Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3boc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N GLN 5.A OE1 no hydrogen 2.991 N/A GLN 5.A N SER 2.A OG no hydrogen 3.032 N/A ILE 6.A N SER 2.A O no hydrogen 2.880 N/A ALA 7.A N PRO 3.A O no hydrogen 3.048 N/A GLU 8.A N ALA 4.A O no hydrogen 2.987 N/A ALA 9.A N GLN 5.A O no hydrogen 2.928 N/A LEU 10.A N ILE 6.A O no hydrogen 2.979 N/A GLN 11.A N ALA 7.A O no hydrogen 2.914 N/A GLY 12.A N GLU 8.A O no hydrogen 3.040 N/A ARG 13.A N LEU 10.A O no hydrogen 2.839 N/A ARG 13.A NE GLU 196.A OE2 no hydrogen 2.975 N/A ARG 13.A NH2 GLU 196.A OE1 no hydrogen 2.712 N/A GLY 14.A N GLN 11.A O no hydrogen 2.835 N/A TRP 15.A N LEU 10.A O no hydrogen 3.093 N/A TRP 15.A NE1 GLU 196.A OE2 no hydrogen 2.688 N/A ASP 16.A N LYS 202.A O no hydrogen 2.986 N/A GLU 18.A N ALA 204.A O no hydrogen 2.961 N/A VAL 20.A N ILE 206.A O no hydrogen 2.766 N/A SER 24.A N THR 21.A OG1 no hydrogen 2.968 N/A SER 24.A OG THR 21.A O no hydrogen 2.593 N/A MET 25.A N ASP 22.A O no hydrogen 3.048 N/A ALA 26.A N ALA 23.A O no hydrogen 2.879 N/A GLN 28.A N MET 25.A O no hydrogen 2.907 N/A LEU 29.A N MET 25.A O no hydrogen 3.242 N/A VAL 30.A N THR 160.A O no hydrogen 2.983 N/A VAL 32.A N ASN 158.A O no hydrogen 2.963 N/A ARG 33.A N GLY 52.A O no hydrogen 3.072 N/A ARG 33.A NH1 MET 51.A O no hydrogen 3.029 N/A GLY 36.A N ARG 33.A O no hydrogen 2.784 N/A ILE 37.A N ARG 50.A O no hydrogen 3.029 N/A LEU 38.A N LEU 88.A O no hydrogen 2.820 N/A LYS 39.A N PRO 54.A O no hydrogen 2.933 N/A LYS 39.A NZ GLU 140.A OE2 no hydrogen 2.730 N/A CYS 40.A SG HIS 92.A NE2 no hydrogen 3.654 N/A GLY 43.A N GLU 148.A OE2 no hydrogen 2.879 N/A ARG 44.A N ASP 42.A OD1 no hydrogen 2.980 N/A ARG 44.A NE ASP 42.A OD1 no hydrogen 2.984 N/A ARG 44.A NE ASP 42.A OD2 no hydrogen 3.384 N/A ARG 44.A NH1 ASP 94.A OD2 no hydrogen 2.819 N/A ARG 44.A NH1 GLY 144.A O no hydrogen 3.221 N/A ARG 44.A NH2 ASP 42.A OD2 no hydrogen 2.732 N/A ARG 44.A NH2 ASP 94.A OD2 no hydrogen 3.313 N/A ARG 44.A NH2 GLY 101.A O no hydrogen 3.067 N/A SER 46.A OG GLU 140.A OE2 no hydrogen 2.647 N/A ASP 47.A N MET 141.A O no hydrogen 3.073 N/A ASN 48.A N SER 46.A OG no hydrogen 3.219 N/A ASN 48.A ND2 ARG 50.A O no hydrogen 3.235 N/A ARG 50.A N ASN 48.A OD1 no hydrogen 2.838 N/A GLY 52.A N GLU 162.A OE2 no hydrogen 2.814 N/A LYS 55.A N ASP 173.A OD2 no hydrogen 