Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gbb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N LEU 48.A O no hydrogen 2.970 N/A ILE 5.A N ASP 81.A OD2 no hydrogen 2.851 N/A VAL 6.A N ASP 50.A O no hydrogen 3.083 N/A THR 7.A N LEU 82.A O no hydrogen 2.900 N/A THR 8.A N LYS 52.A O no hydrogen 3.203 N/A THR 8.A OG1 VAL 84.A O no hydrogen 2.993 N/A ILE 9.A N THR 8.A OG1 no hydrogen 2.643 N/A GLU 11.A N VAL 15.A O no hydrogen 3.058 N/A TYR 14.A N GLU 11.A O no hydrogen 2.759 N/A VAL 15.A N GLU 11.A O no hydrogen 2.894 N/A MET 16.A N GLU 31.A O no hydrogen 2.912 N/A ARG 18.A N ARG 29.A O no hydrogen 2.761 N/A ARG 18.A NE ASP 28.A O no hydrogen 2.983 N/A ARG 18.A NH1 ASP 28.A O no hydrogen 2.938 N/A LYS 22.A N SER 20.A OG no hydrogen 3.194 N/A ASN 27.A ND2 TYR 49.A O no hydrogen 3.076 N/A ARG 29.A N GLY 26.A O no hydrogen 3.224 N/A ARG 29.A NE GLY 26.A O no hydrogen 2.607 N/A ARG 29.A NH2 GLY 26.A O no hydrogen 3.498 N/A PHE 30.A N ASN 27.A O no hydrogen 3.107 N/A GLU 31.A N MET 16.A O no hydrogen 2.996 N/A TYR 33.A N PRO 13.A O no hydrogen 2.965 N/A CYS 34.A N TYR 14.A O no hydrogen 2.920 N/A ASP 36.A N GLY 32.A O no hydrogen 2.958 N/A LEU 37.A N TYR 33.A O no hydrogen 2.891 N/A LEU 38.A N CYS 34.A O no hydrogen 2.737 N/A LYS 39.A N LEU 35.A O no hydrogen 2.848 N/A GLU 40.A N ASP 36.A O no hydrogen 2.985 N/A LEU 41.A N LEU 37.A O no hydrogen 2.970 N/A SER 42.A N LEU 38.A O no hydrogen 2.826 N/A SER 42.A OG PHE 47.A O no hydrogen 2.771 N/A ASN 43.A N LYS 39.A O no hydrogen 3.082 N/A ILE 44.A N GLU 40.A O no hydrogen 2.823 N/A LEU 45.A N LEU 41.A O no hydrogen 2.918 N/A PHE 47.A N SER 42.A O no hydrogen 3.055 N/A ASP 50.A N LEU 4.A O no hydrogen 2.696 N/A VAL 51.A N ASN 27.A OD1 no hydrogen 2.894 N/A LYS 52.A N VAL 6.A O no hydrogen 2.751 N/A LYS 52.A NZ ASP 50.A OD2 no hydrogen 2.562 N/A VAL 54.A N THR 8.A O no hydrogen 2.877 N/A GLY 57.A N VAL 54.A O no hydrogen 3.179 N/A LYS 58.A N ASP 56.A OD1 no hydrogen 2.612 N/A LYS 58.A NZ ASP 137.A OD2 no hydrogen 2.673 N/A TYR 59.A OH GLU 11.A OE1 no hydrogen 2.708 N/A GLY 60.A N ASP 137.A O no hydrogen 3.355 N/A ALA 61.A N ASN 69.A OD1 no hydrogen 2.709 N/A GLN 62.A NE2 GLY 66.A O no hydrogen 2.639 N/A ASN 63.A N GLU 67.A O no hydrogen 2.844 N/A GLY 66.A N ASN 63.A O no hydrogen 3.189 N/A GLU 67.A N ASN 63.A OD1 no hydrogen 3.235 N/A ASN 69.A N ALA 61.A O no hydrogen 3.299 N/A ASN 69.A ND2 ASP 137.A OD2 no hydrogen 2.946 N/A GLY 70.A N ASP 56.A OD2 no hydrogen 2.670 N/A MET 71.A N LYS 58.A O no hydrogen 3.295 N/A VAL 72.A N TYR 59.A O no hydrogen 3.472 N/A LYS 73.A N ASN 69.A O no hydrogen 3.264 N/A LYS 