Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4coq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 2.A N SER 19.A OG.B no hydrogen 3.063 N/A GLY 5.A N ILE 10.A O no hydrogen 2.867 N/A GLY 11.A N GLY 8.A O no hydrogen 3.220 N/A HIS 14.A N GLY 11.A O no hydrogen 2.893 N/A TRP 15.A N PRO 12.A O no hydrogen 3.364 N/A TRP 15.A NE1 GLY 5.A O no hydrogen 2.883 N/A ASP 17.A N HIS 14.A O no hydrogen 3.161 N/A LEU 18.A N TRP 15.A O no hydrogen 3.102 N/A GLU 21.A N SER 19.A OG.A no hydrogen 3.121 N/A GLU 21.A N GLU 21.A OE1.A no hydrogen 2.667 N/A TYR 22.A N SER 19.A O no hydrogen 2.925 N/A TYR 22.A OH ALA 2.A O no hydrogen 2.842 N/A LEU 23.A N PRO 20.A O no hydrogen 3.300 N/A CYS 25.A N TYR 22.A O no hydrogen 2.996 N/A CYS 25.A SG.A TYR 22.A O no hydrogen 3.257 N/A CYS 25.A SG.B PRO 12.A O no hydrogen 3.938 N/A LYS 26.A N LEU 23.A O no hydrogen 2.986 N/A LYS 26.A NZ.A ASP 17.A OD1 no hydrogen 2.974 N/A LYS 26.A NZ.B ASP 17.A OD1 no hydrogen 2.581 N/A LYS 26.A NZ.B ASP 17.A OD2 no hydrogen 3.092 N/A ILE 27.A N LEU 23.A O no hydrogen 3.013 N/A GLY 28.A N MET 24.A O no hydrogen 2.919 N/A ASN 30.A N GLU 182.A OE2 no hydrogen 2.957 N/A GLN 31.A NE2 CYS 180.A O no hydrogen 3.057 N/A GLN 31.A NE2 GLU 182.A OE2 no hydrogen 2.930 N/A SER 32.A N SER 174.A OG no hydrogen 2.843 N/A SER 32.A OG TYR 171.A OH no hydrogen 2.815 N/A SER 32.A OG SER 174.A O no hydrogen 3.355 N/A ILE 36.A N THR 98.A O no hydrogen 2.802 N/A SER 38.A N ASN 100.A OD1 no hydrogen 2.872 N/A SER 38.A OG ASN 100.A OD1 no hydrogen 3.418 N/A ASP 40.A N ASN 37.A OD1 no hydrogen 2.913 N/A ALA 41.A N ASN 37.A O no hydrogen 3.017 N/A ALA 41.A N SER 38.A O no hydrogen 3.315 N/A VAL 42.A N VAL 223.A O no hydrogen 2.775 N/A ALA 44.A N LYS 225.A O no hydrogen 3.005 N/A LEU 46.A N ALA 44.A O no hydrogen 2.889 N/A TYR 52.A N TYR 76.A O no hydrogen 2.767 N/A TYR 53.A OH HIS 112.A NE2 no hydrogen 2.735 N/A SER 55.A OG.A ILE 156.A O no hydrogen 3.065 N/A SER 55.A OG.A ASP 157.A OD1.A no hydrogen 2.703 N/A ASP 56.A N VAL 54.A O no hydrogen 3.081 N/A LYS 58.A N VAL 70.A O no hydrogen 2.770 N/A LYS 58.A NZ.A MET 71.A O no hydrogen 3.313 N/A VAL 60.A N ARG 150.A O no hydrogen 2.915 N/A VAL 61.A N LYS 68.A O no hydrogen 2.786 N/A ASN 62.A N GLN 148.A O no hydrogen 3.051 N/A ASN 62.A ND2 PRO 143.A O no hydrogen 3.110 N/A ASN 63.A N THR 66.A O no hydrogen 3.290 N/A GLY 64.A N ASN 62.A OD1 no hydrogen 2.897 N/A HIS 65.A N ASN 63.A OD1 no hydrogen 2.858 N/A THR 66.A N ASN 63.A OD1 no hydrogen 3.005 N/A THR 66.A OG1 ILE 67.A O no hydrogen 3.261 N/A