Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3he2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N GLU 14.A O no hydrogen 2.915 N/A THR 5.A N THR 12.A O no hydrogen 3.170 N/A GLN 6.A NE2 GLU 8.A O no hydrogen 3.132 N/A ALA 7.A N VAL 10.A O no hydrogen 3.109 N/A VAL 10.A N ALA 7.A O no hydrogen 2.928 N/A LEU 11.A N ALA 43.A O no hydrogen 2.858 N/A THR 12.A N THR 5.A O no hydrogen 2.758 N/A THR 12.A OG1 GLN 175.A OE1 no hydrogen 3.009 N/A ILE 13.A N VAL 45.A O no hydrogen 2.763 N/A GLU 14.A N GLY 3.A O no hydrogen 2.839 N/A LEU 15.A N THR 47.A O no hydrogen 2.867 N/A GLN 16.A N MET 1.A O no hydrogen 3.001 N/A GLN 16.A NE2 GLU 14.A OE1 no hydrogen 2.851 N/A ARG 17.A N ASN 22.A OD1 no hydrogen 2.851 N/A ARG 17.A NH1 ALA 23.A O no hydrogen 2.947 N/A GLU 19.A N GLU 19.A OE1 no hydrogen 3.145 N/A ARG 20.A N ARG 17.A O no hydrogen 3.063 N/A ARG 21.A N PRO 18.A O no hydrogen 3.326 N/A ARG 21.A NH1 THR 51.A OG1 no hydrogen 3.424 N/A ASN 22.A N ARG 17.A O no hydrogen 2.851 N/A ASN 22.A ND2 GLN 49.A O no hydrogen 2.794 N/A ASN 22.A ND2 ALA 52.A O no hydrogen 2.902 N/A ASN 22.A ND2 PHE 53.A O no hydrogen 3.696 N/A ALA 23.A N ARG 20.A O no hydrogen 2.919 N/A LEU 24.A N GLY 56.A O no hydrogen 2.682 N/A SER 26.A N ASP 62.A OD2 no hydrogen 3.194 N/A SER 26.A OG PHE 64.A O no hydrogen 3.231 N/A GLN 27.A NE2 GLU 31.A OE2 no hydrogen 3.547 N/A LEU 28.A N ASN 25.A OD1 no hydrogen 2.784 N/A VAL 29.A N ASN 25.A O no hydrogen 3.056 N/A GLU 30.A N SER 26.A O no hydrogen 2.957 N/A GLU 31.A N GLN 27.A O no hydrogen 2.951 N/A LEU 32.A N LEU 28.A O no hydrogen 2.973 N/A THR 33.A N VAL 29.A O no hydrogen 3.073 N/A THR 33.A OG1 VAL 29.A O no hydrogen 2.836 N/A GLN 34.A N GLU 30.A O no hydrogen 3.067 N/A ALA 35.A N GLU 31.A O no hydrogen 2.963 N/A ILE 36.A N LEU 32.A O no hydrogen 2.840 N/A ARG 37.A N THR 33.A O no hydrogen 2.989 N/A LYS 38.A N GLN 34.A O no hydrogen 3.448 N/A ARG 42.A N ALA 9.A O no hydrogen 2.764 N/A ALA 43.A N ALA 9.A O no hydrogen 3.318 N/A ILE 44.A N PRO 85.A O no hydrogen 3.021 N/A VAL 45.A N LEU 11.A O no hydrogen 2.863 N/A LEU 46.A N VAL 87.A O no hydrogen 2.807 N/A THR 47.A N ILE 13.A O no hydrogen 3.060 N/A THR 47.A OG1 ALA 89.A O no hydrogen 2.930 N/A THR 47.A OG1 ASN 91.A OD1 no hydrogen 3.490 N/A GLY 48.A N ASN 91.A OD1 no hydrogen 2.868 N/A GLN 49.A N LEU 15.A O no hydrogen 2.919 N/A PHE 53.A N PRO 93.A O no hydrogen 3.037 N/A CYS 54.A N PRO 93.A O no hydrogen 3.013 N/A CYS 54.A SG ASN 22.A O no hydrogen 3.292 N/A CYS 54.A SG GLY 56.A O no hydrogen 3.615 N/A ALA 55.A N ARG 21.A O no hydrogen 2.822 N/A ASP 58.A N LEU 24.A O no hydrogen 2.844 N/A SER 60.A OG ASP 58.A OD1 no hydrogen 2.948 N/A ASP 62.A N LEU 59.A O no hydrogen 3.314 N/A ASP 67.A N