Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6sxe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG SER 4.A OG no hydrogen 2.720 N/A SER 4.A OG SER 1.A O no hydrogen 3.297 N/A SER 4.A OG SER 1.A OG no hydrogen 2.720 N/A LYS 6.A N HIS 2.A O no hydrogen 3.232 N/A ILE 7.A N MET 3.A O no hydrogen 3.370 N/A ARG 8.A N SER 4.A O no hydrogen 3.355 N/A ARG 8.A NH1 ALA 68.A O no hydrogen 2.803 N/A ASP 9.A N ARG 5.A O no hydrogen 3.215 N/A LEU 10.A N LYS 6.A O no hydrogen 3.099 N/A ILE 11.A N ILE 7.A O no hydrogen 2.971 N/A GLU 12.A N ARG 8.A O no hydrogen 2.890 N/A SER 13.A N LEU 10.A O no hydrogen 3.167 N/A SER 13.A OG LEU 10.A O no hydrogen 2.679 N/A PHE 16.A N SER 13.A OG no hydrogen 3.353 N/A GLN 17.A N SER 13.A O no hydrogen 3.414 N/A ASN 18.A N LYS 14.A O no hydrogen 3.004 N/A VAL 19.A N ARG 15.A O no hydrogen 2.897 N/A ILE 20.A N PHE 16.A O no hydrogen 3.101 N/A THR 21.A N GLN 17.A O no hydrogen 2.925 N/A THR 21.A OG1 GLN 17.A O no hydrogen 2.695 N/A ALA 22.A N ASN 18.A O no hydrogen 2.920 N/A ILE 23.A N VAL 19.A O no hydrogen 3.005 N/A ILE 24.A N ILE 20.A O no hydrogen 3.049 N/A VAL 25.A N THR 21.A O no hydrogen 3.118 N/A LEU 26.A N ALA 22.A O no hydrogen 2.911 N/A ASN 27.A N ILE 23.A O no hydrogen 2.794 N/A ASN 27.A ND2 ASP 51.A OD1 no hydrogen 2.929 N/A GLY 28.A N ILE 24.A O no hydrogen 2.861 N/A ALA 29.A N VAL 25.A O no hydrogen 2.836 N/A VAL 30.A N LEU 26.A O no hydrogen 3.031 N/A LEU 31.A N ASN 27.A O no hydrogen 3.070 N/A GLY 32.A N GLY 28.A O no hydrogen 3.127 N/A LEU 33.A N ALA 29.A O no hydrogen 3.013 N/A LEU 34.A N VAL 30.A O no hydrogen 2.991 N/A THR 35.A N GLY 32.A O no hydrogen 3.239 N/A THR 35.A OG1 GLY 32.A O no hydrogen 2.683 N/A ASP 36.A N LEU 33.A O no hydrogen 3.168 N/A THR 38.A N ASP 36.A OD1 no hydrogen 3.071 N/A THR 38.A OG1 ASP 36.A OD1 no hydrogen 2.694 N/A SER 43.A N SER 40.A OG no hydrogen 3.360 N/A GLN 44.A N SER 40.A O no hydrogen 3.143 N/A ASN 45.A N ALA 41.A O no hydrogen 3.086 N/A LEU 46.A N SER 42.A O no hydrogen 2.993 N/A LEU 47.A N SER 43.A O no hydrogen 3.191 N/A GLU 48.A N GLN 44.A O no hydrogen 3.017 N/A ARG 49.A N ASN 45.A O no hydrogen 3.096 N/A VAL 50.A N LEU 46.A O no hydrogen 3.042 N/A ASP 51.A N LEU 47.A O no hydrogen 2.851 N/A GLN 52.A N GLU 48.A O no hydrogen 2.983 N/A LEU 53.A N ARG 49.A O no hydrogen 2.903 N/A CYS 54.A N VAL 50.A O no hydrogen 3.052 N/A CYS 54.A SG ILE 23.A O no hydrogen 3.684 N/A CYS 54.A SG VAL 50.A O no hydrogen 