Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2frq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N TYR 172.A O no hydrogen 2.889 N/A TRP 8.A N VAL 170.A O no hydrogen 2.906 N/A TRP 8.A NE1 VAL 129.A O no hydrogen 2.688 N/A ARG 9.A N ASP 7.A OD1 no hydrogen 2.940 N/A ARG 9.A NE ASP 7.A OD1 no hydrogen 3.106 N/A ARG 9.A NE ASP 7.A OD2 no hydrogen 3.351 N/A ARG 9.A NH2 ASP 7.A OD2 no hydrogen 2.983 N/A GLU 10.A N ASP 7.A O no hydrogen 3.019 N/A LYS 11.A N TRP 8.A O no hydrogen 3.056 N/A GLY 12.A N ARG 9.A O no hydrogen 3.225 N/A CYS 13.A N TRP 8.A O no hydrogen 3.351 N/A CYS 13.A SG LYS 11.A O no hydrogen 3.666 N/A THR 15.A OG1 GLU 16.A O no hydrogen 3.460 N/A THR 15.A OG1 GLU 36.A OE1 no hydrogen 2.752 N/A LYS 18.A NZ GLU 16.A O no hydrogen 2.862 N/A LYS 18.A NZ SER 48.A OG no hydrogen 2.963 N/A GLN 20.A N SER 186.A O no hydrogen 2.931 N/A CYS 23.A N GLN 20.A O no hydrogen 3.416 N/A GLY 24.A N CYS 67.A O no hydrogen 2.924 N/A ALA 25.A N CYS 23.A O no hydrogen 2.744 N/A TRP 27.A NE1 GLY 66.A O no hydrogen 3.169 N/A PHE 29.A N ALA 25.A O no hydrogen 3.033 N/A SER 30.A N CYS 26.A O no hydrogen 2.883 N/A SER 30.A OG VAL 167.A O no hydrogen 2.688 N/A ALA 31.A N TRP 27.A O no hydrogen 3.071 N/A VAL 32.A N ALA 28.A O no hydrogen 3.017 N/A GLY 33.A N PHE 29.A O no hydrogen 2.974 N/A ALA 34.A N SER 30.A O no hydrogen 3.122 N/A LEU 35.A N ALA 31.A O no hydrogen 3.123 N/A GLU 36.A N VAL 32.A O no hydrogen 2.743 N/A ALA 37.A N GLY 33.A O no hydrogen 3.459 N/A GLN 38.A NE2 LYS 132.A O no hydrogen 3.053 N/A LEU 39.A N LEU 35.A O no hydrogen 2.862 N/A LYS 40.A N GLU 36.A O no hydrogen 3.059 N/A LYS 40.A NZ GLY 44.A O no hydrogen 2.773 N/A LEU 41.A N ALA 37.A O no hydrogen 3.003 N/A LYS 42.A N GLN 38.A O no hydrogen 2.991 N/A THR 43.A N LEU 39.A O no hydrogen 2.815 N/A THR 43.A OG1 LEU 39.A O no hydrogen 2.913 N/A GLY 44.A N LYS 40.A O no hydrogen 2.741 N/A LYS 45.A N THR 43.A OG1 no hydrogen 3.225 N/A LYS 45.A NZ THR 43.A OG1 no hydrogen 3.019 N/A LEU 49.A N GLU 36.A OE2 no hydrogen 2.877 N/A SER 50.A N ASP 86.A O no hydrogen 2.967 N/A SER 50.A OG TYR 91.A O no hydrogen 2.733 N/A GLN 52.A NE2 ASP 56.A OD1 no hydrogen 2.821 N/A GLN 52.A NE2 ASP 56.A OD2 no hydrogen 3.366 N/A GLN 52.A NE2 MET 96.A O no hydrogen 2.855 N/A ASN 53.A N SER 50.A OG no hydrogen 2.909 N/A ASN 53.A ND2 TYR 78.A OH no hydrogen 3.163 N/A VAL 55.A N ALA 51.A O no hydrogen 3.009 N/A ASP 