARG 196.A N THR 174.A O no hydrogen 2.810 N/A ARG 196.A NH1 ASN 194.A OD1 no hydrogen 2.785 N/A ARG 196.A NH1 TYR 195.A O no hydrogen 2.964 N/A ARG 196.A NH2 ASN 104.A OD1 no hydrogen 2.895 N/A ARG 196.A NH2 ASN 194.A OD1 no hydrogen 3.372 N/A THR 198.A N LYS 172.A O no hydrogen 2.866 N/A THR 198.A OG1 LYS 172.A O no hydrogen 2.660 N/A VAL 200.A N PHE 170.A O no hydrogen 2.783 N/A ASP 204.A N ALA 201.A O no hydrogen 2.870 N/A ALA 205.A N GLU 202.A O no hydrogen 3.072 N/A THR 206.A N LEU 171.A O no hydrogen 2.860 N/A PHE 208.A N PHE 161.A O no hydrogen 2.813 N/A SER 210.A N ALA 159.A O no hydrogen 2.946 N/A SER 210.A OG LEU 156.A O no hydrogen 2.747 N/A ASP 211.A N LYS 215.A O no hydrogen 2.947 N/A SER 213.A N ASP 211.A OD1 no hydrogen 2.807 N/A GLY 214.A N ASP 211.A O no hydrogen 2.779 N/A LYS 215.A N ASP 211.A OD1 no hydrogen 2.954 N/A PHE 216.A N PHE 145.A O no hydrogen 2.958 N/A LEU 218.A N ARG 143.A O no hydrogen 3.128 N/A ASN 219.A N ILE 188.A O no hydrogen 3.357 N/A ASN 219.A ND2 ASP 189.A OD1 no hydrogen 2.771 N/A PHE 221.A N TYR 141.A O no hydrogen 2.936 N/A THR 225.A N ASP 223.A OD1 no hydrogen 2.927 N/A THR 226.A N ASP 223.A OD1 no hydrogen 2.785 N/A THR 226.A OG1 ASP 223.A OD1 no hydrogen 2.891 N/A THR 226.A OG1 ASP 223.A OD2 no hydrogen 2.797 N/A TYR 228.A N PHE 247.A O no hydrogen 2.765 N/A THR 229.A N SER 164.A O no hydrogen 2.863 N/A THR 229.A OG1 ASP 246.A OD1 no hydrogen 2.733 N/A ALA 230.A N THR 245.A O no hydrogen 2.707 N/A VAL 231.A N LYS 162.A O no hydrogen 2.767 N/A THR 233.A N GLY 160.A O no hydrogen 2.790 N/A THR 233.A OG1 GLY 160.A O no hydrogen 3.459 N/A ASN 234.A N GLY 160.A O no hydrogen 2.956 N/A TYR 239.A N PRO 236.A O no hydrogen 3.069 N/A TYR 239.A OH ASP 149.A OD2 no hydrogen 2.487 N/A ASP 240.A N ALA 259.A O no hydrogen 2.794 N/A ALA 242.A N GLU 232.A OE2 no hydrogen 2.894 N/A THR 245.A N ALA 230.A O no hydrogen 2.994 N/A THR 245.A OG1 ALA 243.A O no hydrogen 3.436 N/A PHE 247.A N TYR 228.A O no hydrogen 2.818 N/A LYS 248.A NZ THR 225.A O no hydrogen 3.410 N/A LYS 248.A NZ THR 227.A OG1 no hydrogen 2.737 N/A ASN 251.A N GLU 142.A O no hydrogen 2.784 N/A SER 252.A N ASP 250.A OD1 no hydrogen 3.029 N/A SER 252.A OG ASP 250.A OD1 no hydrogen 2.616 N/A SER 254.A N THR 144.A O no hydrogen 3.071 N/A ILE 256.A N VAL 146.A O no hydrogen 2.862 N/A ASP 258.A N LYS 148.A O no hydrogen 2.805 N/A SER 261.A N GLY 238.A O no hydrogen 2.813 N/A SER 261.A OG ASP 240.A OD1 no hydrogen 2.760 N/A