Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4d72_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ TYR 164.A OH no hydrogen 3.145 N/A LYS 4.A NZ LYS 197.A O no hydrogen 2.829 N/A ARG 5.A N GLY 162.A O no hydrogen 2.778 N/A ARG 5.A NE ASN 161.A O no hydrogen 2.829 N/A ARG 5.A NH1 TYR 125.A O no hydrogen 2.979 N/A ARG 5.A NH1 TYR 128.A O no hydrogen 2.788 N/A ARG 5.A NH1 LEU 131.A O no hydrogen 3.075 N/A ARG 5.A NH2 TYR 125.A O no hydrogen 2.897 N/A ARG 5.A NH2 ASN 161.A O no hydrogen 3.331 N/A ILE 8.A N GLU 7.A OE1 no hydrogen 3.021 N/A ASN 9.A N HIS 12.A O no hydrogen 2.918 N/A ASN 10.A ND2 ALA 322.A O no hydrogen 2.954 N/A HIS 12.A N ASN 9.A OD1 no hydrogen 2.739 N/A HIS 12.A ND1 ASN 9.A OD1 no hydrogen 3.203 N/A LEU 14.A N VAL 285.A O no hydrogen 2.817 N/A LEU 15.A N TYR 53.A O no hydrogen 2.883 N/A MET 16.A N TYR 287.A O no hydrogen 2.961 N/A MET 17.A N VAL 55.A O no hydrogen 2.752 N/A LEU 19.A N GLN 57.A O no hydrogen 2.764 N/A ALA 21.A N HIS 59.A O no hydrogen 2.855 N/A ASN 22.A N THR 32.A O no hydrogen 2.892 N/A GLY 23.A N ASP 62.A OD1 no hydrogen 2.847 N/A GLU 25.A N ASN 22.A OD1 no hydrogen 3.003 N/A PHE 26.A N ASN 22.A O no hydrogen 2.995 N/A ASN 27.A N GLY 23.A O no hydrogen 3.026 N/A GLN 28.A N GLU 25.A O no hydrogen 2.900 N/A GLY 29.A N PHE 26.A O no hydrogen 2.889 N/A LYS 30.A N GLU 25.A O no hydrogen 2.916 N/A LYS 30.A NZ GLN 28.A OE1 no hydrogen 3.505 N/A TYR 31.A OH ASP 72.A OD1 no hydrogen 2.499 N/A TYR 31.A OH ASP 72.A OD2 no hydrogen 3.290 N/A THR 32.A OG1 GLU 25.A OE1 no hydrogen 2.680 N/A TRP 34.A N TYR 20.A O no hydrogen 2.909 N/A TRP 34.A NE1 ASP 62.A OD1 no hydrogen 2.871 N/A GLY 36.A N PHE 33.A O no hydrogen 2.942 N/A THR 38.A N ASN 300.A OD1 no hydrogen 2.763 N/A THR 40.A N GLU 80.A OE2 no hydrogen 3.096 N/A THR 40.A OG1 GLU 80.A OE2 no hydrogen 2.715 N/A GLY 41.A N THR 38.A OG1 no hydrogen 2.852 N/A LYS 42.A N THR 38.A O no hydrogen 2.794 N/A LYS 42.A NZ ASP 37.A OD2 no hydrogen 2.783 N/A TRP 43.A N LEU 39.A O no hydrogen 3.084 N/A GLU 44.A N THR 40.A O no hydrogen 3.033 N/A ASN 45.A N.A GLY 41.A O no hydrogen 3.166 N/A ASN 45.A N.B GLY 41.A O no hydrogen 3.177 N/A ASN 45.A N.B LYS 42.A O no hydrogen 3.166 N/A ASN 45.A ND2.B ASN 300.A O no hydrogen 2.689 N/A ILE 46.A N LYS 42.A O no hydrogen 3.183 N/A ILE 46.A N TRP 43.A O no hydrogen 2.975 N/A LEU 50.A N PRO 47.A O no hydrogen 2.841 N/A LYS 51.A N PRO 47.A O no hydrogen 3.153 N/A LYS 51.A NZ TRP 43.A O no hydrogen 3.483 N/A LYS 51.A NZ GLU 44.A O no hydrogen 3.347 N/A LYS 51.A NZ ILE 46.A O no hydrogen 2.604 N/A LYS 51.A NZ ASP 48.A OD1 no hydrogen 3.030 N/A TYR 53.A N LEU 50.A O no hydrogen 2.772 N/A THR 54.A N LYS 51.A O no hydrogen 3.503 N/A VAL 55.A N LEU 15.A O no hydrogen 3.184 N/A ILE 56.A N PRO 96.A O no hydrogen 3.133 N/A GLN 57.A N MET 17.A O no hydrogen 2.921 N/A GLN 57.A NE2 THR 100.A OG1 no hydrogen 3.028 N/A LEU 58.A N ILE 98.A O no hydrogen 2.890 N/A HIS 59.A N LEU 19.A O no hydrogen 2.880 N/A ASP 61.A N HIS 59.A ND1 no hydrogen 2.952 N/A LEU 63.A N PRO 60.A O no hydrogen 2.946 N/A LYS 65.A NZ TYR 109.A O no hydrogen 3.094 N/A ARG 66.A N PRO 64.A O no hydrogen 3.057 N/A ARG 71.A NH1 ASP 67.A OD1 no hydrogen 2.707 N/A ARG 71.A NH1 TRP 115.A O no hydrogen 2.999 N/A ARG 71.A NH2 ASP 67.A OD1 no hydrogen 3.382 N/A ARG 71.A NH2 ASP 67.A OD2 no hydrogen 2.694 N/A ASP 72.A N GLY 68.A O no hydrogen 2.812 N/A PHE 73.A N ALA 69.A O no hydrogen 2.978 