Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dpw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N ASP 1.A OD1 no hydrogen 3.471 N/A SER 5.A N ASP 1.A O no hydrogen 2.908 N/A LYS 6.A N PRO 2.A O no hydrogen 3.035 N/A LYS 6.A N MET 3.A O no hydrogen 3.096 N/A LYS 6.A NZ MET 88.A O no hydrogen 3.145 N/A GLY 7.A N MET 3.A O no hydrogen 3.461 N/A GLU 8.A N VAL 4.A O no hydrogen 3.053 N/A GLU 9.A N SER 5.A O no hydrogen 2.772 N/A LEU 10.A N LYS 6.A O no hydrogen 3.245 N/A PHE 11.A N GLY 7.A O no hydrogen 3.023 N/A PHE 11.A N GLU 8.A O no hydrogen 3.326 N/A VAL 15.A N GLY 38.A O no hydrogen 2.855 N/A ILE 17.A N GLY 36.A O no hydrogen 2.784 N/A LEU 18.A N LEU 119.A O no hydrogen 2.981 N/A VAL 19.A N GLY 34.A O no hydrogen 2.902 N/A GLU 20.A N ASN 121.A O no hydrogen 2.989 N/A LEU 21.A N VAL 32.A O no hydrogen 2.852 N/A ASP 22.A N ILE 123.A O no hydrogen 2.917 N/A GLY 23.A N PHE 30.A O no hydrogen 2.819 N/A ASP 24.A N LEU 125.A O no hydrogen 3.179 N/A VAL 25.A N HIS 28.A O no hydrogen 3.030 N/A ASN 26.A N GLY 127.A O no hydrogen 2.814 N/A ASN 26.A ND2 PHE 130.A O no hydrogen 2.902 N/A HIS 28.A N VAL 25.A O no hydrogen 2.945 N/A PHE 30.A N GLY 23.A O no hydrogen 2.860 N/A SER 31.A N THR 53.A OG1 no hydrogen 3.151 N/A VAL 32.A N LEU 21.A O no hydrogen 2.907 N/A SER 33.A N ILE 50.A O no hydrogen 3.033 N/A SER 33.A OG GLU 20.A OE1 no hydrogen 3.101 N/A GLY 34.A N VAL 19.A O no hydrogen 2.962 N/A GLU 35.A N LYS 48.A O no hydrogen 2.900 N/A GLY 36.A N ILE 17.A O no hydrogen 3.111 N/A GLU 37.A N THR 46.A O no hydrogen 3.192 N/A GLY 38.A N VAL 15.A O no hydrogen 3.005 N/A ASP 39.A N LYS 44.A O no hydrogen 2.847 N/A THR 41.A OG1 THR 12.A O no hydrogen 3.177 N/A TYR 42.A N ASP 39.A O no hydrogen 3.201 N/A GLY 43.A N ALA 40.A O no hydrogen 3.213 N/A LYS 44.A N ASP 39.A O no hydrogen 2.975 N/A LEU 45.A N GLU 222.A O no hydrogen 2.765 N/A THR 46.A N GLU 37.A O no hydrogen 3.027 N/A LEU 47.A N LEU 220.A O no hydrogen 2.857 N/A LYS 48.A N GLU 35.A O no hydrogen 2.771 N/A LYS 48.A NZ ASP 210.A OD2 no hydrogen 2.739 N/A LYS 48.A NZ GLU 213.A OE1 no hydrogen 2.840 N/A PHE 49.A N MET 218.A O no hydrogen 2.817 N/A ILE 50.A N SER 33.A O no hydrogen 2.657 N/A CYS 51.A N ASP 216.A O no hydrogen 2.759 N/A CYS 51.A SG SER 31.A O no hydrogen 3.627 N/A CYS 51.A SG THR 53.A OG1 no hydrogen 3.601 N/A CYS 51.A SG GLY 54.A O no hydrogen 3.254 N/A THR 52.A N SER 31.A O no hydrogen 3.050 N/A LEU 56.A N ASP 216.A OD2 no hydrogen 3.125 N/A TRP 60.A NE1 ASP 216.A OD1 no hydrogen 