Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5f3e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A ND2 ARG 8.A O no hydrogen 3.046 N/A ASN 4.A ND2 GLY 33.A O no hydrogen 3.147 N/A SER 6.A OG ASN 4.A OD1 no hydrogen 3.347 N/A ALA 7.A N ASN 4.A O no hydrogen 2.987 N/A ARG 8.A N ASN 4.A OD1 no hydrogen 3.174 N/A ARG 8.A NE ASP 243.A OD2 no hydrogen 2.794 N/A ARG 8.A NH2 ASP 243.A OD1 no hydrogen 2.849 N/A ARG 8.A NH2 ASP 243.A OD2 no hydrogen 3.308 N/A ILE 9.A N ASP 243.A OD2 no hydrogen 2.825 N/A PHE 12.A N LYS 41.A O no hydrogen 2.879 N/A THR 15.A N GLU 18.A OE1 no hydrogen 3.027 N/A THR 15.A OG1 GLU 18.A OE1 no hydrogen 3.220 N/A GLU 18.A N THR 15.A OG1 no hydrogen 3.252 N/A PHE 19.A N THR 15.A O no hydrogen 2.889 N/A ARG 20.A N MET 16.A O no hydrogen 3.139 N/A ARG 24.A N ASN 21.A OD1 no hydrogen 3.295 N/A TYR 25.A N ASN 21.A O no hydrogen 3.011 N/A ILE 26.A N PHE 22.A O no hydrogen 3.084 N/A ALA 27.A N SER 23.A O no hydrogen 3.105 N/A TYR 28.A N ARG 24.A O no hydrogen 2.961 N/A ILE 29.A N TYR 25.A O no hydrogen 2.863 N/A GLU 30.A N ILE 26.A O no hydrogen 3.132 N/A SER 31.A N ALA 27.A O no hydrogen 3.116 N/A SER 31.A OG TYR 28.A O no hydrogen 2.654 N/A GLN 32.A N TYR 28.A O no hydrogen 3.320 N/A GLN 32.A N ILE 29.A O no hydrogen 3.196 N/A GLN 32.A NE2 SER 31.A OG no hydrogen 2.875 N/A GLY 33.A N GLU 30.A O no hydrogen 2.784 N/A ALA 34.A N ILE 29.A O no hydrogen 3.003 N/A HIS 35.A N HIS 35.A ND1 no hydrogen 2.838 N/A HIS 35.A NE2 THR 327.A O no hydrogen 3.004 N/A ARG 36.A N GLY 33.A O no hydrogen 3.225 N/A ARG 36.A NE GLU 199.A OE2 no hydrogen 3.160 N/A ARG 36.A NH1 GLU 1.A O no hydrogen 2.837 N/A ARG 36.A NH1 LEU 3.A O no hydrogen 3.157 N/A ARG 36.A NH2 GLU 199.A OE1 no hydrogen 3.208 N/A ARG 36.A NH2 GLU 199.A OE2 no hydrogen 3.511 N/A GLY 38.A N HIS 35.A O no hydrogen 2.800 N/A ALA 40.A N ILE 254.A O no hydrogen 2.818 N/A LYS 41.A N MET 10.A O no hydrogen 3.083 N/A LYS 41.A NZ THR 246.A O no hydrogen 2.738 N/A LYS 41.A NZ GLU 251.A OE1 no hydrogen 2.903 N/A VAL 42.A N PHE 252.A O no hydrogen 2.903 N/A VAL 43.A N PHE 12.A O no hydrogen 2.873 N/A GLU 47.A N GLU 47.A OE2 no hydrogen 2.883 N/A TRP 48.A N PRO 45.A O no hydrogen 2.879 N/A ARG 51.A NE SER 53.A O no hydrogen 3.118 N/A ARG 51.A NH1 LEU 135.A O no hydrogen 2.858 N/A ARG 51.A NH2 ASP 56.A OD1 no hydrogen 3.117 N/A ALA 52.A N GLU 137.A OE1 no hydrogen 3.217 N/A TYR 54.A OH HIS 186.A ND1 no hydrogen 2.842 N/A LEU 60.A N ILE 57.A O no hydrogen 