N/A TYR 74.A N ALA 70.A O no hydrogen 2.854 N/A TYR 74.A OH LEU 58.A O no hydrogen 3.326 N/A TYR 74.A OH THR 100.A O no hydrogen 2.690 N/A GLU 75.A N ARG 71.A O no hydrogen 2.853 N/A HIS 76.A N ASP 72.A O no hydrogen 3.082 N/A MET 77.A N PHE 73.A O no hydrogen 3.101 N/A LEU 78.A N TYR 74.A O no hydrogen 2.785 N/A GLU 79.A N GLU 75.A O no hydrogen 2.933 N/A GLU 80.A N HIS 76.A O no hydrogen 3.055 N/A ALA 81.A N MET 77.A O no hydrogen 2.797 N/A ALA 82.A N LEU 78.A O no hydrogen 2.809 N/A LYS 83.A N GLU 79.A O no hydrogen 3.052 N/A LYS 83.A NZ GLU 79.A OE1 no hydrogen 3.231 N/A TYR 84.A N ALA 81.A O no hydrogen 3.434 N/A TYR 84.A OH GLU 44.A OE2 no hydrogen 3.328 N/A ASN 86.A N LYS 91.A O no hydrogen 3.004 N/A ASN 86.A ND2 GLU 93.A OE1 no hydrogen 3.080 N/A LYS 88.A N ASN 86.A OD1 no hydrogen 2.958 N/A THR 89.A N ASN 86.A O no hydrogen 3.230 N/A GLY 90.A N ASN 86.A O no hydrogen 2.667 N/A LYS 91.A N THR 89.A OG1 no hydrogen 3.271 N/A GLU 93.A N TYR 84.A O no hydrogen 2.803 N/A ILE 95.A N ALA 81.A O no hydrogen 2.983 N/A VAL 97.A N ASN 130.A O no hydrogen 2.839 N/A ILE 98.A N ILE 56.A O no hydrogen 2.709 N/A LEU 99.A N GLY 133.A O no hydrogen 3.262 N/A THR 100.A N LEU 58.A O no hydrogen 2.939 N/A THR 100.A OG1 LEU 58.A O no hydrogen 2.648 N/A VAL 101.A N PHE 135.A O no hydrogen 2.852 N/A TYR 102.A N PHE 135.A O no hydrogen 3.413 N/A THR 103.A OG1 THR 137.A O no hydrogen 2.543 N/A ALA 104.A N ALA 138.A O no hydrogen 3.226 N/A GLY 105.A N SER 139.A OG no hydrogen 2.886 N/A ASN 106.A N THR 103.A O no hydrogen 2.761 N/A ASN 106.A ND2 THR 103.A O no hydrogen 3.302 N/A MET 107.A N ALA 104.A O no hydrogen 3.184 N/A HIS 110.A N MET 107.A O no hydrogen 2.812 N/A THR 111.A N MET 107.A O no hydrogen 3.075 N/A ALA 113.A N THR 111.A OG1 no hydrogen 3.006 N/A HIS 114.A N THR 111.A O no hydrogen 3.309 N/A HIS 114.A ND1 ASN 106.A O no hydrogen 2.804 N/A TRP 115.A N SER 112.A O no hydrogen 3.196 N/A TRP 120.A N SER 117.A OG no hydrogen 2.909 N/A TRP 120.A NE1 GLU 75.A OE2 no hydrogen 2.771 N/A ILE 121.A N SER 117.A O no hydrogen 2.967 N/A ASP 122.A N THR 118.A O no hydrogen 2.866 N/A LYS 123.A N SER 119.A O no hydrogen 3.005 N/A MET 124.A N TRP 120.A O no hydrogen 2.938 N/A TYR 125.A N ILE 121.A O no hydrogen 2.929 N/A TYR 125.A OH SER 158.A OG no hydrogen 2.885 N/A GLN 126.A N ASP 122.A O no hydrogen 2.981 N/A GLN 126.A NE2 ASP 122.A OD1 no hydrogen 2.870 N/A LYS 127.A N LYS 123.A O no hydrogen 2.913 N/A TYR 128.A N MET 124.A O no hydrogen 2.763 N/A TYR 128.A OH GLU 79.A OE2 no hydrogen 2.503 N/A ASN 130.A ND2 ILE 95.A O no hydrogen 2.760 N/A LEU 131.A N TYR 128.A O no hydrogen 3.110 N/A HIS 132.A N VAL 97.A O no hydrogen 2.942 N/A ILE 134.A N TYR 164.A O no hydrogen 2.860 N/A PHE 135.A N LEU 99.A O no hydrogen 2.790 N/A SER 136.A N ILE 166.A O no hydrogen 2.782 N/A THR 137.A N TYR 102.A O no hydrogen 2.923 N/A ALA 138.A N ALA 168.A O no hydrogen 3.108 N/A SER 139.A N GLU 169.A OE1 no hydrogen 3.077 N/A SER 139.A N GLU 169.A OE2 no hydrogen 2.962 N/A TYR 140.A N GLU 169.A OE2 no hydrogen 2.872 N/A ILE 142.A N SER 139.A O no hydrogen 2.910 N/A TRP 143.A NE1 GLU 148.A OE2 no hydrogen 2.744 N/A ILE 147.A N ALA 144.A O no hydrogen 3.151 N/A GLU 148.A N GLU 148.A OE1 no hydrogen 2.884 N/A LYS 150.A N ASP 146.A O no hydrogen 2.877 N/A ALA 151.A N ILE 147.A O no hydrogen 2.867 N/A ALA 152.A N GLU 148.A O no hydrogen 3.036 N/A ASP 153.A N ASN 149.A O no hydrogen 3.256 