THR 66.A OG1 PHE 91.A O no hydrogen 2.720 N/A LYS 68.A N VAL 61.A O no hydrogen 2.922 N/A VAL 69.A N PHE 89.A O no hydrogen 2.753 N/A VAL 70.A N TYR 59.A O no hydrogen 2.897 N/A MET 71.A N LYS 87.A O no hydrogen 2.821 N/A GLY 72.A N ASP 56.A O no hydrogen 2.853 N/A ARG 74.A N ASP 56.A OD2 no hydrogen 2.938 N/A TYR 76.A N TYR 52.A O no hydrogen 3.034 N/A VAL 77.A N PHE 84.A O no hydrogen 2.880 N/A VAL 78.A N SER 50.A O no hydrogen 2.954 N/A VAL 79.A N LYS 82.A O no hydrogen 3.044 N/A LYS 82.A N VAL 79.A O no hydrogen 2.971 N/A LYS 82.A NZ ASP 80.A O no hydrogen 3.277 N/A PHE 84.A N VAL 77.A O no hydrogen 2.820 N/A TYR 85.A N LEU 113.A O no hydrogen 2.825 N/A LEU 86.A N GLY 75.A O no hydrogen 2.820 N/A LYS 87.A N VAL 111.A O no hydrogen 2.896 N/A PHE 89.A N VAL 69.A O no hydrogen 2.988 N/A HIS 90.A N HIS 109.A O no hydrogen 2.933 N/A HIS 90.A ND1 GLN 88.A OE1 no hydrogen 2.769 N/A PHE 91.A N THR 66.A OG1 no hydrogen 3.090 N/A HIS 92.A N GLU 107.A O no hydrogen 2.844 N/A HIS 92.A ND1 ASN 211.A O no hydrogen 2.865 N/A ALA 93.A N ASN 211.A OD1 no hydrogen 2.852 N/A SER 95.A N TYR 104.A O no hydrogen 2.871 N/A SER 95.A OG HIS 97.A O no hydrogen 2.641 N/A SER 95.A OG HIS 103.A ND1 no hydrogen 3.372 N/A SER 95.A OG TYR 104.A O no hydrogen 3.232 N/A HIS 97.A N GLU 107.A OE1 no hydrogen 2.936 N/A HIS 97.A ND1 GLU 107.A OE2 no hydrogen 2.814 N/A HIS 97.A NE2 TYR 171.A OH no hydrogen 2.634 N/A THR 98.A N ILE 34.A O no hydrogen 3.320 N/A THR 98.A OG1 ASP 35.A OD1 no hydrogen 2.555 N/A VAL 99.A N LYS 102.A O no hydrogen 2.965 N/A ASN 100.A N ILE 36.A O no hydrogen 2.886 N/A ASN 100.A ND2 SER 38.A OG no hydrogen 3.063 N/A GLY 101.A N ASP 35.A OD1 no hydrogen 2.757 N/A LYS 102.A N VAL 99.A O no hydrogen 3.027 N/A HIS 103.A ND1 SER 95.A O no hydrogen 2.854 N/A TYR 104.A N SER 95.A OG no hydrogen 3.001 N/A GLU 107.A N HIS 92.A O no hydrogen 2.864 N/A ALA 108.A N VAL 124.A O no hydrogen 2.801 N/A HIS 109.A N HIS 90.A O no hydrogen 2.830 N/A HIS 109.A NE2 GLU 107.A OE2 no hydrogen 2.760 N/A PHE 110.A N LEU 122.A O no hydrogen 2.804 N/A VAL 111.A N GLN 88.A O no hydrogen 2.839 N/A HIS 112.A N THR 120.A O no hydrogen 2.839 N/A HIS 112.A ND1 THR 120.A O no hydrogen 2.956 N/A HIS 112.A NE2 TYR 53.A OH no hydrogen 2.735 N/A LEU 113.A N TYR 85.A O no hydrogen 2.920 N/A ASP 114.A N ASN 118.A O no hydrogen 2.919 N/A ASN 116.A N ASP 114.A OD1 no hydrogen 2.876 N/A GLY 117.A N ASP 114.A O no hydrogen 2.958 N/A ASN 118.A N ASP 114.A OD1 no hydrogen 2.838 N/A ASN 118.A ND2 ASP 114.A OD1 no hydrogen 3.335 N/A ASN 