Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3en6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N VAL 52.A O no hydrogen 3.253 N/A ARG 5.A NH1 PRO 57.A O no hydrogen 3.103 N/A ARG 5.A NH2 PRO 57.A O no hydrogen 2.885 N/A GLU 6.A N GLU 6.A OE2 no hydrogen 2.793 N/A SER 7.A N PRO 4.A O no hydrogen 3.084 N/A SER 7.A OG PRO 4.A O no hydrogen 2.490 N/A ARG 9.A N THR 23.A O no hydrogen 2.872 N/A GLU 11.A N MET 21.A O no hydrogen 2.772 N/A VAL 12.A N MET 21.A O no hydrogen 3.092 N/A LEU 14.A N VAL 19.A O no hydrogen 2.672 N/A GLY 15.A N VAL 19.A O no hydrogen 3.080 N/A VAL 19.A N GLY 15.A O no hydrogen 2.762 N/A TRP 20.A N ILE 32.A O no hydrogen 2.705 N/A TRP 20.A NE1 GLU 18.A OE2 no hydrogen 3.146 N/A MET 21.A N VAL 12.A O no hydrogen 2.825 N/A GLY 22.A N VAL 30.A O no hydrogen 2.903 N/A THR 23.A N ARG 9.A O no hydrogen 2.725 N/A THR 23.A OG1 GLU 11.A OE1 no hydrogen 2.891 N/A THR 23.A OG1 GLU 11.A OE2 no hydrogen 3.032 N/A TRP 24.A N THR 28.A O no hydrogen 2.735 N/A ASN 25.A N SER 7.A O no hydrogen 2.826 N/A THR 27.A N TRP 24.A O no hydrogen 3.184 N/A THR 28.A N TRP 24.A O no hydrogen 2.997 N/A VAL 30.A N GLY 22.A O no hydrogen 3.135 N/A ALA 31.A N THR 62.A O no hydrogen 2.944 N/A ILE 32.A N TRP 20.A O no hydrogen 2.826 N/A LYS 33.A N ILE 60.A O no hydrogen 2.957 N/A THR 34.A N GLU 18.A O no hydrogen 2.838 N/A THR 34.A OG1 GLU 18.A O no hydrogen 3.464 N/A LYS 40.A N VAL 37.A O no hydrogen 2.905 N/A LEU 41.A N VAL 37.A O no hydrogen 3.041 N/A ARG 42.A N TYR 100.A OH no hydrogen 2.824 N/A LYS 45.A N HIS 43.A ND1 no hydrogen 3.105 N/A LEU 46.A N HIS 43.A O no hydrogen 3.027 N/A VAL 47.A N VAL 126.A O no hydrogen 2.821 N/A GLN 48.A N GLU 63.A OE1 no hydrogen 2.584 N/A TYR 50.A N VAL 61.A O no hydrogen 2.659 N/A ALA 51.A N VAL 61.A O no hydrogen 3.181 N/A VAL 52.A N TRP 1.A O no hydrogen 2.933 N/A VAL 53.A N TYR 59.A O no hydrogen 2.838 N/A TYR 59.A N VAL 53.A O no hydrogen 2.989 N/A ILE 60.A N LYS 33.A O no hydrogen 2.992 N/A VAL 61.A N ALA 51.A O no hydrogen 2.922 N/A THR 62.A N ALA 31.A O no hydrogen 3.021 N/A THR 62.A OG1 GLU 63.A O no hydrogen 3.281 N/A GLU 63.A N GLN 48.A O no hydrogen 3.024 N/A SER 66.A OG GLU 120.A OE1 no hydrogen 3.037 N/A LYS 67.A N VAL 118.A O no hydrogen 2.876 N/A LYS 67.A NZ GLU 120.A OE1 no hydrogen 3.264 N/A GLY 68.A N MET 65.A O no hydrogen 3.230 N/A LEU 70.A N ILE 116.A O no hydrogen 2.824 N/A LEU 71.A N ALA 113.A O no hydrogen 3.258 N/A ASP 72.A N SER 69.A OG no hydrogen 3.029 N/A PHE 73.A N SER 69.A O no hydrogen 2.949 N/A LEU 74.A N LEU 70.A O no hydrogen 2.808 N/A LYS 75.A N LEU 