Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4whl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N ASP 1.A O no hydrogen 3.436 N/A SER 5.A OG ASP 1.A O no hydrogen 3.441 N/A ASP 6.A N CYS 2.A O no hydrogen 3.376 N/A MET 7.A N HIS 3.A O no hydrogen 2.858 N/A LEU 8.A N LEU 4.A O no hydrogen 3.161 N/A GLN 9.A N SER 5.A O no hydrogen 3.369 N/A GLN 10.A N ASP 6.A O no hydrogen 3.170 N/A GLN 10.A NE2 PRO 169.A O no hydrogen 3.157 N/A LEU 11.A N MET 7.A O no hydrogen 3.045 N/A HIS 12.A N LEU 8.A O no hydrogen 2.907 N/A SER 13.A N GLN 9.A O no hydrogen 2.786 N/A VAL 14.A N GLN 10.A O no hydrogen 2.896 N/A ASN 15.A N LEU 11.A O no hydrogen 2.920 N/A ALA 16.A N HIS 12.A O no hydrogen 2.569 N/A SER 17.A N SER 13.A O no hydrogen 3.329 N/A SER 17.A OG VAL 14.A O no hydrogen 2.788 N/A LYS 18.A N ASN 15.A O no hydrogen 2.768 N/A ARG 22.A N SER 20.A O no hydrogen 2.779 N/A ARG 22.A NE SER 17.A O no hydrogen 3.305 N/A ARG 22.A NE LYS 18.A O no hydrogen 3.355 N/A ARG 22.A NH1 GLU 192.A O no hydrogen 3.134 N/A ARG 22.A NH1 GLU 193.A O no hydrogen 2.969 N/A ARG 22.A NH2 SER 17.A O no hydrogen 2.989 N/A ARG 22.A NH2 GLU 192.A O no hydrogen 2.639 N/A ARG 26.A N TYR 194.A O no hydrogen 2.814 N/A GLU 29.A N ARG 26.A O no hydrogen 2.971 N/A ALA 30.A N GLN 27.A O no hydrogen 2.781 N/A GLU 31.A N GLU 28.A O no hydrogen 3.230 N/A ASP 32.A N THR 185.A O no hydrogen 3.006 N/A CYS 35.A N ASP 32.A O no hydrogen 3.172 N/A CYS 35.A SG ASP 32.A OD2 no hydrogen 3.573 N/A CYS 35.A SG ALA 34.A O no hydrogen 3.858 N/A ILE 36.A N PRO 33.A O no hydrogen 3.302 N/A TRP 40.A NE1 ALA 123.A O no hydrogen 2.783 N/A VAL 41.A N GLN 155.A OE1 no hydrogen 2.764 N/A SER 42.A N GLN 56.A O no hydrogen 2.870 N/A SER 42.A OG GLN 56.A O no hydrogen 3.289 N/A LYS 43.A N GLN 56.A O no hydrogen 3.431 N/A LYS 43.A NZ MET 116.A O no hydrogen 2.728 N/A LYS 43.A NZ LEU 120.A O no hydrogen 2.832 N/A VAL 45.A N GLY 54.A O no hydrogen 2.895 N/A TYR 47.A N GLY 52.A O no hydrogen 2.958 N/A SER 48.A N ASP 46.A OD1 no hydrogen 2.976 N/A SER 48.A OG ASP 46.A OD1 no hydrogen 2.866 N/A LYS 50.A N TYR 47.A O no hydrogen 3.159 N/A TYR 51.A N TYR 47.A O no hydrogen 2.797 N/A GLY 52.A N TYR 47.A O no hydrogen 3.106 N/A LEU 53.A N LEU 65.A O no hydrogen 2.997 N/A GLY 54.A N VAL 45.A O no hydrogen 2.734 N/A TYR 55.A N GLY 63.A O no hydrogen 3.019 N/A GLN 56.A N LYS 43.A O no hydrogen 2.861 N/A GLN 56.A NE2 SER 42.A OG no hydrogen 2.800 N/A LEU 