Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ley_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N GLN 2.A OE1 no hydrogen 2.799 N/A VAL 9.A N ASP 6.A O no hydrogen 3.141 N/A SER 11.A N ARG 15.A O no hydrogen 2.751 N/A SER 11.A OG ARG 15.A O no hydrogen 3.359 N/A GLN 13.A N SER 11.A OG no hydrogen 3.336 N/A GLY 14.A N SER 11.A O no hydrogen 2.910 N/A ARG 15.A N SER 11.A OG no hydrogen 3.196 N/A ARG 15.A NE GLU 20.A OE1 no hydrogen 3.364 N/A ARG 15.A NE GLU 20.A OE2 no hydrogen 2.922 N/A ARG 15.A NH2 GLU 20.A OE1 no hydrogen 2.678 N/A GLN 18.A NE2 ASP 4.A O no hydrogen 2.600 N/A ILE 19.A N ILE 16.A O no hydrogen 3.123 N/A GLU 20.A N ILE 16.A O no hydrogen 3.204 N/A TYR 21.A N HIS 17.A O no hydrogen 2.747 N/A TYR 21.A OH ASP 4.A OD2 no hydrogen 2.943 N/A ALA 22.A N GLN 18.A O no hydrogen 2.982 N/A MET 23.A N ILE 19.A O no hydrogen 3.050 N/A GLU 24.A N GLU 20.A O no hydrogen 3.279 N/A GLU 24.A N TYR 21.A O no hydrogen 3.014 N/A ALA 25.A N ALA 22.A O no hydrogen 3.074 N/A LYS 27.A N MET 23.A O no hydrogen 3.179 N/A GLN 28.A N GLU 24.A O no hydrogen 3.106 N/A GLY 29.A N VAL 26.A O no hydrogen 2.963 N/A SER 30.A OG LEU 46.A O no hydrogen 2.648 N/A THR 32.A N ILE 157.A O no hydrogen 3.058 N/A THR 32.A OG1 VAL 44.A O no hydrogen 2.838 N/A THR 32.A OG1 SER 70.A OG no hydrogen 2.721 N/A VAL 33.A N VAL 44.A O no hydrogen 2.814 N/A GLY 34.A N MET 155.A O no hydrogen 2.856 N/A LEU 35.A N VAL 42.A O no hydrogen 2.959 N/A SER 37.A N HIS 40.A O no hydrogen 2.961 N/A SER 37.A OG HIS 40.A O no hydrogen 3.522 N/A LYS 38.A N MET 176.A O no hydrogen 2.935 N/A THR 39.A N SER 37.A OG no hydrogen 3.252 N/A THR 39.A OG1 HIS 40.A ND1 no hydrogen 2.605 N/A HIS 40.A N SER 37.A OG no hydrogen 2.973 N/A HIS 40.A NE2 ASP 214.A OD1 no hydrogen 2.839 N/A ALA 41.A N VAL 211.A O no hydrogen 2.785 N/A VAL 42.A N LEU 35.A O no hydrogen 2.815 N/A LEU 43.A N GLY 209.A O no hydrogen 2.767 N/A VAL 44.A N VAL 33.A O no hydrogen 2.717 N/A ALA 45.A N SER 207.A O no hydrogen 2.770 N/A LEU 46.A N ALA 31.A O no hydrogen 3.042 N/A LYS 47.A N ASN 205.A O no hydrogen 2.771 N/A LYS 47.A NZ ASP 221.A OD2 no hydrogen 2.999 N/A GLN 57.A N ARG 48.A O no hydrogen 3.209 N/A LYS 59.A NZ SER 30.A O no hydrogen 2.652 N/A LYS 59.A NZ SER 30.A OG no hydrogen 3.068 N/A LYS 59.A NZ ILE 71.A O no hydrogen 2.704 N/A LEU 61.A N ILE 69.A O no hydrogen 2.838 N/A VAL 63.A N ILE 67.A O no hydrogen 3.019 N/A ASP 64.A N ILE 67.A O no hydrogen 3.007 N/A ASN 65.A N ASP 64.A OD1 no hydrogen 2.819 N/A HIS 66.A NE2 LEU 100.A O no hydrogen 