56.A N GLN 52.A O no hydrogen 2.818 N/A CYS 57.A N ASN 53.A O no hydrogen 2.916 N/A CYS 57.A SG ASN 53.A O no hydrogen 3.353 N/A SER 58.A N LEU 54.A O no hydrogen 2.863 N/A SER 58.A OG ASN 64.A OD1 no hydrogen 3.019 N/A TYR 62.A N THR 59A.A O no hydrogen 2.827 N/A TYR 62.A OH ASP 81.A OD1 no hydrogen 2.744 N/A GLY 63.A N GLU 60B.A O no hydrogen 2.986 N/A ASN 64.A N THR 59A.A O no hydrogen 3.102 N/A ASN 64.A ND2 THR 74.A OG1 no hydrogen 3.093 N/A LYS 65.A N GLY 69.A O no hydrogen 2.728 N/A CYS 67.A N ASP 97.A OD2 no hydrogen 2.895 N/A CYS 67.A SG ASP 97.A OD2 no hydrogen 3.847 N/A ASN 68.A N LYS 65.A O no hydrogen 2.919 N/A GLY 69.A N GLY 66.A O no hydrogen 3.141 N/A THR 74.A OG1 TYR 62.A O no hydrogen 2.956 N/A THR 74.A OG1 ASN 64.A OD1 no hydrogen 2.998 N/A THR 74.A OG1 PHE 71.A O no hydrogen 3.423 N/A ALA 75.A N PHE 71.A O no hydrogen 3.166 N/A PHE 76.A N MET 72.A O no hydrogen 2.922 N/A GLN 77.A N THR 73.A O no hydrogen 3.099 N/A GLN 77.A NE2 ASP 81.A OD2 no hydrogen 2.897 N/A TYR 78.A N THR 74.A O no hydrogen 2.996 N/A ILE 79.A N ALA 75.A O no hydrogen 3.123 N/A ILE 80.A N PHE 76.A O no hydrogen 3.026 N/A ASP 81.A N GLN 77.A O no hydrogen 2.764 N/A ASN 82.A N TYR 78.A O no hydrogen 2.689 N/A ASN 82.A ND2 GLY 84.A O no hydrogen 2.885 N/A LYS 83.A N ILE 80.A O no hydrogen 3.124 N/A GLY 84.A N ILE 79.A O no hydrogen 3.085 N/A ILE 85.A N ALA 109.A O no hydrogen 3.066 N/A ASP 86.A N ASN 53.A OD1 no hydrogen 2.889 N/A SER 87.A N TYR 106.A O no hydrogen 3.250 N/A SER 87.A OG SER 90.A OG no hydrogen 2.997 N/A ASP 88.A N SER 48.A O no hydrogen 2.943 N/A SER 90.A N SER 87.A OG no hydrogen 3.097 N/A SER 90.A OG SER 87.A O no hydrogen 3.073 N/A SER 90.A OG SER 87.A OG no hydrogen 2.997 N/A TYR 91.A N SER 87.A O no hydrogen 3.044 N/A TYR 91.A N ASP 88.A O no hydrogen 3.275 N/A TYR 91.A OH ASP 56.A OD2 no hydrogen 2.752 N/A TYR 93.A OH GLN 20.A O no hydrogen 2.643 N/A LYS 94.A N GLN 52.A OE1 no hydrogen 2.718 N/A GLN 98.A N ASP 56.A OD1 no hydrogen 2.938 N/A GLN 98.A NE2 ASP 56.A OD2 no hydrogen 2.995 N/A GLN 101.A N TYR 91.A OH no hydrogen 2.895 N/A ASP 103.A N ASP 86.A OD2 no hydrogen 3.128 N/A LYS 105.A N ASP 103.A OD1 no hydrogen 2.972 N/A TYR 106.A N ASP 103.A O no hydrogen 3.024 N/A ARG 107.A N SER 104.A O no hydrogen 3.126 N/A ARG 107.A NE LYS 83.A O no hydrogen 2.930 N/A ARG 107.A NH2 LYS 83.A O no hydrogen 3.497 N/A ALA 108.A N ILE 85.A O no hydrogen 