Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bb5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE GLU 4.A OE1 no hydrogen 3.213 N/A MET 5.A N ARG 2.A O no hydrogen 3.057 N/A LEU 6.A N PRO 3.A O no hydrogen 3.308 N/A GLN 7.A N GLU 4.A O no hydrogen 3.160 N/A GLY 8.A N GLY 32.A O no hydrogen 2.803 N/A LYS 9.A N LEU 6.A O no hydrogen 3.007 N/A LYS 9.A NZ MET 5.A O no hydrogen 2.841 N/A LYS 10.A N ASP 88.A OD2 no hydrogen 2.732 N/A LYS 10.A NZ GLY 85.A O no hydrogen 3.070 N/A VAL 11.A N HIS 34.A O no hydrogen 2.884 N/A ILE 12.A N MET 89.A O no hydrogen 3.013 N/A VAL 13.A N VAL 36.A O no hydrogen 2.982 N/A THR 14.A N ILE 91.A O no hydrogen 3.042 N/A THR 14.A OG1 ILE 91.A O no hydrogen 3.510 N/A THR 14.A OG1 HIS 94.A ND1 no hydrogen 2.679 N/A ALA 16.A N THR 38.A O no hydrogen 2.977 N/A ARG 22.A N LYS 18.A O no hydrogen 3.190 N/A GLU 23.A N GLY 19.A O no hydrogen 3.190 N/A MET 24.A N ILE 20.A O no hydrogen 2.831 N/A ALA 25.A N GLY 21.A O no hydrogen 3.004 N/A TYR 26.A N ARG 22.A O no hydrogen 2.939 N/A HIS 27.A N GLU 23.A O no hydrogen 2.921 N/A HIS 27.A NE2 GLU 213.A O no hydrogen 2.815 N/A LEU 28.A N MET 24.A O no hydrogen 2.937 N/A ALA 29.A N ALA 25.A O no hydrogen 3.055 N/A LYS 30.A N TYR 26.A O no hydrogen 2.981 N/A MET 31.A N HIS 27.A O no hydrogen 3.024 N/A GLY 32.A N ALA 29.A O no hydrogen 2.958 N/A ALA 33.A N LEU 28.A O no hydrogen 2.947 N/A HIS 34.A N LYS 9.A O no hydrogen 2.764 N/A HIS 34.A ND1 SER 59.A OG no hydrogen 2.604 N/A VAL 35.A N SER 59.A O no hydrogen 2.901 N/A VAL 36.A N VAL 11.A O no hydrogen 2.962 N/A VAL 37.A N HIS 61.A O no hydrogen 2.958 N/A THR 38.A N VAL 13.A O no hydrogen 3.162 N/A THR 38.A OG1 ILE 63.A O no hydrogen 2.609 N/A SER 41.A OG THR 44.A OG1 no hydrogen 2.811 N/A THR 44.A N SER 41.A OG no hydrogen 3.280 N/A THR 44.A OG1 SER 41.A OG no hydrogen 2.811 N/A LEU 45.A N SER 41.A O no hydrogen 2.984 N/A GLN 46.A N LYS 42.A O no hydrogen 2.890 N/A LYS 47.A N GLU 43.A O no hydrogen 3.435 N/A VAL 48.A N THR 44.A O no hydrogen 3.134 N/A VAL 49.A N LEU 45.A O no hydrogen 2.831 N/A SER 50.A N GLN 46.A O no hydrogen 3.000 N/A SER 50.A OG GLN 46.A O no hydrogen 3.006 N/A HIS 51.A N LYS 47.A O no hydrogen 3.069 N/A CYS 52.A N VAL 48.A O no hydrogen 2.869 N/A CYS 52.A SG ALA 25.A O no hydrogen 3.298 N/A CYS 52.A SG VAL 48.A O no hydrogen 3.335 N/A LEU 53.A N VAL 49.A O no hydrogen 3.043 N/A GLU 54.A N SER 50.A O no hydrogen 3.021 N/A LEU 55.A N CYS 52.A O no hydrogen 2.948 N/A GLY 56.A N LEU 53.A O no hydrogen 3.175 N/A ALA 57.A N CYS 52.A O no hydrogen 3.122 N/A ALA 58.A N ALA 33.A O no hydrogen 3.036 N/A SER 59.A OG HIS 34.A ND1 no hydrogen 2.604 N/A HIS 61.A N VAL 35.A O no hydrogen 3.106 N/A ILE 63.A N VAL 37.A O no hydrogen 3.190 N/A GLY 65.A N ALA 39.A O no hydrogen 3.039 N/A THR 66.A OG1 GLU 68.A OE1 no hydrogen 2.639 N/A GLU 68.A N THR 