3.159 N/A ILE 62.A N MET 87.A O no hydrogen 2.715 N/A ILE 66.A N.A TYR 127.A O no hydrogen 2.763 N/A ILE 66.A N.B TYR 127.A O no hydrogen 2.764 N/A GLN 67.A N ILE 82.A O no hydrogen 2.782 N/A GLN 67.A NE2 PRO 124.A O no hydrogen 3.221 N/A GLN 68.A N PRO 125.A O no hydrogen 2.885 N/A GLN 68.A NE2 SER 169.A O no hydrogen 2.885 N/A LEU 69.A N.A TYR 80.A O no hydrogen 2.938 N/A LEU 69.A N.B TYR 80.A O no hydrogen 2.952 N/A THR 71.A N THR 78.A O no hydrogen 2.829 N/A GLN 73.A N LEU 76.A O no hydrogen 3.070 N/A LEU 76.A N GLN 73.A O no hydrogen 3.130 N/A PHE 77.A N LEU 229.A O no hydrogen 2.882 N/A THR 78.A N THR 71.A O no hydrogen 2.740 N/A GLN 79.A N MET 227.A O no hydrogen 2.750 N/A TYR 80.A N LEU 69.A O.A no hydrogen 2.708 N/A TYR 80.A N LEU 69.A O.B no hydrogen 2.718 N/A ILE 82.A N GLN 67.A O no hydrogen 3.013 N/A LYS 84.A N PRO 65.A O no hydrogen 2.823 N/A MET 87.A N ILE 62.A O no hydrogen 3.106 N/A THR 88.A N GLU 91.A OE1 no hydrogen 3.185 N/A VAL 89.A N LEU 60.A O no hydrogen 2.990 N/A ARG 90.A N ASP 58.A O no hydrogen 3.074 N/A ARG 90.A NH1 ASP 59.A OD1 no hydrogen 2.691 N/A ARG 90.A NH2 ASP 59.A OD1 no hydrogen 3.525 N/A GLU 91.A N THR 88.A OG1 no hydrogen 3.396 N/A PHE 92.A N THR 88.A O no hydrogen 2.969 N/A ARG 93.A N VAL 89.A O no hydrogen 2.818 N/A ARG 93.A NH1 ASP 58.A OD1 no hydrogen 2.691 N/A ARG 93.A NH2 ASP 58.A OD1 no hydrogen 3.006 N/A LYS 94.A N ARG 90.A O no hydrogen 3.168 N/A ILE 95.A N GLU 91.A O no hydrogen 3.248 N/A ALA 96.A N PHE 92.A O no hydrogen 2.809 N/A ASN 97.A N ARG 93.A O no hydrogen 2.997 N/A SER 98.A N ILE 95.A O no hydrogen 3.154 N/A SER 98.A OG ILE 95.A O no hydrogen 2.695 N/A TYR 101.A N SER 98.A O no hydrogen 3.223 N/A CYS 102.A N SER 98.A O no hydrogen 2.823 N/A CYS 102.A SG ASP 99.A O no hydrogen 3.858 N/A CYS 102.A SG THR 103.A O no hydrogen 4.036 N/A THR 103.A OG1 HIS 266.A O no hydrogen 2.671 N/A SER 107.A N GLU 111.A OE1 no hydrogen 2.786 N/A SER 107.A OG GLU 111.A OE1 no hydrogen 2.986 N/A GLU 111.A N GLU 108.A O no hydrogen 2.914 N/A LEU 112.A N GLU 108.A O no hydrogen 3.321 N/A GLU 113.A N PHE 109.A O no hydrogen 2.752 N/A ARG 114.A N GLU 110.A O no hydrogen 2.962 N/A LYS 115.A N GLU 111.A O no hydrogen 3.033 N/A TYR 116.A N LEU 112.A O no hydrogen 2.993 N/A TYR 116.A OH SER 169.A OG no hydrogen 2.694 N/A TRP 117.A N GLU 113.A O no hydrogen 3.217 N/A TRP 117.A NE1 TYR 194.A OH no hydrogen 3.050 N/A LYS 118.A N ARG 114.A O no hydrogen 3.005 N/A ASN 119.A N LYS 115.A O no