Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8i67_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N SER 1.A O no hydrogen 3.073 N/A ARG 5.A N SER 1.A O no hydrogen 2.802 N/A ARG 5.A NH1 GLU 9.A OE1 no hydrogen 3.049 N/A GLU 9.A N PRO 6.A O no hydrogen 2.853 N/A LEU 10.A N PRO 6.A O no hydrogen 3.094 N/A VAL 11.A N LEU 7.A O no hydrogen 3.005 N/A GLU 12.A N PHE 54.A O no hydrogen 3.072 N/A ARG 13.A NH1 ASP 59.A OD2 no hydrogen 2.883 N/A GLY 14.A N GLU 12.A OE2 no hydrogen 2.925 N/A TRP 15.A N GLU 12.A OE1 no hydrogen 3.044 N/A ALA 16.A N GLU 12.A O no hydrogen 2.849 N/A ALA 16.A N ARG 13.A O no hydrogen 3.100 N/A ALA 17.A N ARG 13.A O no hydrogen 3.331 N/A ALA 18.A N GLY 14.A O no hydrogen 3.028 N/A LEU 19.A N TRP 15.A O no hydrogen 2.965 N/A GLU 20.A N ALA 17.A O no hydrogen 3.250 N/A VAL 22.A N LEU 19.A O no hydrogen 2.817 N/A ALA 23.A N GLU 20.A O no hydrogen 3.161 N/A GLN 25.A NE2 GLY 145.A O no hydrogen 2.779 N/A VAL 26.A N VAL 22.A O no hydrogen 2.821 N/A ALA 27.A N ALA 23.A O no hydrogen 3.250 N/A HIS 28.A N ASP 24.A O no hydrogen 2.949 N/A MET 29.A N GLN 25.A O no hydrogen 2.921 N/A GLY 30.A N VAL 26.A O no hydrogen 3.105 N/A GLN 31.A N ALA 27.A O no hydrogen 3.090 N/A PHE 32.A N HIS 28.A O no hydrogen 2.897 N/A LEU 33.A N MET 29.A O no hydrogen 2.941 N/A ARG 34.A N GLY 30.A O no hydrogen 3.057 N/A ARG 34.A NH1 GLN 31.A OE1.B no hydrogen 3.351 N/A ALA 35.A N GLN 31.A O no hydrogen 2.922 N/A GLU 36.A N PHE 32.A O no hydrogen 3.114 N/A ILE 37.A N LEU 33.A O no hydrogen 3.062 N/A ALA 38.A N ARG 34.A O no hydrogen 2.873 N/A ALA 39.A N ALA 35.A O no hydrogen 3.047 N/A ALA 39.A N GLU 36.A O no hydrogen 3.120 N/A GLY 40.A N ILE 37.A O no hydrogen 2.925 N/A ARG 41.A N GLU 36.A O no hydrogen 2.927 N/A ARG 41.A NE GLU 36.A OE1 no hydrogen 2.834 N/A ARG 41.A NH2 GLU 36.A OE2 no hydrogen 2.970 N/A LEU 44.A N VAL 133.A O no hydrogen 2.898 N/A ASN 49.A N ALA 46.A O no hydrogen 2.802 N/A VAL 50.A N GLY 47.A O no hydrogen 3.250 N/A ARG 52.A N ASN 49.A O no hydrogen 3.064 N/A ARG 52.A NH1 VAL 78.A O no hydrogen 3.148 N/A PHE 54.A N LEU 51.A O no hydrogen 3.020 N/A THR 55.A N ARG 52.A O no hydrogen 2.850 N/A THR 55.A OG1 ARG 52.A O no hydrogen 2.616 N/A PHE 58.A N GLU 12.A OE1 no hydrogen 3.181 N/A ASN 60.A N PRO 57.A O no hydrogen 3.067 N/A VAL 61.A N PHE 58.A O no hydrogen 3.362 N/A ARG 62.A N GLY 123.A O no hydrogen 2.851 N/A ARG 62.A NE GLU 221.A O no