Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sdu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N TRP 1.A O no hydrogen 3.534 N/A VAL 6.A N GLY 2.A O no hydrogen 3.134 N/A HIS 7.A N TYR 3.A O no hydrogen 2.986 N/A HIS 7.A NE2 LYS 474.A O no hydrogen 3.093 N/A SER 8.A N LEU 5.A O no hydrogen 3.211 N/A SER 8.A OG LEU 5.A O no hydrogen 2.615 N/A LEU 9.A N VAL 6.A O no hydrogen 3.171 N/A TYR 13.A N SER 11.A OG no hydrogen 3.272 N/A ASP 15.A N PRO 12.A O no hydrogen 3.180 N/A SER 17.A N ASP 15.A OD2 no hydrogen 3.031 N/A SER 17.A OG ASP 15.A OD2 no hydrogen 2.993 N/A TYR 18.A N ASP 15.A O no hydrogen 3.141 N/A ARG 19.A NH1 ASP 461.A OD1 no hydrogen 2.857 N/A ARG 19.A NH2 ASP 461.A OD1 no hydrogen 3.107 N/A GLU 20.A N SER 16.A O no hydrogen 2.949 N/A ARG 21.A N SER 17.A O no hydrogen 2.933 N/A ARG 21.A NH2 GLU 456.A OE2 no hydrogen 2.885 N/A ALA 22.A N TYR 18.A O no hydrogen 2.913 N/A GLU 23.A N ARG 19.A O no hydrogen 2.940 N/A VAL 24.A N GLU 20.A O no hydrogen 3.184 N/A LEU 25.A N ARG 21.A O no hydrogen 3.014 N/A VAL 26.A N ALA 22.A O no hydrogen 2.870 N/A SER 27.A N GLU 23.A O no hydrogen 3.049 N/A SER 27.A OG.A GLU 23.A O no hydrogen 3.557 N/A SER 27.A OG.A VAL 24.A O no hydrogen 2.824 N/A SER 27.A OG.B GLU 23.A O no hydrogen 3.253 N/A GLU 28.A N VAL 24.A O no hydrogen 2.885 N/A ILE 29.A N LEU 25.A O no hydrogen 2.898 N/A LYS 30.A N VAL 26.A O no hydrogen 2.982 N/A LYS 30.A NZ.B HIS 282.A O no hydrogen 3.305 N/A LYS 30.A NZ.B GLU 286.A OE1 no hydrogen 2.789 N/A LYS 30.A NZ.B GLU 286.A OE2 no hydrogen 2.715 N/A ALA 31.A N SER 27.A O no hydrogen 3.042 N/A MET 32.A N GLU 28.A O no hydrogen 2.885 N/A LEU 33.A N ILE 29.A O no hydrogen 2.887 N/A ASN 34.A N ALA 31.A O no hydrogen 3.332 N/A ILE 37.A N LEU 33.A O no hydrogen 3.157 N/A ILE 37.A N ASN 34.A O no hydrogen 3.214 N/A THR 38.A N ASN 34.A O no hydrogen 2.720 N/A THR 38.A OG1 ASN 34.A OD1 no hydrogen 3.330 N/A THR 38.A OG1 GLU 289.A OE1 no hydrogen 3.457 N/A THR 38.A OG1 GLU 289.A OE2 no hydrogen 2.896 N/A GLY 39.A N ASN 34.A O no hydrogen 3.055 N/A SER 43.A N GLU 266.A OE1 no hydrogen 2.712 N/A MET 44.A N GLU 266.A OE2 no hydrogen 2.924 N/A THR 46.A N LYS 445.A O no hydrogen 3.369 N/A SER 48.A N VAL 256.A O no hydrogen 2.778 N/A SER 48.A OG ASP 51.A OD2 no hydrogen 2.562 N/A TYR 50.A OH GLU 201.A OE2 no hydrogen 2.632 N/A ASP 51.A N SER 48.A OG no hydrogen 2.991 N/A THR 52.A N SER 48.A O no hydrogen 2.841 N/A THR 52.A OG1 SER 48.A O no hydrogen 2.740 N/A THR 52.A OG1 VAL 256.A O no hydrogen 3.276 N/A ALA 53.A N ALA 49.A O no hydrogen 3.052 N/A TRP 54.A N TYR 50.A O no hydrogen 3.347 N/A VAL 55.A N ASP 51.A O no hydrogen 3.000 N/A ALA 56.A N THR 52.A O no hydrogen 2.874 N/A ARG 57.A N TRP 54.A O no hydrogen 3.118 N/A ARG 57.A NH1 GLU 155.A OE1 no hydrogen 3.458 N/A ARG 57.A NH1 GLU 155.A OE2 no hydrogen 2.924 N/A ARG 57.A NH2 GLU 155.A OE1 no hydrogen 2.928 N/A VAL 58.A N VAL 55.A O no hydrogen 3.110 N/A ALA 60.A N ARG 66.A O no hydrogen 2.732 N/A ILE 61.A N GLN 68.A OE1 no hydrogen 2.954 N/A GLY 63.A N ALA 60.A O no hydrogen 3.043 N/A SER 64.A N ASP 62.A OD1 no hydrogen 2.919 N/A SER 64.A OG ASP 62.A OD1 no hydrogen 2.706 N/A ARG 66.A N SER 64.A O no hydrogen 2.930 N/A GLN 68.A N VAL 58.A O no hydrogen 2.803 N/A GLN 71.A N GLN 71.A OE1 no hydrogen 2.873 N/A GLN 71.A NE2 GLY 253.A O no hydrogen 3.454 N/A THR 72.A N PHE 69.A O no hydrogen 3.022 N/A THR 72.A OG1 PHE 69.A O no hydrogen 2.664 N/A ASP 74.A N PRO 70.A O no hydrogen 3.225 N/A TRP 75.A N GLN 71.A O no hydrogen 2.951 N/A ILE 76.A N THR 72.A O no hydrogen 3.037 N/A LEU 77.A N VAL 73.A O no hydrogen 2.960 N/A LYS 78.A N ASP 74.A O no hydrogen 3.084 N/A LYS 78.A N TRP 75.A O no hydrogen 3.110 N/A LYS 78.A NZ ASP 74.A OD1.B no hydrogen 2.943 N/A ASN 79.A N ILE 76.A O no hydrogen 3.354 N/A ASN 79.A ND2 TRP 75.A O no hydrogen 2.852 N/A GLN 80.A NE2 GLY 84.A O no hydrogen 2.790 N/A GLN 80.A NE2 GLN 117.A O no hydrogen 2.984 N/A LEU 81.A N SER 85.A O no hydrogen 2.702 N/A GLY 84.A N LEU 81.A O no hydrogen 3.006 N/A SER 85.A N ASP 83.A OD1 no hydrogen 2.931 N/A SER 85.A OG ASP 83.A OD1 no hydrogen 2.694 N/A TRP 86.A N THR 101.A OG1 no hydrogen 3.136 N/A TRP 86.A NE1 ILE 76.A O no hydrogen 2.821 N/A SER 90.A OG HIS 91.A ND1 no hydrogen 2.695 N/A HIS 91.A N ILE 88.A O no hydrogen 3.211 N/A HIS 91.A ND1 SER 90.A OG no hydrogen 2.695 N/A SER 95.A OG SER 140.A O no hydrogen 2.915 N/A ARG 97.A N LEU 93.A O no hydrogen 2.952 N/A ARG 97.A NH1 SER 85.A OG no hydrogen 2.807 N/A ARG 97.A NH2 ILE 88.A O no hydrogen 3.339 N/A ARG 97.A NH2 HIS 91.A O no hydrogen 3.138 N/A LEU 98.A N LEU 94.A O no hydrogen 2.823 N/A LEU 99.A N SER 95.A O no hydrogen 3.022 N/A ALA 100.A N ASP 96.A O no hydrogen 2.981 N/A THR 101.A N ARG 97.A O no hydrogen 2.922 N/A THR 101.A OG1 ARG 97.A O no hydrogen 2.590 N/A LEU 102.A N LEU 98.A O no hydrogen 2.972 N/A SER 103.A N LEU 99.A O no hydrogen 2.955 N/A SER 103.A OG TYR 50.A O no hydrogen 3.035 N/A CYS 104.A N ALA 100.A O no hydrogen 2.913 N/A CYS 104.A SG ALA 49.A O no hydrogen 3.589 N/A CYS 104.A SG ALA 100.A O no hydrogen 3.448 N/A VAL 105.A N THR 101.A O no hydrogen 2.856 N/A LEU 106.A N LEU 102.A O