N/A TYR 154.A N LYS 150.A O no hydrogen 2.962 N/A LEU 155.A N ALA 151.A O no hydrogen 2.944 N/A LYS 156.A N ALA 152.A O no hydrogen 2.938 N/A VAL 157.A N ASP 153.A O no hydrogen 2.937 N/A SER 158.A N TYR 154.A O no hydrogen 3.116 N/A SER 158.A OG TYR 125.A OH no hydrogen 2.885 N/A SER 158.A OG TYR 154.A O no hydrogen 2.850 N/A ALA 159.A N LEU 155.A O no hydrogen 2.936 N/A LYS 160.A N LYS 156.A O no hydrogen 2.892 N/A LYS 160.A NZ ASP 122.A OD1 no hydrogen 3.252 N/A LYS 160.A NZ ASP 122.A OD2 no hydrogen 3.099 N/A ASN 161.A N SER 158.A O no hydrogen 3.000 N/A GLY 162.A N ALA 159.A O no hydrogen 3.189 N/A GLY 163.A N SER 158.A O no hydrogen 2.767 N/A TYR 164.A N HIS 132.A O no hydrogen 2.967 N/A TYR 164.A OH ARG 6.A O no hydrogen 2.783 N/A PHE 165.A N ASN 198.A O no hydrogen 2.861 N/A ILE 166.A N ILE 134.A O no hydrogen 2.765 N/A TRP 167.A N ILE 200.A O no hydrogen 2.929 N/A TRP 167.A NE1 GLU 169.A OE1 no hydrogen 2.822 N/A ALA 168.A N SER 136.A O no hydrogen 2.798 N/A GLU 169.A N MET 202.A O no hydrogen 2.842 N/A ASN 171.A N THR 216.A OG1 no hydrogen 3.023 N/A ASN 171.A ND2 GLU 177.A OE2 no hydrogen 3.323 N/A SER 172.A N GLN 170.A O no hydrogen 2.815 N/A SER 172.A OG ASN 212.A OD1 no hydrogen 3.173 N/A ALA 175.A N SER 172.A O no hydrogen 3.189 N/A ILE 176.A N ASN 171.A OD1 no hydrogen 3.001 N/A LYS 178.A N SER 174.A O no hydrogen 2.817 N/A LYS 178.A NZ GLY 173.A O no hydrogen 2.939 N/A ALA 179.A N ALA 175.A O no hydrogen 2.924 N/A PHE 180.A N GLU 177.A O no hydrogen 3.183 N/A GLY 181.A N LYS 178.A O no hydrogen 2.979 N/A LYS 182.A N GLU 177.A O no hydrogen 3.161 N/A LYS 182.A NZ ASP 339.A OD2 no hydrogen 2.653 N/A GLY 184.A N GLY 181.A O no hydrogen 2.911 N/A LYS 185.A NZ ASN 145.A O no hydrogen 2.954 N/A LYS 190.A N ILE 186.A O no hydrogen 3.011 N/A SER 191.A N ALA 187.A O no hydrogen 2.911 N/A SER 191.A OG ALA 152.A O no hydrogen 3.229 N/A VAL 192.A N PHE 188.A O no hydrogen 2.701 N/A ASP 193.A N GLN 189.A O no hydrogen 3.014 N/A LYS 194.A N LYS 190.A O no hydrogen 3.422 N/A TYR 195.A N SER 191.A O no hydrogen 2.741 N/A TRP 196.A N VAL 192.A O no hydrogen 3.006 N/A ASN 198.A N TYR 195.A O no hydrogen 2.854 N/A LEU 199.A N TRP 196.A O no hydrogen 3.081 N/A ILE 200.A N PHE 165.A O no hydrogen 2.951 N/A PHE 201.A N GLN 231.A O no hydrogen 3.332 N/A MET 202.A N TRP 167.A O no hydrogen 2.783 N/A PHE 203.A N GLY 233.A O no hydrogen 3.026 N/A LYS 204.A N GLN 170.A OE1 no hydrogen 2.915 N/A LYS 204.A NZ THR 206.A OG1 no hydrogen 2.626 N/A LYS 204.A NZ GLU 290.A OE2 no hydrogen 3.221 N/A ASN 205.A N LEU 235.A O no hydrogen 3.076 N/A ASN 205.A ND2 GLU 275.A OE1 no hydrogen 2.809 N/A THR 206.A OG1 ASP 237.A OD2 no hydrogen 2.508 N/A ALA 208.A N THR 206.A O no hydrogen 2.652 N/A GLU 210.A N PRO 207.A O no hydrogen 3.243 N/A GLY 211.A N ALA 208.A O no hydrogen 3.121 N/A THR 215.A OG1 ASN 212.A O no hydrogen 3.163 N/A THR 216.A N ASN 212.A O no hydrogen 2.991 N/A THR 216.A OG1 ASN 212.A O no hydrogen 2.651 N/A GLU 217.A N ASP 213.A O no hydrogen 3.011 N/A SER 218.A N SER 214.A O no hydrogen 2.928 N/A SER 218.A OG TYR 340.A OH no hydrogen 2.578 N/A SER 218.A OG ILE 370.A O no hydrogen 2.577 N/A TYR 219.A N THR 215.A O no hydrogen 2.994 N/A TYR 219.A OH GLU 177.A OE2 no hydrogen 2.772 N/A TYR 219.A OH GLY 338.A O no hydrogen 3.316 N/A MET 220.A N THR 216.A O no hydrogen 2.967 N/A LYS 221.A N GLU 217.A O no hydrogen 3.003 N/A LYS 221.A NZ VAL 369.A O no hydrogen 