Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3o3f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N GLU 4.A OE2 no hydrogen 2.678 N/A LEU 5.A N GLY 1.A O no hydrogen 2.936 N/A TYR 6.A N ILE 2.A O no hydrogen 3.240 N/A LYS 7.A N ASP 3.A O no hydrogen 2.576 N/A LYS 7.A NZ LEU 35.A O no hydrogen 2.751 N/A LYS 7.A NZ GLU 36.A OE1 no hydrogen 2.947 N/A LYS 7.A NZ GLU 36.A OE2 no hydrogen 3.135 N/A LYS 8.A N GLU 4.A O no hydrogen 2.831 N/A GLU 9.A N LEU 5.A O no hydrogen 3.144 N/A PHE 10.A N TYR 6.A O no hydrogen 2.922 N/A GLY 11.A N LYS 7.A O no hydrogen 2.885 N/A ALA 14.A N PHE 102.A O no hydrogen 3.093 N/A GLY 15.A N VAL 33.A O no hydrogen 2.998 N/A VAL 16.A N LEU 104.A O no hydrogen 2.785 N/A ASP 17.A N ALA 31.A O no hydrogen 3.130 N/A GLU 18.A N ASP 17.A OD2.A no hydrogen 2.511 N/A GLU 18.A N GLU 18.A OE2.B no hydrogen 2.833 N/A ALA 19.A N VAL 29.A O no hydrogen 2.657 N/A ARG 21.A N GLU 18.A OE1.A no hydrogen 3.114 N/A ARG 21.A NH2 GLU 18.A OE2.A no hydrogen 3.326 N/A CYS 23.A N GLY 20.A O no hydrogen 3.380 N/A CYS 23.A SG ALA 25.A O no hydrogen 3.316 N/A CYS 23.A SG LYS 160.A O no hydrogen 2.839 N/A LEU 24.A N GLY 161.A O no hydrogen 2.918 N/A GLY 26.A N ILE 179.A O no hydrogen 2.820 N/A VAL 28.A N ALA 71.A O no hydrogen 3.008 N/A VAL 29.A N ALA 19.A O no hydrogen 2.916 N/A ALA 30.A N GLY 69.A O no hydrogen 2.831 N/A ALA 31.A N ASP 17.A O no hydrogen 2.897 N/A ALA 32.A N GLY 67.A O no hydrogen 2.868 N/A VAL 33.A N GLY 15.A O no hydrogen 2.922 N/A VAL 34.A N ALA 65.A O no hydrogen 2.906 N/A SER 45.A N SER 133.A OG no hydrogen 3.072 N/A LYS 46.A N ASP 44.A OD2 no hydrogen 3.365 N/A GLN 47.A N ASP 44.A O no hydrogen 2.988 N/A LEU 48.A N SER 45.A O no hydrogen 3.445 N/A LYS 52.A N SER 49.A OG no hydrogen 2.960 N/A ARG 53.A N SER 49.A O no hydrogen 3.069 N/A ARG 53.A NE SER 45.A O no hydrogen 2.831 N/A ARG 53.A NH2 SER 45.A O no hydrogen 3.242 N/A GLU 54.A N PRO 50.A O no hydrogen 2.955 N/A ARG 55.A N ALA 51.A O no hydrogen 3.267 N/A LEU 56.A N LYS 52.A O no hydrogen 2.818 N/A LEU 57.A N ARG 53.A O no hydrogen 2.813 N/A ASP 58.A N GLU 54.A O no hydrogen 3.254 N/A GLU 59.A N ARG 55.A O no hydrogen 3.262 N/A ILE 60.A N LEU 56.A O no hydrogen 3.184 N/A MET 61.A N LEU 57.A O no hydrogen 2.751 N/A GLU 62.A N GLU 59.A O no hydrogen 2.962 N/A LYS 63.A N GLU 59.A O no hydrogen 2.988 N/A LYS 63.A NZ GLU 38.A O no hydrogen 2.828 N/A LYS 63.A NZ GLU 59.A OE2 no hydrogen 2.730 N/A ALA 64.A N ILE 60.A O no hydrogen 3.022 N/A ALA 65.A N VAL 34.A O no hydrogen 2.823 N/A GLY 67.A N ALA 32.A O no hydrogen 2.913 N/A GLY 69.A N ALA 30.A O no hydrogen 2.943 N/A ALA 