3.312 N/A LEU 55.A N ASP 51.A O no hydrogen 2.982 N/A THR 56.A N GLN 52.A O no hydrogen 3.072 N/A THR 56.A OG1 GLN 52.A O no hydrogen 3.379 N/A THR 56.A OG1 LEU 53.A O no hydrogen 2.780 N/A ILE 57.A N LEU 53.A O no hydrogen 3.108 N/A PHE 58.A N CYS 54.A O no hydrogen 3.280 N/A ILE 59.A N LEU 55.A O no hydrogen 3.146 N/A VAL 60.A N THR 56.A O no hydrogen 3.007 N/A GLU 61.A N ILE 57.A O no hydrogen 2.958 N/A ILE 62.A N PHE 58.A O no hydrogen 2.941 N/A SER 63.A N ILE 59.A O no hydrogen 3.124 N/A SER 63.A OG ILE 59.A O no hydrogen 2.733 N/A LEU 64.A N VAL 60.A O no hydrogen 2.911 N/A LYS 65.A N GLU 61.A O no hydrogen 3.097 N/A LYS 65.A NZ GLU 61.A OE1 no hydrogen 3.044 N/A ILE 66.A N ILE 62.A O no hydrogen 2.809 N/A TYR 67.A N SER 63.A O no hydrogen 3.168 N/A ALA 68.A N LEU 64.A O no hydrogen 3.141 N/A TYR 69.A N LYS 65.A O no hydrogen 3.098 N/A TYR 69.A OH GLU 12.A OE2 no hydrogen 2.737 N/A GLY 70.A N ILE 66.A O no hydrogen 2.814 N/A PHE 74.A N GLY 70.A O no hydrogen 2.837 N/A PHE 75.A N VAL 71.A O no hydrogen 3.064 N/A SER 77.A N PHE 74.A O no hydrogen 3.347 N/A ASN 80.A ND2 PHE 74.A O no hydrogen 2.973 N/A LEU 81.A N SER 77.A O no hydrogen 3.246 N/A PHE 82.A N GLY 78.A O no hydrogen 3.138 N/A ASP 83.A N TRP 79.A O no hydrogen 3.035 N/A PHE 84.A N ASN 80.A O no hydrogen 2.768 N/A VAL 85.A N LEU 81.A O no hydrogen 2.849 N/A ILE 86.A N PHE 82.A O no hydrogen 2.955 N/A VAL 87.A N ASP 83.A O no hydrogen 3.355 N/A ALA 88.A N PHE 84.A O no hydrogen 2.750 N/A ILE 89.A N VAL 85.A O no hydrogen 2.839 N/A ALA 90.A N VAL 87.A O no hydrogen 3.242 N/A LEU 91.A N ALA 88.A O no hydrogen 3.314 N/A ALA 94.A N MET 92.A O no hydrogen 3.079 N/A ARG 105.A NH1 GLU 48.A OE1 no hydrogen 2.844 N/A ARG 105.A NH2 GLU 48.A OE1 no hydrogen 3.290 N/A PHE 107.A N PHE 104.A O no hydrogen 3.437 N/A ARG 108.A N ARG 105.A O no hydrogen 3.183 N/A ARG 108.A NE ASN 27.A OD1 no hydrogen 3.090 N/A ARG 108.A NH1 ASN 27.A OD1 no hydrogen 3.170 N/A VAL 109.A N ILE 106.A O no hydrogen 3.073 N/A MET 110.A N PHE 107.A O no hydrogen 3.106 N/A ARG 111.A N ARG 108.A O no hydrogen 3.206 N/A ARG 111.A NE ASP 83.A OD1 no hydrogen 3.198 N/A ARG 111.A NH1 GLU 61.A OE1 no hydrogen 3.445 N/A ARG 111.A NH1 GLU 61.A OE2 no hydrogen 2.888 N/A ARG 111.A NH2 GLU 61.A OE1 no hydrogen 2.779 N/A LEU 112.A N VAL 109.A O no hydrogen 2.943 N/A VAL 113.A N MET 110.A O no hydrogen 3.171 N/A SER 114.A OG ASP 83.A OD1 no hydrogen 2.667 N/A SER 114.A OG ARG 