Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1w66_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N GLY 1.A O no hydrogen 3.059 N/A SER 6.A OG LEU 213.A O no hydrogen 3.461 N/A SER 6.A OG ASP 214.A OD1 no hydrogen 2.725 N/A ILE 7.A N LEU 213.A O no hydrogen 3.120 N/A ARG 8.A N SER 6.A OG no hydrogen 3.013 N/A ARG 8.A NE ASP 214.A OD1 no hydrogen 2.883 N/A ARG 8.A NH1 SER 12.A O no hydrogen 3.026 N/A ARG 8.A NH1 ASP 214.A OD2 no hydrogen 2.811 N/A ARG 8.A NH2 SER 12.A O no hydrogen 2.782 N/A ARG 8.A NH2 ASP 44.A OD1 no hydrogen 2.863 N/A SER 9.A N GLY 97.A O no hydrogen 2.995 N/A LYS 10.A NZ GLY 42.A O no hydrogen 2.890 N/A ASP 15.A N ASP 44.A O no hydrogen 2.862 N/A ARG 17.A N LEU 46.A O no hydrogen 2.836 N/A ARG 17.A NE ASP 15.A OD1 no hydrogen 3.014 N/A ARG 17.A NH2 ASP 15.A OD1 no hydrogen 3.461 N/A GLN 18.A NE2 ARG 202.A O no hydrogen 3.349 N/A LEU 19.A N LEU 48.A O no hydrogen 2.827 N/A VAL 22.A N GLU 50.A O no hydrogen 2.823 N/A TYR 24.A OH THR 76.A OG1 no hydrogen 2.834 N/A THR 26.A N ASP 23.A OD1 no hydrogen 2.963 N/A THR 26.A OG1 ASP 23.A OD1 no hydrogen 3.178 N/A ALA 27.A N ASP 23.A O no hydrogen 2.973 N/A TRP 28.A N TYR 24.A O no hydrogen 2.951 N/A GLN 29.A N ARG 25.A O no hydrogen 2.915 N/A LEU 30.A N THR 26.A O no hydrogen 3.059 N/A GLN 31.A N ALA 27.A O no hydrogen 2.864 N/A GLN 31.A NE2 HIS 159.A ND1 no hydrogen 3.592 N/A ARG 32.A N TRP 28.A O no hydrogen 3.056 N/A ARG 32.A NH2 ASP 77.A OD2 no hydrogen 2.937 N/A GLU 33.A N GLN 29.A O no hydrogen 2.991 N/A LEU 34.A N LEU 30.A O no hydrogen 2.850 N/A ALA 35.A N GLN 31.A O no hydrogen 2.891 N/A ASP 36.A N ARG 32.A O no hydrogen 2.988 N/A ALA 37.A N GLU 33.A O no hydrogen 2.980 N/A ARG 38.A N LEU 34.A O no hydrogen 2.844 N/A ARG 38.A NE ASP 44.A OD2 no hydrogen 2.799 N/A ARG 38.A NH1 ARG 38.A O no hydrogen 2.937 N/A VAL 39.A N ALA 35.A O no hydrogen 2.932 N/A ALA 40.A N ASP 36.A O no hydrogen 3.060 N/A GLY 41.A N ARG 38.A O no hydrogen 2.906 N/A GLY 42.A N ALA 37.A O no hydrogen 2.853 N/A THR 45.A N ILE 95.A O no hydrogen 3.015 N/A LEU 46.A N ASP 15.A O no hydrogen 2.846 N/A LEU 47.A N TYR 93.A O no hydrogen 2.982 N/A LEU 48.A N ARG 17.A O no hydrogen 2.960 N/A LEU 49.A N VAL 91.A O no hydrogen 2.937 N/A GLU 50.A N GLY 20.A O no hydrogen 3.036 N/A HIS 51.A ND1 VAL 22.A O no hydrogen 2.800 N/A HIS 51.A NE2 TYR 93.A OH no hydrogen 2.659 N/A VAL 54.A N HIS 85.A O no hydrogen 2.887 N/A TYR 55.A OH ALA 171.A O no hydrogen 2.676 N/A THR 56.A N THR 83.A O no hydrogen 2.996 N/A ALA 57.A N VAL 74.A O no hydrogen 2.855 N/A GLY 58.A N