71.A N VAL 28.A O no hydrogen 3.014 N/A SER 72.A N GLU 75.A OE1 no hydrogen 2.844 N/A SER 72.A OG GLU 75.A OE1 no hydrogen 3.358 N/A GLU 75.A N SER 72.A OG no hydrogen 3.336 N/A ILE 76.A N SER 72.A O no hydrogen 2.913 N/A ASP 77.A N PRO 73.A O no hydrogen 2.897 N/A LEU 78.A N GLU 74.A O no hydrogen 2.844 N/A TYR 79.A N GLU 75.A O no hydrogen 2.729 N/A ASN 80.A N ILE 76.A O no hydrogen 2.740 N/A PHE 82.A N ASN 80.A OD1 no hydrogen 2.828 N/A ASN 83.A N ASN 80.A OD1 no hydrogen 2.955 N/A ALA 84.A N ASN 80.A O no hydrogen 2.922 N/A THR 85.A N ILE 81.A O no hydrogen 2.888 N/A THR 85.A OG1 ILE 81.A O no hydrogen 2.793 N/A LYS 86.A N PHE 82.A O no hydrogen 3.018 N/A LEU 87.A N ASN 83.A O no hydrogen 2.941 N/A ALA 88.A N ALA 84.A O no hydrogen 2.927 N/A MET 89.A N THR 85.A O no hydrogen 2.990 N/A ASN 90.A N LYS 86.A O no hydrogen 2.857 N/A ARG 91.A N LEU 87.A O no hydrogen 2.892 N/A ARG 91.A NH1 ILE 70.A O no hydrogen 2.844 N/A ARG 91.A NH1 GLU 75.A OE1 no hydrogen 3.157 N/A ARG 91.A NH1 GLU 75.A OE2 no hydrogen 3.399 N/A ARG 91.A NH2 GLU 75.A OE2 no hydrogen 2.897 N/A ALA 92.A N ALA 88.A O no hydrogen 2.944 N/A LEU 93.A N MET 89.A O no hydrogen 3.102 N/A GLU 94.A N ASN 90.A O no hydrogen 3.089 N/A ASN 95.A N ARG 91.A O no hydrogen 3.133 N/A ASN 95.A N ALA 92.A O no hydrogen 2.990 N/A ASN 95.A ND2 ILE 68.A O no hydrogen 2.712 N/A LEU 96.A N LEU 93.A O no hydrogen 3.157 N/A LYS 99.A NZ GLU 94.A O no hydrogen 3.274 N/A SER 101.A N ILE 12.A O no hydrogen 2.773 N/A PHE 102.A N ILE 12.A O no hydrogen 3.369 N/A VAL 103.A N PRO 115.A O no hydrogen 3.004 N/A LEU 104.A N ALA 14.A O no hydrogen 2.784 N/A VAL 105.A N THR 117.A O no hydrogen 2.977 N/A ASN 106.A N VAL 16.A O no hydrogen 3.002 N/A ASN 106.A ND2 ASP 17.A OD2.A no hydrogen 2.838 N/A ASN 106.A ND2 ASP 123.A OD2 no hydrogen 3.147 N/A GLY 107.A N LEU 119.A O no hydrogen 2.933 N/A SER 113.A N ASN 90.A OD1 no hydrogen 2.805 N/A SER 113.A OG ASN 90.A OD1 no hydrogen 3.324 N/A THR 117.A N VAL 103.A O no hydrogen 3.012 N/A THR 117.A OG1 CYS 118.A O no hydrogen 3.507 N/A CYS 118.A SG ILE 110.A O no hydrogen 3.111 N/A LEU 119.A N VAL 105.A O no hydrogen 2.762 N/A GLY 122.A N LEU 119.A O no hydrogen 2.750 N/A ASP 123.A N ASN 106.A OD1 no hydrogen 3.081 N/A GLN 124.A N LYS 121.A O no hydrogen 2.968 N/A LYS 125.A N GLY 122.A O no hydrogen 3.027 N/A LYS 125.A NZ VAL 120.A O no hydrogen 2.774 N/A SER 126.A N GLY 122.A O no hydrogen 3.144 N/A SER 126.A OG ASP 3.A OD1 no hydrogen 3.451 N/A SER 126.A OG ASP 3.A OD2 no hydrogen 2.754 N/A LEU 128.A N ASP 3.A OD1 no hydrogen 2.906 N/A ILE 129.A N SER 126.A OG no hydrogen 3.033 