2.791 N/A GLY 222.A N SER 218.A O no hydrogen 2.959 N/A LEU 223.A N TYR 219.A O no hydrogen 2.718 N/A TRP 224.A N MET 220.A O no hydrogen 3.216 N/A LEU 225.A N LYS 221.A O no hydrogen 2.985 N/A SER 226.A N GLY 222.A O no hydrogen 2.901 N/A SER 226.A OG GLY 222.A O no hydrogen 2.707 N/A SER 226.A OG LEU 223.A O no hydrogen 3.355 N/A ASN 227.A N TRP 224.A O no hydrogen 3.045 N/A HIS 228.A N LEU 223.A O no hydrogen 2.709 N/A HIS 228.A NE2 LYS 378.A O no hydrogen 3.340 N/A THR 229.A OG1 LEU 199.A O no hydrogen 3.063 N/A THR 229.A OG1 GLN 231.A O no hydrogen 3.009 N/A TYR 230.A N LEU 199.A O no hydrogen 2.872 N/A TYR 230.A OH GLU 7.A OE1 no hydrogen 2.523 N/A GLY 233.A N PHE 201.A O no hydrogen 3.262 N/A GLY 234.A N VAL 286.A O no hydrogen 3.124 N/A LEU 235.A N PHE 203.A O no hydrogen 2.837 N/A MET 236.A N ASN 288.A O no hydrogen 2.950 N/A ASP 237.A N ASN 205.A OD1 no hydrogen 2.829 N/A THR 238.A N GLU 290.A O no hydrogen 2.758 N/A THR 238.A OG1 TRP 264.A O no hydrogen 2.815 N/A THR 238.A OG1 GLU 290.A O no hydrogen 3.483 N/A TRP 239.A N ASP 237.A OD1 no hydrogen 2.805 N/A LYS 240.A N ASP 237.A O no hydrogen 3.069 N/A LYS 240.A NZ ASP 237.A O no hydrogen 2.781 N/A LYS 240.A NZ GLU 267.A OE1 no hydrogen 2.958 N/A LYS 240.A NZ GLU 275.A OE1 no hydrogen 2.802 N/A LYS 240.A NZ GLU 275.A OE2 no hydrogen 2.895 N/A TRP 241.A N THR 238.A O no hydrogen 3.300 N/A TRP 241.A NE1 TRP 247.A O no hydrogen 2.870 N/A GLU 243.A N TRP 239.A O no hydrogen 3.069 N/A THR 244.A N LYS 240.A O no hydrogen 3.074 N/A THR 244.A OG1 LYS 240.A O no hydrogen 2.940 N/A THR 244.A OG1 TRP 241.A O no hydrogen 3.513 N/A GLY 245.A N TYR 242.A O no hydrogen 2.969 N/A LYS 246.A N TRP 241.A O no hydrogen 3.019 N/A LYS 246.A NZ THR 244.A OG1 no hydrogen 2.937 N/A TRP 247.A NE1 SER 252.A O no hydrogen 3.085 N/A ALA 251.A N LYS 248.A O no hydrogen 3.083 N/A ASN 254.A ND2 THR 244.A O no hydrogen 2.833 N/A ILE 255.A N GLY 245.A O no hydrogen 2.873 N/A GLY 256.A N ASN 254.A OD1 no hydrogen 2.861 N/A LYS 257.A NZ GLU 243.A OE1 no hydrogen 2.647 N/A SER 258.A OG ILE 255.A O no hydrogen 2.615 N/A GLN 259.A N GLN 263.A OE1 no hydrogen 2.932 N/A GLN 259.A NE2 LYS 500.A O no hydrogen 2.967 N/A GLN 259.A NE2 LEU 502.A O no hydrogen 2.837 N/A ARG 262.A NE GLN 259.A OE1 no hydrogen 3.165 N/A ARG 262.A NE PRO 503.A O no hydrogen 3.387 N/A ARG 262.A NH1 LEU 489.A O no hydrogen 2.967 N/A ARG 262.A NH2 PRO 503.A O no hydrogen 2.555 N/A GLN 263.A N GLN 259.A O no hydrogen 2.930 N/A GLN 263.A NE2 LYS 246.A O no hydrogen 2.815 N/A GLN 263.A NE2 GLY 256.A O no hydrogen 3.197 N/A TRP 264.A N GLY 260.A O no hydrogen 3.059 N/A TRP 264.A NE1 ASP 261.A OD1 no hydrogen 2.819 N/A LEU 265.A N ARG 262.A O no hydrogen 3.285 N/A THR 266.A N GLN 263.A O no hydrogen 3.028 N/A THR 266.A OG1 ARG 262.A O no hydrogen 2.853 N/A GLU 269.A N GLU 269.A OE1 no hydrogen 2.702 N/A SER 270.A N PHE 482.A O no hydrogen 2.912 N/A SER 270.A OG HIS 463.A O no hydrogen 2.560 N/A SER 270.A OG PHE 482.A O no hydrogen 3.409 N/A MET 271.A N PRO 268.A O no hydrogen 3.091 N/A LEU 272.A N GLU 269.A O no hydrogen 3.114 N/A GLU 274.A N SER 270.A O no hydrogen 3.135 N/A GLU 275.A N MET 271.A O no hydrogen 3.005 N/A ALA 276.A N LEU 272.A O no hydrogen 3.003 N/A LEU 277.A N GLY 273.A O no hydrogen 2.966 N/A GLY 278.A N GLU 275.A O no hydrogen 3.028 N/A VAL 279.A N ALA 276.A O no hydrogen 3.010 N/A TYR 280.A N ALA 276.A O no hydrogen 3.136 N/A TYR 280.A