LYS 81.A O no hydrogen 3.000 N/A THR 61.A N GLY 58.A O no hydrogen 3.007 N/A THR 61.A OG1 GLY 58.A O no hydrogen 2.824 N/A GLU 62.A N GLU 65.A OE2 no hydrogen 2.916 N/A GLU 65.A N GLU 62.A O no hydrogen 2.948 N/A ARG 66.A N THR 63.A O no hydrogen 3.172 N/A ARG 66.A NH2 ASP 75.A OD1 no hydrogen 3.061 N/A ILE 68.A N ALA 174.A O no hydrogen 2.837 N/A GLY 70.A N PRO 67.A O no hydrogen 3.110 N/A THR 71.A N ASP 69.A OD1 no hydrogen 3.112 N/A THR 71.A OG1 ASP 69.A OD1 no hydrogen 2.710 N/A THR 71.A OG1 ASP 69.A OD2 no hydrogen 3.385 N/A VAL 74.A N TYR 55.A O no hydrogen 2.850 N/A THR 76.A N ALA 57.A O no hydrogen 2.928 N/A THR 76.A OG1 TYR 24.A OH no hydrogen 2.834 N/A ARG 78.A NH1 GLY 79.A O no hydrogen 2.918 N/A ARG 78.A NH1 LYS 81.A O no hydrogen 2.897 N/A ARG 78.A NH2 THR 56.A OG1 no hydrogen 2.856 N/A ARG 78.A NH2 LYS 81.A O no hydrogen 2.957 N/A GLY 79.A N VAL 150.A O no hydrogen 2.851 N/A LYS 81.A NZ GLU 62.A OE1 no hydrogen 2.938 N/A LYS 81.A NZ GLU 65.A OE1 no hydrogen 2.731 N/A THR 83.A N THR 56.A O no hydrogen 2.960 N/A HIS 85.A N VAL 54.A O no hydrogen 2.909 N/A HIS 85.A ND1 GLN 89.A OE1 no hydrogen 2.744 N/A GLY 88.A N GLU 50.A OE1 no hydrogen 2.774 N/A GLN 89.A N GLY 86.A O no hydrogen 3.213 N/A GLN 89.A NE2 TRP 84.A O no hydrogen 2.961 N/A GLN 89.A NE2 ASN 164.A OD1 no hydrogen 2.927 N/A LEU 90.A N LEU 163.A O no hydrogen 2.888 N/A VAL 91.A N LEU 49.A O no hydrogen 2.854 N/A GLY 92.A N PHE 161.A O no hydrogen 2.881 N/A TYR 93.A N LEU 47.A O no hydrogen 2.847 N/A TYR 93.A OH HIS 51.A NE2 no hydrogen 2.659 N/A ILE 95.A N THR 45.A O no hydrogen 2.778 N/A ILE 96.A N THR 157.A OG1 no hydrogen 2.862 N/A GLY 97.A N ASP 44.A OD2 no hydrogen 2.829 N/A LEU 98.A N ALA 155.A O no hydrogen 2.819 N/A ALA 99.A N ILE 7.A O no hydrogen 2.911 N/A ASN 106.A N ASP 103.A OD1 no hydrogen 3.043 N/A ASN 106.A ND2 ALA 2.A O no hydrogen 2.888 N/A TYR 107.A N ASP 103.A O no hydrogen 3.154 N/A VAL 108.A N VAL 104.A O no hydrogen 2.951 N/A ARG 109.A N VAL 105.A O no hydrogen 2.876 N/A ARG 110.A N ASN 106.A O no hydrogen 2.952 N/A ARG 110.A NE ASN 106.A OD1 no hydrogen 2.732 N/A ARG 110.A NH1 GLY 5.A O no hydrogen 2.817 N/A ARG 110.A NH1 ALA 212.A O no hydrogen 3.024 N/A ARG 110.A NH2 ALA 4.A O no hydrogen 2.879 N/A ARG 110.A NH2 ASN 106.A OD1 no hydrogen 3.315 N/A LEU 111.A N TYR 107.A O no hydrogen 3.062 N/A GLU 112.A N VAL 108.A O no hydrogen 2.918 N/A GLU 113.A N ARG 109.A O no hydrogen 2.851 N/A SER 114.A N ARG 110.A O no hydrogen 2.993 N/A SER 114.A OG.A LEU 111.A O no hydrogen 2.763 N/A SER 114.A OG.B ARG 110.A O