2.831 N/A LYS 55.A NZ GLY 53.A O no hydrogen 2.822 N/A LYS 55.A NZ THR 160.A OG1 no hydrogen 2.963 N/A LYS 55.A NZ LEU 161.A O no hydrogen 3.074 N/A LYS 55.A NZ GLU 162.A OE1 no hydrogen 2.777 N/A MET 56.A N LYS 39.A O no hydrogen 2.969 N/A GLY 59.A N MET 56.A O no hydrogen 2.844 N/A ILE 60.A N SER 90.A O no hydrogen 3.094 N/A TYR 61.A N GLY 58.A O no hydrogen 3.231 N/A ALA 62.A N GLY 59.A O no hydrogen 3.250 N/A ILE 63.A N ILE 60.A O no hydrogen 2.913 N/A ALA 64.A N ILE 60.A O no hydrogen 3.416 N/A HIS 65.A N TYR 61.A O no hydrogen 2.799 N/A ASN 66.A N ALA 62.A O no hydrogen 2.984 N/A ASN 66.A ND2 ASP 183.A O no hydrogen 3.016 N/A ARG 67.A N ILE 63.A O no hydrogen 3.087 N/A ARG 67.A NH1 GLU 81.A OE1 no hydrogen 2.706 N/A ARG 67.A NH2 GLU 81.A OE1 no hydrogen 3.417 N/A ARG 67.A NH2 GLU 81.A OE2 no hydrogen 2.856 N/A ARG 67.A NH2 PHE 180.A O no hydrogen 2.956 N/A GLY 68.A N HIS 65.A O no hydrogen 3.192 N/A VAL 69.A N ALA 64.A O no hydrogen 2.754 N/A GLY 74.A N SER 71.A OG no hydrogen 2.908 N/A LEU 75.A N SER 71.A O no hydrogen 2.891 N/A LYS 76.A N ILE 72.A O no hydrogen 3.025 N/A GLN 77.A N GLU 73.A O no hydrogen 3.038 N/A ILE 78.A N GLY 74.A O no hydrogen 3.066 N/A THR 79.A N LEU 75.A O no hydrogen 3.056 N/A THR 79.A OG1 LEU 75.A O no hydrogen 2.957 N/A LYS 80.A N LYS 76.A O no hydrogen 2.977 N/A LYS 80.A NZ ALA 135.A O no hydrogen 2.994 N/A GLU 81.A N GLN 77.A O no hydrogen 2.947 N/A VAL 82.A N ILE 78.A O no hydrogen 2.814 N/A ALA 83.A N THR 79.A O no hydrogen 2.954 N/A SER 84.A N LYS 80.A O no hydrogen 2.874 N/A SER 84.A OG LYS 80.A O no hydrogen 3.503 N/A SER 84.A OG GLU 81.A O no hydrogen 2.675 N/A LYS 85.A N VAL 82.A O no hydrogen 2.858 N/A LYS 85.A NZ GLU 81.A OE2 no hydrogen 2.556 N/A LEU 88.A N GLY 36.A O no hydrogen 3.107 N/A SER 90.A OG LEU 38.A O no hydrogen 2.728 N/A VAL 91.A N ILE 138.A O no hydrogen 3.384 N/A HIS 92.A ND1 GLY 93.A O no hydrogen 2.859 N/A GLY 93.A N GLU 140.A O no hydrogen 2.981 N/A ASP 94.A N ASP 98.A O no hydrogen 2.881 N/A HIS 95.A N HIS 142.A O no hydrogen 3.083 N/A SER 96.A N ASP 94.A OD1 no hydrogen 2.931 N/A SER 97.A N ASP 94.A OD1 no hydrogen 2.722 N/A LEU 100.A N SER 97.A O no hydrogen 3.015 N/A GLY 101.A N ASP 98.A O no hydrogen 2.967 N/A CYS 102.A SG HIS 92.A NE2 no hydrogen 3.401 N/A LYS 106.A N CYS 102.A O no hydrogen 2.963 N/A LEU 107.A N GLY 103.A O no hydrogen 2.933 N/A