no hydrogen 3.090 N/A VAL 107.A N SER 103.A O no hydrogen 3.356 N/A LEU 108.A N CYS 104.A O no hydrogen 3.086 N/A LEU 109.A N VAL 105.A O no hydrogen 3.108 N/A LYS 110.A N LEU 106.A O no hydrogen 2.941 N/A LYS 110.A NZ ARG 57.A O no hydrogen 2.821 N/A TRP 111.A N VAL 107.A O no hydrogen 3.192 N/A TRP 111.A NE1 ALA 56.A O no hydrogen 2.796 N/A ASN 112.A N LEU 109.A O no hydrogen 3.016 N/A VAL 113.A N LEU 108.A O no hydrogen 3.057 N/A GLN 117.A N GLN 117.A OE1 no hydrogen 2.712 N/A GLN 117.A NE2 LEU 77.A O no hydrogen 3.148 N/A VAL 118.A N GLY 114.A O no hydrogen 2.949 N/A GLU 119.A N ASP 115.A O no hydrogen 3.059 N/A GLN 120.A N LEU 116.A O no hydrogen 3.019 N/A GLY 121.A N GLN 117.A O no hydrogen 2.827 N/A ILE 122.A N VAL 118.A O no hydrogen 2.877 N/A GLU 123.A N GLU 119.A O no hydrogen 3.137 N/A PHE 124.A N GLN 120.A O no hydrogen 3.104 N/A ILE 125.A N GLY 121.A O no hydrogen 3.012 N/A LYS 126.A N ILE 122.A O no hydrogen 2.894 N/A LYS 126.A NZ GLU 130.A OE2 no hydrogen 2.618 N/A SER 127.A N GLU 123.A O no hydrogen 2.913 N/A SER 127.A OG.B GLU 123.A O no hydrogen 3.016 N/A SER 127.A OG.B PHE 124.A O no hydrogen 3.363 N/A ASN 128.A N PHE 124.A O no hydrogen 2.992 N/A ASN 128.A ND2 PHE 124.A O no hydrogen 2.923 N/A LEU 129.A N ILE 125.A O no hydrogen 3.005 N/A GLU 130.A N LYS 126.A O no hydrogen 3.133 N/A LEU 131.A N ASN 128.A O no hydrogen 3.222 N/A VAL 132.A N LEU 129.A O no hydrogen 3.413 N/A LYS 133.A N ASP 137.A OD2 no hydrogen 3.055 N/A ASP 134.A N ASP 137.A OD2 no hydrogen 3.335 N/A THR 136.A OG1 ASP 134.A OD2 no hydrogen 3.035 N/A ASP 137.A N ASP 134.A O no hydrogen 3.005 N/A GLN 138.A N GLU 135.A O no hydrogen 3.021 N/A GLN 138.A NE2 TYR 169.A OH no hydrogen 2.634 N/A SER 140.A N ASP 139.A OD1 no hydrogen 2.756 N/A SER 140.A OG SER 396.A OG no hydrogen 2.700 N/A SER 140.A OG ASN 399.A OD1 no hydrogen 3.423 N/A VAL 142.A N SER 95.A OG no hydrogen 3.112 N/A THR 143.A N ALA 440.A O no hydrogen 2.835 N/A PHE 145.A N VAL 142.A O no hydrogen 3.103 N/A ILE 147.A N ASP 144.A O no hydrogen 3.086 N/A ILE 148.A N ASP 144.A O no hydrogen 2.886 N/A PHE 149.A N PHE 145.A O no hydrogen 2.842 N/A LEU 152.A N ILE 148.A O no hydrogen 2.939 N/A LEU 153.A N PHE 149.A O no hydrogen 2.782 N/A ARG 154.A N PRO 150.A O no hydrogen 2.946 N/A ARG 154.A NH1 GLN 174.A OE1 no hydrogen 3.209 N/A ARG 154.A NH2 GLN 174.A OE1 no hydrogen 2.606 N/A GLU 155.A N SER 151.A O no hydrogen 3.181 N/A ALA 156.A N LEU 152.A O no hydrogen 3.156 N/A GLN 157.A N LEU 153.A O no hydrogen 2.966 N/A SER 158.A N ARG 154.A O no hydrogen 3.055 N/A SER 158.A OG GLU 155.A O no hydrogen 2.674 N/A LEU 159.A N ALA 156.A O no hydrogen 3.003 N/A ARG 160.A N GLN 157.A O no hydrogen 2.835 N/A LEU 161.A N ALA 156.A O no hydrogen 3.258 N/A LEU 163.A N LEU 161.A O no hydrogen 2.792 N/A TYR 165.A N LEU 163.A O no hydrogen 2.901 N/A TYR 165.A OH LEU 161.A O no hydrogen 2.848 N/A LEU 167.A N PRO 164.A O no hydrogen 3.310 N/A HIS 171.A N LEU 167.A O no hydrogen 3.181 N/A HIS 171.A NE2 ASP 166.A OD2 no hydrogen 2.736 N/A LEU 172.A N PRO 168.A O no hydrogen 2.854 N/A LEU 173.A N TYR 169.A O no hydrogen 3.035 N/A GLN 174.A N ILE 170.A O no hydrogen 3.181 N/A GLN 174.A NE2 GLN 178.A OE1 no hydrogen 3.033 N/A THR 175.A N HIS 171.A O no hydrogen 2.994 N/A THR 175.A OG1 HIS 171.A O no hydrogen 3.262 N/A LYS 176.A N LEU 172.A O no hydrogen 2.867 N/A ARG 177.A N LEU 173.A O no hydrogen 2.820 N/A ARG 177.A NH1 ILE 147.A O no hydrogen 2.946 N/A ARG 177.A NH1 GLY 202.A O no hydrogen 2.870 N/A GLN 178.A N GLN 174.A O no hydrogen 2.980 N/A GLU 179.A N THR 175.A O no hydrogen 3.027 N/A ARG 180.A N LYS 176.A O no hydrogen 2.971 N/A ARG 180.A NH1 ASP 144.A OD1 no hydrogen 2.630 N/A ARG 180.A NH2 ASP 144.A OD1 no hydrogen 3.526 N/A LEU 181.A N ARG 177.A O no hydrogen 2.916 N/A ALA 182.A N GLN 178.A O no hydrogen 3.015 N/A LEU 184.A N LEU 181.A O no hydrogen 3.257 N/A SER 185.A OG GLU 188.A OE1 no hydrogen 2.710 N/A ARG 186.A NH2 LEU 181.A O no hydrogen 3.248 N/A ILE 189.A N ARG 186.A O no hydrogen 3.021 N/A TYR 190.A N GLU 187.A O no hydrogen 3.354 N/A ALA 191.A N GLU 188.A O no hydrogen 3.189 N/A VAL 192.A N GLU 188.A O no hydrogen 2.966 N/A LEU 197.A N SER 194.A O no hydrogen 3.095 N/A TYR 198.A N PRO 195.A O no hydrogen 3.113 N/A TYR 198.A OH CYS 258.A O no hydrogen 2.770 N/A SER 199.A N LEU 196.A O no hydrogen 2.986 N/A SER 199.A OG ASP 144.A OD2 no hydrogen 2.595 N/A LEU 200.A N SER 228.A OG no hydrogen 3.056 N/A GLU 201.A N GLU 201.A OE1 no hydrogen 2.807 N/A GLY 202.A N SER 199.A O no hydrogen 2.939 N/A ILE 203.A N LEU 200.A O no hydrogen 3.018 N/A GLN 204.A NE2 GLU 201.A O no hydrogen 3.027 N/A ILE 206.A N ILE 203.A O no hydrogen 3.027 N/A VAL 207.A N ILE 203.A O no hydrogen 3.362 N/A GLU 208.A N TYR 190.A OH no hydrogen 2.775 N/A GLU 210.A N GLU 208.A OE2 no hydrogen 3.011 N/A ARG 211.A N GLU 208.A O no hydrogen 2.976 N/A ARG 211.A NH1 GLU 187.A OE1 no hydrogen 3.093 N/A ARG 211.A NH2 GLU 187.A OE2 no hydrogen 2.545 N/A VAL 215.A N ILE 212.A O no hydrogen 3.235 N/A GLN 216.A N MET 213.A O no hydrogen 3.159 N/A GLN 216.A NE2 GLY 220.A O no hydrogen 2.890 N/A GLN 216.A NE2 ASP 238.A OD2 no hydrogen 