hydrogen 2.877 N/A ASN 119.A ND2 LYS 115.A O no hydrogen 3.052 N/A LEU 120.A N.A TYR 116.A O no hydrogen 2.855 N/A PHE 122.A N ASN 119.A O no hydrogen 3.012 N/A ASN 123.A ND2 LYS 100.A O no hydrogen 2.766 N/A TYR 127.A N ILE 66.A O.A no hydrogen 2.763 N/A TYR 127.A N ILE 66.A O.B no hydrogen 2.696 N/A GLY 128.A N PHE 163.A O no hydrogen 2.949 N/A VAL 131.A N LEU 161.A O no hydrogen 2.953 N/A GLY 133.A N PRO 159.A O no hydrogen 3.114 N/A THR 134.A OG1 GLU 272.A OE1 no hydrogen 3.329 N/A THR 134.A OG1 GLU 272.A OE2 no hydrogen 2.701 N/A LEU 135.A N GLU 272.A OE1 no hydrogen 2.884 N/A TYR 136.A N THR 134.A OG1 no hydrogen 3.091 N/A TYR 136.A OH TRP 143.A O no hydrogen 2.703 N/A GLU 137.A N PRO 50.A O no hydrogen 2.870 N/A VAL 140.A N GLU 137.A O no hydrogen 3.418 N/A ASN 144.A ND2 VAL 140.A O no hydrogen 2.711 N/A GLY 146.A N ASN 144.A OD1 no hydrogen 2.997 N/A ARG 147.A N ASN 144.A O no hydrogen 2.785 N/A ARG 147.A NH1 LYS 138.A O no hydrogen 2.320 N/A ARG 147.A NH1 ASP 141.A OD1 no hydrogen 3.564 N/A ARG 147.A NH2 ASP 141.A OD1 no hydrogen 2.843 N/A THR 150.A OG1 ALA 277.A O no hydrogen 3.435 N/A LEU 152.A N THR 150.A OG1 no hydrogen 3.392 N/A ASP 153.A N THR 150.A O no hydrogen 3.307 N/A LEU 154.A N ILE 151.A O no hydrogen 3.206 N/A VAL 155.A N LEU 152.A O no hydrogen 3.024 N/A TYR 160.A N SER 273.A O no hydrogen 2.926 N/A TYR 160.A OH ASN 132.A OD1 no hydrogen 3.407 N/A LEU 161.A N VAL 131.A O no hydrogen 2.712 N/A TYR 162.A N ALA 271.A O no hydrogen 2.874 N/A TYR 162.A OH ASP 130.A OD1 no hydrogen 2.736 N/A PHE 163.A N GLY 128.A O no hydrogen 2.805 N/A GLY 164.A N ASN 269.A O no hydrogen 2.985 N/A MET 165.A N THR 168.A OG1 no hydrogen 3.339 N/A LYS 167.A N ASN 265.A O no hydrogen 2.993 N/A LYS 167.A NZ ASN 119.A O no hydrogen 3.182 N/A LYS 167.A NZ PHE 122.A O no hydrogen 2.740 N/A THR 168.A N MET 165.A O no hydrogen 3.237 N/A THR 168.A OG1 MET 165.A O no hydrogen 2.782 N/A SER 169.A N GLN 68.A OE1 no hydrogen 2.840 N/A SER 169.A OG TYR 116.A OH no hydrogen 2.694 N/A SER 169.A OG LYS 167.A O no hydrogen 3.180 N/A PHE 170.A N GLY 263.A O no hydrogen 3.061 N/A TRP 172.A N THR 228.A O no hydrogen 2.978 N/A TRP 172.A NE1 ILE 230.A O no hydrogen 3.059 N/A HIS 173.A N HIS 261.A O no hydrogen 3.192 N/A HIS 173.A ND1 ALA 171.A O no hydrogen 2.778 N/A THR 174.A OG1 ASP 178.A OD1 no hydrogen 2.798 N/A ASP 178.A N GLU 175.A O no hydrogen 2.969 N/A LEU 179.A N ASP 176.A O no hydrogen 3.299 N/A TYR 180.A N PHE 276.A O no hydrogen 