hydrogen 2.850 N/A ARG 62.A NH2 GLU 221.A O no hydrogen 3.119 N/A ARG 62.A NH2 PRO 222.A O no hydrogen 2.960 N/A VAL 63.A N GLY 123.A O no hydrogen 3.186 N/A LEU 64.A N VAL 165.A O no hydrogen 2.967 N/A ILE 65.A N LEU 125.A O no hydrogen 2.927 N/A VAL 66.A N ILE 167.A O no hydrogen 2.868 N/A GLY 67.A N LEU 127.A O no hydrogen 2.998 N/A TYR 71.A OH PHE 82.A O no hydrogen 2.680 N/A HIS 76.A N THR 73.A O no hydrogen 3.212 N/A SER 81.A N LEU 126.A O no hydrogen 2.882 N/A SER 81.A OG LEU 127.A O no hydrogen 3.352 N/A SER 83.A N LEU 80.A O no hydrogen 2.944 N/A VAL 84.A N GLY 114.A O no hydrogen 2.960 N/A VAL 88.A N ALA 85.A O no hydrogen 3.039 N/A ARG 89.A NH2 ASP 87.A O no hydrogen 2.772 N/A ALA 96.A N PRO 92.A O no hydrogen 3.041 N/A ASN 97.A N ARG 93.A O no hydrogen 3.075 N/A ASN 97.A ND2 PRO 193.A O no hydrogen 2.875 N/A ILE 98.A N SER 94.A O no hydrogen 2.901 N/A PHE 99.A N LEU 95.A O no hydrogen 2.826 N/A ASP 100.A N ALA 96.A O no hydrogen 2.928 N/A GLU 101.A N ASN 97.A O no hydrogen 3.010 N/A TYR 102.A N ILE 98.A O no hydrogen 2.863 N/A THR 103.A N PHE 99.A O no hydrogen 2.837 N/A THR 103.A OG1 PHE 99.A O no hydrogen 3.561 N/A THR 103.A OG1 ASP 100.A O no hydrogen 3.091 N/A ALA 104.A N ASP 100.A O no hydrogen 3.023 N/A ASP 105.A N GLU 101.A O no hydrogen 2.767 N/A LEU 106.A N TYR 102.A O no hydrogen 3.020 N/A GLY 107.A N THR 103.A O no hydrogen 2.888 N/A SER 112.A N PRO 228.A OXT no hydrogen 2.947 N/A SER 112.A OG PRO 228.A O no hydrogen 2.727 N/A SER 112.A OG PRO 228.A OXT no hydrogen 3.313 N/A ASP 115.A N ASN 113.A OD1 no hydrogen 3.141 N/A LEU 116.A N SER 83.A OG no hydrogen 2.887 N/A THR 117.A N ASP 115.A OD1 no hydrogen 3.004 N/A THR 117.A OG1 ASP 115.A OD1 no hydrogen 2.812 N/A THR 117.A OG1 ASP 115.A OD2 no hydrogen 3.451 N/A TRP 119.A NE1 TRP 225.A O no hydrogen 2.880 N/A ALA 120.A N LEU 116.A O no hydrogen 3.446 N/A GLN 121.A N THR 117.A O no hydrogen 2.902 N/A ARG 122.A N TRP 119.A O no hydrogen 3.048 N/A ARG 122.A NH1 ASP 224.A O no hydrogen 2.865 N/A ARG 122.A NH1 ARG 226.A O no hydrogen 2.787 N/A VAL 124.A N TRP 119.A O no hydrogen 3.094 N/A LEU 125.A N VAL 63.A O no hydrogen 2.795 N/A LEU 127.A N ILE 65.A O no hydrogen 2.958 N/A ARG 129.A N GLY 67.A O no hydrogen 2.916 N/A ARG 129.A NE ASP 172.A O no hydrogen 3.337 N/A ARG 129.A NE THR 175.A OG1 no hydrogen 2.961 N/A ARG 129.A NH1 GLU 147.A O no hydrogen 2.897 N/A ARG 129.A NH1 THR 150.A OG1 