2.925 N/A SER 217.A N SER 221.A O no hydrogen 2.889 N/A SER 217.A OG SER 221.A O no hydrogen 3.363 N/A GLY 220.A N SER 217.A O no hydrogen 2.860 N/A SER 221.A N ASP 219.A OD1 no hydrogen 2.966 N/A SER 221.A OG ASP 219.A OD1 no hydrogen 2.907 N/A PHE 222.A N THR 229.A OG1 no hydrogen 2.915 N/A SER 224.A N SER 221.A OG no hydrogen 3.055 N/A SER 224.A OG LEU 223.A O no hydrogen 2.619 N/A SER 225.A N PHE 222.A O no hydrogen 3.082 N/A SER 225.A OG TYR 198.A O no hydrogen 3.241 N/A ALA 227.A N ASP 51.A OD1 no hydrogen 3.000 N/A SER 228.A N SER 225.A OG no hydrogen 2.986 N/A SER 228.A OG LEU 197.A O no hydrogen 2.727 N/A THR 229.A N SER 225.A O no hydrogen 2.990 N/A THR 229.A OG1 SER 225.A O no hydrogen 2.656 N/A ALA 230.A N PRO 226.A O no hydrogen 2.824 N/A CYS 231.A N ALA 227.A O no hydrogen 3.053 N/A VAL 232.A N SER 228.A O no hydrogen 3.088 N/A PHE 233.A N THR 229.A O no hydrogen 2.843 N/A MET 234.A N ALA 230.A O no hydrogen 2.957 N/A HIS 235.A N CYS 231.A O no hydrogen 3.250 N/A HIS 235.A N VAL 232.A O no hydrogen 3.149 N/A HIS 235.A NE2 GLN 204.A OE1 no hydrogen 2.929 N/A THR 236.A N VAL 232.A O no hydrogen 2.972 N/A THR 236.A N PHE 233.A O no hydrogen 3.147 N/A THR 236.A OG1 VAL 232.A O no hydrogen 2.679 N/A GLY 237.A N PHE 233.A O no hydrogen 2.761 N/A ASP 238.A N THR 236.A OG1 no hydrogen 3.152 N/A LYS 240.A NZ GLN 218.A O no hydrogen 2.872 N/A CYS 241.A N ASP 238.A OD2 no hydrogen 2.944 N/A CYS 241.A SG GLY 220.A O no hydrogen 3.797 N/A CYS 241.A SG ASP 238.A OD2 no hydrogen 3.652 N/A LEU 242.A N ASP 238.A O no hydrogen 3.279 N/A GLU 243.A N ALA 239.A O no hydrogen 2.984 N/A PHE 244.A N LYS 240.A O no hydrogen 2.999 N/A LEU 245.A N CYS 241.A O no hydrogen 3.103 N/A ASN 246.A N LEU 242.A O no hydrogen 2.860 N/A SER 247.A N GLU 243.A O no hydrogen 2.912 N/A SER 247.A OG PHE 244.A O no hydrogen 2.801 N/A VAL 248.A N PHE 244.A O no hydrogen 3.018 N/A MET 249.A N LEU 245.A O no hydrogen 3.028 N/A ILE 250.A N ASN 246.A O no hydrogen 2.846 N/A LYS 251.A N SER 247.A O no hydrogen 3.101 N/A LYS 251.A NZ GLU 42.A O no hydrogen 2.969 N/A PHE 252.A N VAL 248.A O no hydrogen 2.961 N/A GLY 253.A N MET 249.A O no hydrogen 2.694 N/A VAL 256.A N THR 52.A OG1 no hydrogen 3.004 N/A CYS 258.A SG TYR 198.A OH no hydrogen 3.815 N/A TYR 260.A N SER 224.A O no hydrogen 2.994 N/A VAL 262.A N SER 43.A OG no hydrogen 2.894 N/A LEU 264.A N TRP 305.A O no hydrogen 3.050 N/A LEU 265.A N TRP 305.A O no hydrogen 3.002 N/A GLU 266.A N VAL 262.A O no hydrogen 2.915 N/A ARG 267.A N ASP 263.A O no hydrogen 3.368 N/A ARG 267.A NH1 ASP 263.A O no hydrogen 3.480 N/A ARG 267.A NH2 GLU 42.A OE1 no hydrogen 3.269 N/A LEU 268.A N LEU 264.A O no hydrogen 3.107 N/A LEU 269.A N LEU 265.A O no hydrogen 2.811 N/A ILE 270.A N GLU 266.A O no hydrogen 2.883 N/A VAL 271.A N ARG 267.A O no hydrogen 3.113 N/A ASP 272.A N LEU 268.A O no hydrogen 2.854 N/A ASN 273.A N LEU 269.A O no hydrogen 3.019 N/A ASN 273.A ND2 LEU 269.A O no hydrogen 2.834 N/A ILE 274.A N ILE 270.A O no hydrogen 3.061 N/A VAL 275.A N VAL 271.A O no hydrogen 2.903 N/A ARG 276.A N ASP 272.A O no hydrogen 2.884 N/A LEU 277.A N ASN 273.A O no hydrogen 2.965 N/A GLY 278.A N VAL 275.A O no hydrogen 2.943 N/A ILE 279.A N ILE 274.A O no hydrogen 3.159 N/A ARG 281.A NH1 ASP 461.A OD1 no hydrogen 3.564 N/A ARG 281.A NH1 ASP 461.A OD2 no hydrogen 2.727 N/A ARG 281.A NH2 ASP 461.A OD1 no hydrogen 2.894 N/A HIS 282.A N ILE 279.A O no hydrogen 3.257 N/A HIS 282.A NE2 ASP 461.A OD1 no hydrogen 3.127 N/A HIS 282.A NE2 ASP 461.A OD2 no hydrogen 3.262 N/A PHE 283.A N TYR 280.A O no hydrogen 3.011 N/A ILE 287.A N PHE 283.A O no hydrogen 2.906 N/A LYS 288.A N GLU 284.A O no hydrogen 3.047 N/A LYS 288.A NZ ASP 292.A OD2 no hydrogen 2.668 N/A GLU 289.A N LYS 285.A O no hydrogen 3.017 N/A ALA 290.A N GLU 286.A O no hydrogen 2.944 N/A LEU 291.A N ILE 287.A O no hydrogen 2.871 N/A ASP 292.A N LYS 288.A O no hydrogen 2.749 N/A TYR 293.A N GLU 289.A O no hydrogen 3.303 N/A TYR 293.A OH ASP 263.A OD2 no hydrogen 2.679 N/A VAL 294.A N ALA 290.A O no hydrogen 3.108 N/A TYR 295.A N LEU 291.A O no hydrogen 2.783 N/A TYR 295.A OH ASN 330.A O no hydrogen 2.942 N/A ARG 296.A N ASP 292.A O no hydrogen 3.002 N/A HIS 297.A N VAL 294.A O no hydrogen 3.007 N/A HIS 297.A ND1 TYR 293.A O no hydrogen 3.120 N/A TRP 298.A N TYR 295.A O no hydrogen 3.166 N/A ASN 299.A ND2 HIS 297.A O no hydrogen 3.231 N/A ASN 299.A ND2 GLY 302.A O no hydrogen 3.013 N/A ARG 301.A N ASN 299.A OD1 no hydrogen 2.792 N/A GLY 302.A N ASN 299.A O no hydrogen 3.029 N/A ILE 303.A N THR 317.A OG1 no hydrogen 2.911 N/A TRP 305.A NE1 SER 224.A OG no hydrogen 2.898 N/A ARG 307.A N ASP 263.A OD1 no hydrogen 2.931 N/A ARG 307.A NH1 ASP 263.A OD2 no hydrogen 3.168 N/A ASN 309.A N GLY 306.A O no hydrogen 3.131 N/A ASP 313.A N ILE 303.A O no hydrogen 2.817 N/A THR 316.A N ASP 313.A OD2 no hydrogen 2.921 N/A THR 316.A OG1 ASP 313.A OD2 no hydrogen 2.656 N/A THR 317.A N ASP 313.A O no hydrogen 2.850 N/A THR 317.A OG1 ILE 303.A O no hydrogen 2.854 N/A THR 317.A OG1 ASP 313.A O no hydrogen 2.980 N/A ALA 318.A N LEU 314.A O no hydrogen 2.791 N/A LEU 319.A N GLU 315.A O no hydrogen 3.123 