PHE 64.A O no hydrogen 2.996 N/A TYR 68.A N ALA 65.A O no hydrogen 3.276 N/A ARG 71.A N ASP 67.A O no hydrogen 3.129 N/A LEU 72.A N TYR 68.A O no hydrogen 2.915 N/A ILE 73.A N PRO 69.A O no hydrogen 3.097 N/A GLU 74.A N ASP 70.A O no hydrogen 3.069 N/A LEU 75.A N ARG 71.A O no hydrogen 2.843 N/A HIS 76.A N LEU 72.A O no hydrogen 2.950 N/A HIS 76.A ND1 GLN 104.A OE1 no hydrogen 2.985 N/A LYS 77.A N ILE 73.A O no hydrogen 2.821 N/A ALA 78.A N GLU 74.A O no hydrogen 2.742 N/A MET 79.A N LEU 75.A O no hydrogen 2.854 N/A ASP 80.A N HIS 76.A O no hydrogen 2.830 N/A ALA 81.A N LYS 77.A O no hydrogen 2.965 N/A SER 82.A N MET 79.A O no hydrogen 3.219 N/A MET 84.A N SER 82.A OG no hydrogen 2.959 N/A VAL 86.A N ASP 106.A OD2 no hydrogen 2.863 N/A VAL 87.A N ILE 44.A O no hydrogen 2.740 N/A GLY 88.A N LEU 107.A O no hydrogen 2.898 N/A ALA 89.A N LEU 46.A O no hydrogen 2.631 N/A ILE 90.A N VAL 109.A O no hydrogen 2.798 N/A ASN 91.A ND2 GLY 50.A O no hydrogen 3.163 N/A ASN 91.A ND2 ALA 52.A O no hydrogen 3.101 N/A ALA 94.A N PHE 115.A O no hydrogen 2.989 N/A ILE 95.A N CYS 54.A O no hydrogen 3.057 N/A GLY 96.A N GLN 117.A O no hydrogen 3.077 N/A GLY 98.A N ILE 95.A O no hydrogen 2.950 N/A GLN 100.A N GLY 96.A O no hydrogen 3.121 N/A LEU 101.A N ALA 97.A O no hydrogen 2.896 N/A ALA 102.A N GLY 98.A O no hydrogen 2.875 N/A MET 103.A N LEU 99.A O no hydrogen 2.903 N/A GLN 104.A N GLN 100.A O no hydrogen 3.296 N/A GLN 104.A N LEU 101.A O no hydrogen 3.081 N/A GLN 104.A NE2 GLN 104.A O no hydrogen 3.423 N/A CYS 105.A N ALA 102.A O no hydrogen 3.299 N/A CYS 105.A SG LEU 101.A O no hydrogen 3.741 N/A ASP 106.A N VAL 86.A O no hydrogen 2.712 N/A LEU 107.A N VAL 86.A O no hydrogen 3.190 N/A ARG 108.A N ASN 166.A OD1 no hydrogen 2.891 N/A ARG 108.A NE MET 164.A O no hydrogen 2.770 N/A ARG 108.A NH2 ALA 102.A O no hydrogen 2.623 N/A ARG 108.A NH2 CYS 105.A O no hydrogen 2.836 N/A VAL 109.A N GLY 88.A O no hydrogen 2.896 N/A VAL 110.A N ARG 167.A O no hydrogen 2.850 N/A ALA 111.A N ILE 90.A O no hydrogen 2.948 N/A ALA 114.A N ALA 111.A O no hydrogen 2.983 N/A PHE 116.A N LEU 154.A O no hydrogen 2.827 N/A GLN 117.A N ALA 94.A O no hydrogen 3.184 N/A GLN 117.A NE2 ALA 151.A O no hydrogen 2.965 N/A LYS 122.A N PRO 119.A O no hydrogen 2.894 N/A TYR 123.A N THR 120.A O no hydrogen 2.992 N/A LEU 125.A N THR 120.A O no hydrogen 3.067 N/A SER 131.A N ASP 128.A OD2 no hydrogen 3.322 N/A SER 131.A OG ASP 128.A OD1 no hydrogen 2.661 N/A SER 131.A OG ASP 128.A OD2 no hydrogen 3.228 N/A ARG 133.A N ASN 129.A O no hydrogen 2.868 N/A ARG 133.A NE GLU 203.A OE1 no hydrogen 2.884 N/A ARG 133.A NH2 GLU 203.A OE1 no hydrogen 2.925 N/A ARG 134.A N TRP 130.A O no hydrogen 2.806 N/A ARG 134.A NH1 SER 137.A