OH HIS 320.A O no hydrogen 2.591 N/A LEU 281.A N LEU 277.A O no hydrogen 2.888 N/A ASN 282.A N VAL 279.A O no hydrogen 3.095 N/A GLY 283.A N TYR 280.A O no hydrogen 3.080 N/A GLY 284.A N VAL 279.A O no hydrogen 2.855 N/A VAL 285.A N TRP 232.A O no hydrogen 3.061 N/A VAL 286.A N TRP 232.A O no hydrogen 3.321 N/A TYR 287.A N LEU 14.A O no hydrogen 2.896 N/A ASN 288.A N GLY 234.A O no hydrogen 3.241 N/A ASN 288.A ND2 GLN 57.A OE1 no hydrogen 2.830 N/A PHE 289.A N ASN 288.A OD1 no hydrogen 2.813 N/A GLU 290.A N MET 236.A O no hydrogen 3.238 N/A HIS 291.A N THR 238.A OG1 no hydrogen 3.087 N/A ALA 293.A N HIS 291.A ND1 no hydrogen 3.048 N/A TYR 294.A N HIS 291.A O no hydrogen 3.130 N/A TYR 294.A OH GLU 267.A O no hydrogen 2.605 N/A THR 295.A N HIS 291.A O no hydrogen 2.978 N/A THR 295.A OG1 HIS 291.A O no hydrogen 2.869 N/A TYR 296.A N PRO 292.A O no hydrogen 2.973 N/A TYR 296.A OH MET 16.A O no hydrogen 2.770 N/A TYR 296.A OH ASN 288.A OD1 no hydrogen 3.243 N/A GLY 297.A N PRO 292.A O no hydrogen 3.137 N/A ASN 299.A N GLY 35.A O no hydrogen 2.783 N/A ASN 299.A ND2 GLU 515.A OE2 no hydrogen 2.840 N/A ASN 300.A N ASP 37.A OD1 no hydrogen 2.763 N/A ASN 300.A ND2 THR 38.A OG1 no hydrogen 3.141 N/A LYS 301.A N VAL 298.A O no hydrogen 2.786 N/A SER 303.A N TYR 296.A O no hydrogen 2.982 N/A SER 303.A OG TYR 294.A O no hydrogen 2.640 N/A PHE 306.A N SER 303.A OG no hydrogen 3.117 N/A SER 307.A N SER 303.A O no hydrogen 2.846 N/A SER 307.A OG SER 303.A O no hydrogen 3.435 N/A SER 307.A OG GLU 308.A OE2 no hydrogen 2.620 N/A GLU 308.A N LEU 304.A O no hydrogen 2.841 N/A VAL 309.A N LEU 305.A O no hydrogen 3.073 N/A ILE 310.A N LEU 305.A O no hydrogen 3.233 N/A LYS 311.A N PHE 306.A O no hydrogen 2.789 N/A LYS 311.A NZ GLU 302.A OE1 no hydrogen 2.643 N/A LYS 311.A NZ GLU 302.A OE2 no hydrogen 3.565 N/A PHE 313.A N VAL 309.A O no hydrogen 2.735 N/A PHE 314.A N ILE 310.A O no hydrogen 2.785 N/A ARG 315.A N LYS 311.A O no hydrogen 2.910 N/A ARG 315.A NE ASP 49.A OD2 no hydrogen 2.841 N/A ARG 315.A NH1 GLU 312.A OE2 no hydrogen 3.279 N/A ARG 315.A NH2 ASP 49.A OD1 no hydrogen 2.954 N/A TYR 316.A N GLU 312.A O no hydrogen 3.066 N/A VAL 317.A N PHE 313.A O no hydrogen 3.122 N/A ILE 318.A N PHE 314.A O no hydrogen 3.128 N/A ALA 319.A N ARG 315.A O no hydrogen 2.996 N/A HIS 320.A N TYR 316.A O no hydrogen 2.779 N/A LYS 325.A NZ ASN 227.A OD1 no hydrogen 2.601 N/A LYS 327.A N SER 324.A OG no hydrogen 2.937 N/A LYS 327.A NZ ASP 331.A OD1 no hydrogen 3.280 N/A LYS 327.A NZ ASP 331.A OD2 no hydrogen 3.427 N/A VAL 328.A N SER 324.A O no hydrogen 2.914 N/A LEU 329.A N LYS 325.A O no hydrogen 2.887 N/A GLU 330.A N GLU 326.A O no hydrogen 3.039 N/A ASP 331.A N LYS 327.A O no hydrogen 3.130 N/A THR 332.A N VAL 328.A O no hydrogen 2.972 N/A THR 332.A N LEU 329.A O no hydrogen 3.296 N/A THR 332.A OG1 VAL 328.A O no hydrogen 2.847 N/A LYS 333.A N TYR 415.A OH no hydrogen 3.136 N/A LYS 333.A NZ GLU 330.A O no hydrogen 3.362 N/A VAL 334.A N TYR 415.A OH no hydrogen 3.320 N/A PHE 335.A N GLN 392.A O no hydrogen 2.939 N/A ILE 336.A N PRO 371.A O no hydrogen 2.893 N/A HIS 337.A N LYS 394.A O no hydrogen 2.848 N/A GLY 338.A N ILE 373.A O no hydrogen 2.939 N/A TYR 340.A N TYR 219.A OH no hydrogen 2.839 N/A TYR 340.A OH SER 218.A OG no hydrogen 2.578 N/A SER 341.A N GLU 177.A OE2 no hydrogen 3.105 N/A SER 341.A OG GLU 177.A OE1 no hydrogen 2.512 N/A SER 341.A OG GLU 177.A OE2 no hydrogen 