2.796 N/A THR 62.A N PRO 59.A O no hydrogen 2.973 N/A THR 62.A OG1 PRO 59.A O no hydrogen 2.763 N/A THR 62.A OG1 TYR 106.A OH no hydrogen 2.910 N/A LEU 63.A N TRP 60.A O no hydrogen 2.900 N/A VAL 64.A N PRO 61.A O no hydrogen 3.364 N/A THR 65.A OG1 HIS 181.A NE2 no hydrogen 2.886 N/A THR 66.A N LEU 63.A O no hydrogen 2.989 N/A PHE 67.A N LEU 63.A O no hydrogen 3.025 N/A CYS 70.A N TYR 92.A OH no hydrogen 3.323 N/A CYS 70.A SG TYR 92.A OH no hydrogen 3.879 N/A PHE 71.A N LEU 68.A O no hydrogen 3.070 N/A ALA 72.A N MET 69.A O no hydrogen 3.078 N/A ARG 73.A N VAL 224.A O no hydrogen 2.953 N/A TYR 74.A OH HIS 199.A NE2 no hydrogen 2.715 N/A HIS 77.A NE2 ILE 229.A O no hydrogen 2.446 N/A MET 78.A N PRO 75.A O no hydrogen 2.964 N/A LYS 79.A N ASP 76.A O no hydrogen 3.238 N/A LYS 79.A NZ GLU 8.A OE1 no hydrogen 2.850 N/A HIS 81.A N MET 78.A O no hydrogen 2.810 N/A ASP 82.A N LYS 79.A O no hydrogen 3.451 N/A PHE 83.A N HIS 81.A O no hydrogen 3.165 N/A LYS 85.A N ASP 82.A OD1 no hydrogen 2.932 N/A LYS 85.A NZ CYS 70.A O no hydrogen 2.855 N/A LYS 85.A NZ ALA 72.A O no hydrogen 2.797 N/A LYS 85.A NZ ASP 82.A OD2 no hydrogen 2.787 N/A SER 86.A N ASP 82.A O no hydrogen 3.465 N/A SER 86.A OG PHE 83.A O no hydrogen 2.921 N/A ALA 87.A N PHE 83.A O no hydrogen 3.129 N/A MET 88.A N LYS 85.A O no hydrogen 3.007 N/A GLY 91.A N ALA 87.A O no hydrogen 2.876 N/A TYR 92.A N VAL 112.A O no hydrogen 2.929 N/A VAL 93.A N THR 186.A O no hydrogen 2.892 N/A GLN 94.A N ALA 110.A O no hydrogen 2.764 N/A GLU 95.A N GLN 184.A O no hydrogen 2.831 N/A ARG 96.A N THR 108.A O no hydrogen 3.027 N/A ARG 96.A NE GLN 183.A OE1 no hydrogen 2.927 N/A ARG 96.A NH1 THR 65.A O no hydrogen 2.698 N/A ARG 96.A NH2 GLN 183.A OE1 no hydrogen 2.916 N/A THR 97.A N TYR 182.A O no hydrogen 3.013 N/A ILE 98.A N TYR 106.A O no hydrogen 2.703 N/A PHE 99.A N ASP 180.A O no hydrogen 2.808 N/A PHE 100.A N GLY 104.A O no hydrogen 2.973 N/A LYS 101.A N LEU 178.A O no hydrogen 2.938 N/A ASP 103.A N PHE 100.A O no hydrogen 2.903 N/A GLY 104.A N ASP 103.A OD1 no hydrogen 2.842 N/A ASN 105.A N ILE 128.A O no hydrogen 3.074 N/A TYR 106.A N ILE 98.A O no hydrogen 3.005 N/A TYR 106.A OH THR 62.A OG1 no hydrogen 2.910 N/A LYS 107.A N LYS 126.A O no hydrogen 2.826 N/A THR 108.A N ARG 96.A O no hydrogen 3.009 N/A ARG 109.A N GLU 124.A O no hydrogen 2.864 N/A ARG 109.A NH2 GLU 111.A OE2 no hydrogen 3.303 N/A ALA 110.A N GLN 94.A O no hydrogen 2.977 N/A GLU 111.A N ARG 122.A O no hydrogen 2.943 N/A VAL 112.A N TYR 