118.A ND2 ASP 114.A OD2 no hydrogen 3.055 N/A THR 120.A N HIS 112.A O no hydrogen 2.934 N/A VAL 121.A N ARG 185.A O no hydrogen 2.842 N/A LEU 122.A N PHE 110.A O no hydrogen 2.932 N/A GLY 123.A N ILE 187.A O no hydrogen 2.774 N/A VAL 124.A N ALA 108.A O no hydrogen 2.865 N/A PHE 126.A N PHE 106.A O no hydrogen 2.917 N/A LYS 127.A N VAL 193.A O no hydrogen 2.794 N/A GLY 129.A N MET 195.A O no hydrogen 2.778 N/A LYS 130.A N GLU 194.A OE1 no hydrogen 2.879 N/A ASN 132.A N GLN 199.A OE1 no hydrogen 2.839 N/A ASN 132.A ND2 GLU 194.A O no hydrogen 2.931 N/A GLU 134.A N ASN 132.A OD1 no hydrogen 3.143 N/A LEU 135.A N ASN 132.A OD1 no hydrogen 3.035 N/A GLU 136.A N ASN 132.A O no hydrogen 2.906 N/A LYS 137.A N GLU 134.A O no hydrogen 3.113 N/A LYS 137.A NZ GLU 134.A OE1 no hydrogen 2.945 N/A LYS 137.A NZ GLU 134.A OE2 no hydrogen 3.533 N/A LYS 137.A NZ ARG 155.A O no hydrogen 2.754 N/A TRP 139.A N LEU 135.A O no hydrogen 2.886 N/A TRP 139.A NE1 GLN 199.A O no hydrogen 2.904 N/A ARG 140.A N GLU 136.A O no hydrogen 3.037 N/A VAL 141.A N VAL 138.A O no hydrogen 3.075 N/A MET 142.A N TRP 139.A O no hydrogen 3.142 N/A GLY 147.A N ASN 62.A O no hydrogen 2.714 N/A GLN 148.A NE2 LYS 149.A O no hydrogen 2.820 N/A ARG 150.A N VAL 60.A O no hydrogen 2.755 N/A ARG 150.A NH1 MET 142.A O no hydrogen 3.448 N/A ARG 155.A NE.A ASP 157.A OD1.A no hydrogen 3.040 N/A ARG 155.A NE.B SER 55.A OG.A no hydrogen 3.215 N/A ARG 155.A NH2.A ASP 157.A OD2.A no hydrogen 3.561 N/A ASP 157.A N GLU 134.A OE2 no hydrogen 2.772 N/A GLU 159.A N ASP 157.A OD1.B no hydrogen 3.283 N/A LYS 160.A N ASP 157.A O no hydrogen 3.002 N/A LYS 160.A NZ ASP 157.A OD2.A no hydrogen 2.801 N/A LEU 161.A N PRO 158.A O no hydrogen 3.058 N/A LEU 162.A N GLU 159.A O no hydrogen 3.098 N/A ASN 165.A N GLU 191.A OE1.A no hydrogen 3.122 N/A ARG 166.A NE PRO 163.A O no hydrogen 2.763 N/A ARG 166.A NH1 GLU 159.A OE2.A no hydrogen 3.064 N/A ARG 166.A NH2 GLU 159.A OE2.A no hydrogen 2.951 N/A ARG 166.A NH2 GLU 159.A OE2.B no hydrogen 2.734 N/A ASP 167.A N ASN 165.A OD1 no hydrogen 2.939 N/A TYR 168.A OH ALA 47.A O no hydrogen 2.507 N/A TYR 169.A N VAL 188.A O no hydrogen 2.790 N/A ARG 170.A N MET 224.A O no hydrogen 2.920 N/A ARG 170.A NH1 ASP 80.A OD1 no hydrogen 2.820 N/A ARG 170.A NH2 ASP 80.A OD2 no hydrogen 2.915 N/A TYR 171.A N TRP 186.A O no hydrogen 3.276 N/A TYR 171.A OH SER 32.A OG no hydrogen 2.815 N/A TYR 171.A OH HIS 97.A NE2 no hydrogen 2.634 N/A GLY 173.A N VAL 184.A O no hydrogen 2.825 N/A SER 174.A N SER 32.A OG no hydrogen 2.883 N/A SER 174.A