3.343 N/A ASN 342.A N.A ASP 339.A O no hydrogen 3.267 N/A ASN 342.A N.B ASP 339.A O no hydrogen 3.252 N/A LYS 343.A N TYR 340.A O no hydrogen 3.049 N/A ASN 345.A N TYR 340.A O no hydrogen 2.840 N/A LYS 347.A N GLY 344.A O no hydrogen 3.125 N/A PHE 348.A N ASN 345.A O no hydrogen 3.004 N/A PHE 349.A N GLY 346.A O no hydrogen 3.198 N/A VAL 350.A N LYS 347.A O no hydrogen 3.208 N/A ASN 351.A N THR 354.A O no hydrogen 2.789 N/A VAL 352.A N PHE 349.A O no hydrogen 2.850 N/A ASN 353.A N PHE 349.A O no hydrogen 2.898 N/A ASN 353.A ND2 ASN 368.A O no hydrogen 3.169 N/A THR 354.A N PHE 349.A O no hydrogen 3.135 N/A ARG 356.A NE ASP 355.A OD1 no hydrogen 2.992 N/A ARG 356.A NH1 GLU 441.A OE1 no hydrogen 3.503 N/A ARG 356.A NH1 GLU 441.A OE2 no hydrogen 2.818 N/A ARG 356.A NH2 ASP 355.A OD2 no hydrogen 2.867 N/A ARG 356.A NH2 GLU 441.A OE1 no hydrogen 2.839 N/A LEU 361.A N THR 359.A OG1 no hydrogen 2.957 N/A TYR 362.A N TYR 435.A OH no hydrogen 2.819 N/A TYR 362.A OH GLU 217.A OE1 no hydrogen 2.574 N/A MET 363.A N ASN 353.A O no hydrogen 2.822 N/A THR 364.A OG1 TYR 419.A OH no hydrogen 3.258 N/A ARG 366.A N THR 364.A OG1 no hydrogen 3.064 N/A ARG 366.A NE TYR 415.A O no hydrogen 2.769 N/A ARG 366.A NH2 ASN 412.A O no hydrogen 3.418 N/A ARG 366.A NH2 TYR 415.A O no hydrogen 3.087 N/A TYR 367.A OH ASN 412.A OD1 no hydrogen 2.725 N/A ASN 368.A N GLY 365.A O no hydrogen 2.821 N/A ASN 368.A ND2 VAL 369.A O no hydrogen 3.132 N/A ALA 372.A N SER 218.A O no hydrogen 3.083 N/A ILE 373.A N ILE 336.A O no hydrogen 3.118 N/A GLY 375.A N ASP 339.A OD1 no hydrogen 2.909 N/A LEU 377.A N PRO 374.A O no hydrogen 3.119 N/A LYS 381.A NZ ASN 227.A O no hydrogen 3.168 N/A LYS 383.A N THR 379.A O no hydrogen 2.944 N/A GLU 384.A N ASP 380.A O no hydrogen 3.000 N/A SER 385.A N LEU 382.A O no hydrogen 3.009 N/A SER 387.A N SER 385.A OG no hydrogen 3.206 N/A SER 388.A OG LEU 382.A O no hydrogen 2.839 N/A SER 388.A OG SER 385.A O no hydrogen 3.217 N/A ILE 391.A N SER 388.A O no hydrogen 3.193 N/A GLN 392.A N LYS 333.A O no hydrogen 2.940 N/A LYS 394.A N PHE 335.A O no hydrogen 2.999 N/A LYS 394.A NZ GLU 400.A OE2 no hydrogen 3.562 N/A ILE 396.A N HIS 337.A O no hydrogen 2.969 N/A SER 398.A N GLU 395.A O no hydrogen 3.072 N/A SER 398.A OG GLU 395.A O no hydrogen 2.685 N/A GLU 400.A N GLU 400.A OE1 no hydrogen 2.732 N/A PHE 401.A N SER 398.A O no hydrogen 3.113 N/A SER 402.A N PRO 399.A O no hydrogen 3.220 N/A SER 402.A OG PRO 399.A O no hydrogen 2.704 N/A ALA 406.A N SER 403.A OG no hydrogen 3.125 N/A ARG 407.A N SER 403.A O no hydrogen 3.032 N/A ARG 407.A NE PHE 401.A O no hydrogen 2.940 N/A ARG 407.A NH2 PHE 401.A O no hydrogen 3.078 N/A LYS 408.A N THR 404.A O no hydrogen 3.107 N/A LYS 408.A NZ ASN 351.A O no hydrogen 2.926 N/A GLU 409.A N GLN 405.A O no hydrogen 2.892 N/A TYR 410.A N ALA 406.A O no hydrogen 2.812 N/A TYR 410.A OH GLN 392.A OE1 no hydrogen 2.746 N/A LEU 411.A N ARG 407.A O no hydrogen 2.774 N/A ASN 412.A N LYS 408.A O no hydrogen 2.835 N/A LEU 414.A N LEU 411.A O no hydrogen 3.017 N/A TYR 415.A N LEU 411.A O no hydrogen 2.815 N/A TYR 419.A OH THR 364.A OG1 no hydrogen 3.258 N/A TYR 419.A OH ILE 423.A O no hydrogen 2.687 N/A GLU 420.A N LYS 448.A O no hydrogen 3.051 N/A PHE 424.A N TYR 435.A O no hydrogen 2.978 N/A ALA 425.A N TYR 419.A OH no hydrogen 3.295 N/A GLN 426.A N PHE 433.A O no hydrogen 2.868 N/A GLN 426.A NE2 LEU 281.A O no hydrogen 3.506 N/A LEU 