92.A O no hydrogen 2.860 N/A LYS 113.A N VAL 120.A O no hydrogen 2.974 N/A PHE 114.A N PRO 89.A O no hydrogen 3.263 N/A GLU 115.A N THR 118.A O no hydrogen 2.869 N/A THR 118.A N GLU 115.A O no hydrogen 3.309 N/A LEU 119.A N PRO 16.A O no hydrogen 2.858 N/A VAL 120.A N LYS 113.A O no hydrogen 2.959 N/A ASN 121.A N LEU 18.A O no hydrogen 3.013 N/A ASN 121.A ND2 PHE 67.A O no hydrogen 3.264 N/A ARG 122.A N GLU 111.A O no hydrogen 3.129 N/A ILE 123.A N GLU 20.A O no hydrogen 2.737 N/A GLU 124.A N ARG 109.A O no hydrogen 2.883 N/A LEU 125.A N ASP 22.A O no hydrogen 2.881 N/A LYS 126.A N LYS 107.A O no hydrogen 2.837 N/A GLY 127.A N ASP 24.A O no hydrogen 2.824 N/A ILE 128.A N ASN 105.A O no hydrogen 2.984 N/A PHE 130.A N ASN 26.A OD1 no hydrogen 2.936 N/A LYS 131.A N ASP 103.A OD1 no hydrogen 2.731 N/A LYS 131.A NZ ASP 102.A O no hydrogen 3.007 N/A GLY 134.A N LYS 131.A O no hydrogen 2.988 N/A ASN 135.A ND2 GLN 177.A OE1 no hydrogen 3.013 N/A GLY 138.A N GLY 134.A O no hydrogen 2.966 N/A HIS 139.A N ILE 136.A O no hydrogen 2.964 N/A LYS 140.A N ASN 135.A O no hydrogen 2.889 N/A LYS 140.A NZ ASP 133.A O no hydrogen 2.969 N/A GLU 142.A N ASN 170.A O no hydrogen 2.800 N/A TYR 143.A OH SER 208.A O no hydrogen 2.785 N/A ASN 144.A N GLU 142.A O no hydrogen 2.964 N/A ASN 144.A ND2 GLU 142.A OE1 no hydrogen 3.115 N/A ASN 146.A ND2 ARG 168.A O no hydrogen 2.933 N/A ASN 146.A ND2 ASN 170.A OD1 no hydrogen 3.611 N/A SER 147.A OG TYR 203.A O no hydrogen 3.509 N/A HIS 148.A N TYR 203.A O no hydrogen 3.230 N/A VAL 150.A N LEU 201.A O no hydrogen 2.949 N/A ILE 152.A N HIS 199.A O no hydrogen 2.917 N/A MET 153.A N LYS 162.A O no hydrogen 2.831 N/A ASP 155.A N GLY 160.A O no hydrogen 2.878 N/A LYS 158.A N ASP 155.A O no hydrogen 3.014 N/A ASN 159.A N LYS 156.A O no hydrogen 3.175 N/A GLY 160.A N ASP 155.A O no hydrogen 3.078 N/A ILE 161.A N ASN 185.A O no hydrogen 3.071 N/A LYS 162.A N MET 153.A O no hydrogen 2.796 N/A VAL 163.A N GLN 183.A O no hydrogen 2.896 N/A ASN 164.A N TYR 151.A O no hydrogen 3.438 N/A ASN 164.A ND2 HIS 181.A O no hydrogen 2.614 N/A PHE 165.A N HIS 181.A O no hydrogen 3.040 N/A ILE 167.A N ALA 179.A O no hydrogen 2.974 N/A ARG 168.A N HIS 148.A NE2 no hydrogen 3.430 N/A HIS 169.A N GLN 177.A O no hydrogen 2.871 N/A ASN 170.A ND2 ASN 144.A OD1 no hydrogen 3.438 N/A ASN 170.A ND2 ASN 146.A OD1 no hydrogen 3.633 N/A ILE 171.A N SER 175.A O no hydrogen 3.075 N/A GLU 172.A N LYS 140.A O no hydrogen 2.858 N/A GLY 174.A N ILE 171.A O no hydrogen 