73.A NZ ASP 77.A OD1 no hydrogen 3.311 N/A GLU 74.A N GLY 70.A O no hydrogen 3.132 N/A LEU 75.A N MET 71.A O no hydrogen 3.057 N/A ILE 76.A N VAL 72.A O no hydrogen 3.097 N/A ASP 77.A N LYS 73.A O no hydrogen 2.977 N/A HIS 78.A N LEU 75.A O no hydrogen 2.939 N/A HIS 78.A ND1 ILE 76.A O no hydrogen 3.113 N/A ARG 79.A N GLU 74.A O no hydrogen 2.758 N/A ARG 79.A NE GLU 74.A OE1 no hydrogen 3.155 N/A ARG 79.A NE GLU 74.A OE2 no hydrogen 3.407 N/A ARG 79.A NH1 ASP 77.A OD2 no hydrogen 2.860 N/A ARG 79.A NH2 GLU 74.A OE2 no hydrogen 3.158 N/A ARG 79.A NH2 ASP 77.A OD2 no hydrogen 3.010 N/A ASP 81.A N ILE 5.A O no hydrogen 2.895 N/A LEU 82.A N ILE 5.A O no hydrogen 3.439 N/A ALA 83.A N GLY 217.A O no hydrogen 2.676 N/A VAL 84.A N THR 7.A O no hydrogen 3.208 N/A LEU 87.A N ALA 85.A O no hydrogen 2.617 N/A THR 88.A OG1 SER 139.A OG no hydrogen 3.305 N/A THR 88.A OG1 GLU 188.A OE2 no hydrogen 2.632 N/A ILE 89.A N GLY 213.A O no hydrogen 3.057 N/A ARG 93.A N THR 90.A O no hydrogen 3.183 N/A ARG 93.A N THR 90.A OG1 no hydrogen 3.281 N/A ARG 93.A NH1 THR 88.A O no hydrogen 2.823 N/A ARG 93.A NH2 GLY 60.A O no hydrogen 2.931 N/A GLU 94.A N THR 90.A O no hydrogen 2.968 N/A LYS 95.A NZ TYR 91.A OH no hydrogen 2.894 N/A VAL 96.A N ARG 93.A O no hydrogen 2.950 N/A ILE 97.A N ARG 93.A O no hydrogen 2.971 N/A ASP 98.A N THR 218.A O no hydrogen 3.096 N/A SER 100.A N VAL 216.A O no hydrogen 2.979 N/A SER 100.A OG LYS 101.A O no hydrogen 2.863 N/A LYS 101.A N THR 229.A OG1 no hydrogen 3.257 N/A PHE 103.A N TYR 214.A O no hydrogen 2.781 N/A THR 105.A OG1.B LYS 212.A O no hydrogen 3.401 N/A LEU 106.A N LYS 212.A O no hydrogen 2.812 N/A GLY 107.A N SER 189.A OG no hydrogen 3.004 N/A ILE 108.A N ASP 210.A OD1 no hydrogen 2.810 N/A SER 109.A N MET 187.A O no hydrogen 2.898 N/A SER 109.A OG GLY 207.A O no hydrogen 3.038 N/A LEU 111.A N LEU 185.A O no hydrogen 2.864 N/A TYR 112.A N THR 203.A O no hydrogen 3.041 N/A TYR 112.A OH ASP 182.A OD1 no hydrogen 2.696 N/A ARG 113.A NH2 THR 181.A O no hydrogen 3.090 N/A LYS 114.A N ASN 201.A O no hydrogen 3.108 N/A LYS 114.A NZ CYS 200.A O no hydrogen 2.940 N/A ILE 118.A N THR 116.A OG1 no hydrogen 3.307 N/A ASP 119.A N ASP 123.A OD2 no hydrogen 2.748 N/A ASP 123.A N SER 120.A OG no hydrogen 3.170 N/A LEU 124.A N SER 120.A O no hydrogen 3.316 N/A LEU 124.A N ALA 121.A O no hydrogen 2.978 N/A ALA 125.A N ALA 121.A O no hydrogen 2.831 N/A LYS 126.A N ASP 122.A O no hydrogen 2.992 N/A GLN 127.A N LEU 124.A O no hydrogen 3.417 N/A GLN 127.A NE2 LEU 124.A O no hydrogen 2.904 N/A GLN 127.A NE2 ILE 130.A O no hydrogen 2.941 N/A ILE 130.A N GLN 127.A OE1 