66.A OG1 no hydrogen 3.277 N/A ASP 69.A N THR 66.A O no hydrogen 3.178 N/A ALA 73.A N ASP 69.A O no hydrogen 3.160 N/A GLU 74.A N MET 70.A O no hydrogen 3.071 N/A GLN 75.A N THR 71.A O no hydrogen 3.038 N/A PHE 76.A N PHE 72.A O no hydrogen 2.710 N/A VAL 77.A N ALA 73.A O no hydrogen 3.400 N/A GLN 79.A N GLN 75.A O no hydrogen 3.030 N/A ALA 80.A N PHE 76.A O no hydrogen 2.820 N/A GLY 81.A N VAL 77.A O no hydrogen 2.863 N/A LYS 82.A N ALA 78.A O no hydrogen 3.091 N/A LEU 83.A N GLN 79.A O no hydrogen 2.939 N/A MET 84.A N ALA 80.A O no hydrogen 3.148 N/A GLY 86.A N GLY 81.A O no hydrogen 2.835 N/A ASP 88.A N LYS 10.A O no hydrogen 2.756 N/A MET 89.A N LYS 10.A O no hydrogen 3.120 N/A LEU 90.A N SER 138.A O no hydrogen 2.854 N/A ILE 91.A N ILE 12.A O no hydrogen 2.833 N/A LEU 92.A N VAL 140.A O no hydrogen 2.843 N/A ASN 93.A N THR 14.A OG1 no hydrogen 2.880 N/A ASN 93.A ND2 THR 14.A O no hydrogen 3.153 N/A HIS 94.A N THR 14.A OG1 no hydrogen 3.195 N/A HIS 94.A ND1 THR 14.A OG1 no hydrogen 2.679 N/A HIS 94.A NE2 SER 120.A OG no hydrogen 2.637 N/A THR 96.A N ASN 117.A OD1 no hydrogen 2.824 N/A THR 98.A OG1 THR 96.A O no hydrogen 2.855 N/A ASN 101.A N LEU 153.A O no hydrogen 3.216 N/A ILE 107.A N ASP 105.A O no hydrogen 2.865 N/A HIS 109.A N ASP 106.A OD1 no hydrogen 3.147 N/A VAL 110.A N ASP 106.A O no hydrogen 3.270 N/A ARG 111.A N ILE 107.A O no hydrogen 2.912 N/A LYS 112.A N HIS 108.A O no hydrogen 2.900 N/A LYS 112.A NZ GLU 68.A OE2 no hydrogen 3.133 N/A SER 113.A N HIS 109.A O no hydrogen 2.890 N/A SER 113.A OG HIS 109.A O no hydrogen 2.818 N/A MET 114.A N VAL 110.A O no hydrogen 2.942 N/A GLU 115.A N ARG 111.A O no hydrogen 2.879 N/A VAL 116.A N LYS 112.A O no hydrogen 2.928 N/A ASN 117.A N SER 113.A O no hydrogen 2.845 N/A ASN 117.A ND2 SER 160.A OG no hydrogen 2.977 N/A PHE 118.A N MET 114.A O no hydrogen 3.224 N/A LEU 119.A N MET 114.A O no hydrogen 2.885 N/A SER 120.A N GLU 115.A O no hydrogen 2.876 N/A SER 120.A OG HIS 94.A NE2 no hydrogen 2.637 N/A SER 120.A OG VAL 116.A O no hydrogen 2.565 N/A TYR 121.A OH HIS 94.A O no hydrogen 2.611 N/A VAL 122.A N PHE 118.A O no hydrogen 3.324 N/A VAL 123.A N LEU 119.A O no hydrogen 2.949 N/A LEU 124.A N SER 120.A O no hydrogen 2.858 N/A THR 125.A N TYR 121.A O no hydrogen 3.018 N/A THR 125.A OG1 TYR 121.A O no hydrogen 2.791 N/A VAL 126.A N VAL 122.A O no hydrogen 2.966 N/A ALA 127.A N VAL 123.A O no hydrogen 3.037 N/A ALA 128.A N LEU 124.A O no hydrogen 2.904 N/A LEU 129.A N THR 125.A O no hydrogen 2.839 N/A LEU 132.A N ALA 128.A O no hydrogen 2.991 N/A LYS 133.A N LEU 129.A O no hydrogen 2.736 N/A GLN 134.A N PRO 130.A O no hydrogen 3.172 N/A SER 135.A N MET 131.A O no hydrogen 3.117 N/A SER 135.A OG LEU 87.A O no hydrogen 2.671 N/A SER 135.A OG MET 131.A O no hydrogen 3.270 N/A SER 135.A OG LEU 132.A O no hydrogen 3.458 N/A ASN 