OG LEU 175.A O no hydrogen 2.788 N/A LEU 175.A N SER 181.A O no hydrogen 2.952 N/A THR 176.A OG1 GLU 96.A OE1 no hydrogen 2.557 N/A THR 176.A OG1 GLU 96.A OE2 no hydrogen 3.475 N/A CYS 180.A N THR 177.A O no hydrogen 2.928 N/A CYS 180.A SG.B LEU 175.A O no hydrogen 3.619 N/A VAL 184.A N GLY 173.A O no hydrogen 3.148 N/A ARG 185.A N ILE 119.A O no hydrogen 3.013 N/A ARG 185.A NE ASP 80.A OD2 no hydrogen 2.914 N/A ARG 185.A NH2 ASP 80.A OD2 no hydrogen 2.990 N/A TRP 186.A N TYR 171.A O no hydrogen 2.999 N/A TRP 186.A NE1 SER 174.A O no hydrogen 2.891 N/A ILE 187.A N VAL 121.A O no hydrogen 2.916 N/A VAL 188.A N TYR 169.A O no hydrogen 2.815 N/A PHE 189.A N GLY 123.A O no hydrogen 2.988 N/A LYS 190.A N ASP 167.A O no hydrogen 3.071 N/A LYS 190.A NZ LYS 225.A OXT no hydrogen 2.822 N/A VAL 193.A N PHE 125.A O no hydrogen 2.864 N/A MET 195.A N LYS 127.A O no hydrogen 2.985 N/A SER 196.A N GLN 199.A OE1 no hydrogen 3.064 N/A GLN 199.A N SER 196.A OG no hydrogen 2.953 N/A GLN 199.A NE2 ASN 132.A O no hydrogen 3.035 N/A GLN 199.A NE2 GLU 136.A OE1 no hydrogen 2.949 N/A LEU 200.A N SER 196.A O no hydrogen 3.017 N/A GLU 201.A N ARG 197.A O no hydrogen 2.847 N/A LYS 202.A N GLU 198.A O no hydrogen 2.945 N/A LYS 202.A NZ TRP 139.A O no hydrogen 2.870 N/A PHE 203.A N GLN 199.A O no hydrogen 3.261 N/A ARG 204.A N LEU 200.A O no hydrogen 2.987 N/A ARG 204.A NH1 GLU 201.A OE1.A no hydrogen 2.937 N/A LYS 205.A N GLU 201.A O no hydrogen 2.928 N/A VAL 206.A N LYS 202.A O no hydrogen 2.916 N/A MET 207.A N PHE 203.A O no hydrogen 2.950 N/A GLY 208.A N ARG 204.A O no hydrogen 2.831 N/A ASN 211.A N ALA 93.A O no hydrogen 3.138 N/A ASN 211.A ND2 HIS 65.A O no hydrogen 2.958 N/A ASN 211.A ND2 PHE 91.A O no hydrogen 2.989 N/A ASN 212.A ND2 SER 95.A O no hydrogen 3.441 N/A ARG 213.A N GLU 96.A OE2 no hydrogen 2.872 N/A ARG 213.A NH1 GLN 31.A OE1 no hydrogen 2.831 N/A ARG 213.A NH1 SER 32.A O no hydrogen 2.818 N/A ARG 213.A NH2 GLN 31.A OE1 no hydrogen 3.033 N/A GLN 216.A N PRO 33.A O no hydrogen 2.802 N/A GLN 216.A NE2 PRO 214.A O no hydrogen 2.930 N/A ASN 219.A ND2 LYS 29.A O no hydrogen 2.960 N/A ARG 221.A N LEU 218.A O no hydrogen 3.158 N/A ARG 221.A NE LEU 218.A O no hydrogen 2.924 N/A ARG 221.A NH1 GLN 31.A O no hydrogen 2.950 N/A ARG 221.A NH1 SER 172.A O no hydrogen 2.927 N/A ARG 221.A NH2 GLN 31.A O no hydrogen 2.878 N/A ARG 221.A NH2 PRO 217.A O no hydrogen 2.859 N/A MET 224.A N ARG 170.A O no hydrogen 2.909 N/A LYS 225.A N VAL 42.A O no hydrogen 2.901 N/A LYS 225.A NZ SER 38.A O no hydrogen 2.734 N/A