no hydrogen 2.849 N/A ARG 129.A NH2 THR 175.A OG1 no hydrogen 3.044 N/A VAL 130.A N GLN 68.A O no hydrogen 3.081 N/A THR 132.A OG1 HIS 141.A ND1 no hydrogen 2.747 N/A VAL 133.A N LEU 44.A O no hydrogen 3.038 N/A ARG 134.A N SER 140.A OG no hydrogen 2.977 N/A SER 136.A N PRO 72.A O no hydrogen 2.782 N/A ASN 137.A N ARG 134.A O no hydrogen 3.172 N/A ASN 137.A ND2 PRO 135.A O no hydrogen 2.949 N/A ALA 139.A N ASP 69.A OD2 no hydrogen 2.718 N/A SER 140.A N ASN 137.A O no hydrogen 3.167 N/A SER 140.A OG ASN 137.A O no hydrogen 2.602 N/A HIS 141.A ND1 THR 132.A OG1 no hydrogen 2.747 N/A ARG 142.A N ALA 139.A O no hydrogen 3.079 N/A ARG 142.A NE ASP 172.A OD2 no hydrogen 3.115 N/A ARG 142.A NH2 ASP 172.A OD2 no hydrogen 2.909 N/A GLY 143.A N GLU 147.A OE2 no hydrogen 2.850 N/A LYS 144.A N HIS 141.A O no hydrogen 3.306 N/A TRP 146.A NE1 THR 132.A OG1 no hydrogen 2.819 N/A GLU 147.A N GLU 147.A OE1 no hydrogen 2.785 N/A VAL 149.A N TRP 146.A O no hydrogen 2.745 N/A THR 150.A N TRP 146.A O no hydrogen 3.097 N/A THR 150.A OG1 ARG 129.A O no hydrogen 2.598 N/A THR 150.A OG1 GLU 147.A O no hydrogen 3.376 N/A GLU 151.A N GLU 147.A O no hydrogen 2.839 N/A CYS 152.A N ALA 148.A O no hydrogen 3.042 N/A CYS 152.A SG ALA 18.A O no hydrogen 3.526 N/A ALA 153.A N VAL 149.A O no hydrogen 3.012 N/A ILE 154.A N THR 150.A O no hydrogen 3.169 N/A ARG 155.A N GLU 151.A O no hydrogen 2.945 N/A ARG 155.A NH1 GLU 151.A OE2 no hydrogen 2.692 N/A ALA 156.A N CYS 152.A O no hydrogen 2.940 N/A LEU 157.A N ALA 153.A O no hydrogen 3.070 N/A ALA 158.A N ILE 154.A O no hydrogen 2.960 N/A ALA 159.A N ARG 155.A O no hydrogen 3.056 N/A ALA 159.A N ALA 156.A O no hydrogen 3.205 N/A ARG 160.A N LEU 157.A O no hydrogen 3.125 N/A ARG 160.A NE LEU 157.A O no hydrogen 3.032 N/A ARG 160.A NH1 VAL 61.A O no hydrogen 2.975 N/A ARG 160.A NH2 VAL 61.A O no hydrogen 2.775 N/A ALA 162.A N ARG 160.A O no hydrogen 2.893 N/A LEU 164.A N ASN 184.A O no hydrogen 2.920 N/A VAL 165.A N ARG 62.A O no hydrogen 3.133 N/A ALA 166.A N VAL 186.A O no hydrogen 2.941 N/A ILE 167.A N LEU 64.A O no hydrogen 2.758 N/A LEU 168.A N ILE 188.A O no hydrogen 2.855 N/A TRP 169.A N VAL 66.A O no hydrogen 2.966 N/A GLY 170.A N SER 190.A O no hydrogen 3.045 N/A SER 174.A N GLY 170.A O no hydrogen 3.139 N/A SER 174.A OG ARG 171.A O no hydrogen 2.905 N/A THR 175.A N ASP 172.A O no hydrogen 3.253 N/A THR 175.A OG1 ASP 172.A O no hydrogen 