N/A GLY 130.A N SER 126.A O no hydrogen 2.882 N/A ALA 131.A N LYS 127.A O no hydrogen 2.795 N/A ALA 132.A N LEU 128.A O no hydrogen 2.958 N/A SER 133.A N ILE 129.A O no hydrogen 2.838 N/A SER 133.A OG GLY 130.A O no hydrogen 2.590 N/A ILE 134.A N GLY 130.A O no hydrogen 3.283 N/A VAL 135.A N ALA 131.A O no hydrogen 3.041 N/A ALA 136.A N ALA 132.A O no hydrogen 2.878 N/A LYS 137.A N SER 133.A O no hydrogen 3.079 N/A LYS 137.A NZ ASP 141.A OD1 no hydrogen 2.758 N/A VAL 138.A N ILE 134.A O no hydrogen 3.094 N/A PHE 139.A N VAL 135.A O no hydrogen 2.960 N/A ARG 140.A N ALA 136.A O no hydrogen 2.808 N/A ARG 140.A NE PRO 27.A O no hydrogen 2.842 N/A ARG 140.A NH1 PRO 27.A O no hydrogen 3.135 N/A ARG 140.A NH2 LYS 160.A O no hydrogen 3.235 N/A ASP 141.A N LYS 137.A O no hydrogen 2.835 N/A ARG 142.A N VAL 138.A O no hydrogen 2.936 N/A LEU 143.A N PHE 139.A O no hydrogen 3.118 N/A MET 144.A N ARG 140.A O no hydrogen 2.905 N/A SER 145.A N ASP 141.A O no hydrogen 2.861 N/A SER 145.A OG ASP 141.A O no hydrogen 3.048 N/A GLU 146.A N ARG 142.A O no hydrogen 2.996 N/A PHE 147.A N LEU 143.A O no hydrogen 3.102 N/A HIS 148.A N MET 144.A O no hydrogen 3.017 N/A HIS 148.A N SER 145.A O no hydrogen 2.937 N/A HIS 148.A ND1 PHE 154.A O no hydrogen 2.808 N/A ARG 149.A N SER 145.A O no hydrogen 3.369 N/A ARG 149.A NE.A SER 145.A O no hydrogen 3.041 N/A MET 150.A N GLU 146.A O no hydrogen 3.378 N/A TYR 151.A N PHE 147.A O no hydrogen 2.794 N/A PHE 154.A N TYR 151.A O no hydrogen 2.887 N/A SER 155.A N GLU 170.A OE1 no hydrogen 3.043 N/A SER 155.A N GLU 170.A OE2 no hydrogen 3.329 N/A SER 155.A OG GLU 170.A OE1 no hydrogen 3.516 N/A SER 155.A OG GLU 170.A OE2 no hydrogen 2.630 N/A PHE 156.A N PHE 154.A O no hydrogen 2.744 N/A LYS 158.A N SER 155.A O no hydrogen 2.933 N/A HIS 159.A N SER 155.A O no hydrogen 3.099 N/A HIS 159.A NE2 GLU 170.A OE1 no hydrogen 2.970 N/A LYS 160.A N PHE 156.A O no hydrogen 3.029 N/A LYS 160.A NZ LYS 158.A O no hydrogen 3.430 N/A GLY 161.A N HIS 159.A ND1 no hydrogen 2.988 N/A TYR 162.A N HIS 159.A O no hydrogen 2.893 N/A THR 164.A N TYR 162.A O no hydrogen 2.821 N/A HIS 167.A N THR 164.A OG1 no hydrogen 3.204 N/A HIS 167.A ND1 TYR 162.A O no hydrogen 2.641 N/A HIS 167.A NE2 HIS 180.A NE2 no hydrogen 3.067 N/A LEU 168.A N THR 164.A O no hydrogen 3.009 N/A ASN 169.A N LYS 165.A O no hydrogen 2.869 N/A ASN 169.A ND2 GLU 166.A OE1 no hydrogen 3.058 N/A GLU 170.A N GLU 166.A O no hydrogen 2.745 N/A ILE 171.A N HIS 167.A O no hydrogen 2.833 N/A ARG 172.A N LEU 168.A O no hydrogen 2.952 N/A ARG 172.A NH1 ASN 169.A OD1 no hydrogen 2.914 N/A LYS 173.A N ASN 169.A