71.A O no hydrogen 3.154 N/A GLY 76.A N PHE 73.A O no hydrogen 3.137 N/A GLY 79.A N GLY 76.A O no hydrogen 3.091 N/A TYR 81.A N MET 78.A O no hydrogen 2.835 N/A LEU 82.A N MET 78.A O no hydrogen 3.212 N/A LEU 82.A N GLY 79.A O no hydrogen 3.271 N/A ARG 83.A NE GLY 233.A O no hydrogen 3.490 N/A ARG 83.A NH1 LYS 80.A O no hydrogen 2.967 N/A ARG 83.A NH1 LEU 82.A O no hydrogen 2.693 N/A LEU 84.A N LEU 236.A O no hydrogen 3.112 N/A LEU 87.A N ARG 83.A O no hydrogen 2.951 N/A VAL 88.A N LEU 84.A O no hydrogen 2.689 N/A ASP 89.A N PRO 85.A O no hydrogen 3.048 N/A MET 90.A N GLN 86.A O no hydrogen 3.085 N/A ALA 91.A N LEU 87.A O no hydrogen 2.953 N/A ALA 92.A N VAL 88.A O no hydrogen 2.960 N/A GLN 93.A N ASP 89.A O no hydrogen 3.034 N/A ILE 94.A N MET 90.A O no hydrogen 3.052 N/A ALA 95.A N ALA 91.A O no hydrogen 2.837 N/A SER 96.A N ALA 92.A O no hydrogen 2.875 N/A GLY 97.A N GLN 93.A O no hydrogen 2.941 N/A MET 98.A N ILE 94.A O no hydrogen 2.790 N/A ALA 99.A N ALA 95.A O no hydrogen 2.560 N/A TYR 100.A N SER 96.A O no hydrogen 3.116 N/A VAL 101.A N GLY 97.A O no hydrogen 3.110 N/A GLU 102.A N MET 98.A O no hydrogen 2.815 N/A ARG 103.A N ALA 99.A O no hydrogen 2.947 N/A MET 104.A N TYR 100.A O no hydrogen 2.873 N/A ASN 105.A N GLU 102.A O no hydrogen 2.846 N/A TYR 106.A N VAL 101.A O no hydrogen 3.005 N/A HIS 108.A N ASP 147.A OD2 no hydrogen 2.746 N/A ARG 109.A N ASP 147.A OD1 no hydrogen 2.786 N/A ARG 112.A NE ASP 110.A OD2 no hydrogen 2.270 N/A ARG 112.A NH2 ASP 110.A OD1 no hydrogen 2.518 N/A ALA 113.A N GLU 157.A OE1 no hydrogen 2.763 N/A ASN 115.A N ARG 112.A O no hydrogen 2.896 N/A ASN 115.A ND2 ASP 110.A O no hydrogen 2.780 N/A ASN 115.A ND2 ASP 110.A OD1 no hydrogen 2.918 N/A ILE 116.A N ALA 113.A O no hydrogen 3.300 N/A LEU 117.A N LYS 125.A O no hydrogen 2.879 N/A VAL 118.A N GLY 68.A O no hydrogen 3.001 N/A GLY 119.A N VAL 123.A O no hydrogen 2.628 N/A VAL 123.A N GLU 120.A O no hydrogen 3.098 N/A CYS 124.A SG LEU 122.A O no hydrogen 3.850 N/A LYS 125.A N LEU 117.A O no hydrogen 2.687 N/A LYS 125.A NZ GLU 63.A OE1 no hydrogen 3.190 N/A LYS 125.A NZ GLU 63.A OE2 no hydrogen 2.698 N/A VAL 126.A N LYS 45.A O no hydrogen 2.851 N/A ALA 127.A N ASN 115.A O no hydrogen 3.221 N/A LYS 130.A NZ PRO 165.A O no hydrogen 3.045 N/A LYS 130.A NZ TYR 166.A O no hydrogen 3.156 N/A LYS 130.A NZ MET 169.A O no hydrogen 2.947 N/A TRP 131.A N PRO 128.A O no hydrogen 2.778 N/A TRP 131.A NE1 GLU 157.A OE1 no hydrogen 2.890 N/A THR 132.A N ILE 129.A O no hydrogen 3.096 N/A THR 132.A OG1 PRO 128.A O no hydrogen 2.623 N/A GLU 135.A N GLU 135.A