2.706 N/A ILE 67.A N ASP 64.A O no hydrogen 3.085 N/A GLY 68.A N ALA 132.A O no hydrogen 2.970 N/A ILE 69.A N LEU 61.A O no hydrogen 2.875 N/A SER 70.A N LEU 130.A O no hydrogen 2.806 N/A SER 70.A OG THR 32.A OG1 no hydrogen 2.721 N/A SER 70.A OG LYS 59.A O no hydrogen 3.402 N/A ILE 71.A N LYS 59.A O no hydrogen 3.050 N/A ALA 72.A N GLY 128.A O no hydrogen 2.933 N/A LEU 74.A N GLY 126.A O no hydrogen 2.812 N/A ALA 78.A N LEU 74.A O no hydrogen 2.937 N/A ARG 79.A N THR 75.A O no hydrogen 2.913 N/A LEU 80.A N ALA 76.A O no hydrogen 3.104 N/A LEU 81.A N ASP 77.A O no hydrogen 3.047 N/A CYS 82.A N ALA 78.A O no hydrogen 2.848 N/A CYS 82.A SG HIS 62.A O no hydrogen 3.906 N/A ASN 83.A N ARG 79.A O no hydrogen 2.881 N/A PHE 84.A N LEU 80.A O no hydrogen 3.060 N/A MET 85.A N LEU 81.A O no hydrogen 2.941 N/A ARG 86.A N CYS 82.A O no hydrogen 2.875 N/A ARG 86.A NE HIS 62.A O no hydrogen 2.911 N/A ARG 86.A NH1 ASN 83.A OD1 no hydrogen 3.463 N/A ARG 86.A NH2 HIS 62.A O no hydrogen 2.867 N/A GLN 87.A N ASN 83.A O no hydrogen 3.008 N/A GLN 87.A NE2 ASP 91.A OD2 no hydrogen 2.938 N/A GLU 88.A N PHE 84.A O no hydrogen 2.912 N/A CYS 89.A N MET 85.A O no hydrogen 2.956 N/A CYS 89.A SG MET 85.A O no hydrogen 3.336 N/A LEU 90.A N ARG 86.A O no hydrogen 2.970 N/A ASP 91.A N GLN 87.A O no hydrogen 2.919 N/A SER 92.A N GLU 88.A O no hydrogen 3.124 N/A SER 92.A OG ARG 98.A O no hydrogen 3.009 N/A ARG 93.A N CYS 89.A O no hydrogen 3.194 N/A ARG 93.A NE ASP 64.A OD1 no hydrogen 3.250 N/A ARG 93.A NE ASP 64.A OD2 no hydrogen 2.831 N/A ARG 93.A NH2 ASP 64.A OD2 no hydrogen 3.390 N/A ARG 93.A NH2 HIS 66.A ND1 no hydrogen 3.393 N/A PHE 94.A N LEU 90.A O no hydrogen 2.929 N/A VAL 95.A N ASP 91.A O no hydrogen 2.915 N/A PHE 96.A N SER 92.A O no hydrogen 2.865 N/A ASP 97.A N ARG 93.A O no hydrogen 2.994 N/A ARG 98.A NE.A ARG 98.A O no hydrogen 3.272 N/A ARG 98.A NH2.A SER 92.A OG no hydrogen 3.072 N/A ARG 98.A NH2.B ARG 98.A O no hydrogen 3.421 N/A ARG 98.A NH2.B PRO 99.A O no hydrogen 3.353 N/A VAL 102.A N ASP 135.A OD2 no hydrogen 2.919 N/A LEU 105.A N PRO 101.A O no hydrogen 3.055 N/A VAL 106.A N VAL 102.A O no hydrogen 2.989 N/A SER 107.A N SER 103.A O no hydrogen 3.119 N/A SER 107.A OG SER 103.A O no hydrogen 3.211 N/A SER 107.A OG TYR 149.A OH no hydrogen 3.155 N/A LEU 108.A N ARG 104.A O no hydrogen 3.052 N/A ILE 109.A N LEU 105.A O no hydrogen 2.978 N/A GLY 110.A N VAL 106.A O no hydrogen 2.966 N/A SER 111.A N SER 107.A O no hydrogen 3.057 N/A LYS 112.A N LEU 108.A O no hydrogen 2.890 N/A THR 