N/A GLY 320.A N THR 316.A O no hydrogen 2.832 N/A PHE 321.A N THR 317.A O no hydrogen 2.822 N/A ARG 322.A N ALA 318.A O no hydrogen 3.119 N/A ARG 322.A NH2 ASP 272.A OD1 no hydrogen 2.526 N/A LEU 323.A N LEU 319.A O no hydrogen 3.034 N/A LEU 324.A N GLY 320.A O no hydrogen 2.898 N/A ARG 325.A N PHE 321.A O no hydrogen 3.001 N/A ARG 325.A NH1 LEU 366.A O no hydrogen 2.882 N/A ARG 325.A NH1 GLU 371.A OE1 no hydrogen 2.755 N/A ARG 325.A NH1 GLU 371.A OE2 no hydrogen 3.444 N/A ARG 325.A NH2 VAL 331.A O no hydrogen 3.108 N/A ARG 325.A NH2 GLU 371.A OE2 no hydrogen 2.719 N/A LEU 326.A N ARG 322.A O no hydrogen 2.919 N/A HIS 327.A N LEU 323.A O no hydrogen 3.009 N/A HIS 327.A N LEU 324.A O no hydrogen 3.148 N/A HIS 327.A ND1 LEU 323.A O no hydrogen 2.757 N/A ARG 328.A N ARG 325.A O no hydrogen 2.976 N/A ARG 328.A NE LEU 729.A O no hydrogen 3.566 N/A ARG 328.A NH2 LYS 730.A O no hydrogen 2.901 N/A ARG 328.A NH2 ASP 732.A OD1 no hydrogen 3.129 N/A TYR 329.A N LEU 324.A O no hydrogen 2.877 N/A TYR 329.A OH ASP 292.A OD1 no hydrogen 2.718 N/A ALA 334.A N SER 332.A OG no hydrogen 3.175 N/A ILE 335.A N SER 332.A O no hydrogen 3.237 N/A PHE 336.A N PRO 333.A O no hydrogen 3.060 N/A ASP 337.A N ALA 334.A O no hydrogen 3.028 N/A ASN 338.A N ILE 335.A O no hydrogen 3.176 N/A ASN 338.A ND2 GLU 300.A O no hydrogen 2.761 N/A ASN 338.A ND2 ILE 335.A O no hydrogen 2.721 N/A PHE 339.A N PHE 336.A O no hydrogen 3.006 N/A LYS 340.A N ASP 337.A O no hydrogen 3.207 N/A LYS 340.A NZ GLU 376.A OE1 no hydrogen 3.025 N/A SER 346.A OG ILE 344.A O no hydrogen 3.120 N/A GLN 349.A NE2 LEU 141.A O no hydrogen 2.919 N/A LYS 352.A N GLN 349.A OE1 no hydrogen 2.786 N/A LYS 352.A NZ ASP 313.A OD1 no hydrogen 3.032 N/A LYS 352.A NZ ASP 313.A OD2 no hydrogen 2.883 N/A LYS 352.A NZ GLU 315.A OE1 no hydrogen 2.850 N/A ASP 353.A N GLN 349.A O no hydrogen 3.038 N/A VAL 354.A N PHE 350.A O no hydrogen 2.850 N/A ALA 355.A N ASN 351.A O no hydrogen 2.822 N/A SER 356.A N LYS 352.A O no hydrogen 2.882 N/A SER 356.A OG LYS 352.A O no hydrogen 2.977 N/A MET 357.A N ASP 353.A O no hydrogen 3.123 N/A LEU 358.A N VAL 354.A O no hydrogen 2.871 N/A ASN 359.A N ALA 355.A O no hydrogen 2.965 N/A ASN 359.A ND2 GLU 315.A O no hydrogen 3.079 N/A LEU 360.A N SER 356.A O no hydrogen 2.879 N/A TYR 361.A N MET 357.A O no hydrogen 2.820 N/A TYR 361.A OH ALA 411.A O no hydrogen 3.050 N/A ARG 362.A N LEU 358.A O no hydrogen 3.006 N/A ALA 363.A N ASN 359.A O no hydrogen 2.888 N/A SER 364.A N LEU 360.A O no hydrogen 2.871 N/A SER 364.A OG TYR 361.A O no hydrogen 2.670 N/A GLN 365.A N ARG 362.A O no hydrogen 3.211 N/A GLN 365.A NE2 TYR 361.A O no hydrogen 3.587 N/A LEU 366.A N ALA 363.A O no hydrogen 3.092 N/A PHE 368.A N GLU 371.A OE1 no hydrogen 2.835 N/A GLU 371.A N PHE 368.A O no hydrogen 3.187 N/A ASN 372.A N GLY 370.A O no hydrogen 2.925 N/A LEU 374.A N GLU 371.A O no hydrogen 3.081 N/A GLU 376.A N ASN 372.A O no hydrogen 3.027 N/A ALA 377.A N ILE 373.A O no hydrogen 2.844 N/A LYS 378.A N LEU 374.A O no hydrogen 2.831 N/A SER 379.A N ASP 375.A O no hydrogen 3.133 N/A PHE 380.A N GLU 376.A O no hydrogen 2.916 N/A ALA 381.A N ALA 377.A O no hydrogen 2.889 N/A THR 382.A N LYS 378.A O no hydrogen 2.953 N/A THR 382.A OG1 LYS 378.A O no hydrogen 2.839 N/A LYS 383.A N SER 379.A O no hydrogen 3.086 N/A TYR 384.A N PHE 380.A O no hydrogen 2.919 N/A LEU 385.A N ALA 381.A O no hydrogen 2.821 N/A ARG 386.A N THR 382.A O no hydrogen 2.948 N/A GLU 387.A N LYS 383.A O no hydrogen 3.011 N/A ALA 388.A N TYR 384.A O no hydrogen 2.859 N/A LEU 389.A N LEU 385.A O no hydrogen 3.116 N/A GLU 390.A N GLU 387.A O no hydrogen 2.963 N/A LYS 391.A N ALA 388.A O no hydrogen 3.026 N/A LYS 391.A NZ GLU 387.A OE2 no hydrogen 2.943 N/A GLU 393.A N GLU 393.A OE1 no hydrogen 2.755 N/A THR 394.A N LYS 391.A O no hydrogen 3.103 N/A THR 394.A OG1 ALA 388.A O no hydrogen 2.493 N/A SER 395.A N SER 392.A O no hydrogen 2.894 N/A SER 396.A N GLU 393.A O no hydrogen 3.094 N/A SER 396.A OG ASP 139.A OD1 no hydrogen 3.438 N/A SER 396.A OG SER 140.A OG no hydrogen 2.700 N/A SER 396.A OG GLU 393.A O no hydrogen 3.340 N/A TRP 398.A N ASP 139.A OD1 no hydrogen 2.886 N/A ASN 399.A N SER 396.A OG no hydrogen 3.123 N/A ASN 399.A ND2 ASN 351.A OD1 no hydrogen 2.815 N/A ASN 400.A N SER 396.A O no hydrogen 2.897 N/A LYS 401.A N ALA 397.A O no hydrogen 3.057 N/A GLN 402.A N ASN 399.A O no hydrogen 3.092 N/A GLN 402.A NE2 ALA 437.A O no hydrogen 2.889 N/A ASN 403.A N ASN 400.A O no hydrogen 3.126 N/A LEU 404.A N ASN 399.A O no hydrogen 3.047 N/A SER 405.A OG GLN 406.A OE1 no hydrogen 2.948 N/A GLN 406.A N GLN 406.A OE1 no hydrogen 2.825 N/A GLU 407.A N ASN 403.A O no hydrogen 2.981 N/A ILE 408.A N LEU 404.A O no hydrogen 2.885 N/A LYS 409.A N SER 405.A O no hydrogen 2.927 N/A TYR 410.A N GLN 406.A O no hydrogen 2.858 N/A TYR 410.A OH GLU 424.A OE1 no hydrogen 2.650 N/A TYR 410.A OH GLU 424.A OE2 no hydrogen 3.002 N/A ALA 411.A N GLU 407.A O no hydrogen 3.004 N/A LEU 412.A N ILE 408.A O no hydrogen 3.040 N/A LYS 413.A N LYS 409.A O no hydrogen 3.118 N/A THR 414.A N ALA 411.A O no hydrogen 3.222 N/A THR 414.A OG1 TYR 410.A O no hydrogen 2.662 N/A TRP 