Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3eng_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N PHE 184.A O no hydrogen 3.469 N/A GLY 3.A N PHE 182.A O no hydrogen 2.897 N/A ARG 4.A N ASN 118.A O no hydrogen 2.830 N/A SER 5.A OG PRO 180.A O no hydrogen 2.689 N/A THR 6.A N PHE 120.A O no hydrogen 3.090 N/A THR 6.A OG1 HIS 119.A NE2 no hydrogen 2.718 N/A THR 6.A OG1 ASP 121.A OD1 no hydrogen 2.698 N/A ARG 7.A NE GLY 148.A O no hydrogen 3.059 N/A ARG 7.A NH1 ASP 178.A OD1 no hydrogen 2.823 N/A ARG 7.A NH2 GLY 148.A O no hydrogen 3.088 N/A TYR 8.A N LEU 122.A O no hydrogen 3.001 N/A TRP 9.A N GLY 128.A O no hydrogen 3.018 N/A CYS 11.A SG GLN 138.A OE1 no hydrogen 3.496 N/A CYS 12.A N ASP 10.A OD1 no hydrogen 2.998 N/A CYS 12.A SG ASP 10.A O no hydrogen 3.764 N/A CYS 12.A SG PHE 132.A O no hydrogen 4.018 N/A LYS 13.A NZ PHE 41.A O no hydrogen 2.781 N/A LYS 13.A NZ ALA 43.A O no hydrogen 2.906 N/A SER 15.A N SER 110.A OG no hydrogen 2.989 N/A SER 15.A OG GLU 82.A OE2 no hydrogen 2.781 N/A SER 15.A OG SER 110.A OG no hydrogen 3.420 N/A SER 15.A OG THR 111.A OG1 no hydrogen 3.301 N/A CYS 16.A N THR 109.A O no hydrogen 3.157 N/A GLY 17.A N PRO 14.A O no hydrogen 2.982 N/A LYS 21.A NZ SER 15.A O no hydrogen 2.943 N/A LYS 21.A NZ GLU 82.A OE1 no hydrogen 3.017 N/A LYS 21.A NZ GLU 82.A OE2 no hydrogen 3.425 N/A ASN 25.A N ARG 200.A O no hydrogen 3.219 N/A ASN 25.A ND2 GLY 198.A O no hydrogen 3.349 N/A GLN 26.A NE2 PRO 27.A O no hydrogen 2.925 N/A VAL 28.A N CYS 16.A O no hydrogen 3.077 N/A PHE 29.A N THR 197.A O no hydrogen 2.965 N/A CYS 31.A N TYR 54.A O no hydrogen 2.861 N/A CYS 31.A SG PHE 35.A O no hydrogen 3.534 N/A ASN 32.A N GLN 36.A O no hydrogen 2.916 N/A ASN 34.A N ASN 32.A OD1 no hydrogen 2.946 N/A PHE 35.A N ASN 32.A O no hydrogen 2.938 N/A GLN 36.A N ASN 32.A OD1 no hydrogen 2.979 N/A ARG 37.A NH2 ALA 195.A O no hydrogen 2.987 N/A ILE 38.A N SER 30.A O no hydrogen 2.977 N/A ASP 42.A N ASP 40.A OD1 no hydrogen 2.959 N/A ALA 43.A N ASP 40.A O no hydrogen 3.204 N/A LYS 44.A NZ PRO 49.A O no hydrogen 2.680 N/A GLY 46.A N ALA 53.A O no hydrogen 2.655 N/A CYS 47.A N SER 45.A OG no hydrogen 3.094 N/A CYS 47.A SG ASP 10.A O no hydrogen 4.004 N/A GLU 48.A N SER 45.A O no hydrogen 3.026 N/A GLY 51.A N GLU 48.A O no hydrogen 2.828 N/A VAL 52.A N LYS 44.A O no hydrogen 2.896 N/A ALA 53.A N LYS 44.A O no hydrogen 2.906 N/A TYR 54.A N CYS 31.A O no hydrogen 2.703 N/A SER 55.A