113.A N ILE 109.A O no hydrogen 2.824 N/A THR 113.A OG1 ILE 109.A O no hydrogen 2.715 N/A GLN 114.A N GLY 110.A O no hydrogen 3.021 N/A GLN 114.A NE2 GLN 118.A OE1 no hydrogen 2.887 N/A THR 117.A N GLN 114.A O no hydrogen 2.920 N/A THR 117.A OG1 GLN 114.A O no hydrogen 2.588 N/A GLN 118.A N ILE 115.A O no hydrogen 3.216 N/A ARG 122.A N ARG 119.A O no hydrogen 3.164 N/A ARG 123.A NH1 ASP 77.A OD2 no hydrogen 2.644 N/A ARG 123.A NH1 PRO 124.A O no hydrogen 2.931 N/A ARG 123.A NH2 ASP 77.A OD1 no hydrogen 3.065 N/A GLY 126.A N ASP 77.A OD2 no hydrogen 2.819 N/A GLY 128.A N ALA 72.A O no hydrogen 2.816 N/A LEU 129.A N THR 144.A O no hydrogen 3.207 N/A LEU 130.A N SER 70.A O no hydrogen 2.903 N/A ILE 131.A N PHE 142.A O no hydrogen 2.712 N/A ALA 132.A N GLY 68.A O no hydrogen 2.944 N/A GLY 133.A N HIS 140.A O no hydrogen 3.018 N/A TYR 134.A N HIS 66.A O no hydrogen 2.987 N/A ASP 135.A N GLY 138.A O no hydrogen 3.127 N/A MET 137.A N ASP 135.A OD1 no hydrogen 2.882 N/A GLY 138.A N ASP 135.A O no hydrogen 2.707 N/A HIS 140.A N GLY 133.A O no hydrogen 2.817 N/A HIS 140.A NE2 ASP 135.A OD1 no hydrogen 2.741 N/A PHE 142.A N ILE 131.A O no hydrogen 2.874 N/A GLN 143.A N PHE 150.A O no hydrogen 2.926 N/A THR 144.A N LEU 129.A O no hydrogen 2.931 N/A ASN 148.A N SER 146.A OG no hydrogen 3.201 N/A TYR 149.A N ASN 148.A OD1 no hydrogen 2.905 N/A PHE 150.A N GLN 143.A O no hydrogen 2.894 N/A CYS 152.A N ILE 141.A O no hydrogen 2.834 N/A CYS 152.A SG PHE 150.A O no hydrogen 3.764 N/A MET 155.A N GLY 34.A O no hydrogen 2.721 N/A SER 156.A OG THR 32.A O no hydrogen 2.759 N/A ILE 157.A N THR 32.A O no hydrogen 3.214 N/A ALA 159.A N GLY 29.A O no hydrogen 2.759 N/A ARG 160.A NE THR 194.A O no hydrogen 2.656 N/A ARG 160.A NH2 THR 194.A O no hydrogen 3.494 N/A SER 161.A N GLY 158.A O no hydrogen 3.162 N/A SER 161.A OG GLY 158.A O no hydrogen 2.787 N/A SER 163.A N ARG 160.A O no hydrogen 3.254 N/A ARG 165.A N SER 161.A O no hydrogen 2.828 N/A ARG 165.A NH1 SER 156.A O no hydrogen 2.878 N/A ARG 165.A NH1 SER 161.A OG no hydrogen 2.726 N/A THR 166.A N GLN 162.A O no hydrogen 2.914 N/A THR 166.A OG1 GLN 162.A O no hydrogen 2.975 N/A TYR 167.A N SER 163.A O no hydrogen 3.095 N/A TYR 167.A OH HIS 186.A ND1 no hydrogen 2.841 N/A LEU 168.A N ALA 164.A O no hydrogen 2.978 N/A GLU 169.A N ARG 165.A O no hydrogen 2.920 N/A ARG 170.A N THR 166.A O no hydrogen 3.006 N/A ARG 170.A NH1 GLU 193.A OE2 no hydrogen 3.445 N/A HIS 171.A N TYR 167.A O no hydrogen 3.086 N/A HIS 171.A N LEU 168.A O no hydrogen 3.263 