416.A N GLN 365.A OE1 no hydrogen 2.791 N/A HIS 417.A NE2 THR 725.A OG1 no hydrogen 2.745 N/A ALA 418.A N SER 415.A OG no hydrogen 3.080 N/A SER 419.A OG SER 415.A O no hydrogen 2.690 N/A SER 419.A OG TRP 416.A O no hydrogen 3.501 N/A ARG 422.A N ALA 504.A O no hydrogen 3.024 N/A ARG 422.A NH1 GLY 278.A O no hydrogen 3.224 N/A GLU 424.A N VAL 420.A O no hydrogen 2.910 N/A ALA 425.A N PRO 421.A O no hydrogen 3.128 N/A LYS 426.A N ARG 422.A O no hydrogen 2.990 N/A LYS 426.A NZ GLU 772.A O no hydrogen 2.861 N/A LYS 426.A NZ GLU 776.A O no hydrogen 2.576 N/A ARG 427.A N VAL 423.A O no hydrogen 2.839 N/A ARG 427.A NE GLU 772.A OE2 no hydrogen 2.857 N/A ARG 427.A NH1 TYR 410.A OH no hydrogen 3.049 N/A ARG 427.A NH2 GLU 772.A OE1 no hydrogen 2.967 N/A TYR 428.A N GLU 424.A O no hydrogen 2.958 N/A TYR 428.A OH ASN 273.A OD1 no hydrogen 2.605 N/A CYS 429.A N ALA 425.A O no hydrogen 2.986 N/A CYS 429.A SG LEU 277.A O no hydrogen 3.867 N/A CYS 429.A SG ALA 425.A O no hydrogen 3.455 N/A GLN 430.A N ARG 427.A O no hydrogen 3.023 N/A VAL 431.A N TYR 428.A O no hydrogen 2.958 N/A TYR 432.A N TYR 428.A O no hydrogen 2.802 N/A TYR 432.A OH VAL 449.A O no hydrogen 2.675 N/A TYR 432.A OH ASN 451.A O no hydrogen 3.382 N/A ARG 433.A NH1 LYS 401.A O no hydrogen 2.799 N/A ARG 433.A NH2 LYS 401.A O no hydrogen 2.891 N/A TYR 436.A N ARG 433.A O no hydrogen 3.223 N/A ARG 438.A N TYR 444.A O no hydrogen 2.748 N/A ARG 438.A NH2 ASN 450.A OD1 no hydrogen 2.920 N/A ALA 440.A N CYS 442.A O no hydrogen 2.986 N/A LYS 441.A N TYR 198.A OH no hydrogen 3.252 N/A LYS 441.A NZ TYR 198.A O no hydrogen 2.847 N/A LYS 441.A NZ GLU 201.A OE2 no hydrogen 2.832 N/A CYS 442.A SG VAL 443.A O no hydrogen 3.426 N/A VAL 443.A N ASP 96.A OD1 no hydrogen 2.932 N/A TYR 444.A N ARG 438.A O no hydrogen 2.829 N/A LYS 445.A N THR 46.A OG1 no hydrogen 2.967 N/A LYS 445.A NZ SER 90.A OG no hydrogen 2.744 N/A LYS 445.A NZ ASP 435.A OD1 no hydrogen 2.619 N/A LYS 445.A NZ ASP 435.A OD2 no hydrogen 3.209 N/A TYR 448.A OH GLY 41.A O no hydrogen 3.217 N/A VAL 449.A N LEU 446.A O no hydrogen 2.892 N/A ASN 450.A N LEU 446.A O no hydrogen 2.944 N/A ASN 450.A ND2 ARG 433.A O no hydrogen 3.033 N/A ASN 451.A N TYR 432.A OH no hydrogen 2.950 N/A ASN 451.A ND2 PRO 447.A O no hydrogen 2.984 N/A LYS 453.A NZ GLU 28.A OE1 no hydrogen 2.838 N/A PHE 454.A N ASN 451.A OD1 no hydrogen 2.924 N/A GLU 456.A N GLU 452.A O no hydrogen 2.941 N/A LEU 457.A N LYS 453.A O no hydrogen 2.973 N/A GLY 458.A N PHE 454.A O no hydrogen 2.873 N/A LYS 459.A N LEU 455.A O no hydrogen 2.959 N/A LEU 460.A N GLU 456.A O no hydrogen 3.126 N/A ASP 461.A N LEU 457.A O no hydrogen 2.802 N/A PHE 462.A N GLY 458.A O no hydrogen 3.093 N/A ASN 463.A N LYS 459.A O no hydrogen 3.117 N/A ASN 463.A ND2 LEU 778.A O no hydrogen 2.774 N/A ILE 464.A N LEU 460.A O no hydrogen 2.918 N/A ILE 465.A N ASP 461.A O no hydrogen 3.028 N/A GLN 466.A N PHE 462.A O no hydrogen 2.954 N/A GLN 466.A NE2 CYS 773.A O no hydrogen 3.042 N/A GLN 466.A NE2 GLU 776.A O no hydrogen 3.029 N/A SER 467.A N ASN 463.A O no hydrogen 2.939 N/A SER 467.A OG ILE 464.A O no hydrogen 2.824 N/A ILE 468.A N ILE 464.A O no hydrogen 3.018 N/A HIS 469.A N ILE 465.A O no hydrogen 2.949 N/A HIS 469.A NE2 TYR 507.A O no hydrogen 2.806 N/A GLN 470.A N GLN 466.A O no hydrogen 2.852 N/A GLN 470.A NE2 LEU 774.A O no hydrogen 2.885 N/A GLN 470.A NE2 ILE 775.A O no hydrogen 3.145 N/A GLU 471.A N SER 467.A O no hydrogen 3.179 N/A GLU 472.A N ILE 468.A O no hydrogen 3.100 N/A MET 473.A N HIS 469.A O no hydrogen 2.849 N/A LYS 474.A N GLN 470.A O no hydrogen 3.177 N/A LYS 474.A NZ LEU 9.A O no hydrogen 2.663 N/A LYS 474.A NZ GLU 471.A OE2 no hydrogen 2.610 N/A ASN 475.A N GLU 471.A O no hydrogen 3.275 N/A VAL 476.A N GLU 472.A O no hydrogen 2.845 N/A THR 477.A N MET 473.A O no hydrogen 2.933 N/A THR 477.A OG1 HIS 7.A NE2 no hydrogen 3.247 N/A THR 477.A OG1 MET 473.A O no hydrogen 2.894 N/A THR 477.A OG1 LYS 474.A O no hydrogen 3.199 N/A SER 478.A N LYS 474.A O no hydrogen 2.921 N/A SER 478.A OG.A HIS 7.A NE2 no hydrogen 3.165 N/A SER 478.A OG.A LYS 474.A O no hydrogen 2.840 N/A TRP 479.A N ASN 475.A O no hydrogen 2.866 N/A PHE 480.A N VAL 476.A O no hydrogen 2.859 N/A ARG 481.A N THR 477.A O no hydrogen 3.096 N/A ASP 482.A N TRP 479.A O no hydrogen 3.152 N/A SER 483.A N PHE 480.A O no hydrogen 3.169 N/A SER 483.A OG PHE 480.A O no hydrogen 2.787 N/A LEU 485.A N SER 483.A OG no hydrogen 3.083 N/A LEU 487.A N GLY 484.A O no hydrogen 3.061 N/A PHE 488.A N LEU 485.A O no hydrogen 3.133 N/A THR 489.A N LEU 487.A O no hydrogen 3.101 N/A ALA 491.A N PHE 488.A O no hydrogen 2.930 N/A ARG 494.A NH2 THR 526.A OG1 no hydrogen 2.935 N/A GLU 497.A N GLU 497.A OE1 no hydrogen 2.704 N/A PHE 498.A N ARG 494.A O no hydrogen 3.183 N/A TYR 499.A N PRO 495.A O no hydrogen 2.927 N/A TYR 499.A OH GLU 472.A OE1 no hydrogen 2.782 N/A PHE 500.A N LEU 496.A O no hydrogen 2.850 N/A LEU 501.A N GLU 497.A O no hydrogen 3.091 N/A ALA 503.A N TYR 499.A O no hydrogen 2.803 N/A ALA 504.A N PHE 500.A O no hydrogen 2.995 N/A GLY 505.A N VAL 502.A O no hydrogen 3.195 N/A THR 506.A N VAL 502.A O no hydrogen 2.826 N/A TYR 507.A