428.A N ARG 431.A O no hydrogen 2.917 N/A ASN 430.A N ASP 429.A OD2 no hydrogen 2.820 N/A ARG 431.A N LEU 428.A O no hydrogen 2.759 N/A ARG 431.A NE ASP 429.A OD2 no hydrogen 3.154 N/A ARG 431.A NH1 TYR 280.A OH no hydrogen 2.996 N/A ARG 431.A NH1 TYR 316.A OH no hydrogen 2.897 N/A ARG 431.A NH2 ASP 429.A OD1 no hydrogen 2.993 N/A TRP 432.A N PHE 468.A O no hydrogen 2.784 N/A TRP 432.A NE1 LYS 450.A O no hydrogen 2.899 N/A PHE 433.A N GLN 426.A O no hydrogen 2.907 N/A VAL 434.A N GLY 466.A O no hydrogen 2.926 N/A TYR 435.A N PHE 424.A O no hydrogen 2.918 N/A ASN 436.A N THR 464.A O no hydrogen 3.208 N/A ASN 436.A ND2 VAL 443.A O no hydrogen 2.985 N/A ASN 436.A ND2 PHE 460.A O no hydrogen 2.874 N/A TYR 437.A N GLN 445.A OE1 no hydrogen 2.984 N/A TYR 437.A OH ASP 422.A OD1 no hydrogen 2.358 N/A LYS 438.A N ASN 436.A OD1 no hydrogen 2.960 N/A ASN 440.A N GLU 441.A OE2 no hydrogen 3.042 N/A VAL 443.A N GLU 441.A O no hydrogen 2.846 N/A GLN 445.A N PHE 460.A O no hydrogen 2.818 N/A GLY 447.A N VAL 458.A O no hydrogen 3.165 N/A LYS 448.A N GLU 420.A O no hydrogen 2.760 N/A LYS 448.A NZ GLU 455.A OE1 no hydrogen 2.650 N/A LEU 449.A N MET 456.A O no hydrogen 2.745 N/A PHE 451.A N LEU 454.A O no hydrogen 2.808 N/A LEU 454.A N PHE 451.A O no hydrogen 3.017 N/A GLU 455.A N ARG 535.A O no hydrogen 3.247 N/A MET 456.A N LEU 449.A O no hydrogen 2.772 N/A ASN 457.A N VAL 533.A O no hydrogen 2.741 N/A VAL 458.A N GLY 447.A O no hydrogen 2.954 N/A GLU 459.A N LYS 531.A O no hydrogen 2.870 N/A PHE 460.A N GLN 445.A O no hydrogen 2.834 N/A HIS 463.A NE2 VAL 439.A O no hydrogen 2.796 N/A THR 464.A OG1 GLU 461.A O no hydrogen 3.123 N/A THR 464.A OG1 PRO 462.A O no hydrogen 3.419 N/A TYR 465.A N ASN 480.A O no hydrogen 2.941 N/A GLY 466.A N VAL 434.A O no hydrogen 2.786 N/A ILE 467.A N ASN 478.A O no hydrogen 2.757 N/A PHE 468.A N TRP 432.A O no hydrogen 2.817 N/A GLU 469.A N LYS 476.A O no hydrogen 2.843 N/A ARG 470.A N ASN 430.A O no hydrogen 2.950 N/A ARG 470.A NH1 GLY 474.A O no hydrogen 2.902 N/A ARG 470.A NH2 GLU 585.A OE2 no hydrogen 2.679 N/A ILE 471.A N GLY 474.A O no hydrogen 2.970 N/A GLY 474.A N ILE 471.A O no hydrogen 2.977 N/A LEU 475.A N LEU 581.A O no hydrogen 2.879 N/A LYS 476.A N GLU 469.A O no hydrogen 2.746 N/A VAL 477.A N PHE 579.A O no hydrogen 2.847 N/A ASN 478.A N ILE 467.A O no hydrogen 2.885 N/A LEU 479.A N LEU 577.A O no hydrogen 2.865 N/A ASN 480.A N TYR 465.A O no hydrogen 2.791 N/A ASN 480.A ND2 GLU 308.A O no hydrogen 3.049 N/A ASN 480.A ND2 ASN 576.A OD1.B no hydrogen 3.012 N/A ASN 481.A N GLY 575.A O no hydrogen 3.104 N/A ASN 481.A ND2 SER 573.A O no hydrogen 2.850 N/A PHE 482.A N ASN 480.A OD1 no hydrogen 3.125 N/A ARG 483.A NH1 HIS 463.A ND1 no hydrogen 2.986 N/A THR 484.A N GLU 269.A OE1 no hydrogen 3.083 N/A THR 484.A OG1 GLU 269.A OE2 no hydrogen 2.752 N/A ASN 485.A N GLN 523.A O no hydrogen 2.850 N/A LYS 486.A NZ LEU 265.A O no hydrogen 2.633 N/A LYS 486.A NZ GLU 269.A OE2 no hydrogen 3.414 N/A LYS 486.A NZ TYR 294.A OH no hydrogen 2.758 N/A ASP 487.A N ASN 485.A OD1 no hydrogen 2.883 N/A LEU 489.A N LYS 486.A O no hydrogen 3.071 N/A TRP 490.A N ASP 487.A O no hydrogen 2.802 N/A TRP 490.A NE1 THR 266.A OG1 no hydrogen 3.167 N/A SER 491.A N SER 488.A O no hydrogen 3.303 N/A SER 491.A OG SER 488.A O no hydrogen 2.861 N/A ALA 493.A N TRP 490.A O no hydrogen 3.390 N/A GLN 494.A N GLN 498.A OE1 no hydrogen 2.894 N/A GLN 498.A N ASP 