57.A N SER 61.A O no hydrogen 3.030 N/A CYS 58.A N TRP 40.A O no hydrogen 3.009 N/A CYS 58.A SG ILE 38.A O no hydrogen 2.891 N/A ASN 60.A N LEU 57.A O no hydrogen 2.734 N/A SER 61.A N ASP 59.A OD1 no hydrogen 3.130 N/A SER 61.A OG ASP 59.A OD1 no hydrogen 2.666 N/A VAL 62.A N LEU 74.A O no hydrogen 2.907 N/A GLY 63.A N TYR 55.A O no hydrogen 2.800 N/A VAL 64.A N LEU 72.A O no hydrogen 3.070 N/A LEU 65.A N LEU 53.A O no hydrogen 2.907 N/A PHE 66.A N THR 70.A O no hydrogen 2.795 N/A ASN 67.A N TYR 51.A O no hydrogen 3.105 N/A ASN 67.A ND2 SER 48.A O no hydrogen 2.725 N/A SER 69.A N PHE 66.A O no hydrogen 2.921 N/A THR 70.A N ASP 68.A OD1 no hydrogen 2.977 N/A THR 70.A OG1 ASP 68.A OD1 no hydrogen 2.992 N/A THR 70.A OG1 ASP 68.A OD2 no hydrogen 3.016 N/A THR 70.A OG1 TYR 83.A OH no hydrogen 3.130 N/A ARG 71.A N ILE 84.A O no hydrogen 2.987 N/A ARG 71.A NE LEU 135.A O no hydrogen 3.033 N/A ARG 71.A NH2 ARG 136.A O no hydrogen 2.897 N/A LEU 72.A N VAL 64.A O no hydrogen 3.337 N/A ILE 73.A N GLN 82.A O no hydrogen 2.814 N/A LEU 74.A N VAL 62.A O no hydrogen 2.836 N/A TYR 75.A N SER 80.A O no hydrogen 3.003 N/A ASN 76.A ND2 ASP 59.A O no hydrogen 2.666 N/A GLY 78.A N TYR 75.A O no hydrogen 3.254 N/A ASP 79.A N ASP 77.A OD1 no hydrogen 2.659 N/A SER 80.A N ASP 77.A OD1 no hydrogen 2.699 N/A SER 80.A OG ASP 77.A OD2 no hydrogen 2.505 N/A LEU 81.A N LEU 93.A O no hydrogen 2.805 N/A GLN 82.A N ILE 73.A O no hydrogen 2.978 N/A TYR 83.A N SER 91.A O no hydrogen 2.876 N/A ILE 84.A N ARG 71.A O no hydrogen 2.694 N/A GLU 85.A N THR 89.A O no hydrogen 2.932 N/A GLY 88.A N GLU 85.A O no hydrogen 3.181 N/A THR 89.A N ASP 87.A OD1 no hydrogen 2.830 N/A THR 89.A OG1 ASP 87.A OD1 no hydrogen 2.596 N/A SER 91.A N TYR 83.A O no hydrogen 3.127 N/A TYR 92.A OH GLU 90.A OE1 no hydrogen 2.864 N/A LEU 93.A N LEU 81.A O no hydrogen 3.047 N/A THR 94.A N SER 97.A O no hydrogen 3.346 N/A THR 94.A OG1 SER 97.A O no hydrogen 3.421 N/A VAL 95.A N ASP 79.A O no hydrogen 2.958 N/A SER 96.A OG ASP 79.A OD1 no hydrogen 2.997 N/A SER 97.A N THR 94.A OG1 no hydrogen 3.115 N/A HIS 98.A ND1 PRO 99.A O no hydrogen 2.724 N/A LEU 102.A N PRO 99.A O no hydrogen 3.446 N/A MET 103.A N ASN 100.A O no hydrogen 2.886 N/A LYS 105.A NZ ASP 68.A OD2 no hydrogen 2.602 N/A LYS 105.A NZ THR 70.A OG1 no hydrogen 2.869 N/A LYS 105.A NZ TYR 83.A OH no hydrogen 3.163 N/A ILE 106.A N LEU 102.A O no hydrogen 2.795 N/A THR 107.A N MET 103.A O