2.706 N/A LEU 176.A N ALA 173.A O no hydrogen 3.204 N/A LYS 177.A N SER 174.A O no hydrogen 2.914 N/A LYS 177.A NZ GLU 189.A OE1 no hydrogen 3.214 N/A MET 179.A N LEU 176.A O no hydrogen 3.150 N/A LEU 180.A N LYS 177.A O no hydrogen 3.037 N/A ASN 184.A N ASN 184.A OD1 no hydrogen 2.684 N/A ASN 184.A ND2 ALA 158.A O no hydrogen 2.944 N/A ASN 184.A ND2 ALA 162.A O no hydrogen 3.154 N/A CYS 185.A N ALA 182.A O no hydrogen 3.249 N/A CYS 185.A SG ALA 158.A O no hydrogen 4.036 N/A VAL 186.A N LEU 164.A O no hydrogen 3.117 N/A ILE 188.A N ALA 166.A O no hydrogen 2.727 N/A SER 190.A N LEU 168.A O no hydrogen 3.279 N/A SER 190.A OG PRO 191.A O no hydrogen 2.810 N/A SER 194.A N HIS 192.A ND1 no hydrogen 3.019 N/A LEU 196.A N SER 194.A OG no hydrogen 3.248 N/A SER 197.A N SER 194.A O no hydrogen 3.006 N/A SER 197.A OG HIS 192.A O no hydrogen 2.700 N/A SER 197.A OG SER 194.A O no hydrogen 3.507 N/A ALA 198.A N SER 194.A O no hydrogen 2.837 N/A ARG 200.A N.A SER 197.A O no hydrogen 3.004 N/A ARG 200.A N.B SER 197.A O no hydrogen 3.003 N/A GLY 201.A N ALA 198.A O no hydrogen 3.388 N/A PHE 202.A N ALA 198.A O no hydrogen 2.926 N/A PHE 203.A N ALA 198.A O no hydrogen 3.332 N/A GLY 204.A N GLU 101.A OE1 no hydrogen 2.831 N/A SER 205.A N PHE 202.A O no hydrogen 3.129 N/A SER 205.A OG PHE 202.A O no hydrogen 2.587 N/A ARG 206.A N GLU 101.A OE2 no hydrogen 2.911 N/A PHE 208.A N ASP 105.A OD2 no hydrogen 3.026 N/A SER 209.A N ASP 105.A OD2 no hydrogen 2.912 N/A SER 209.A OG ASP 105.A OD1 no hydrogen 2.648 N/A ARG 210.A N ARG 206.A O no hydrogen 3.212 N/A ARG 210.A NH2 SER 205.A O no hydrogen 2.826 N/A ALA 211.A N PRO 207.A O no hydrogen 2.907 N/A ASN 212.A N PHE 208.A O no hydrogen 3.172 N/A ASN 212.A ND2 ILE 223.A O no hydrogen 2.909 N/A GLU 213.A N SER 209.A O no hydrogen 2.952 N/A LEU 214.A N ARG 210.A O no hydrogen 2.931 N/A LEU 215.A N ALA 211.A O no hydrogen 2.960 N/A VAL 216.A N ASN 212.A O no hydrogen 2.869 N/A GLY 217.A N GLU 213.A O no hydrogen 2.986 N/A MET 218.A N LEU 214.A O no hydrogen 3.199 N/A MET 218.A N LEU 215.A O no hydrogen 2.965 N/A GLY 219.A N VAL 216.A O no hydrogen 2.882 N/A ALA 220.A N LEU 215.A O no hydrogen 2.942 N/A ILE 223.A N ASN 212.A OD1 no hydrogen 2.838 N/A TRP 225.A NE1 PHE 208.A O no hydrogen 3.118 N/A ARG 226.A N ASP 224.A OD1 no hydrogen 3.003 N/A ARG 226.A NE LEU 227.A O no hydrogen 3.511 N/A LEU 227.A N TYR 102.A OH no hydrogen 2.906 N/A