111.A O no hydrogen 3.003 N/A VAL 115.A N ARG 111.A O no hydrogen 2.841 N/A ILE 116.A N LEU 112.A O no hydrogen 2.937 N/A ARG 120.A N ILE 116.A O no hydrogen 2.909 N/A ARG 120.A NH1 SER 114.A O no hydrogen 2.790 N/A ARG 121.A N PRO 117.A O no hydrogen 3.079 N/A ARG 121.A NH1 GLU 231.A OE1 no hydrogen 3.494 N/A VAL 122.A N THR 118.A O no hydrogen 3.380 N/A VAL 123.A N MET 119.A O no hydrogen 3.364 N/A GLN 124.A N ARG 120.A O no hydrogen 3.070 N/A GLY 125.A N ARG 121.A O no hydrogen 2.952 N/A MET 126.A N VAL 122.A O no hydrogen 3.093 N/A LEU 127.A N VAL 123.A O no hydrogen 2.806 N/A LEU 128.A N GLN 124.A O no hydrogen 2.944 N/A ALA 129.A N GLY 125.A O no hydrogen 3.093 N/A LEU 130.A N LEU 127.A O no hydrogen 3.259 N/A VAL 133.A N LEU 130.A O no hydrogen 2.964 N/A GLY 134.A N PRO 131.A O no hydrogen 3.123 N/A ALA 137.A N VAL 133.A O no hydrogen 3.046 N/A ALA 138.A N GLY 134.A O no hydrogen 3.024 N/A LEU 139.A N SER 135.A O no hydrogen 2.964 N/A LEU 140.A N VAL 136.A O no hydrogen 2.969 N/A THR 141.A N ALA 137.A O no hydrogen 3.088 N/A THR 141.A OG1 ALA 137.A O no hydrogen 2.740 N/A VAL 142.A N ALA 138.A O no hydrogen 3.030 N/A VAL 143.A N LEU 139.A O no hydrogen 3.037 N/A PHE 144.A N LEU 140.A O no hydrogen 3.036 N/A TYR 145.A N THR 141.A O no hydrogen 2.927 N/A ILE 146.A N VAL 142.A O no hydrogen 2.956 N/A ALA 147.A N VAL 143.A O no hydrogen 2.919 N/A ALA 148.A N PHE 144.A O no hydrogen 2.856 N/A VAL 149.A N TYR 145.A O no hydrogen 3.154 N/A MET 150.A N ILE 146.A O no hydrogen 3.071 N/A ALA 151.A N ALA 147.A O no hydrogen 2.860 N/A THR 152.A N ALA 148.A O no hydrogen 2.963 N/A THR 152.A OG1 ALA 148.A O no hydrogen 2.683 N/A THR 152.A OG1 SER 169.A OG no hydrogen 2.719 N/A ASN 153.A N VAL 149.A O no hydrogen 3.138 N/A LEU 154.A N MET 150.A O no hydrogen 2.874 N/A TYR 155.A N ALA 151.A O no hydrogen 2.941 N/A GLY 156.A N THR 152.A O no hydrogen 3.034 N/A THR 158.A OG1 TYR 155.A O no hydrogen 3.344 N/A THR 158.A OG1 HIS 194.A NE2 no hydrogen 2.772 N/A PHE 159.A N TYR 155.A O no hydrogen 2.684 N/A PHE 163.A N PHE 159.A O no hydrogen 2.821 N/A GLY 164.A N PRO 160.A O no hydrogen 2.922 N/A LYS 168.A N ASP 165.A OD1 no hydrogen 2.738 N/A LYS 168.A NZ PRO 160.A O no hydrogen 2.801 N/A SER 169.A N ASP 165.A O no hydrogen 3.041 N/A SER 169.A OG THR 152.A OG1 no hydrogen 2.719 N/A SER 169.A OG ASP 165.A O no hydrogen 3.106 N/A LEU 170.A N LEU 166.A O no hydrogen 2.980 N/A TYR 171.A N SER 167.A O no