O no hydrogen 3.007 N/A LYS 173.A NZ ASN 174.A OD1 no hydrogen 2.951 N/A ASN 174.A N GLU 170.A O no hydrogen 2.810 N/A ASN 174.A ND2 GLU 170.A O no hydrogen 2.820 N/A GLY 175.A N ILE 171.A O no hydrogen 2.757 N/A LEU 177.A N HIS 180.A ND1 no hydrogen 2.898 N/A HIS 180.A N LEU 177.A O no hydrogen 3.233 N/A HIS 180.A NE2 HIS 167.A NE2 no hydrogen 3.067 N/A ARG 181.A N LEU 24.A O no hydrogen 2.805 N/A ARG 181.A NE GLY 26.A O no hydrogen 2.853 N/A ARG 181.A NH1 GLY 20.A O no hydrogen 2.890 N/A ARG 181.A NH1 ARG 21.A O no hydrogen 3.010 N/A ARG 181.A NH2 GLY 20.A O no hydrogen 2.747 N/A ARG 181.A NH2 GLY 26.A O no hydrogen 2.905 N/A ARG 181.A NH2 PRO 27.A O no hydrogen 3.083 N/A LEU 182.A N ASP 77.A OD2 no hydrogen 2.977 N/A SER 183.A N ASP 77.A OD1 no hydrogen 2.983 N/A SER 183.A OG ASP 77.A OD1 no hydrogen 2.688 N/A PHE 184.A N ARG 181.A O no hydrogen 3.030 N/A VAL 187.A N PHE 184.A O no hydrogen 2.908 N/A LEU 188.A N PHE 184.A O no hydrogen 2.901 N/A GLU 189.A N GLU 185.A O no hydrogen 2.931 N/A LEU 190.A N VAL 187.A O no hydrogen 3.109 N/A LEU 191.A N LEU 188.A O no hydrogen 3.185 N/A LEU 195.A N THR 192.A OG1 no hydrogen 2.996 N/A LEU 196.A N THR 192.A O no hydrogen 2.914 N/A ARG 197.A N ASP 193.A O no hydrogen 2.889 N/A ARG 197.A NE ASP 193.A OD1 no hydrogen 2.753 N/A GLU 198.A N ASP 194.A O no hydrogen 2.941 N/A PHE 199.A N LEU 195.A O no hydrogen 2.807 N/A PHE 200.A N LEU 196.A O no hydrogen 3.103 N/A GLU 201.A N ARG 197.A O no hydrogen 2.844 N/A LYS 202.A N GLU 198.A O no hydrogen 2.933 N/A LYS 202.A NZ GLU 198.A OE1 no hydrogen 2.813 N/A GLY 203.A N PHE 200.A O no hydrogen 2.880 N/A LEU 204.A N PHE 199.A O no hydrogen 2.763 N/A SER 206.A OG GLU 74.A OE1 no hydrogen 2.837 N/A ARG 209.A N SER 206.A OG no hydrogen 3.161 N/A ARG 209.A NE ASP 77.A OD2 no hydrogen 2.886 N/A ARG 209.A NH1 PRO 178.A O no hydrogen 2.933 N/A ARG 209.A NH2 ASP 77.A OD2 no hydrogen 2.767 N/A ARG 209.A NH2 PRO 178.A O no hydrogen 3.147 N/A PHE 210.A N SER 206.A O no hydrogen 2.864 N/A GLU 211.A N GLU 207.A O no hydrogen 2.841 N/A ARG 212.A N ASN 208.A O no hydrogen 3.059 N/A ARG 212.A NH2 LEU 78.A O no hydrogen 3.090 N/A ILE 213.A N ARG 209.A O no hydrogen 2.958 N/A LEU 214.A N PHE 210.A O no hydrogen 2.842 N/A ASN 215.A N GLU 211.A O no hydrogen 3.198 N/A LEU 216.A N ARG 212.A O no hydrogen 3.029 N/A LEU 217.A N ILE 213.A O no hydrogen 2.784 N/A GLY 218.A N LEU 214.A O no hydrogen 2.957 N/A ALA 219.A N ASN 215.A O no hydrogen 2.996 N/A ARG 220.A N LEU 217.A O no hydrogen 2.916 N/A ARG 220.A NH1 LEU 188.A O no hydrogen 3.093 N/A ARG 220.A NH1 LEU 191.A O no hydrogen 2.995 N/A