495.A OD1 no hydrogen 2.885 N/A ALA 499.A N ASP 495.A O no hydrogen 2.952 N/A LYS 500.A N ALA 496.A O no hydrogen 2.912 N/A LYS 501.A N GLN 498.A O no hydrogen 3.163 N/A LYS 501.A NZ ASN 497.A OD1 no hydrogen 3.064 N/A LEU 502.A N ALA 499.A O no hydrogen 3.077 N/A THR 506.A OG1 LEU 505.A O no hydrogen 2.519 N/A LYS 507.A NZ ASP 61.A OD2 no hydrogen 2.873 N/A LYS 508.A NZ GLU 24.A OE1 no hydrogen 2.915 N/A GLY 509.A N THR 506.A OG1 no hydrogen 3.079 N/A ALA 510.A N THR 506.A O no hydrogen 2.857 N/A ILE 511.A N LYS 507.A O no hydrogen 3.074 N/A LYS 512.A N LYS 508.A O no hydrogen 2.963 N/A TRP 513.A N GLY 509.A O no hydrogen 2.768 N/A ILE 514.A N ALA 510.A O no hydrogen 2.996 N/A GLU 515.A N ILE 511.A O no hydrogen 3.085 N/A GLU 516.A N LYS 512.A O no hydrogen 2.864 N/A HIS 517.A N TRP 513.A O no hydrogen 2.689 N/A TYR 518.A N ILE 514.A O no hydrogen 2.931 N/A TYR 518.A OH GLU 269.A OE2 no hydrogen 2.518 N/A ILE 519.A N ILE 514.A O no hydrogen 2.813 N/A THR 522.A OG1 TYR 518.A O no hydrogen 2.678 N/A ARG 528.A N SER 573.A O no hydrogen 2.851 N/A ARG 528.A NH1 GLU 461.A OE1 no hydrogen 3.069 N/A ARG 528.A NH1 PRO 462.A O no hydrogen 2.921 N/A ARG 528.A NH2 PRO 462.A O no hydrogen 3.196 N/A ARG 528.A NH2 HIS 463.A O no hydrogen 2.967 N/A ARG 528.A NH2 ASN 481.A O no hydrogen 2.890 N/A THR 530.A N ILE 571.A O no hydrogen 2.804 N/A LYS 531.A N GLU 459.A O no hydrogen 3.225 N/A ILE 532.A N ILE 569.A O no hydrogen 2.952 N/A VAL 533.A N ASN 457.A O no hydrogen 2.766 N/A LEU 534.A N VAL 567.A O no hydrogen 2.936 N/A ARG 535.A N GLU 455.A O no hydrogen 2.852 N/A GLY 536.A N HIS 565.A O no hydrogen 2.886 N/A ILE 537.A N HIS 565.A O no hydrogen 2.867 N/A ASP 538.A N LEU 584.A O no hydrogen 2.952 N/A THR 542.A N HIS 582.A O no hydrogen 2.930 N/A HIS 544.A N GLU 580.A O no hydrogen 2.795 N/A SER 547.A N GLU 578.A O no hydrogen 2.870 N/A THR 549.A N ASN 576.A O.A no hydrogen 2.963 N/A THR 549.A N ASN 576.A O.B no hydrogen 3.045 N/A THR 549.A OG1 GLU 308.A OE1 no hydrogen 2.776 N/A SER 552.A OG THR 549.A O no hydrogen 2.612 N/A ASP 554.A N ASN 572.A O no hydrogen 3.007 N/A SER 557.A N THR 570.A O no hydrogen 2.867 N/A ASN 559.A N THR 568.A O no hydrogen 2.819 N/A ASP 561.A N MET 566.A O no hydrogen 2.866 N/A ASN 564.A ND2 ASP 561.A OD2 no hydrogen 2.686 N/A HIS 565.A N GLN 562.A O no hydrogen 3.083 N/A MET 566.A N ASP 561.A O no hydrogen 3.348 N/A VAL 567.A N LEU 534.A O no hydrogen 2.933 N/A THR 568.A N ASN 559.A O no hydrogen 2.987 N/A ILE 569.A N ILE 532.A O no hydrogen 2.697 N/A THR 570.A N SER 557.A O no hydrogen 2.838 N/A ILE 571.A N THR 530.A O no hydrogen 2.866 N/A SER 573.A N ARG 528.A O no hydrogen 2.988 N/A SER 573.A OG ASN 481.A OD1 no hydrogen 3.521 N/A ASN 574.A N SER 552.A O no hydrogen 2.938 N/A ASN 574.A ND2 ARG 483.A O no hydrogen 3.434 N/A GLY 575.A N ASN 481.A OD1 no hydrogen 2.974 N/A ASN 576.A N.A THR 549.A OG1 no hydrogen 2.930 N/A ASN 576.A N.B THR 549.A OG1 no hydrogen 2.899 N/A ASN 576.A ND2.A GLU 308.A O no hydrogen 2.988 N/A LEU 577.A N LEU 479.A O no hydrogen 2.832 N/A GLU 578.A N SER 547.A O no hydrogen 2.841 N/A PHE 579.A N VAL 477.A O no hydrogen 3.134 N/A GLU 580.A N HIS 544.A O no hydrogen 2.860 N/A LEU 581.A N LEU 475.A O no hydrogen 2.860 N/A HIS 582.A N THR 542.A O no hydrogen 2.709 N/A HIS 582.A NE2 GLU 580.A OE1 no hydrogen 2.842 N/A PHE 583.A N ASN 473.A O no hydrogen 3.034 N/A HIS 586.A N GLY 536.A O no hydrogen 2.913 N/A