N CYS 11.A O no hydrogen 3.134 N/A SER 55.A OG CYS 12.A O no hydrogen 2.888 N/A CYS 56.A SG PHE 29.A O no hydrogen 3.670 N/A GLN 59.A N CYS 56.A O no hydrogen 3.135 N/A GLN 59.A NE2 PHE 29.A O no hydrogen 3.137 N/A GLN 59.A NE2 ARG 196.A O no hydrogen 3.400 N/A THR 60.A OG1 ALA 57.A O no hydrogen 2.765 N/A TRP 62.A N LEU 70.A O no hydrogen 2.857 N/A VAL 64.A N PHE 68.A O no hydrogen 2.801 N/A ASN 65.A N PHE 68.A O no hydrogen 3.251 N/A ASP 67.A N ASN 65.A OD1 no hydrogen 3.017 N/A PHE 68.A N ASN 65.A O no hydrogen 3.351 N/A ALA 69.A N LYS 103.A O no hydrogen 2.992 N/A LEU 70.A N TRP 62.A O no hydrogen 2.876 N/A GLY 71.A N VAL 105.A O no hydrogen 3.037 N/A ALA 73.A N GLN 107.A O no hydrogen 3.052 N/A ALA 74.A N ASP 121.A O no hydrogen 2.855 N/A THR 75.A N SER 110.A O no hydrogen 2.856 N/A THR 75.A OG1 SER 108.A OG no hydrogen 2.771 N/A SER 76.A N HIS 119.A O no hydrogen 3.075 N/A ALA 78.A N ASN 118.A OD1 no hydrogen 3.053 N/A SER 80.A N ILE 77.A O no hydrogen 3.223 N/A SER 80.A OG ASN 81.A O no hydrogen 3.450 N/A ASN 81.A N SER 80.A OG no hydrogen 2.636 N/A GLY 84.A N ASN 81.A O no hydrogen 2.836 N/A GLY 84.A N ASN 81.A OD1 no hydrogen 3.031 N/A TRP 85.A N ASN 81.A O no hydrogen 3.134 N/A TRP 85.A NE1 THR 111.A OG1 no hydrogen 2.838 N/A CYS 86.A N GLU 82.A O no hydrogen 2.988 N/A CYS 87.A N SER 108.A O no hydrogen 2.906 N/A ALA 88.A N TRP 85.A O no hydrogen 2.975 N/A TYR 90.A N VAL 106.A O no hydrogen 2.928 N/A GLU 91.A N ARG 185.A O no hydrogen 2.722 N/A LEU 92.A N MET 104.A O no hydrogen 2.788 N/A THR 93.A N SER 183.A O no hydrogen 2.937 N/A PHE 94.A N LYS 102.A O no hydrogen 3.025 N/A THR 95.A N SER 181.A O no hydrogen 2.932 N/A THR 95.A OG1 SER 181.A OG no hydrogen 3.035 N/A SER 96.A OG SER 181.A OG no hydrogen 3.271 N/A ALA 100.A N GLY 97.A O no hydrogen 3.243 N/A GLY 101.A N PHE 94.A O no hydrogen 2.839 N/A LYS 102.A N VAL 99.A O no hydrogen 2.927 N/A LYS 102.A NZ ASP 66.A O no hydrogen 2.849 N/A LYS 103.A N ASP 67.A O no hydrogen 2.937 N/A LYS 103.A NZ THR 93.A OG1 no hydrogen 2.691 N/A MET 104.A N LEU 92.A O no hydrogen 2.940 N/A VAL 105.A N ALA 69.A O no hydrogen 3.069 N/A VAL 106.A N TYR 90.A O no hydrogen 2.970 N/A GLN 107.A N GLY 71.A O no hydrogen 3.038 N/A GLN 107.A NE2 CYS 87.A O no hydrogen 3.000 N/A GLN 107.A NE2 CYS 199.A O no hydrogen 2.788 N/A SER 108.A N ALA 88.A O no hydrogen 2.912 N/A SER 108.A OG THR 75.A OG1 no hydrogen 2.771 N/A SER 108.A OG SER 110.A O no