136.A N LYS 133.A O no hydrogen 3.388 N/A GLY 137.A N LEU 132.A O no hydrogen 2.819 N/A SER 138.A N ASP 88.A O no hydrogen 2.873 N/A SER 138.A OG SER 183.A OG no hydrogen 2.718 N/A SER 138.A OG GLY 223.A O no hydrogen 3.537 N/A ILE 139.A N SER 183.A O no hydrogen 2.823 N/A VAL 140.A N LEU 90.A O no hydrogen 2.800 N/A VAL 141.A N THR 185.A O no hydrogen 2.695 N/A VAL 142.A N LEU 92.A O no hydrogen 2.850 N/A SER 143.A N CYS 187.A O no hydrogen 2.657 N/A SER 144.A N SER 143.A OG no hydrogen 2.692 N/A LEU 145.A N LEU 189.A O no hydrogen 2.864 N/A ALA 146.A N SER 144.A OG no hydrogen 2.818 N/A GLY 147.A N SER 144.A O no hydrogen 2.786 N/A LYS 148.A N LEU 145.A O no hydrogen 2.934 N/A LYS 148.A NZ ASP 165.A OD2 no hydrogen 2.803 N/A LYS 148.A NZ GLU 229.A OE2 no hydrogen 2.804 N/A VAL 149.A N LEU 145.A O no hydrogen 2.979 N/A SER 158.A N VAL 154.A O no hydrogen 2.740 N/A SER 158.A OG ALA 146.A O no hydrogen 3.236 N/A SER 158.A OG VAL 154.A O no hydrogen 2.851 N/A ALA 159.A N ALA 155.A O no hydrogen 2.977 N/A SER 160.A N ALA 156.A O no hydrogen 3.128 N/A SER 160.A OG TYR 157.A O no hydrogen 2.751 N/A LYS 161.A N TYR 157.A O no hydrogen 3.039 N/A LYS 161.A NZ VAL 142.A O no hydrogen 2.798 N/A PHE 162.A N SER 158.A O no hydrogen 2.845 N/A ALA 163.A N ALA 159.A O no hydrogen 2.879 N/A LEU 164.A N SER 160.A O no hydrogen 3.234 N/A ASP 165.A N LYS 161.A O no hydrogen 3.305 N/A GLY 166.A N PHE 162.A O no hydrogen 2.999 N/A PHE 167.A N ALA 163.A O no hydrogen 2.875 N/A PHE 168.A N LEU 164.A O no hydrogen 2.864 N/A SER 169.A N ASP 165.A O no hydrogen 2.922 N/A SER 169.A OG ASP 165.A O no hydrogen 2.859 N/A SER 169.A OG ASP 165.A OD1 no hydrogen 2.764 N/A SER 170.A N GLY 166.A O no hydrogen 3.250 N/A ILE 171.A N PHE 167.A O no hydrogen 3.036 N/A ARG 172.A N PHE 168.A O no hydrogen 2.960 N/A ARG 172.A NE ILE 184.A O no hydrogen 3.169 N/A ARG 172.A NH2 ILE 184.A O no hydrogen 2.786 N/A LYS 173.A N SER 169.A O no hydrogen 3.314 N/A LYS 173.A NZ GLU 251.A OE1 no hydrogen 2.784 N/A GLU 174.A N SER 170.A O no hydrogen 3.112 N/A TYR 175.A N ILE 171.A O no hydrogen 2.834 N/A SER 176.A N ARG 172.A O no hydrogen 3.221 N/A SER 176.A OG LYS 173.A O no hydrogen 2.706 N/A VAL 177.A N LYS 173.A O no hydrogen 3.339 N/A SER 178.A N GLU 174.A O no hydrogen 2.947 N/A SER 178.A OG GLU 174.A O no hydrogen 2.608 N/A VAL 180.A N TYR 175.A O no hydrogen 2.777 N/A SER 183.A N GLY 137.A O no hydrogen 3.067 N/A THR 185.A N ILE 139.A O no hydrogen 2.855 N/A THR 185.A OG1 GLN 227.A O no hydrogen 2.671 N/A LEU 186.A N GLU 228.A O no hydrogen 2.888 N/A CYS 187.A N VAL 141.A O no hydrogen 2.797 N/A CYS 187.A SG VAL 141.A O no hydrogen 3.875 N/A VAL 188.A N VAL 230.A O no hydrogen 2.702 N/A GLY 190.A N TYR 232.A O no hydrogen 2.814 N/A ASP 193.A N ALA 210.A O no hydrogen 2.833 N/A THR 194.A N ILE 192.A O no hydrogen 2.815 