no hydrogen 2.637 N/A GLU 131.A N ASP 182.A O no hydrogen 3.137 N/A GLY 133.A N ALA 184.A O no hydrogen 3.396 N/A ARG 136.A N VAL 168.A O no hydrogen 2.803 N/A SER 139.A OG THR 88.A OG1 no hydrogen 3.305 N/A SER 139.A OG GLU 188.A OE2 no hydrogen 3.369 N/A THR 142.A N GLY 138.A O no hydrogen 3.196 N/A THR 142.A OG1 SER 139.A O no hydrogen 3.471 N/A PHE 143.A N SER 139.A O no hydrogen 2.974 N/A PHE 144.A N THR 140.A O no hydrogen 3.333 N/A LYS 145.A N MET 141.A O no hydrogen 2.916 N/A LYS 146.A N THR 142.A O no hydrogen 2.858 N/A SER 147.A N PHE 144.A O no hydrogen 3.307 N/A LYS 148.A NZ LYS 146.A O no hydrogen 3.269 N/A ILE 149.A N SER 147.A OG no hydrogen 2.982 N/A THR 151.A OG1 ASP 122.A OD1 no hydrogen 3.189 N/A GLU 153.A N ILE 149.A O no hydrogen 2.961 N/A LYS 154.A N SER 150.A O no hydrogen 3.043 N/A MET 155.A N THR 151.A O no hydrogen 3.064 N/A TRP 156.A N TYR 152.A O no hydrogen 2.862 N/A ALA 157.A N GLU 153.A O no hydrogen 2.918 N/A PHE 158.A N LYS 154.A O no hydrogen 3.117 N/A MET 159.A N MET 155.A O no hydrogen 2.884 N/A SER 160.A N TRP 156.A O no hydrogen 2.937 N/A SER 160.A OG TRP 156.A O no hydrogen 2.642 N/A SER 161.A N PHE 158.A O no hydrogen 3.102 N/A SER 161.A OG PHE 158.A O no hydrogen 2.721 N/A VAL 168.A N ALA 134.A O no hydrogen 2.968 N/A LYS 169.A N GLU 173.A OE2 no hydrogen 3.135 N/A SER 171.A OG GLU 11.A OE2 no hydrogen 2.599 N/A GLU 173.A N ASN 170.A OD1 no hydrogen 2.898 N/A GLY 174.A N ASN 170.A O no hydrogen 3.155 N/A ILE 175.A N SER 171.A O no hydrogen 2.782 N/A GLN 176.A N ASP 172.A O no hydrogen 2.835 N/A ARG 177.A N GLU 173.A O no hydrogen 2.993 N/A ARG 177.A NH1 SER 165.A O no hydrogen 2.909 N/A ARG 177.A NH2 GLU 131.A OE1 no hydrogen 2.897 N/A ARG 177.A NH2 SER 165.A O no hydrogen 3.089 N/A VAL 178.A N GLY 174.A O no hydrogen 3.070 N/A LEU 179.A N ILE 175.A O no hydrogen 3.126 N/A THR 180.A N GLN 176.A O no hydrogen 3.052 N/A THR 180.A OG1 GLN 176.A O no hydrogen 2.976 N/A THR 181.A N ARG 177.A O no hydrogen 3.044 N/A THR 181.A OG1 ARG 177.A O no hydrogen 2.638 N/A TYR 183.A N THR 181.A O no hydrogen 2.852 N/A TYR 183.A OH ALA 166.A O no hydrogen 2.769 N/A ALA 184.A N GLU 131.A O no hydrogen 2.919 N/A LEU 185.A N LEU 111.A O no hydrogen 2.927 N/A LEU 186.A N GLY 133.A O no hydrogen 2.903 N/A MET 187.A N SER 109.A O no hydrogen 2.997 N/A SER 189.A N GLY 107.A O no hydrogen 2.692 N/A SER 189.A OG GLY 107.A O no hydrogen 3.223 N/A THR 190.A OG1 TYR 14.A OH no hydrogen 3.283 N/A SER 191.A N GLU 188.A O no hydrogen 3.205 N/A ILE 192.A N GLU 188.A O no hydrogen 3.260 N/A GLU 193.A N SER 189.A O no hydrogen 3.008 N/A TYR 194.A N