OG no hydrogen 3.001 N/A ARG 134.A NH1 ASP 199.A OD2 no hydrogen 2.867 N/A ARG 134.A NH2 ASP 199.A OD1 no hydrogen 2.855 N/A LEU 135.A N SER 131.A O no hydrogen 3.032 N/A SER 136.A N ILE 132.A O no hydrogen 2.992 N/A SER 136.A OG ILE 132.A O no hydrogen 2.828 N/A SER 137.A N ARG 133.A O no hydrogen 2.969 N/A SER 137.A OG ARG 134.A O no hydrogen 2.459 N/A LEU 138.A N ARG 134.A O no hydrogen 2.979 N/A LEU 138.A N LEU 135.A O no hydrogen 2.904 N/A VAL 139.A N LEU 135.A O no hydrogen 2.878 N/A GLY 140.A N SER 136.A O no hydrogen 2.705 N/A ALA 144.A N GLY 140.A O no hydrogen 3.017 N/A ARG 145.A N HIS 141.A O no hydrogen 2.886 N/A ARG 145.A NH2 HIS 141.A NE2 no hydrogen 2.956 N/A ALA 146.A N GLY 142.A O no hydrogen 3.387 N/A MET 147.A N ARG 143.A O no hydrogen 2.871 N/A LEU 148.A N ALA 144.A O no hydrogen 2.830 N/A LEU 149.A N ARG 145.A O no hydrogen 2.756 N/A SER 150.A N ALA 146.A O no hydrogen 2.994 N/A SER 150.A OG ALA 146.A O no hydrogen 2.534 N/A GLU 152.A N ALA 146.A O no hydrogen 3.344 N/A LEU 154.A N PHE 116.A O no hydrogen 2.814 N/A ILE 158.A N THR 155.A OG1 no hydrogen 3.281 N/A ALA 159.A N THR 155.A O no hydrogen 2.766 N/A LEU 160.A N ALA 156.A O no hydrogen 2.854 N/A HIS 161.A N GLU 157.A O no hydrogen 3.034 N/A THR 162.A N ILE 158.A O no hydrogen 2.840 N/A THR 162.A OG1 LEU 138.A O no hydrogen 2.856 N/A THR 162.A OG1 ALA 159.A O no hydrogen 3.270 N/A GLY 163.A N LEU 160.A O no hydrogen 3.256 N/A MET 164.A N THR 162.A OG1 no hydrogen 3.253 N/A ALA 165.A N ALA 159.A O no hydrogen 2.975 N/A ASN 166.A N ARG 108.A O no hydrogen 2.917 N/A ARG 167.A N ARG 108.A O no hydrogen 3.212 N/A GLY 169.A N VAL 110.A O no hydrogen 2.836 N/A THR 170.A N ASP 173.A OD2 no hydrogen 2.879 N/A THR 170.A OG1 ASP 173.A OD2 no hydrogen 2.958 N/A ASP 173.A N THR 170.A OG1 no hydrogen 3.316 N/A ALA 174.A N THR 170.A O no hydrogen 3.073 N/A GLN 175.A N LEU 171.A O no hydrogen 2.963 N/A ALA 176.A N ALA 172.A O no hydrogen 2.953 N/A TRP 177.A N ASP 173.A O no hydrogen 3.027 N/A ALA 178.A N ALA 174.A O no hydrogen 2.920 N/A ALA 179.A N GLN 175.A O no hydrogen 3.127 N/A GLU 180.A N ALA 176.A O no hydrogen 3.367 N/A ILE 181.A N TRP 177.A O no hydrogen 2.779 N/A ALA 182.A N ALA 178.A O no hydrogen 2.744 N/A ARG 183.A N GLU 180.A O no hydrogen 2.942 N/A LEU 184.A N ILE 181.A O no hydrogen 3.221 N/A ALA 188.A N ALA 185.A O no hydrogen 2.895 N/A ILE 189.A N ALA 185.A O no hydrogen 3.232 N/A GLN 190.A N PRO 186.A O no hydrogen 2.725 N/A HIS 191.A N LEU 187.A O no hydrogen 2.896 N/A ALA 192.A N ALA 188.A O no hydrogen 3.154 N/A LYS 193.A N ILE 189.A O no hydrogen 2.897 N/A LYS 193.A NZ MET 79.A O no hydrogen 3.173 N/A LYS 193.A NZ SER 82.A O no hydrogen 3.116 N/A LYS 193.A NZ MET 84.A O no