hydrogen 3.191 N/A THR 172.A N LYS 168.A O no hydrogen 3.057 N/A LEU 173.A N SER 169.A O no hydrogen 2.862 N/A PHE 174.A N LEU 170.A O no hydrogen 2.992 N/A GLN 175.A N TYR 171.A O no hydrogen 3.170 N/A GLN 175.A NE2 GLU 180.A O no hydrogen 2.804 N/A VAL 176.A N THR 172.A O no hydrogen 2.979 N/A MET 177.A N LEU 173.A O no hydrogen 2.964 N/A THR 178.A N PHE 174.A O no hydrogen 3.089 N/A THR 178.A OG1 GLN 175.A O no hydrogen 2.865 N/A LEU 179.A N VAL 176.A O no hydrogen 2.853 N/A GLU 180.A N GLN 175.A O no hydrogen 3.134 N/A SER 181.A OG GLU 180.A OE2 no hydrogen 2.628 N/A GLY 185.A N SER 181.A O no hydrogen 2.864 N/A ILE 186.A N SER 181.A O no hydrogen 3.143 N/A VAL 187.A N TRP 182.A O no hydrogen 2.800 N/A ARG 188.A N SER 183.A O no hydrogen 2.775 N/A VAL 190.A N ILE 186.A O no hydrogen 3.139 N/A MET 191.A N VAL 187.A O no hydrogen 2.795 N/A ASN 192.A N ARG 188.A O no hydrogen 3.310 N/A ASN 192.A N PRO 189.A O no hydrogen 3.335 N/A VAL 193.A N VAL 190.A O no hydrogen 3.215 N/A HIS 194.A N VAL 190.A O no hydrogen 2.786 N/A HIS 194.A NE2 THR 158.A OG1 no hydrogen 2.772 N/A ALA 197.A N HIS 194.A O no hydrogen 3.100 N/A VAL 199.A N ASN 196.A O no hydrogen 3.074 N/A PHE 200.A N ALA 197.A O no hydrogen 3.028 N/A PHE 201.A N ALA 197.A O no hydrogen 3.279 N/A ILE 202.A N TRP 198.A O no hydrogen 3.052 N/A PHE 204.A N PHE 200.A O no hydrogen 3.190 N/A ILE 205.A N PHE 201.A O no hydrogen 2.926 N/A MET 206.A N ILE 202.A O no hydrogen 2.941 N/A LEU 207.A N PRO 203.A O no hydrogen 2.936 N/A THR 208.A N PHE 204.A O no hydrogen 2.974 N/A THR 208.A OG1 PHE 204.A O no hydrogen 2.823 N/A THR 208.A OG1 ILE 205.A O no hydrogen 3.517 N/A THR 209.A N ILE 205.A O no hydrogen 3.024 N/A THR 209.A OG1 ILE 205.A O no hydrogen 2.707 N/A THR 209.A OG1 MET 206.A O no hydrogen 3.485 N/A LEU 210.A N MET 206.A O no hydrogen 3.374 N/A THR 211.A N LEU 207.A O no hydrogen 3.091 N/A THR 211.A OG1 LEU 207.A O no hydrogen 2.858 N/A VAL 212.A N THR 208.A O no hydrogen 2.864 N/A LEU 213.A N THR 209.A O no hydrogen 3.137 N/A ASN 214.A N LEU 210.A O no hydrogen 3.003 N/A LEU 215.A N THR 211.A O no hydrogen 2.881 N/A PHE 216.A N VAL 212.A O no hydrogen 2.869 N/A ILE 217.A N LEU 213.A O no hydrogen 2.808 N/A GLY 218.A N ASN 214.A O no hydrogen 2.894 N/A ILE 219.A N LEU 215.A O no hydrogen 3.105 N/A ILE 220.A N PHE 216.A O no hydrogen 2.925 N/A VAL 221.A N ILE 217.A O no hydrogen 3.010 N/A ASP 222.A N GLY 218.A O no hydrogen 3.288 N/A ALA 