hydrogen 3.393 N/A THR 109.A N ALA 73.A O no hydrogen 2.942 N/A SER 110.A OG SER 15.A OG no hydrogen 3.420 N/A THR 111.A OG1 SER 15.A OG no hydrogen 3.301 N/A THR 111.A OG1 GLU 82.A OE2 no hydrogen 2.600 N/A GLY 112.A N THR 75.A O no hydrogen 2.997 N/A SER 117.A N ASP 114.A O no hydrogen 3.070 N/A ASN 118.A ND2 ASP 2.A O no hydrogen 2.851 N/A HIS 119.A N SER 76.A O no hydrogen 2.858 N/A HIS 119.A ND1 ASP 114.A OD2 no hydrogen 3.100 N/A HIS 119.A NE2 THR 6.A OG1 no hydrogen 2.718 N/A PHE 120.A N ARG 4.A O no hydrogen 2.975 N/A ASP 121.A N ALA 74.A O no hydrogen 2.839 N/A LEU 122.A N THR 6.A O no hydrogen 2.964 N/A ASN 123.A N PHE 72.A O no hydrogen 3.011 N/A ASN 123.A ND2 GLN 59.A O no hydrogen 3.218 N/A ILE 124.A N TYR 8.A O no hydrogen 2.875 N/A GLY 127.A N ILE 124.A O no hydrogen 2.781 N/A GLY 130.A N ARG 146.A O no hydrogen 2.806 N/A GLY 134.A N ASP 10.A O no hydrogen 2.899 N/A THR 136.A N ASP 133.A OD1 no hydrogen 3.108 N/A THR 136.A OG1 ASP 133.A OD1 no hydrogen 3.565 N/A THR 136.A OG1 ASP 133.A OD2 no hydrogen 2.624 N/A GLN 138.A N GLY 134.A O no hydrogen 3.042 N/A GLN 138.A NE2 ALA 33.A O no hydrogen 3.027 N/A PHE 139.A N CYS 135.A O no hydrogen 3.064 N/A GLY 140.A N THR 136.A O no hydrogen 2.813 N/A GLY 141.A N CYS 135.A O no hydrogen 3.084 N/A GLN 145.A N GLY 149.A O no hydrogen 3.082 N/A GLN 145.A NE2 TYR 147.A O no hydrogen 3.638 N/A ARG 146.A NH1 ILE 131.A O no hydrogen 3.311 N/A ARG 146.A NH2 ILE 131.A O no hydrogen 3.386 N/A GLY 149.A N GLN 145.A O no hydrogen 3.031 N/A ILE 150.A N GLY 126.A O no hydrogen 2.940 N/A SER 151.A N GLU 155.A OE2 no hydrogen 2.762 N/A SER 152.A N GLU 155.A OE2 no hydrogen 3.160 N/A SER 152.A OG GLU 155.A OE2 no hydrogen 3.554 N/A ARG 153.A NE ASP 172.A OD1 no hydrogen 2.763 N/A ARG 153.A NH2 ASP 172.A OD2 no hydrogen 2.991 N/A GLU 155.A N SER 152.A O no hydrogen 3.047 N/A CYS 156.A N ARG 153.A O no hydrogen 2.886 N/A ASP 157.A N ASN 154.A O no hydrogen 3.158 N/A ARG 158.A N GLU 155.A O no hydrogen 3.272 N/A PHE 159.A N CYS 156.A O no hydrogen 3.194 N/A LEU 163.A N PRO 160.A O no hydrogen 3.085 N/A LYS 164.A N ASP 161.A O no hydrogen 3.322 N/A LYS 164.A NZ ASP 157.A O no hydrogen 3.202 N/A CYS 167.A N LEU 163.A O no hydrogen 3.250 N/A CYS 167.A SG PRO 125.A O no hydrogen 3.774 N/A TYR 168.A N LYS 164.A O no hydrogen 2.911 N/A TYR 168.A OH ASP 157.A OD1 no hydrogen 2.461 N/A TRP 169.A N PRO 165.A O no hydrogen 3.198 N/A ARG 170.A N CYS 167.A