no hydrogen 2.974 N/A SER 114.A OG.B ALA 208.A O no hydrogen 3.157 N/A LEU 115.A N LEU 111.A O no hydrogen 3.197 N/A ILE 116.A N GLU 112.A O no hydrogen 2.862 N/A GLN 117.A N GLU 113.A O no hydrogen 2.969 N/A VAL 118.A N SER 114.A O no hydrogen 3.057 N/A CYS 119.A N LEU 115.A O no hydrogen 2.984 N/A CYS 119.A SG LEU 115.A O no hydrogen 3.429 N/A ALA 120.A N ILE 116.A O no hydrogen 2.840 N/A ASP 121.A N GLN 117.A O no hydrogen 2.868 N/A LEU 122.A N CYS 119.A O no hydrogen 3.016 N/A GLY 123.A N ALA 120.A O no hydrogen 2.863 N/A LEU 124.A N CYS 119.A O no hydrogen 3.002 N/A GLY 127.A N TRP 136.A O no hydrogen 2.841 N/A ARG 128.A NE GLU 112.A OE1 no hydrogen 2.844 N/A ARG 128.A NH1 GLU 113.A OE1 no hydrogen 3.092 N/A ARG 128.A NH2 ARG 109.A O no hydrogen 2.929 N/A ARG 128.A NH2 GLU 113.A OE1 no hydrogen 2.822 N/A ARG 132.A N VAL 129.A O no hydrogen 2.961 N/A ARG 132.A NH1 ASP 182.A OD1 no hydrogen 2.793 N/A ARG 132.A NH2 ASP 182.A OD1 no hydrogen 3.314 N/A ARG 132.A NH2 ASP 182.A OD2 no hydrogen 3.117 N/A GLY 134.A N GLU 112.A OE2 no hydrogen 2.932 N/A VAL 135.A N ALA 146.A O no hydrogen 2.977 N/A TRP 136.A N GLY 127.A O no hydrogen 2.883 N/A TRP 136.A NE1 ARG 132.A O no hydrogen 2.972 N/A LEU 137.A N ARG 143.A O no hydrogen 2.788 N/A ARG 143.A N LEU 137.A O no hydrogen 3.042 N/A ARG 143.A NE GLU 191.A OE2 no hydrogen 2.833 N/A ARG 143.A NH1 PRO 138.A O no hydrogen 3.423 N/A ARG 143.A NH2 GLU 191.A OE1 no hydrogen 2.860 N/A LYS 144.A N ALA 184.A O no hydrogen 2.872 N/A LYS 144.A NZ SER 133.A O no hydrogen 3.543 N/A VAL 145.A N VAL 135.A O no hydrogen 2.874 N/A ALA 146.A N VAL 135.A O no hydrogen 3.414 N/A ALA 147.A N ALA 162.A O no hydrogen 2.950 N/A GLY 149.A N GLY 160.A O no hydrogen 2.895 N/A ARG 151.A N LEU 158.A O no hydrogen 3.138 N/A ARG 151.A NE SER 153.A OG.B no hydrogen 3.194 N/A ARG 151.A NH1 ASP 77.A OD2 no hydrogen 2.493 N/A ARG 151.A NH2 SER 153.A OG.B no hydrogen 2.962 N/A SER 153.A N THR 156.A O no hydrogen 2.960 N/A THR 156.A N SER 153.A O no hydrogen 2.982 N/A THR 156.A OG1 ARG 154.A O no hydrogen 2.942 N/A THR 157.A N ILE 96.A O no hydrogen 2.889 N/A THR 157.A OG1 PRO 94.A O no hydrogen 2.733 N/A THR 157.A OG1 ILE 96.A O no hydrogen 3.506 N/A LEU 158.A N ARG 151.A O no hydrogen 2.809 N/A HIS 159.A N GLN 31.A OE1 no hydrogen 2.693 N/A HIS 159.A NE2 ASP 77.A OD1 no hydrogen 2.731 N/A GLY 160.A N GLY 149.A O no hydrogen 2.949 N/A PHE 161.A N GLY 92.A O no hydrogen 2.901 N/A ALA 162.A N ALA 147.A O no hydrogen 2.849 N/A LEU 163.A N LEU 90.A O no hydrogen 2.836 N/A ASN 164.A N VAL 145.A O no