3.172 N/A TYR 180.A OH GLU 30.A OE2 no hydrogen 2.528 N/A TYR 180.A OH THR 278.A OG1 no hydrogen 2.836 N/A SER 181.A N THR 255.A O no hydrogen 3.108 N/A SER 181.A OG THR 255.A OG1 no hydrogen 2.962 N/A ILE 182.A N THR 274.A O no hydrogen 3.049 N/A ASN 183.A N MET 253.A O no hydrogen 2.871 N/A TYR 184.A N GLU 272.A O no hydrogen 2.782 N/A LEU 185.A N GLU 251.A O no hydrogen 3.199 N/A HIS 186.A ND1 TYR 54.A OH no hydrogen 2.842 N/A HIS 186.A NE2 GLU 272.A OE1 no hydrogen 2.731 N/A GLU 189.A N PHE 268.A O no hydrogen 2.929 N/A LYS 191.A N GLN 247.A O no hydrogen 3.032 N/A LYS 191.A NZ ASN 265.A OD1 no hydrogen 2.822 N/A SER 192.A N PHE 264.A O no hydrogen 2.880 N/A SER 192.A OG THR 246.A OG1 no hydrogen 2.881 N/A SER 192.A OG HIS 266.A NE2 no hydrogen 2.682 N/A TRP 193.A N VAL 245.A O no hydrogen 2.749 N/A TRP 193.A NE1 GLN 247.A OE1 no hydrogen 2.965 N/A TYR 194.A N ALA 262.A O no hydrogen 2.849 N/A TYR 194.A OH GLU 113.A OE2 no hydrogen 2.667 N/A SER 195.A N ASP 243.A O no hydrogen 2.993 N/A VAL 196.A N TYR 260.A O no hydrogen 2.958 N/A HIS 200.A N PRO 197.A O no hydrogen 2.771 N/A GLY 201.A N PRO 198.A O no hydrogen 2.998 N/A ARG 203.A N HIS 200.A O no hydrogen 2.986 N/A GLU 205.A N GLY 201.A O no hydrogen 3.132 N/A ARG 206.A N LYS 202.A O no hydrogen 3.022 N/A LEU 207.A N ARG 203.A O no hydrogen 3.070 N/A ALA 208.A N LEU 204.A O no hydrogen 2.820 N/A LYS 209.A N GLU 205.A O no hydrogen 2.836 N/A GLY 210.A N ARG 206.A O no hydrogen 3.170 N/A PHE 211.A N LEU 207.A O no hydrogen 3.120 N/A PHE 212.A N ALA 208.A O no hydrogen 2.878 N/A ALA 216.A N PHE 212.A O no hydrogen 3.228 N/A GLN 217.A N PRO 213.A O no hydrogen 3.092 N/A GLN 217.A N GLY 214.A O no hydrogen 3.274 N/A SER 218.A N GLY 214.A O no hydrogen 3.242 N/A SER 218.A OG GLY 214.A O no hydrogen 2.911 N/A CYS 219.A N SER 215.A O no hydrogen 3.077 N/A CYS 219.A SG HIS 225.A NE2 no hydrogen 3.548 N/A ARG 224.A N ALA 221.A O no hydrogen 3.075 N/A ARG 224.A NE VAL 289.A O no hydrogen 2.735 N/A ARG 224.A NH1 ASP 178.A OD1 no hydrogen 2.947 N/A ARG 224.A NH1 VAL 289.A O no hydrogen 2.921 N/A ARG 224.A NH2 GLU 175.A O no hydrogen 2.920 N/A ARG 224.A NH2 ASP 178.A OD1 no hydrogen 3.384 N/A HIS 225.A N PHE 222.A O no hydrogen 3.115 N/A LYS 226.A N LEU 223.A O no hydrogen 3.009 N/A LYS 226.A NZ ARG 224.A O no hydrogen 3.362 N/A LEU 229.A N PHE 77.A O no hydrogen 2.923 N/A SER 231.A N GLY 75.A O no hydrogen 2.912 N/A MET 234.A N SER 231.A OG no hydrogen 3.372 N/A LEU 