no hydrogen 2.956 N/A THR 107.A OG1 MET 103.A O no hydrogen 2.685 N/A LEU 108.A N LYS 104.A O no hydrogen 2.934 N/A LEU 109.A N LYS 105.A O no hydrogen 3.107 N/A LYS 110.A N ILE 106.A O no hydrogen 2.936 N/A TYR 111.A N THR 107.A O no hydrogen 3.018 N/A PHE 112.A N LEU 108.A O no hydrogen 3.027 N/A ARG 113.A N LEU 109.A O no hydrogen 2.792 N/A ASN 114.A N LYS 110.A O no hydrogen 2.740 N/A TYR 115.A N TYR 111.A O no hydrogen 3.039 N/A MET 116.A N PHE 112.A O no hydrogen 3.067 N/A SER 117.A N ARG 113.A O no hydrogen 2.870 N/A SER 117.A OG.B ARG 113.A O no hydrogen 3.414 N/A SER 117.A OG.B ASN 114.A O no hydrogen 2.552 N/A GLU 118.A N TYR 115.A O no hydrogen 3.276 N/A LYS 122.A NZ CYS 58.A O no hydrogen 2.831 N/A ALA 123.A N SER 42.A O no hydrogen 3.010 N/A ILE 127.A N GLY 124.A O no hydrogen 3.269 N/A ARG 131.A NH1 GLU 90.A OE1 no hydrogen 3.402 N/A ARG 131.A NH1 GLU 90.A OE2 no hydrogen 3.519 N/A ARG 131.A NH2 TYR 92.A OH no hydrogen 3.190 N/A TYR 134.A N SER 150.A OG no hydrogen 2.902 N/A LEU 135.A N TYR 55.A OH no hydrogen 3.086 N/A ARG 136.A N HIS 148.A O no hydrogen 2.700 N/A THR 137.A N HIS 148.A O no hydrogen 3.131 N/A PHE 139.A N ILE 146.A O no hydrogen 3.265 N/A ARG 140.A NH1 ASP 46.A OD2 no hydrogen 3.433 N/A THR 141.A N ALA 144.A O no hydrogen 2.868 N/A THR 141.A OG1 ALA 144.A O no hydrogen 3.275 N/A THR 141.A OG1 TYR 206.A OH no hydrogen 2.783 N/A SER 143.A N THR 141.A OG1 no hydrogen 3.063 N/A SER 143.A OG.A TYR 206.A OH no hydrogen 2.536 N/A ILE 145.A N ASN 157.A O no hydrogen 2.925 N/A ILE 146.A N PHE 139.A O no hydrogen 3.094 N/A LEU 147.A N GLN 155.A O no hydrogen 2.896 N/A HIS 148.A N THR 137.A O no hydrogen 2.746 N/A LEU 149.A N SER 153.A O no hydrogen 2.936 N/A SER 150.A N TYR 134.A O no hydrogen 2.829 N/A SER 150.A OG TYR 134.A O no hydrogen 3.487 N/A GLY 152.A N LEU 149.A O no hydrogen 2.944 N/A SER 153.A OG LEU 167.A O no hydrogen 2.827 N/A VAL 154.A N LEU 167.A O no hydrogen 3.291 N/A GLN 155.A N LEU 147.A O no hydrogen 2.940 N/A GLN 155.A NE2 VAL 41.A O no hydrogen 3.023 N/A GLN 155.A NE2 ASN 157.A OD1 no hydrogen 3.009 N/A ILE 156.A N LEU 165.A O no hydrogen 2.835 N/A ASN 157.A N ILE 145.A O no hydrogen 3.051 N/A PHE 158.A N THR 163.A O no hydrogen 2.746 N/A PHE 159.A N SER 143.A O no hydrogen 3.094 N/A HIS 162.A N PHE 158.A O no hydrogen 3.009 N/A THR 163.A N ASP 161.A OD1 no hydrogen 3.313 N/A THR 163.A OG1 ASP 161.A OD1 no hydrogen 2.534 N/A LYS 164.A N