OH TYR 280.A OH no hydrogen 2.649 N/A GLU 508.A N GLU 508.A OE1 no hydrogen 2.689 N/A GLN 510.A N GLN 510.A OE1 no hydrogen 2.812 N/A TYR 511.A N GLU 508.A O no hydrogen 2.986 N/A LYS 513.A NZ GLU 580.A OE2 no hydrogen 3.290 N/A CYS 514.A SG GLY 639.A O no hydrogen 3.395 N/A ARG 515.A N TYR 511.A O no hydrogen 3.117 N/A ARG 515.A NE GLU 472.A OE1 no hydrogen 2.781 N/A ARG 515.A NH1 THR 506.A O no hydrogen 2.967 N/A ARG 515.A NH1 GLU 508.A O no hydrogen 2.813 N/A ARG 515.A NH2 GLU 472.A OE2 no hydrogen 2.878 N/A ARG 515.A NH2 GLU 508.A O no hydrogen 3.030 N/A PHE 516.A N ALA 512.A O no hydrogen 2.944 N/A LEU 517.A N LYS 513.A O no hydrogen 2.938 N/A PHE 518.A N CYS 514.A O no hydrogen 2.983 N/A THR 519.A N ARG 515.A O no hydrogen 3.036 N/A THR 519.A OG1 ARG 515.A O no hydrogen 2.767 N/A LYS 520.A N PHE 516.A O no hydrogen 2.990 N/A LYS 520.A NZ GLU 576.A OE1 no hydrogen 3.033 N/A LYS 520.A NZ GLU 576.A OE2 no hydrogen 2.989 N/A VAL 521.A N LEU 517.A O no hydrogen 3.032 N/A ALA 522.A N PHE 518.A O no hydrogen 2.952 N/A CYS 523.A N THR 519.A O no hydrogen 2.979 N/A CYS 523.A SG THR 519.A O no hydrogen 3.305 N/A LEU 524.A N LYS 520.A O no hydrogen 2.998 N/A GLN 525.A N VAL 521.A O no hydrogen 2.844 N/A GLN 525.A NE2 GLY 631.A O no hydrogen 2.828 N/A THR 526.A N ALA 522.A O no hydrogen 3.150 N/A LEU 528.A N LEU 524.A O no hydrogen 2.993 N/A ASP 529.A N GLN 525.A O no hydrogen 2.722 N/A ASP 530.A N THR 526.A O no hydrogen 3.254 N/A MET 531.A N VAL 527.A O no hydrogen 2.876 N/A TYR 532.A N LEU 528.A O no hydrogen 2.986 N/A TYR 532.A OH THR 545.A OG1 no hydrogen 2.791 N/A ASP 533.A N ASP 529.A O no hydrogen 2.977 N/A THR 534.A OG1 ASP 533.A OD1 no hydrogen 2.852 N/A TYR 535.A N ASP 530.A O no hydrogen 2.882 N/A GLY 536.A N MET 531.A O no hydrogen 2.814 N/A THR 537.A N GLU 540.A OE1 no hydrogen 3.117 N/A THR 537.A OG1 ASP 539.A OD1 no hydrogen 2.964 N/A GLU 540.A N THR 537.A OG1 no hydrogen 3.158 N/A LEU 541.A N THR 537.A O no hydrogen 2.772 N/A LYS 542.A N LEU 538.A O no hydrogen 2.762 N/A LEU 543.A N ASP 539.A O no hydrogen 3.159 N/A PHE 544.A N GLU 540.A O no hydrogen 2.828 N/A THR 545.A N LEU 541.A O no hydrogen 2.737 N/A THR 545.A OG1 TYR 532.A OH no hydrogen 2.791 N/A THR 545.A OG1 LEU 541.A O no hydrogen 2.712 N/A GLU 546.A N LYS 542.A O no hydrogen 2.971 N/A ALA 547.A N LEU 543.A O no hydrogen 3.030 N/A VAL 548.A N PHE 544.A O no hydrogen 2.977 N/A ARG 549.A N THR 545.A O no hydrogen 3.262 N/A ARG 549.A NH1 GLU 546.A OE1 no hydrogen 2.919 N/A ARG 550.A N GLU 546.A O no hydrogen 3.253 N/A ARG 550.A N ALA 547.A O no hydrogen 3.223 N/A ARG 550.A NE GLU 546.A OE2 no hydrogen 3.363 N/A TRP 551.A N ALA 547.A O no hydrogen 3.336 N/A TRP 551.A NE1 GLU 598.A OE1 no hydrogen 2.692 N/A SER 554.A N ASP 552.A OD2 no hydrogen 2.905 N/A SER 554.A OG ASP 552.A OD1 no hydrogen 3.441 N/A SER 554.A OG ASP 552.A OD2 no hydrogen 2.677 N/A PHE 555.A N ASP 552.A O no hydrogen 3.183 N/A THR 556.A N LEU 553.A O no hydrogen 3.109 N/A THR 556.A OG1 LEU 553.A O no hydrogen 3.197 N/A GLU 557.A N SER 554.A O no hydrogen 3.437 N/A ASN 558.A N PHE 555.A O no hydrogen 3.308 N/A ASN 558.A ND2 PHE 555.A O no hydrogen 2.637 N/A LEU 559.A N THR 556.A O no hydrogen 2.926 N/A TYR 562.A OH GLU 540.A OE1 no hydrogen 2.927 N/A LYS 564.A N PRO 560.A O no hydrogen 2.952 N/A LYS 564.A NZ THR 556.A O no hydrogen 2.865 N/A LYS 564.A NZ GLU 557.A O no hydrogen 2.532 N/A LYS 564.A NZ LEU 559.A O no hydrogen 2.944 N/A LEU 565.A N ASP 561.A O no hydrogen 3.204 N/A CYS 566.A N TYR 562.A O no hydrogen 2.948 N/A TYR 567.A N MET 563.A O no hydrogen 2.821 N/A TYR 567.A OH ALA 547.A O no hydrogen 2.995 N/A GLN 568.A N LYS 564.A O no hydrogen 3.208 N/A GLN 568.A NE2.B GLN 568.A O no hydrogen 3.410 N/A GLN 568.A NE2.B ASP 572.A OD1 no hydrogen 3.324 N/A GLN 568.A NE2.B ASP 572.A OD2 no hydrogen 3.176 N/A ILE 569.A N LEU 565.A O no hydrogen 3.117 N/A TYR 570.A N CYS 566.A O no hydrogen 2.988 N/A TYR 571.A N TYR 567.A O no hydrogen 2.809 N/A ASP 572.A N GLN 568.A O no hydrogen 2.958 N/A ILE 573.A N ILE 569.A O no hydrogen 2.887 N/A VAL 574.A N TYR 570.A O no hydrogen 2.903 N/A HIS 575.A N TYR 571.A O no hydrogen 3.184 N/A HIS 575.A ND1 TYR 571.A O no hydrogen 2.800 N/A GLU 576.A N ASP 572.A O no hydrogen 2.912 N/A VAL 577.A N ILE 573.A O no hydrogen 3.004 N/A ALA 578.A N VAL 574.A O no hydrogen 2.961 N/A TRP 579.A N HIS 575.A O no hydrogen 2.922 N/A GLU 580.A N GLU 576.A O no hydrogen 3.030 N/A ALA 581.A N VAL 577.A O no hydrogen 2.918 N/A GLU 582.A N ALA 578.A O no hydrogen 2.863 N/A LYS 583.A N TRP 579.A O no hydrogen 2.990 N/A GLU 584.A N GLU 580.A O no hydrogen 2.988 N/A GLN 585.A N ALA 581.A O no hydrogen 2.808 N/A GLN 585.A NE2 LEU 641.A O no hydrogen 3.034 N/A GLN 585.A NE2 GLN 646.A O no hydrogen 3.059 N/A GLY 586.A N GLU 582.A O no hydrogen 2.841 N/A ARG 587.A NE LEU 648.A O no hydrogen 3.213 N/A ARG 587.A NH2 LEU 648.A O no hydrogen 2.865 N/A LEU 589.A N GLU 582.A OE2 no hydrogen 2.851 N/A VAL 590.A N GLU 582.A OE2 no hydrogen 3.111 N/A SER 591.A N GLU 588.A OE2 no hydrogen 2.816 N/A SER 591.A OG GLU 588.A OE1 no hydrogen 2.765 N/A SER 591.A OG GLU 588.A OE2 no hydrogen 3.302 