235.A N SER 231.A O no hydrogen 3.093 N/A LYS 236.A N PRO 232.A O no hydrogen 2.928 N/A LYS 237.A N LEU 233.A O no hydrogen 2.940 N/A TYR 238.A N MET 234.A O no hydrogen 3.227 N/A GLY 239.A N LYS 236.A O no hydrogen 3.235 N/A ILE 240.A N LEU 235.A O no hydrogen 2.807 N/A ASP 243.A N SER 195.A O no hydrogen 3.036 N/A LYS 244.A N ASP 243.A OD1 no hydrogen 2.853 N/A LYS 244.A NZ GLU 113.A OE1 no hydrogen 3.231 N/A LYS 244.A NZ GLU 113.A OE2 no hydrogen 2.793 N/A VAL 245.A N TRP 193.A O no hydrogen 3.005 N/A THR 246.A OG1 SER 192.A OG no hydrogen 2.881 N/A GLN 247.A N LYS 191.A O no hydrogen 2.733 N/A GLN 247.A NE2 ASN 183.A O no hydrogen 3.231 N/A GLN 247.A NE2 ASN 183.A OD1 no hydrogen 3.231 N/A GLN 247.A NE2 GLU 251.A O no hydrogen 2.924 N/A GLU 248.A N GLU 251.A OE1 no hydrogen 2.757 N/A GLY 250.A N LEU 185.A O no hydrogen 2.739 N/A GLU 251.A N GLU 248.A O no hydrogen 3.150 N/A PHE 252.A N VAL 42.A O no hydrogen 2.931 N/A MET 253.A N ASN 183.A O no hydrogen 2.809 N/A ILE 254.A N ALA 40.A O no hydrogen 2.735 N/A THR 255.A N SER 181.A O no hydrogen 2.929 N/A THR 255.A OG1 SER 181.A OG no hydrogen 2.962 N/A PHE 256.A N GLY 38.A O no hydrogen 2.948 N/A TYR 258.A OH GLU 205.A OE2 no hydrogen 2.706 N/A GLY 259.A N PHE 256.A O no hydrogen 2.931 N/A TYR 260.A OH GLU 205.A OE2 no hydrogen 2.680 N/A HIS 261.A N HIS 173.A O no hydrogen 2.947 N/A HIS 261.A ND1 GLY 259.A O no hydrogen 2.765 N/A ALA 262.A N TYR 194.A O no hydrogen 3.143 N/A GLY 263.A N PHE 170.A O no hydrogen 3.087 N/A PHE 264.A N SER 192.A O no hydrogen 3.107 N/A ASN 265.A N THR 168.A O no hydrogen 2.967 N/A ASN 265.A ND2 TYR 127.A OH no hydrogen 3.145 N/A ASN 265.A ND2 THR 168.A OG1 no hydrogen 2.907 N/A HIS 266.A N PRO 190.A O no hydrogen 2.878 N/A HIS 266.A NE2 SER 192.A OG no hydrogen 2.682 N/A ASN 269.A N GLY 164.A O no hydrogen 3.110 N/A ASN 269.A ND2 GLU 189.A O no hydrogen 2.990 N/A ASN 269.A ND2 PRO 190.A O no hydrogen 3.283 N/A ASN 269.A ND2 ASN 265.A OD1 no hydrogen 3.055 N/A CYS 270.A N PHE 187.A O no hydrogen 3.202 N/A ALA 271.A N TYR 162.A O no hydrogen 2.962 N/A GLU 272.A N TYR 184.A O no hydrogen 2.841 N/A SER 273.A N TYR 160.A O no hydrogen 2.869 N/A SER 273.A OG ILE 182.A O no hydrogen 3.172 N/A THR 274.A N ILE 182.A O no hydrogen 3.229 N/A THR 274.A OG1 THR 158.A O no hydrogen 3.070 N/A THR 274.A OG1 ASN 275.A O no hydrogen 3.551 N/A ASN 275.A ND2 GLU 175.A OE1 no hydrogen 3.141 N/A ASN 275.A ND2 TYR 180.A O no hydrogen 3.096 N/A PHE 276.A N TYR 