223.A N ILE 219.A O no hydrogen 2.953 N/A MET 224.A N ILE 220.A O no hydrogen 3.061 N/A ALA 225.A N VAL 221.A O no hydrogen 3.189 N/A ILE 226.A N ASP 222.A O no hydrogen 2.776 N/A THR 227.A N ALA 223.A O no hydrogen 3.005 N/A THR 227.A OG1 ARG 121.A O no hydrogen 3.466 N/A THR 227.A OG1 ALA 223.A O no hydrogen 2.886 N/A LYS 228.A N MET 224.A O no hydrogen 3.293 N/A GLU 229.A N ALA 225.A O no hydrogen 2.836 N/A GLN 230.A N ILE 226.A O no hydrogen 2.843 N/A GLN 230.A NE2 GLN 124.A OE1 no hydrogen 3.243 N/A GLU 231.A N THR 227.A O no hydrogen 3.260 N/A GLU 232.A N LYS 228.A O no hydrogen 3.290 N/A GLU 233.A N GLU 229.A O no hydrogen 3.216 N/A GLU 233.A N GLN 230.A O no hydrogen 3.224 N/A ALA 234.A N GLU 231.A O no hydrogen 3.172 N/A LYS 235.A NZ GLU 232.A OE2 no hydrogen 3.355 N/A THR 236.A OG1 GLU 232.A O no hydrogen 2.818 N/A HIS 238.A N THR 236.A OG1 no hydrogen 3.315 N/A GLN 240.A N GLU 233.A OE2 no hydrogen 2.997 N/A GLN 240.A NE2 GLU 241.A O no hydrogen 3.659 N/A ILE 243.A N GLU 229.A OE2 no hydrogen 2.990 N/A THR 246.A N PRO 242.A O no hydrogen 3.192 N/A THR 246.A OG1 GLU 241.A OE1 no hydrogen 2.738 N/A THR 246.A OG1 PRO 242.A O no hydrogen 3.142 N/A LEU 247.A N ILE 243.A O no hydrogen 3.001 N/A LEU 248.A N SER 244.A O no hydrogen 2.803 N/A HIS 249.A N GLN 245.A O no hydrogen 3.238 N/A LEU 250.A N LEU 247.A O no hydrogen 3.426 N/A ARG 253.A N HIS 249.A O no hydrogen 2.944 N/A ARG 253.A NH1 GLU 241.A OE1 no hydrogen 3.197 N/A ARG 253.A NH1 GLU 241.A OE2 no hydrogen 3.237 N/A LEU 254.A N LEU 250.A O no hydrogen 3.082 N/A ASP 255.A N GLY 251.A O no hydrogen 3.093 N/A ARG 256.A N ASP 252.A O no hydrogen 3.366 N/A ILE 257.A N ARG 253.A O no hydrogen 3.415 N/A GLU 258.A N LEU 254.A O no hydrogen 3.139 N/A LYS 259.A N ASP 255.A O no hydrogen 2.945 N/A GLN 260.A N ARG 256.A O no hydrogen 3.084 N/A LEU 261.A N ILE 257.A O no hydrogen 3.102 N/A LEU 261.A N GLU 258.A O no hydrogen 3.252 N/A ALA 262.A N GLU 258.A O no hydrogen 3.199 N/A GLN 263.A N LYS 259.A O no hydrogen 3.212 N/A ASN 264.A N GLN 260.A O no hydrogen 3.284 N/A ASN 265.A N LEU 261.A O no hydrogen 2.958 N/A GLU 266.A N ALA 262.A O no hydrogen 2.852 N/A LEU 267.A N GLN 263.A O no hydrogen 3.220 N/A LEU 268.A N ASN 264.A O no hydrogen 3.009 N/A GLN 269.A N ASN 265.A O no hydrogen 3.168 N/A ARG 270.A NE GLU 266.A O no hydrogen 3.287 N/A ARG 270.A NH2 GLU 266.A OE2 no hydrogen 3.110 N/A GLN 271.A NE2 LEU 268.A O no hydrogen 2.870 N/A