2.911 N/A ALA 109.A N ILE 85.A O no hydrogen 3.399 N/A CYS 111.A SG LYS 113.A O no hydrogen 3.328 N/A CYS 111.A SG GLU 217.A O no hydrogen 3.591 N/A SER 112.A N GLU 217.A O no hydrogen 2.893 N/A SER 112.A OG GLU 217.A O no hydrogen 3.280 N/A SER 112.A OG ILE 218.A O no hydrogen 3.210 N/A THR 115.A N TYR 215.A O no hydrogen 2.863 N/A LEU 117.A N PRO 213.A O no hydrogen 2.894 N/A TYR 119.A OH SER 211.A OG no hydrogen 3.259 N/A GLY 120.A N ALA 210G.A O no hydrogen 2.854 N/A VAL 124.A N ASP 123.A OD2 no hydrogen 2.719 N/A LEU 125.A N ARG 121.A O no hydrogen 3.119 N/A LYS 126.A N GLU 122.A O no hydrogen 2.951 N/A GLU 127.A N ASP 123.A O no hydrogen 3.131 N/A ALA 128.A N VAL 124.A O no hydrogen 3.073 N/A VAL 129.A N LEU 125.A O no hydrogen 2.944 N/A ALA 130.A N LYS 126.A O no hydrogen 2.981 N/A ASN 131.A N GLU 127.A O no hydrogen 2.938 N/A LYS 132.A N ALA 128.A O no hydrogen 2.755 N/A VAL 137.A N VAL 167.A O no hydrogen 3.013 N/A VAL 139.A N HIS 165.A O no hydrogen 2.808 N/A ASP 140.A N CYS 207D.A O no hydrogen 2.877 N/A ALA 141.A N ASN 164.A OD1 no hydrogen 2.902 N/A ARG 142.A N ASP 140.A OD1 no hydrogen 3.098 N/A ARG 142.A NH2 ASN 162.A O no hydrogen 2.289 N/A HIS 143.A NE2 ASP 140.A OD2 no hydrogen 2.830 N/A SER 145.A OG TYR 154.A OH no hydrogen 2.648 N/A SER 145.A OG GLU 156.A OE2 no hydrogen 2.634 N/A PHE 146.A N HIS 143.A O no hydrogen 2.925 N/A LEU 148.A N PRO 144.A O no hydrogen 2.943 N/A TYR 149.A N PHE 146.A O no hydrogen 3.348 N/A TYR 149.A OH GLY 152.A O no hydrogen 2.664 N/A GLY 152.A N GLU 193.A OE2 no hydrogen 3.024 N/A TYR 154.A N ARG 198.A O no hydrogen 2.708 N/A TYR 154.A OH SER 145.A OG no hydrogen 2.648 N/A ASN 162.A N THR 160D.A OG1 no hydrogen 3.086 N/A ASN 164.A N VAL 139.A O no hydrogen 2.921 N/A HIS 165.A N VAL 139.A O no hydrogen 2.946 N/A HIS 165.A NE2 ASN 185.A OD1 no hydrogen 2.810 N/A VAL 167.A N VAL 137.A O no hydrogen 2.905 N/A LEU 168.A N LYS 184J.A O no hydrogen 3.202 N/A VAL 169.A N VAL 135C.A O no hydrogen 2.860 N/A VAL 170.A N LEU 182H.A O no hydrogen 2.814 N/A TYR 172.A N VAL 6.A O no hydrogen 2.838 N/A TYR 172.A OH PRO 3.A O no hydrogen 2.785 N/A GLY 173.A N TYR 180F.A O no hydrogen 3.115 N/A ASN 185.A N GLY 195.A O no hydrogen 3.101 N/A SER 186.A N ASN 185.A OD1 no hydrogen 2.751 N/A SER 186.A OG GLN 20.A OE1 no hydrogen 2.672 N/A GLY 188.A N LYS 18.A O no hydrogen 2.932 N/A PHE 191.A N GLY 188.A O no hydrogen 3.497 N/A