THR 190.A O no hydrogen 3.333 N/A VAL 195.A N SER 191.A O no hydrogen 2.758 N/A THR 196.A N ILE 192.A O no hydrogen 2.824 N/A THR 196.A OG1 ILE 192.A O no hydrogen 2.822 N/A THR 196.A OG1 GLU 193.A O no hydrogen 3.200 N/A GLN 197.A N GLU 193.A O no hydrogen 3.180 N/A ARG 198.A N VAL 195.A O no hydrogen 3.107 N/A ARG 198.A NH1 TYR 194.A O no hydrogen 3.060 N/A ARG 198.A NH2 TRP 249.A O no hydrogen 3.197 N/A ASN 199.A N THR 196.A O no hydrogen 3.263 N/A ASN 199.A ND2 VAL 195.A O no hydrogen 2.765 N/A CYS 200.A SG GLY 253.A O no hydrogen 3.842 N/A LEU 202.A N ASN 199.A O no hydrogen 2.974 N/A THR 203.A N TYR 112.A O no hydrogen 2.786 N/A THR 203.A OG1 GLN 204.A O no hydrogen 3.265 N/A GLN 204.A NE2 GLY 206.A O no hydrogen 3.057 N/A ILE 205.A N ILE 110.A O no hydrogen 2.815 N/A ILE 209.A N ILE 108.A O no hydrogen 2.860 N/A LYS 212.A N LEU 106.A O no hydrogen 2.974 N/A LYS 212.A NZ ASP 210.A OD2 no hydrogen 2.806 N/A TYR 214.A N MET 104.A O.A no hydrogen 2.785 N/A TYR 214.A N MET 104.A O.B no hydrogen 2.823 N/A TYR 214.A OH GLU 188.A OE1 no hydrogen 2.564 N/A GLY 215.A N LEU 87.A O no hydrogen 3.325 N/A VAL 216.A N SER 100.A OG no hydrogen 2.903 N/A GLY 217.A N ALA 83.A O no hydrogen 2.973 N/A THR 218.A N ASP 98.A O no hydrogen 3.162 N/A GLY 221.A N ASP 98.A OD2 no hydrogen 3.400 N/A ARG 225.A N SER 222.A O no hydrogen 3.291 N/A ILE 228.A N TYR 224.A O no hydrogen 2.951 N/A ILE 230.A N ASP 226.A O no hydrogen 3.127 N/A ALA 231.A N LYS 227.A O no hydrogen 2.867 N/A ILE 232.A N ILE 228.A O no hydrogen 2.988 N/A LEU 233.A N THR 229.A O no hydrogen 3.102 N/A GLN 234.A N ILE 230.A O no hydrogen 3.039 N/A LEU 235.A N ALA 231.A O no hydrogen 2.933 N/A GLN 236.A N ILE 232.A O no hydrogen 2.932 N/A GLU 237.A N LEU 233.A O no hydrogen 2.838 N/A GLU 238.A N GLN 234.A O no hydrogen 2.921 N/A GLY 239.A N GLN 236.A O no hydrogen 3.160 N/A LYS 240.A N LEU 235.A O no hydrogen 2.844 N/A LEU 241.A N LEU 235.A O no hydrogen 3.449 N/A MET 243.A N GLY 239.A O no hydrogen 3.068 N/A MET 244.A N LYS 240.A O no hydrogen 2.996 N/A LYS 245.A N LEU 241.A O no hydrogen 3.018 N/A LYS 245.A NZ GLU 193.A OE1 no hydrogen 3.237 N/A GLU 246.A N HIS 242.A O no hydrogen 3.147 N/A LYS 247.A N MET 243.A O no hydrogen 2.855 N/A LYS 247.A NZ ASP 36.A OD2 no hydrogen 2.562 N/A TRP 248.A N MET 244.A O no hydrogen 3.229 N/A TRP 248.A NE1 ASP 36.A OD2 no hydrogen 3.006 N/A TRP 249.A N LYS 245.A O no hydrogen 2.953 N/A TRP 249.A NE1 THR 190.A O no hydrogen 2.917 N/A ARG 250.A N GLU 246.A O no hydrogen 2.946 N/A ARG 250.A NH1 GLU 246.A OE2 no hydrogen 3.003 N/A CYS 254.A SG THR 196.A O no hydrogen 3.309 N/A