N/A PHE 593.A N LEU 589.A O no hydrogen 2.908 N/A ARG 594.A N VAL 590.A O no hydrogen 2.883 N/A ARG 594.A NE HIS 575.A NE2 no hydrogen 3.139 N/A ARG 594.A NH2 HIS 575.A NE2 no hydrogen 2.959 N/A LYS 595.A N SER 591.A O no hydrogen 3.104 N/A LYS 595.A NZ ASP 599.A OD1 no hydrogen 3.148 N/A LYS 595.A NZ ASP 599.A OD2 no hydrogen 2.687 N/A GLY 596.A N PHE 592.A O no hydrogen 3.144 N/A TRP 597.A N PHE 593.A O no hydrogen 2.914 N/A GLU 598.A N ARG 594.A O no hydrogen 2.903 N/A ASP 599.A N LYS 595.A O no hydrogen 2.927 N/A TYR 600.A N GLY 596.A O no hydrogen 3.099 N/A TYR 600.A OH TYR 604.A OH no hydrogen 2.662 N/A LEU 601.A N TRP 597.A O no hydrogen 2.951 N/A LEU 602.A N GLU 598.A O no hydrogen 2.767 N/A GLY 603.A N ASP 599.A O no hydrogen 3.002 N/A TYR 604.A N TYR 600.A O no hydrogen 3.032 N/A TYR 604.A OH TYR 600.A OH no hydrogen 2.662 N/A TYR 605.A N LEU 601.A O no hydrogen 2.972 N/A GLU 606.A N LEU 602.A O no hydrogen 3.028 N/A GLU 607.A N GLY 603.A O no hydrogen 3.122 N/A ALA 608.A N TYR 604.A O no hydrogen 2.860 N/A GLU 609.A N TYR 605.A O no hydrogen 2.815 N/A TRP 610.A N GLU 606.A O no hydrogen 3.070 N/A LEU 611.A N GLU 607.A O no hydrogen 3.009 N/A ALA 612.A N ALA 608.A O no hydrogen 3.031 N/A ALA 613.A N GLU 609.A O no hydrogen 3.122 N/A ALA 613.A N TRP 610.A O no hydrogen 3.235 N/A GLU 614.A N LEU 611.A O no hydrogen 3.166 N/A TYR 615.A N TRP 610.A O no hydrogen 2.880 N/A TYR 615.A OH GLU 621.A OE1 no hydrogen 3.399 N/A TYR 615.A OH GLU 621.A OE2 no hydrogen 2.604 N/A THR 618.A N GLU 621.A OE2 no hydrogen 3.163 N/A LEU 619.A N ASP 700.A OD2 no hydrogen 2.788 N/A GLU 621.A N THR 618.A OG1 no hydrogen 3.003 N/A TYR 622.A N THR 618.A O no hydrogen 2.890 N/A TYR 622.A OH ASP 677.A OD1 no hydrogen 3.075 N/A TYR 622.A OH ASP 677.A OD2 no hydrogen 2.756 N/A ILE 623.A N LEU 619.A O no hydrogen 2.935 N/A LYS 624.A N ASP 620.A O no hydrogen 2.915 N/A ASN 625.A N GLU 621.A O no hydrogen 2.944 N/A ASN 625.A ND2 GLY 603.A O no hydrogen 3.067 N/A ASN 625.A ND2 GLU 606.A OE2 no hydrogen 2.816 N/A GLY 626.A N TYR 622.A O no hydrogen 2.769 N/A ILE 627.A N ILE 623.A O no hydrogen 2.906 N/A THR 628.A N ASN 625.A O no hydrogen 3.011 N/A SER 629.A N ASN 625.A O no hydrogen 2.788 N/A SER 629.A OG ASN 625.A O no hydrogen 3.152 N/A SER 629.A OG ASN 625.A OD1 no hydrogen 2.823 N/A ILE 630.A N GLY 626.A O no hydrogen 2.997 N/A GLN 632.A NE2 SER 672.A OG no hydrogen 2.750 N/A GLN 632.A NE2 GLU 745.A OE1 no hydrogen 3.310 N/A GLN 632.A NE2 THR 749.A OG1 no hydrogen 3.278 N/A ARG 633.A NE ASP 657.A OD1 no hydrogen 2.741 N/A ARG 633.A NE ASP 657.A OD2 no hydrogen 3.441 N/A ARG 633.A NH2 ASP 657.A OD2 no hydrogen 2.837 N/A LEU 635.A N GLY 631.A O no hydrogen 3.176 N/A LEU 636.A N GLN 632.A O no hydrogen 2.846 N/A LEU 637.A N ARG 633.A O no hydrogen 3.079 N/A SER 638.A N ILE 634.A O no hydrogen 3.146 N/A SER 638.A OG ILE 634.A O no hydrogen 2.803 N/A GLY 639.A N LEU 636.A O no hydrogen 3.078 N/A VAL 640.A N LEU 636.A O no hydrogen 2.858 N/A LEU 641.A N LEU 637.A O no hydrogen 3.390 N/A ILE 642.A N GLY 639.A O no hydrogen 3.089 N/A GLY 645.A N GLU 584.A OE1 no hydrogen 2.840 N/A GLN 646.A N MET 643.A O no hydrogen 2.916 N/A GLN 646.A NE2 ASP 644.A O no hydrogen 3.159 N/A LEU 648.A N GLN 585.A OE1 no hydrogen 2.749 N/A GLN 650.A NE2 GLU 654.A OE2 no hydrogen 3.134 N/A ALA 652.A N SER 649.A OG no hydrogen 3.006 N/A LEU 653.A N SER 649.A O no hydrogen 2.843 N/A GLU 654.A N GLN 650.A O no hydrogen 2.953 N/A LYS 655.A N ALA 652.A O no hydrogen 3.078 N/A LYS 655.A NZ ASP 733.A OD1 no hydrogen 2.813 N/A LYS 655.A NZ ASP 733.A OD2 no hydrogen 3.432 N/A VAL 656.A N LEU 653.A O no hydrogen 2.905 N/A ASP 657.A N LEU 653.A O no hydrogen 2.759 N/A GLY 660.A N GLU 666.A OE2 no hydrogen 2.577 N/A ARG 661.A N TYR 658.A O no hydrogen 2.938 N/A ARG 662.A NH1 GLU 723.A OE2 no hydrogen 2.887 N/A VAL 663.A N ARG 661.A O no hydrogen 2.828 N/A THR 665.A N VAL 656.A O no hydrogen 2.953 N/A THR 665.A OG1 VAL 656.A O no hydrogen 3.419 N/A THR 665.A OG1 ASP 657.A OD1 no hydrogen 2.676 N/A LEU 667.A N VAL 663.A O no hydrogen 2.884 N/A ASN 668.A N LEU 664.A O no hydrogen 2.925 N/A ASN 668.A ND2 GLU 745.A OE1 no hydrogen 2.927 N/A ASN 668.A ND2 THR 746.A OG1 no hydrogen 2.786 N/A SER 669.A N THR 665.A O no hydrogen 3.056 N/A SER 669.A OG THR 665.A O no hydrogen 2.923 N/A LEU 670.A N GLU 666.A O no hydrogen 2.952 N/A ILE 671.A N LEU 667.A O no hydrogen 2.850 N/A SER 672.A N ASN 668.A O no hydrogen 2.800 N/A SER 672.A OG ASN 668.A O no hydrogen 2.732 N/A SER 672.A OG ASN 668.A OD1 no hydrogen 3.363 N/A ARG 673.A N SER 669.A O no hydrogen 2.934 N/A ARG 673.A NE ARG 673.A O no hydrogen 2.891 N/A LEU 674.A N LEU 670.A O no hydrogen 3.058 N/A ALA 675.A N ILE 671.A O no hydrogen 2.734 N/A ASP 676.A N SER 672.A O no hydrogen 2.882 N/A ASP 677.A N ARG 673.A O no hydrogen 3.043 N/A THR 678.A N LEU 674.A O no hydrogen 2.928 N/A THR 678.A OG1 ALA 675.A O no hydrogen 2.599 N/A LYS 679.A N ALA 675.A O no hydrogen 3.078 N/A LYS 679.A N ASP 676.A O no hydrogen 3.019 N/A LYS 679.A NZ LYS 754.A O no hydrogen 2.750 N/A LYS 679.A NZ ASP 755.A O no hydrogen 2.985 N/A THR 680.A N ASP 677.A O no hydrogen 