2.921 N/A SER 175.A N ASP 173.A OD1 no hydrogen 2.921 N/A VAL 176.A N SER 175.A OG no hydrogen 2.651 N/A GLN 177.A N HIS 169.A O no hydrogen 2.826 N/A GLN 177.A NE2 LYS 101.A O no hydrogen 2.975 N/A GLN 177.A NE2 LEU 178.A O no hydrogen 3.086 N/A ALA 179.A N ILE 167.A O no hydrogen 2.702 N/A ASP 180.A N PHE 99.A O no hydrogen 2.879 N/A HIS 181.A N PHE 165.A O no hydrogen 2.855 N/A HIS 181.A ND1 ALA 179.A O no hydrogen 2.909 N/A HIS 181.A NE2 THR 65.A OG1 no hydrogen 2.886 N/A TYR 182.A N THR 97.A O no hydrogen 2.993 N/A GLN 183.A N VAL 163.A O no hydrogen 2.902 N/A GLN 183.A NE2 ASN 185.A OD1 no hydrogen 2.853 N/A GLN 184.A N GLU 95.A O no hydrogen 2.975 N/A GLN 184.A NE2 ASP 155.A OD2 no hydrogen 3.136 N/A ASN 185.A N ILE 161.A O no hydrogen 2.910 N/A ASN 185.A ND2 GLN 94.A OE1 no hydrogen 3.005 N/A THR 186.A N VAL 93.A O no hydrogen 3.092 N/A ILE 188.A N GLY 91.A O no hydrogen 2.859 N/A LEU 194.A N SER 86.A OG no hydrogen 2.932 N/A ASP 197.A N HIS 81.A ND1 no hydrogen 3.124 N/A HIS 199.A N ILE 152.A O no hydrogen 3.320 N/A HIS 199.A ND1 ASP 197.A O no hydrogen 2.815 N/A HIS 199.A NE2 TYR 74.A OH no hydrogen 2.715 N/A TYR 200.A N ALA 227.A O no hydrogen 2.947 N/A LEU 201.A N VAL 150.A O no hydrogen 2.842 N/A SER 202.A N THR 225.A O no hydrogen 2.728 N/A SER 202.A OG THR 225.A O no hydrogen 3.386 N/A TYR 203.A N HIS 148.A O no hydrogen 2.884 N/A GLN 204.A N PHE 223.A O no hydrogen 2.986 N/A SER 205.A OG GLU 222.A OE2 no hydrogen 2.514 N/A ALA 206.A N LEU 221.A O no hydrogen 2.830 N/A SER 208.A N VAL 219.A O no hydrogen 2.770 N/A LYS 209.A NZ TYR 143.A OH no hydrogen 3.562 N/A LYS 209.A NZ HIS 217.A O no hydrogen 2.750 N/A ASP 210.A N HIS 217.A NE2 no hydrogen 2.765 N/A ASN 212.A N ASP 210.A OD1 no hydrogen 2.990 N/A GLU 213.A N ASP 210.A O no hydrogen 3.129 N/A ARG 215.A N GLU 213.A OE2 no hydrogen 2.998 N/A ARG 215.A NE GLU 213.A OE2 no hydrogen 2.763 N/A ARG 215.A NH2 GLU 213.A OE1 no hydrogen 2.964 N/A ARG 215.A NH2 GLU 213.A OE2 no hydrogen 3.548 N/A HIS 217.A ND1 ARG 215.A O no hydrogen 2.868 N/A MET 218.A N PHE 49.A O no hydrogen 3.034 N/A VAL 219.A N SER 208.A O no hydrogen 2.817 N/A LEU 220.A N LEU 47.A O no hydrogen 2.822 N/A LEU 221.A N ALA 206.A O no hydrogen 2.951 N/A GLU 222.A N LEU 45.A O no hydrogen 3.013 N/A PHE 223.A N GLN 204.A O no hydrogen 2.863 N/A VAL 224.A N GLY 43.A O no hydrogen 2.876 N/A THR 225.A N SER 202.A O no hydrogen 3.007 N/A ALA 226.A N ARG 73.A O no hydrogen 2.896 N/A ALA 227.A N TYR 200.A O no hydrogen 2.770 N/A