hydrogen 2.907 N/A LYS 193.A NZ ASP 106.A OD2 no hydrogen 2.594 N/A ARG 194.A N GLN 190.A O no hydrogen 3.188 N/A ARG 194.A NE ARG 194.A O no hydrogen 3.184 N/A ARG 194.A NE ASP 198.A OD2 no hydrogen 3.092 N/A ARG 194.A NH1 ASP 80.A OD2 no hydrogen 2.875 N/A ARG 194.A NH2 ASP 80.A OD1 no hydrogen 2.894 N/A ARG 194.A NH2 ASP 80.A OD2 no hydrogen 3.043 N/A ARG 194.A NH2 ASP 198.A OD1 no hydrogen 2.945 N/A VAL 195.A N HIS 191.A O no hydrogen 3.161 N/A LEU 196.A N ALA 192.A O no hydrogen 2.846 N/A ASN 197.A N LYS 193.A O no hydrogen 2.963 N/A ASN 197.A ND2 ASP 80.A O no hydrogen 3.502 N/A ASP 198.A N ARG 194.A O no hydrogen 3.053 N/A ASP 198.A N VAL 195.A O no hydrogen 3.056 N/A ASP 199.A N LEU 196.A O no hydrogen 3.246 N/A ALA 201.A N ASP 199.A OD1 no hydrogen 2.973 N/A TRP 206.A N HIS 209.A ND1 no hydrogen 3.091 N/A HIS 209.A N TRP 206.A O no hydrogen 2.885 N/A HIS 209.A ND1 ASN 129.A OD1 no hydrogen 3.111 N/A LYS 210.A N TRP 206.A O no hydrogen 2.983 N/A LYS 210.A NZ ASP 214.A OD2 no hydrogen 3.086 N/A GLU 211.A N PRO 207.A O no hydrogen 3.072 N/A LEU 212.A N ALA 208.A O no hydrogen 3.026 N/A PHE 213.A N HIS 209.A O no hydrogen 2.725 N/A ASP 214.A N LYS 210.A O no hydrogen 2.928 N/A LYS 215.A N GLU 211.A O no hydrogen 2.996 N/A ALA 216.A N LEU 212.A O no hydrogen 2.918 N/A TRP 217.A N PHE 213.A O no hydrogen 3.090 N/A TRP 217.A NE1 ALA 126.A O no hydrogen 3.005 N/A GLY 218.A N ASP 214.A O no hydrogen 2.876 N/A SER 219.A N ALA 216.A O no hydrogen 3.159 N/A SER 219.A OG ALA 216.A O no hydrogen 2.731 N/A GLN 220.A N ALA 240.A OXT no hydrogen 2.864 N/A ASP 221.A N ALA 240.A O no hydrogen 2.745 N/A VAL 222.A N SER 219.A O no hydrogen 3.356 N/A VAL 222.A N SER 219.A OG no hydrogen 3.316 N/A ILE 223.A N GLN 220.A O no hydrogen 2.876 N/A GLU 224.A N GLN 220.A O no hydrogen 2.956 N/A ALA 225.A N ASP 221.A O no hydrogen 2.840 N/A GLN 226.A NE2 VAL 222.A O no hydrogen 3.340 N/A VAL 227.A N ILE 223.A O no hydrogen 3.001 N/A ALA 228.A N GLU 224.A O no hydrogen 2.890 N/A ARG 229.A N ALA 225.A O no hydrogen 3.082 N/A MET 230.A N GLN 226.A O no hydrogen 2.964 N/A GLU 231.A N VAL 227.A O no hydrogen 2.712 N/A LYS 232.A N ARG 229.A O no hydrogen 3.021 N/A ARG 233.A N ALA 228.A O no hydrogen 3.169 N/A ARG 233.A NE GLU 231.A OE1 no hydrogen 2.911 N/A ARG 233.A NH1 GLU 224.A OE2 no hydrogen 2.768 N/A ARG 233.A NH1 PRO 234.A O no hydrogen 3.053 N/A ARG 233.A NH2 GLU 224.A OE1 no hydrogen 3.001 N/A ARG 233.A NH2 GLU 224.A OE2 no hydrogen 3.259 N/A ARG 233.A NH2 GLU 231.A OE1 no hydrogen 3.522 N/A LYS 236.A N GLU 224.A OE2 no hydrogen 2.945 N/A GLN 238.A N ASP 221.A OD1 no hydrogen 2.879 N/A GLN 238.A NE2 LYS 236.A O no hydrogen 3.063 N/A GLY 239.A N ASP 221.A OD2 no hydrogen 2.786 N/A