N/A ALA 197.A N THR 194.A OG1 no hydrogen 3.217 N/A MET 198.A N THR 194.A O no hydrogen 2.881 N/A LYS 199.A N GLU 195.A O no hydrogen 2.992 N/A LYS 199.A NZ GLU 195.A OE2 no hydrogen 3.103 N/A ALA 200.A N THR 196.A O no hydrogen 3.039 N/A VAL 201.A N ALA 197.A O no hydrogen 3.079 N/A SER 202.A N MET 198.A O no hydrogen 3.224 N/A SER 202.A OG LYS 199.A O no hydrogen 3.327 N/A ILE 204.A N VAL 201.A O no hydrogen 2.970 N/A VAL 205.A N VAL 201.A O no hydrogen 2.992 N/A GLN 208.A N GLN 208.A OE1 no hydrogen 2.808 N/A ALA 210.A N LEU 191.A O no hydrogen 2.812 N/A LYS 212.A N ASP 193.A OD1 no hydrogen 2.802 N/A LYS 212.A NZ GLU 213.A OE2 no hydrogen 3.217 N/A CYS 215.A N PRO 211.A O no hydrogen 3.151 N/A ALA 216.A N LYS 212.A O no hydrogen 2.920 N/A LEU 217.A N GLU 213.A O no hydrogen 3.150 N/A GLU 218.A N GLU 214.A O no hydrogen 2.914 N/A ILE 219.A N CYS 215.A O no hydrogen 3.059 N/A ILE 220.A N ALA 216.A O no hydrogen 3.205 N/A LYS 221.A N LEU 217.A O no hydrogen 2.857 N/A LYS 221.A NZ GLU 218.A OE2 no hydrogen 3.511 N/A GLY 222.A N GLU 218.A O no hydrogen 3.040 N/A GLY 223.A N ILE 219.A O no hydrogen 2.997 N/A ALA 224.A N ILE 220.A O no hydrogen 2.815 N/A LEU 225.A N LYS 221.A O no hydrogen 2.839 N/A ARG 226.A N GLY 223.A O no hydrogen 2.992 N/A ARG 226.A NH1 ASN 136.A O no hydrogen 2.883 N/A ARG 226.A NH1 GLY 137.A O no hydrogen 3.466 N/A ARG 226.A NH2 ASN 136.A O no hydrogen 3.235 N/A ARG 226.A NH2 GLY 137.A O no hydrogen 3.352 N/A ARG 226.A NH2 ASN 181.A O no hydrogen 3.068 N/A GLN 227.A N GLY 222.A O no hydrogen 2.835 N/A GLN 227.A NE2 GLU 229.A O no hydrogen 3.413 N/A VAL 230.A N LEU 186.A O no hydrogen 2.928 N/A TYR 232.A N VAL 188.A O no hydrogen 3.068 N/A SER 234.A OG GLN 208.A O no hydrogen 2.700 N/A SER 235.A N ASP 233.A OD2 no hydrogen 3.236 N/A THR 238.A N SER 235.A OG no hydrogen 3.294 N/A THR 238.A OG1 ASP 233.A OD2 no hydrogen 3.059 N/A THR 239.A OG1 SER 235.A O no hydrogen 2.637 N/A LEU 240.A N TRP 237.A O no hydrogen 3.273 N/A LEU 241.A N TRP 237.A O no hydrogen 3.144 N/A ILE 242.A N THR 238.A O no hydrogen 2.760 N/A ARG 243.A NE THR 239.A O no hydrogen 3.349 N/A ASN 244.A ND2 SER 246.A OG no hydrogen 3.264 N/A ARG 247.A NE GLU 251.A OE2 no hydrogen 2.783 N/A ARG 247.A NH1 ASP 165.A OD1 no hydrogen 3.339 N/A ARG 247.A NH1 ASP 165.A OD2 no hydrogen 2.794 N/A ARG 247.A NH2 ASP 165.A OD1 no hydrogen 2.945 N/A LYS 248.A N ASN 244.A O no hydrogen 3.418 N/A ILE 249.A N PRO 245.A O no hydrogen 2.924 N/A LEU 250.A N SER 246.A O no hydrogen 2.824 N/A GLU 251.A N ARG 247.A O no hydrogen 2.896 N/A GLU 252.A N LYS 248.A O no hydrogen 3.012 N/A LEU 253.A N ILE 249.A O no hydrogen 2.999 N/A SER 255.A OG GLU 252.A O no hydrogen 2.753 N/A SER 257.A OG TYR 254.A O no hydrogen 3.415 N/A ASP 261.A N ASN 259.A OD1 no hydrogen 3.135 N/A PHE 263.A N MET 260.A O no hydrogen 2.800 N/A