3.233 N/A THR 680.A OG1 ASP 676.A O no hydrogen 2.768 N/A THR 680.A OG1 ASP 676.A OD1 no hydrogen 2.980 N/A THR 680.A OG1 GLU 684.A OE2 no hydrogen 2.803 N/A TYR 681.A N ASP 677.A O no hydrogen 2.906 N/A TYR 681.A OH GLU 706.A OE1 no hydrogen 2.950 N/A LYS 682.A N GLY 758.A O no hydrogen 3.373 N/A LYS 682.A NZ TYR 681.A OH no hydrogen 2.642 N/A ALA 683.A N THR 680.A O no hydrogen 3.155 N/A GLU 684.A N THR 680.A O no hydrogen 3.366 N/A LYS 685.A N TYR 681.A O no hydrogen 2.947 N/A LYS 685.A N LYS 682.A O no hydrogen 3.265 N/A ALA 686.A N LYS 682.A O no hydrogen 3.160 N/A GLY 688.A N LYS 685.A O no hydrogen 2.973 N/A GLU 689.A N GLU 684.A O no hydrogen 2.824 N/A SER 692.A N GLU 695.A OE1 no hydrogen 3.273 N/A SER 692.A OG GLU 695.A OE1 no hydrogen 2.324 N/A SER 693.A N ASP 677.A OD2 no hydrogen 3.106 N/A SER 693.A OG ASP 677.A OD2 no hydrogen 2.813 N/A GLU 695.A N GLU 695.A OE1 no hydrogen 2.932 N/A CYS 696.A N SER 692.A O no hydrogen 2.957 N/A CYS 696.A SG PRO 617.A O no hydrogen 3.237 N/A CYS 696.A SG SER 692.A O no hydrogen 3.180 N/A TYR 697.A N SER 693.A O no hydrogen 2.996 N/A MET 698.A N ILE 694.A O no hydrogen 3.133 N/A LYS 699.A N GLU 695.A O no hydrogen 3.075 N/A LYS 699.A NZ VAL 616.A O no hydrogen 2.939 N/A ASP 700.A N CYS 696.A O no hydrogen 3.018 N/A HIS 701.A N TYR 697.A O no hydrogen 2.803 N/A CYS 704.A N HIS 701.A O no hydrogen 2.894 N/A CYS 704.A SG HIS 701.A O no hydrogen 3.205 N/A CYS 704.A SG THR 705.A O no hydrogen 3.459 N/A THR 705.A N GLU 708.A OE1 no hydrogen 2.992 N/A GLU 707.A N THR 705.A OG1 no hydrogen 3.296 N/A ALA 709.A N THR 705.A O no hydrogen 2.919 N/A LEU 710.A N GLU 706.A O no hydrogen 2.921 N/A ASP 711.A N GLU 707.A O no hydrogen 2.963 N/A HIS 712.A N GLU 708.A O no hydrogen 2.920 N/A ILE 713.A N ALA 709.A O no hydrogen 3.170 N/A TYR 714.A N LEU 710.A O no hydrogen 3.047 N/A TYR 714.A OH GLY 756.A O no hydrogen 2.967 N/A SER 715.A N ASP 711.A O no hydrogen 2.999 N/A SER 715.A OG HIS 712.A O no hydrogen 2.512 N/A ILE 716.A N HIS 712.A O no hydrogen 3.206 N/A ILE 716.A N ILE 713.A O no hydrogen 3.089 N/A LEU 717.A N ILE 713.A O no hydrogen 3.042 N/A GLU 718.A N TYR 714.A O no hydrogen 3.019 N/A ALA 720.A N ILE 716.A O no hydrogen 3.381 N/A VAL 721.A N LEU 717.A O no hydrogen 2.828 N/A LYS 722.A N GLU 718.A O no hydrogen 3.132 N/A LYS 722.A NZ ASP 375.A OD1 no hydrogen 3.105 N/A GLU 723.A N PRO 719.A O no hydrogen 2.996 N/A LEU 724.A N ALA 720.A O no hydrogen 2.863 N/A THR 725.A N VAL 721.A O no hydrogen 3.091 N/A THR 725.A OG1 HIS 417.A NE2 no hydrogen 2.745 N/A THR 725.A OG1 VAL 721.A O no hydrogen 2.993 N/A ARG 726.A N LYS 722.A O no hydrogen 3.090 N/A ARG 726.A NE GLU 727.A OE2 no hydrogen 3.224 N/A ARG 726.A NH2 GLU 727.A OE2 no hydrogen 3.072 N/A GLU 727.A N GLU 723.A O no hydrogen 2.882 N/A PHE 728.A N LEU 724.A O no hydrogen 2.991 N/A LEU 729.A N THR 725.A O no hydrogen 2.973 N/A LYS 730.A N ARG 726.A O no hydrogen 2.707 N/A LYS 730.A NZ GLU 727.A OE1 no hydrogen 3.124 N/A LYS 730.A NZ GLU 727.A OE2 no hydrogen 3.134 N/A VAL 734.A N ASP 732.A OD1 no hydrogen 3.056 N/A CYS 738.A N PRO 735.A O no hydrogen 3.054 N/A CYS 738.A SG VAL 640.A O no hydrogen 3.881 N/A LYS 739.A N PRO 735.A O no hydrogen 3.462 N/A LYS 739.A NZ GLU 727.A O no hydrogen 2.829 N/A LYS 739.A NZ LYS 730.A O no hydrogen 2.744 N/A LYS 739.A NZ ASP 732.A OD2 no hydrogen 2.527 N/A LYS 740.A N PHE 736.A O no hydrogen 2.802 N/A LYS 740.A NZ TYR 280.A OH no hydrogen 2.743 N/A LYS 740.A NZ GLU 508.A OE2 no hydrogen 3.449 N/A MET 741.A N ALA 737.A O no hydrogen 2.913 N/A LEU 742.A N CYS 738.A O no hydrogen 3.118 N/A PHE 743.A N LYS 739.A O no hydrogen 2.898 N/A GLU 744.A N LYS 740.A O no hydrogen 2.753 N/A GLU 745.A N MET 741.A O no hydrogen 3.145 N/A THR 746.A N LEU 742.A O no hydrogen 3.194 N/A THR 746.A OG1 LEU 742.A O no hydrogen 2.809 N/A ARG 747.A N PHE 743.A O no hydrogen 2.866 N/A ARG 747.A NE TRP 416.A O no hydrogen 3.282 N/A ARG 747.A NH1 GLU 744.A OE1 no hydrogen 3.095 N/A ARG 747.A NH1 GLU 744.A OE2 no hydrogen 3.080 N/A ARG 747.A NH2 TRP 416.A O no hydrogen 2.821 N/A VAL 748.A N GLU 744.A O no hydrogen 3.059 N/A THR 749.A N GLU 745.A O no hydrogen 2.921 N/A THR 749.A OG1 GLU 745.A O no hydrogen 2.903 N/A THR 749.A OG1 GLU 745.A OE1 no hydrogen 3.354 N/A MET 750.A N THR 746.A O no hydrogen 2.817 N/A VAL 751.A N ARG 747.A O no hydrogen 3.079 N/A ILE 752.A N VAL 748.A O no hydrogen 3.248 N/A PHE 753.A N THR 749.A O no hydrogen 3.238 N/A LYS 754.A N VAL 751.A O no hydrogen 3.259 N/A GLY 760.A N LYS 679.A O no hydrogen 2.777 N/A GLU 765.A N SER 762.A OG no hydrogen 3.046 N/A VAL 766.A N SER 762.A O no hydrogen 3.252 N/A LYS 767.A N LYS 763.A O no hydrogen 3.096 N/A ASP 768.A N LEU 764.A O no hydrogen 2.999 N/A HIS 769.A N GLU 765.A O no hydrogen 2.963 N/A ILE 770.A N VAL 766.A O no hydrogen 3.051 N/A LYS 771.A N LYS 767.A O no hydrogen 2.904 N/A GLU 772.A N ASP 768.A O no hydrogen 2.957 N/A CYS 773.A N HIS 769.A O no hydrogen 2.835 N/A LEU 774.A N ILE 770.A O no hydrogen 2.827 N/A ILE 775.A N LYS 771.A O no hydrogen 3.160 N/A GLU 776.A N LYS 771.A O no hydrogen 2.948 N/A LEU 778.A N ASN 463.A OD1 no hydrogen 2.824 N/A