TRP 108.A N PHE 104.A O no hydrogen 2.966 N/A TRP 108.A NE1 PRO 119.A O no hydrogen 2.938 N/A VAL 109.A N PHE 105.A O no hydrogen 2.699 N/A THR 110.A N LYS 106.A O no hydrogen 2.926 N/A THR 110.A OG1 LYS 106.A O no hydrogen 2.666 N/A THR 110.A OG1 LEU 107.A O no hydrogen 3.175 N/A GLY 111.A N TRP 108.A O no hydrogen 3.093 N/A ARG 112.A N LEU 107.A O no hydrogen 2.932 N/A ASP 114.A N GLY 111.A O no hydrogen 3.081 N/A MET 116.A N PHE 113.A O no hydrogen 3.029 N/A GLY 117.A N ASP 114.A O no hydrogen 3.045 N/A TYR 118.A N PHE 113.A O no hydrogen 3.239 N/A ARG 120.A NE ASP 114.A OD1 no hydrogen 2.986 N/A ARG 120.A NE ASP 114.A OD2 no hydrogen 3.398 N/A ARG 120.A NH2 ASP 114.A OD2 no hydrogen 2.666 N/A GLN 122.A N THR 70.A O no hydrogen 2.786 N/A GLN 122.A NE2 THR 70.A OG1 no hydrogen 2.796 N/A ASP 124.A N GLN 127.A OE1 no hydrogen 2.992 N/A GLN 127.A N ASP 124.A OD1 no hydrogen 2.715 N/A GLY 128.A N ASP 124.A O no hydrogen 2.925 N/A ALA 129.A N ALA 125.A O no hydrogen 3.074 N/A ASN 130.A N ASP 126.A O no hydrogen 2.976 N/A ALA 131.A N GLN 127.A O no hydrogen 3.117 N/A VAL 132.A N GLY 128.A O no hydrogen 3.020 N/A LYS 133.A N ALA 129.A O no hydrogen 2.937 N/A ASP 134.A N ASN 130.A O no hydrogen 2.751 N/A ALA 135.A N ALA 131.A O no hydrogen 2.939 N/A ALA 135.A N VAL 132.A O no hydrogen 3.165 N/A GLY 136.A N LYS 133.A O no hydrogen 3.007 N/A GLY 137.A N VAL 132.A O no hydrogen 2.671 N/A ILE 138.A N PRO 89.A O no hydrogen 2.791 N/A GLU 140.A N VAL 91.A O no hydrogen 3.035 N/A MET 141.A N ASP 47.A OD1 no hydrogen 2.956 N/A HIS 142.A N GLY 93.A O no hydrogen 2.981 N/A HIS 143.A N GLY 45.A O no hydrogen 3.053 N/A HIS 146.A ND1 GLU 148.A OE2 no hydrogen 2.694 N/A THR 147.A N GLN 168.A OE1 no hydrogen 2.776 N/A GLU 148.A N GLU 148.A OE1 no hydrogen 2.894 N/A LYS 149.A N GLN 168.A O no hydrogen 2.922 N/A LYS 149.A NZ ASP 167.A OD1 no hydrogen 3.046 N/A VAL 151.A N ASN 203.A O no hydrogen 2.913 N/A TYR 152.A N PHE 170.A O no hydrogen 2.872 N/A ILE 153.A N LYS 205.A O no hydrogen 2.940 N/A ASN 154.A N VAL 172.A O no hydrogen 2.775 N/A ASN 154.A ND2 LEU 156.A O no hydrogen 3.517 N/A ASN 154.A ND2 ASP 173.A OD1 no hydrogen 2.928 N/A LEU 155.A N VAL 207.A O no hydrogen 3.084 N/A LEU 156.A N ASN 154.A OD1 no hydrogen 2.965 N/A LYS 159.A N LEU 156.A O no hydrogen 3.133 N/A LYS 159.A NZ ASP 31.A OD1 no hydrogen 2.575 N/A THR 160.A N VAL 