hydrogen 2.957 N/A ASN 164.A ND2 THR 186.A O no hydrogen 2.918 N/A CYS 165.A N GLY 88.A O no hydrogen 2.945 N/A CYS 165.A SG LEU 163.A O no hydrogen 3.597 N/A ASP 166.A N GLY 88.A O no hydrogen 3.002 N/A CYS 167.A SG GLY 88.A O no hydrogen 3.902 N/A ALA 170.A N ASP 168.A OD1 no hydrogen 2.930 N/A PHE 172.A N LEU 169.A O no hydrogen 3.045 N/A THR 173.A N ALA 170.A O no hydrogen 2.980 N/A THR 173.A OG1 ALA 170.A O no hydrogen 2.705 N/A ALA 174.A N ALA 171.A O no hydrogen 3.426 N/A ILE 175.A N PHE 172.A O no hydrogen 3.414 N/A VAL 176.A N GLU 65.A O no hydrogen 3.196 N/A CYS 178.A N ILE 82.A O no hydrogen 2.871 N/A CYS 178.A SG ILE 82.A O no hydrogen 3.880 N/A GLY 179.A N VAL 176.A O no hydrogen 3.407 N/A ILE 180.A N PRO 177.A O no hydrogen 2.977 N/A ALA 184.A N ALA 142.A O no hydrogen 3.101 N/A THR 186.A N LYS 144.A O no hydrogen 2.861 N/A THR 186.A OG1 SER 187.A O no hydrogen 3.542 N/A THR 186.A OG1 GLU 191.A OE2 no hydrogen 2.651 N/A SER 187.A N THR 186.A OG1 no hydrogen 2.808 N/A LEU 188.A N ASN 164.A O no hydrogen 2.879 N/A SER 189.A N CYS 165.A O no hydrogen 2.960 N/A SER 189.A OG CYS 165.A O no hydrogen 2.745 N/A SER 189.A OG ARG 194.A O no hydrogen 3.362 N/A SER 189.A OG VAL 196.A O no hydrogen 3.365 N/A ALA 190.A N SER 187.A OG no hydrogen 2.996 N/A GLU 191.A N SER 187.A O no hydrogen 2.981 N/A LEU 192.A N LEU 188.A O no hydrogen 2.894 N/A GLY 193.A N SER 189.A O no hydrogen 2.859 N/A VAL 196.A N SER 189.A OG no hydrogen 2.857 N/A THR 197.A N GLU 200.A OE2.B no hydrogen 2.897 N/A THR 197.A OG1 GLU 200.A OE2.B no hydrogen 3.138 N/A GLU 200.A N THR 197.A O no hydrogen 3.273 N/A GLU 200.A N THR 197.A OG1 no hydrogen 3.078 N/A VAL 201.A N VAL 198.A O no hydrogen 3.102 N/A ARG 202.A NE ASP 199.A OD1 no hydrogen 2.834 N/A ARG 202.A NH1 GLN 18.A OE1 no hydrogen 2.919 N/A ARG 202.A NH1 LEU 48.A O no hydrogen 3.026 N/A ARG 202.A NH2 LEU 19.A O no hydrogen 2.692 N/A THR 204.A OG1.A VAL 201.A O no hydrogen 2.964 N/A VAL 205.A N VAL 201.A O no hydrogen 2.890 N/A ALA 206.A N ARG 202.A O no hydrogen 3.060 N/A ALA 207.A N ALA 203.A O no hydrogen 2.989 N/A ALA 208.A N THR 204.A O no hydrogen 2.952 N/A VAL 209.A N VAL 205.A O no hydrogen 2.962 N/A CYS 210.A N ALA 206.A O no hydrogen 3.035 N/A CYS 210.A SG ALA 206.A O no hydrogen 3.340 N/A ALA 211.A N ALA 207.A O no hydrogen 3.016 N/A ALA 212.A N ALA 208.A O no hydrogen 2.915 N/A LEU 213.A N VAL 209.A O no hydrogen 3.093 N/A ASP 214.A N ALA 211.A O no hydrogen 3.172 N/A GLY 215.A N ALA 212.A O no hydrogen 3.266 N/A VAL 216.A N ALA 211.A O no hydrogen 2.979 N/A