ILE 177.A O no hydrogen 2.899 N/A LYS 164.A NZ HIS 162.A O no hydrogen 3.253 N/A LEU 165.A N ILE 156.A O no hydrogen 2.973 N/A ILE 166.A N THR 175.A O no hydrogen 3.088 N/A LEU 167.A N VAL 154.A O no hydrogen 2.713 N/A CYS 168.A N ALA 173.A O no hydrogen 2.869 N/A ALA 172.A N PRO 169.A O no hydrogen 3.385 N/A ALA 173.A N CYS 168.A O no hydrogen 2.988 N/A VAL 174.A N TYR 186.A O no hydrogen 3.027 N/A THR 175.A N ILE 166.A O no hydrogen 2.889 N/A THR 175.A OG1 THR 185.A OG1 no hydrogen 2.577 N/A TYR 176.A N ARG 184.A O no hydrogen 2.880 N/A TYR 176.A OH GLU 199.A OE2 no hydrogen 2.999 N/A ILE 177.A N LYS 164.A O no hydrogen 2.775 N/A ASP 178.A N ASP 182.A O no hydrogen 2.966 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 3.054 N/A ARG 181.A N ASP 178.A O no hydrogen 3.074 N/A ASP 182.A N ASP 178.A OD1 no hydrogen 2.655 N/A ARG 184.A N TYR 176.A O no hydrogen 3.005 N/A THR 185.A OG1 THR 175.A OG1 no hydrogen 2.577 N/A TYR 186.A N VAL 174.A O no hydrogen 2.873 N/A ARG 187.A N ALA 30.A O no hydrogen 3.370 N/A LEU 188.A N ALA 172.A O no hydrogen 2.993 N/A LEU 191.A N ARG 187.A O no hydrogen 2.968 N/A GLU 192.A N LEU 188.A O no hydrogen 2.815 N/A GLU 193.A N SER 189.A O no hydrogen 3.159 N/A TYR 194.A N LEU 190.A O no hydrogen 2.623 N/A GLY 195.A N LEU 191.A O no hydrogen 2.955 N/A CYS 196.A N PRO 19.A O no hydrogen 3.161 N/A CYS 196.A SG CYS 197.A O no hydrogen 3.683 N/A ALA 201.A N CYS 197.A O no hydrogen 3.104 N/A SER 202.A N LYS 198.A O no hydrogen 3.231 N/A SER 202.A OG.A LYS 198.A O no hydrogen 2.575 N/A SER 202.A OG.A GLU 199.A O no hydrogen 2.465 N/A ARG 203.A N GLU 199.A O no hydrogen 3.109 N/A ARG 203.A NH1 TYR 176.A OH no hydrogen 2.941 N/A ARG 203.A NH1 GLU 199.A OE1 no hydrogen 3.133 N/A LEU 204.A N LEU 200.A O no hydrogen 2.819 N/A ARG 205.A N ALA 201.A O no hydrogen 2.991 N/A ARG 205.A N SER 202.A O no hydrogen 3.026 N/A TYR 206.A N SER 202.A O no hydrogen 3.007 N/A ALA 207.A N ARG 203.A O no hydrogen 2.865 N/A ARG 208.A N LEU 204.A O no hydrogen 3.274 N/A THR 209.A N ARG 205.A O no hydrogen 3.249 N/A THR 209.A OG1 TYR 206.A O no hydrogen 3.199 N/A MET 210.A N TYR 206.A O no hydrogen 2.753 N/A VAL 211.A N ALA 207.A O no hydrogen 2.801 N/A ASP 212.A N ARG 208.A O no hydrogen 2.880 N/A LYS 213.A N THR 209.A O no hydrogen 2.986 N/A LEU 214.A N MET 210.A O no hydrogen 3.178 N/A LEU 215.A N VAL 211.A O no hydrogen 3.320 N/A SER 216.A N ASP 212.A O no hydrogen 3.013 N/A