N/A HIS 171.A ND1 GLU 174.A OE1 no hydrogen 3.147 N/A GLU 174.A N HIS 171.A O no hydrogen 2.961 N/A PHE 175.A N MET 172.A O no hydrogen 3.141 N/A CYS 178.A N PHE 175.A O no hydrogen 3.062 N/A CYS 178.A SG GLU 174.A O no hydrogen 3.191 N/A ASN 179.A N GLU 182.A OE1 no hydrogen 3.040 N/A GLU 182.A N ASN 179.A OD1 no hydrogen 2.957 N/A LEU 183.A N ASN 179.A O no hydrogen 3.033 N/A VAL 184.A N LEU 180.A O no hydrogen 2.934 N/A LYS 185.A N ASN 181.A O no hydrogen 2.994 N/A LYS 185.A NZ PHE 228.A O no hydrogen 3.044 N/A LYS 185.A NZ GLU 230.A O no hydrogen 3.132 N/A LYS 185.A NZ GLY 231.A O no hydrogen 2.970 N/A HIS 186.A N GLU 182.A O no hydrogen 3.068 N/A HIS 186.A ND1 TYR 167.A OH no hydrogen 2.841 N/A GLY 187.A N LEU 183.A O no hydrogen 3.095 N/A LEU 188.A N VAL 184.A O no hydrogen 2.804 N/A ARG 189.A N LYS 185.A O no hydrogen 2.852 N/A ALA 190.A N HIS 186.A O no hydrogen 2.989 N/A LEU 191.A N GLY 187.A O no hydrogen 2.989 N/A ARG 192.A N LEU 188.A O no hydrogen 2.847 N/A GLU 193.A N ARG 189.A O no hydrogen 3.283 N/A GLU 193.A N ALA 190.A O no hydrogen 3.238 N/A THR 194.A N LEU 191.A O no hydrogen 2.978 N/A THR 194.A OG1 LEU 191.A O no hydrogen 2.737 N/A LEU 195.A N ARG 192.A O no hydrogen 3.184 N/A GLN 199.A N PRO 196.A O no hydrogen 2.891 N/A LEU 201.A N ASP 200.A OD1 no hydrogen 2.766 N/A THR 202.A N ASN 205.A OD1 no hydrogen 2.753 N/A LYS 204.A N THR 202.A OG1 no hydrogen 3.099 N/A ASN 205.A N THR 202.A O no hydrogen 3.231 N/A ASN 205.A N THR 202.A OG1 no hydrogen 3.177 N/A ASN 205.A ND2 ASP 200.A O no hydrogen 3.095 N/A VAL 206.A N THR 202.A O no hydrogen 3.230 N/A SER 207.A N ALA 45.A O no hydrogen 3.023 N/A SER 207.A OG ASP 221.A OD2 no hydrogen 2.730 N/A ILE 208.A N TYR 220.A O no hydrogen 2.957 N/A GLY 209.A N LEU 43.A O no hydrogen 2.902 N/A ILE 210.A N THR 218.A O no hydrogen 3.016 N/A VAL 211.A N ALA 41.A O no hydrogen 3.003 N/A GLY 212.A N LEU 215.A O no hydrogen 2.921 N/A LYS 213.A N THR 39.A O no hydrogen 3.162 N/A ASP 214.A N ASP 214.A OD1 no hydrogen 2.493 N/A LEU 215.A N GLY 212.A O no hydrogen 3.045 N/A PHE 217.A N ASN 65.A O no hydrogen 2.727 N/A THR 218.A N ILE 210.A O no hydrogen 2.949 N/A THR 218.A OG1 GLU 216.A O no hydrogen 2.744 N/A TYR 220.A N ILE 208.A O no hydrogen 2.694 N/A ASP 224.A N ASP 221.A O no hydrogen 2.942 N/A VAL 225.A N ASP 222.A O no hydrogen 3.135 N/A SER 226.A N ASP 223.A O no hydrogen 3.278 N/A SER 226.A OG ASP 223.A O no hydrogen 3.265 N/A LEU 229.A N VAL 225.A O no hydrogen 3.050 N/A GLU 230.A N SER 226.A O no hydrogen 2.932 N/A