180.A O no hydrogen 3.136 N/A ALA 277.A N THR 150.A OG1 no hydrogen 3.264 N/A THR 278.A OG1 TYR 180.A OH no hydrogen 2.836 N/A THR 278.A OG1 THR 330.A OG1 no hydrogen 3.091 N/A ARG 279.A N GLU 332.A OE2 no hydrogen 3.125 N/A ARG 280.A N THR 330.A OG1 no hydrogen 3.302 N/A ARG 280.A NE GLU 30.A OE1 no hydrogen 2.780 N/A ARG 280.A NE GLU 30.A OE2 no hydrogen 3.458 N/A ARG 280.A NH1 GLU 30.A OE2 no hydrogen 2.949 N/A TRP 281.A N THR 278.A O no hydrogen 3.135 N/A TRP 281.A NE1 MET 177.A O no hydrogen 2.812 N/A ILE 282.A N ARG 279.A O no hydrogen 3.383 N/A TYR 284.A OH HIS 326.A ND1 no hydrogen 2.808 N/A GLY 285.A N TRP 281.A O no hydrogen 2.830 N/A LYS 286.A N ILE 282.A O no hydrogen 3.068 N/A LYS 286.A NZ GLU 283.A OE1 no hydrogen 2.812 N/A LYS 286.A NZ GLU 283.A OE2 no hydrogen 3.286 N/A LYS 286.A NZ GLN 308.A OE1 no hydrogen 2.751 N/A LYS 286.A NZ ASP 320.A OD2 no hydrogen 2.756 N/A GLN 287.A N GLU 283.A O no hydrogen 3.187 N/A GLN 287.A N TYR 284.A O no hydrogen 3.250 N/A GLN 287.A NE2 GLU 283.A OE2 no hydrogen 3.001 N/A GLN 287.A NE2 THR 322.A O no hydrogen 2.878 N/A CYS 291.A SG HIS 225.A NE2 no hydrogen 3.553 N/A CYS 293.A SG HIS 225.A NE2 no hydrogen 3.249 N/A PHE 303.A N MET 300.A O no hydrogen 3.026 N/A VAL 304.A N MET 300.A O no hydrogen 3.048 N/A ARG 305.A N ASP 301.A O no hydrogen 2.809 N/A PHE 307.A N PHE 303.A O no hydrogen 2.837 N/A GLN 308.A N VAL 304.A O no hydrogen 2.812 N/A GLN 308.A NE2 GLU 283.A OE1 no hydrogen 3.188 N/A ARG 311.A N GLN 308.A O no hydrogen 3.057 N/A TYR 312.A N PRO 309.A O no hydrogen 3.223 N/A TRP 315.A N ARG 311.A O no hydrogen 2.706 N/A LYS 316.A N TYR 312.A O no hydrogen 3.041 N/A ALA 317.A N LYS 313.A O no hydrogen 3.274 N/A GLY 318.A N TRP 315.A O no hydrogen 2.962 N/A LYS 319.A N LEU 314.A O no hydrogen 2.915 N/A THR 322.A OG1 ASP 320.A OD1 no hydrogen 2.670 N/A HIS 326.A ND1 TYR 284.A OH no hydrogen 2.808 N/A THR 327.A N ASP 325.A OD1 no hydrogen 3.131 N/A THR 327.A OG1 ASP 325.A OD1 no hydrogen 2.678 N/A THR 327.A OG1 ASP 325.A OD2 no hydrogen 3.528 N/A LEU 328.A N ASP 325.A O no hydrogen 3.360 N/A THR 330.A N GLU 30.A OE1 no hydrogen 2.801 N/A THR 330.A OG1 THR 278.A OG1 no hydrogen 3.091 N/A THR 330.A OG1 GLU 332.A OE1 no hydrogen 2.603 N/A GLU 332.A N GLU 332.A OE1 no hydrogen 2.887 N/A ALA 333.A N THR 330.A O no hydrogen 2.973 N/A ALA 334.A N PRO 331.A O no hydrogen 3.148 N/A PHE 336.A N ALA 333.A O no hydrogen 2.957 N/A LEU 337.A N ALA 334.A O no hydrogen 2.979 N/A