30.A O no hydrogen 2.951 N/A THR 160.A OG1 GLY 53.A O no hydrogen 3.548 N/A THR 160.A OG1 LEU 161.A O no hydrogen 3.306 N/A THR 160.A OG1 ASP 173.A OD2 no hydrogen 2.694 N/A ASN 166.A N ASN 164.A OD1 no hydrogen 3.044 N/A ASP 167.A N ASN 164.A O no hydrogen 3.064 N/A GLN 168.A NE2 SER 145.A O no hydrogen 2.980 N/A GLN 168.A NE2 GLU 165.A O no hydrogen 3.390 N/A ARG 169.A NE GLU 162.A O no hydrogen 3.077 N/A ARG 169.A NH1 GLN 28.A OE1 no hydrogen 2.738 N/A ARG 169.A NH2 GLN 28.A OE1 no hydrogen 3.053 N/A ARG 169.A NH2 GLU 162.A O no hydrogen 2.732 N/A PHE 170.A N VAL 150.A O no hydrogen 2.956 N/A ILE 171.A N VAL 41.A O no hydrogen 3.248 N/A VAL 172.A N TYR 152.A O no hydrogen 2.796 N/A ASP 173.A N LYS 55.A O no hydrogen 2.949 N/A GLY 174.A N VAL 172.A O no hydrogen 3.085 N/A TRP 175.A NE1 LYS 159.A O no hydrogen 3.014 N/A ALA 176.A N ASP 173.A O no hydrogen 2.893 N/A ALA 177.A N GLY 174.A O no hydrogen 3.179 N/A LYS 179.A N TRP 175.A O no hydrogen 3.348 N/A LYS 179.A NZ LYS 85.A O no hydrogen 3.261 N/A LYS 179.A NZ HIS 87.A NE2 no hydrogen 2.669 N/A PHE 180.A N ALA 176.A O no hydrogen 3.351 N/A PHE 180.A N ALA 177.A O no hydrogen 3.042 N/A GLY 181.A N ASP 178.A O no hydrogen 2.960 N/A LEU 182.A N ALA 177.A O no hydrogen 3.177 N/A ASP 183.A N ASN 66.A OD1 no hydrogen 3.031 N/A LYS 186.A N ASP 183.A OD1 no hydrogen 3.073 N/A LYS 186.A NZ ASN 66.A O no hydrogen 3.095 N/A PHE 187.A N ASP 183.A O no hydrogen 2.828 N/A LEU 188.A N VAL 184.A O no hydrogen 2.822 N/A ILE 189.A N PRO 185.A O no hydrogen 2.947 N/A ALA 190.A N LYS 186.A O no hydrogen 2.925 N/A ALA 191.A N PHE 187.A O no hydrogen 3.043 N/A ALA 192.A N LEU 188.A O no hydrogen 2.917 N/A ALA 193.A N ILE 189.A O no hydrogen 2.878 N/A THR 194.A N ALA 190.A O no hydrogen 2.933 N/A THR 194.A OG1 ALA 190.A O no hydrogen 2.793 N/A VAL 195.A N ALA 191.A O no hydrogen 3.130 N/A GLU 196.A N ALA 192.A O no hydrogen 2.929 N/A MET 197.A N ALA 193.A O no hydrogen 2.772 N/A LEU 198.A N THR 194.A O no hydrogen 2.959 N/A GLY 199.A N GLU 196.A O no hydrogen 2.939 N/A GLY 200.A N VAL 195.A O no hydrogen 2.775 N/A LYS 202.A NZ ARG 13.A O no hydrogen 2.717 N/A ALA 204.A N ASP 16.A O no hydrogen 2.887 N/A LYS 205.A N VAL 151.A O no hydrogen 2.801 N/A ILE 206.A N GLU 18.A O no hydrogen 2.715 N/A VAL 207.A N ILE 153.A O no hydrogen 2.973 N/A VAL 208.A N VAL 20.A O no hydrogen 3.011 N/A