OE1 no hydrogen 2.967 N/A ALA 136.A N ALA 133.A O no hydrogen 2.808 N/A ALA 137.A N ALA 133.A O no hydrogen 2.899 N/A LEU 138.A N PRO 134.A O no hydrogen 2.804 N/A TYR 139.A N GLU 135.A O no hydrogen 3.076 N/A GLY 140.A N ALA 136.A O no hydrogen 3.015 N/A ARG 141.A N GLU 135.A O no hydrogen 3.067 N/A THR 143.A N SER 146.A OG no hydrogen 2.750 N/A LYS 145.A N THR 143.A OG1 no hydrogen 2.915 N/A LYS 145.A NZ ARG 209.A O no hydrogen 2.872 N/A SER 146.A N THR 143.A O no hydrogen 3.006 N/A SER 146.A N THR 143.A OG1 no hydrogen 3.375 N/A SER 146.A OG THR 143.A O no hydrogen 3.025 N/A ASP 147.A N THR 143.A O no hydrogen 3.170 N/A VAL 148.A N ILE 144.A O no hydrogen 2.993 N/A TRP 149.A N LYS 145.A O no hydrogen 3.210 N/A SER 150.A N SER 146.A O no hydrogen 3.138 N/A SER 150.A OG TRP 131.A O no hydrogen 2.552 N/A SER 150.A OG SER 146.A O no hydrogen 3.254 N/A PHE 151.A N ASP 147.A O no hydrogen 2.814 N/A GLY 152.A N VAL 148.A O no hydrogen 3.176 N/A ILE 153.A N TRP 149.A O no hydrogen 3.224 N/A LEU 154.A N SER 150.A O no hydrogen 2.894 N/A LEU 155.A N PHE 151.A O no hydrogen 2.862 N/A THR 156.A N GLY 152.A O no hydrogen 3.337 N/A THR 156.A OG1 ILE 153.A O no hydrogen 2.728 N/A GLU 157.A N ILE 153.A O no hydrogen 3.016 N/A LEU 158.A N LEU 154.A O no hydrogen 2.821 N/A THR 159.A N LEU 155.A O no hydrogen 2.926 N/A THR 159.A OG1 LEU 155.A O no hydrogen 2.951 N/A THR 159.A OG1 THR 156.A O no hydrogen 3.477 N/A THR 160.A N THR 156.A O no hydrogen 2.991 N/A THR 160.A N GLU 157.A O no hydrogen 3.311 N/A THR 160.A OG1 THR 156.A O no hydrogen 2.824 N/A THR 160.A OG1 GLU 157.A O no hydrogen 3.409 N/A LYS 161.A N LEU 158.A O no hydrogen 3.022 N/A LYS 161.A NZ GLY 79.A O no hydrogen 2.872 N/A LYS 161.A NZ LEU 82.A O no hydrogen 2.895 N/A LYS 161.A NZ ASN 235.A O no hydrogen 2.763 N/A GLY 162.A N GLU 157.A O no hydrogen 2.652 N/A ARG 163.A N THR 160.A OG1 no hydrogen 3.050 N/A MET 169.A N TYR 166.A O no hydrogen 3.021 N/A VAL 174.A N VAL 170.A O no hydrogen 2.976 N/A LEU 175.A N ASN 171.A O no hydrogen 2.960 N/A ASP 176.A N ARG 172.A O no hydrogen 2.932 N/A GLN 177.A N GLU 173.A O no hydrogen 2.894 N/A VAL 178.A N VAL 174.A O no hydrogen 2.789 N/A GLU 179.A N LEU 175.A O no hydrogen 3.121 N/A ARG 180.A N GLN 177.A O no hydrogen 3.096 N/A GLY 181.A N VAL 178.A O no hydrogen 3.063 N/A TYR 182.A N GLN 177.A O no hydrogen 3.070 N/A ARG 183.A NE TRP 202.A O no hydrogen 2.858 N/A ARG 183.A NH1 VAL 178.A O no hydrogen 3.227 N/A ARG 183.A NH1 TYR 182.A O no hydrogen 2.794 N/A ARG 183.A NH2 TRP 202.A O no hydrogen 2.713 N/A CYS 186.A SG PRO 187.A O