O no hydrogen 3.244 N/A ARG 170.A NE ASN 176.A OD1 no hydrogen 2.929 N/A ARG 170.A NH1 ILE 150.A O no hydrogen 3.274 N/A ARG 170.A NH2 ILE 150.A O no hydrogen 2.856 N/A ARG 170.A NH2 ASN 176.A OD1 no hydrogen 3.199 N/A PHE 171.A N TYR 168.A O no hydrogen 2.996 N/A ASP 172.A N TYR 168.A O no hydrogen 2.913 N/A TRP 173.A NE1 ASN 65.A O no hydrogen 2.891 N/A PHE 174.A N TRP 169.A O no hydrogen 3.083 N/A ASN 176.A N ARG 170.A O no hydrogen 2.769 N/A ALA 177.A N PHE 174.A O no hydrogen 2.988 N/A SER 181.A N SER 96.A OG no hydrogen 2.941 N/A SER 181.A OG THR 95.A OG1 no hydrogen 3.035 N/A SER 181.A OG SER 96.A OG no hydrogen 3.271 N/A PHE 182.A N GLY 3.A O no hydrogen 3.357 N/A SER 183.A N THR 93.A O no hydrogen 2.917 N/A PHE 184.A N ALA 1.A O no hydrogen 2.851 N/A ARG 185.A N GLU 91.A O no hydrogen 3.148 N/A ARG 185.A NE GLU 91.A OE1 no hydrogen 2.855 N/A ARG 185.A NH2 GLU 91.A OE1 no hydrogen 3.531 N/A ARG 185.A NH2 GLU 91.A OE2 no hydrogen 2.941 N/A VAL 187.A N CYS 89.A O no hydrogen 2.994 N/A GLN 188.A N PRO 208.A O no hydrogen 2.782 N/A CYS 189.A N ASP 204.A OD1 no hydrogen 2.983 N/A CYS 189.A N ASP 204.A OD2 no hydrogen 3.350 N/A CYS 189.A SG CYS 87.A O no hydrogen 3.481 N/A CYS 189.A SG ASP 204.A OD1 no hydrogen 3.680 N/A GLU 192.A N GLU 192.A OE1 no hydrogen 2.712 N/A LEU 193.A N PRO 190.A O no hydrogen 3.064 N/A VAL 194.A N PRO 190.A O no hydrogen 3.396 N/A ALA 195.A N ALA 191.A O no hydrogen 2.924 N/A ARG 196.A N LEU 193.A O no hydrogen 2.934 N/A ARG 196.A NE ASP 58.A O no hydrogen 2.831 N/A ARG 196.A NH2 ASP 58.A O no hydrogen 2.904 N/A THR 197.A N LEU 193.A O no hydrogen 3.294 N/A THR 197.A OG1 GLN 107.A OE1 no hydrogen 2.737 N/A THR 197.A OG1 LEU 193.A O no hydrogen 3.568 N/A GLY 198.A N VAL 194.A O no hydrogen 2.740 N/A CYS 199.A N THR 197.A OG1 no hydrogen 3.392 N/A CYS 199.A SG GLN 26.A O no hydrogen 3.064 N/A ARG 200.A N ASN 25.A OD1 no hydrogen 2.742 N/A ARG 200.A NH1 CYS 189.A O no hydrogen 2.938 N/A ARG 200.A NH1 ASP 204.A OD2 no hydrogen 2.410 N/A ARG 201.A NE ASP 203.A OD1 no hydrogen 2.837 N/A ARG 201.A NE ASP 203.A OD2 no hydrogen 3.418 N/A ARG 201.A NH1 ALA 83.A O no hydrogen 2.838 N/A ARG 201.A NH1 CYS 86.A O no hydrogen 2.937 N/A ARG 201.A NH2 ALA 83.A O no hydrogen 3.150 N/A ARG 201.A NH2 ASP 203.A OD2 no hydrogen 2.882 N/A ASN 202.A N PRO 23.A O no hydrogen 2.799 N/A ASP 204.A N ARG 201.A O no hydrogen 3.494 N/A ASN 206.A N ASP 203.A O no hydrogen 2.994 N/A