GLU 193.A N TYR 196.A O no hydrogen 2.807 N/A GLY 195.A N PHE 191.A O no hydrogen 2.664 N/A TYR 196.A N GLU 193.A O no hydrogen 3.196 N/A ILE 197.A N VAL 183I.A O no hydrogen 2.888 N/A ARG 198.A N TYR 149.A OH no hydrogen 3.273 N/A ARG 198.A NE GLU 193.A OE1 no hydrogen 2.906 N/A ARG 198.A NH2 GLU 193.A OE2 no hydrogen 2.851 N/A MET 199.A N TRP 181G.A O no hydrogen 2.954 N/A ALA 200.A N TYR 154.A O no hydrogen 2.973 N/A ARG 201.A N GLU 179E.A O no hydrogen 3.004 N/A ARG 201.A NE TYR 180F.A O no hydrogen 2.991 N/A ARG 201.A NH2 GLY 173.A O no hydrogen 2.955 N/A ASN 202.A N GLU 122.A OE1 no hydrogen 2.798 N/A ASN 202.A ND2 GLU 179E.A OE2 no hydrogen 2.905 N/A SER 211.A N GLY 208E.A O no hydrogen 2.890 N/A SER 211.A OG TYR 119.A OH no hydrogen 3.259 N/A SER 211.A OG GLY 208E.A O no hydrogen 3.222 N/A SER 214.A N SER 136D.A O no hydrogen 2.880 N/A TYR 215.A N THR 115.A O no hydrogen 3.031 N/A GLU 217.A N LYS 113.A O no hydrogen 2.924 N/A THR 59A.A OG1 GLU 60B.A OE2 no hydrogen 2.989 N/A GLY 133A.A N ALA 128.A O no hydrogen 3.112 N/A LEU 175A.A N LYS 178D.A O no hydrogen 2.782 N/A GLU 60B.A N GLU 60B.A OE2 no hydrogen 2.799 N/A SER 158B.A N GLU 156.A OE1 no hydrogen 2.873 N/A SER 158B.A OG GLU 156.A OE1 no hydrogen 3.410 N/A ASN 205B.A N GLU 122.A OE2 no hydrogen 2.899 N/A ASN 205B.A ND2 SER 211.A OG no hydrogen 3.037 N/A VAL 135C.A N VAL 169.A O no hydrogen 3.015 N/A CYS 159C.A N GLU 156.A O no hydrogen 2.875 N/A CYS 159C.A SG ASP 140.A O no hydrogen 3.546 N/A GLY 177C.A N ASP 174.A OD1 no hydrogen 3.428 N/A HIS 206C.A NE2 GLU 156.A O no hydrogen 2.988 N/A SER 136D.A N SER 214.A O no hydrogen 2.816 N/A SER 136D.A OG SER 30.A O no hydrogen 3.085 N/A SER 136D.A OG SER 30.A OG no hydrogen 3.086 N/A THR 160D.A N ASP 140.A OD2 no hydrogen 2.859 N/A THR 160D.A OG1 ASP 140.A OD2 no hydrogen 2.968 N/A LYS 178D.A N LEU 175A.A O no hydrogen 3.200 N/A GLY 208E.A N ASN 205B.A O no hydrogen 2.912 N/A TYR 180F.A N GLY 173.A O no hydrogen 2.897 N/A ILE 209F.A N HIS 206C.A O no hydrogen 3.309 N/A TRP 181G.A N MET 199.A O no hydrogen 2.715 N/A TRP 181G.A NE1 GLU 122.A OE1 no hydrogen 2.950 N/A ALA 210G.A N ASN 205B.A OD1 no hydrogen 2.778 N/A LEU 182H.A N GLY 171.A O no hydrogen 2.848 N/A VAL 183I.A N ILE 197.A O no hydrogen 2.937 N/A LYS 184J.A N LEU 168.A O no hydrogen 2.795 N/A LYS 184J.A NZ THR 15.A O no hydrogen 3.068 N/A LYS 184J.A NZ GLU 16.A O no hydrogen 3.293 N/A