no hydrogen 3.588 N/A CYS 186.A SG CYS 190.A O no hydrogen 3.002 N/A CYS 190.A N PRO 187.A O no hydrogen 3.006 N/A CYS 190.A SG PRO 191.A O no hydrogen 3.520 N/A SER 193.A OG TYR 222.A OH no hydrogen 2.722 N/A SER 193.A OG GLU 227.A OE1 no hydrogen 2.425 N/A HIS 195.A N PRO 191.A O no hydrogen 3.170 N/A HIS 195.A NE2 MET 184.A O no hydrogen 2.745 N/A ASP 196.A N GLU 192.A O no hydrogen 2.706 N/A LEU 197.A N SER 193.A O no hydrogen 3.185 N/A MET 198.A N LEU 194.A O no hydrogen 3.340 N/A CYS 199.A N HIS 195.A O no hydrogen 2.979 N/A CYS 199.A SG HIS 195.A O no hydrogen 3.393 N/A GLN 200.A N ASP 196.A O no hydrogen 2.941 N/A GLN 200.A N LEU 197.A O no hydrogen 3.069 N/A GLN 200.A NE2 ASP 196.A O no hydrogen 3.325 N/A GLN 200.A NE2 ASP 196.A OD2 no hydrogen 2.656 N/A CYS 201.A N LEU 197.A O no hydrogen 3.129 N/A CYS 201.A SG LEU 197.A O no hydrogen 3.391 N/A TRP 202.A N CYS 199.A O no hydrogen 3.361 N/A ARG 203.A N GLN 200.A O no hydrogen 3.347 N/A ARG 203.A NE GLU 208.A O no hydrogen 2.880 N/A ARG 203.A NH2 GLU 208.A O no hydrogen 2.806 N/A LYS 204.A NZ GLU 179.A OE2 no hydrogen 3.284 N/A GLU 208.A N ASP 205.A O no hydrogen 2.835 N/A ARG 209.A N PRO 206.A O no hydrogen 3.202 N/A ARG 209.A NE ARG 203.A O no hydrogen 2.807 N/A ARG 209.A NH1 GLU 135.A OE1 no hydrogen 2.841 N/A ARG 209.A NH1 ARG 203.A O no hydrogen 2.955 N/A ARG 209.A NH2 GLU 135.A OE1 no hydrogen 3.468 N/A ARG 209.A NH2 GLU 135.A OE2 no hydrogen 2.671 N/A ARG 209.A NH2 LYS 145.A O no hydrogen 3.006 N/A PHE 212.A N GLU 102.A OE2 no hydrogen 2.961 N/A GLU 213.A N GLU 102.A OE1 no hydrogen 3.284 N/A TYR 214.A N THR 211.A OG1 no hydrogen 2.796 N/A LEU 215.A N THR 211.A O no hydrogen 2.976 N/A GLN 216.A N PHE 212.A O no hydrogen 2.674 N/A GLN 216.A NE2 GLU 220.A OE2 no hydrogen 3.030 N/A ALA 217.A N GLU 213.A O no hydrogen 3.191 N/A PHE 218.A N TYR 214.A O no hydrogen 2.964 N/A LEU 219.A N LEU 215.A O no hydrogen 2.964 N/A GLU 220.A N GLN 216.A O no hydrogen 2.869 N/A ASP 221.A N ALA 217.A O no hydrogen 3.082 N/A TYR 222.A N LEU 219.A O no hydrogen 3.226 N/A TYR 222.A OH SER 193.A OG no hydrogen 2.722 N/A THR 224.A N ASP 221.A O no hydrogen 2.919 N/A SER 225.A N ASP 221.A O no hydrogen 2.953 N/A THR 226.A N TYR 222.A O no hydrogen 2.895 N/A GLU 227.A N TYR 222.A O no hydrogen 2.918 N/A TYR 230.A N GLU 227.A O no hydrogen 3.287 N/A TYR 230.A OH LEU 236.A O no hydrogen 2.801 N/A GLY 233.A N LEU 236.A OXT no hydrogen 2.587 N/A ASN 235.A N GLU 189.A OE2 no hydrogen 2.906 N/A ASN 235.A ND2 GLU 189.A OE1 no hydrogen 2.740 N/A LEU 236.A N GLU 189.A OE2 no hydrogen 2.971 N/A