Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mqf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N ASN 95.A OD1 no hydrogen 3.425 N/A SER 3.A N GLU 474.A OE2 no hydrogen 3.084 N/A VAL 4.A N GLU 474.A OE1 no hydrogen 3.204 N/A ARG 5.A N ILE 2.A O no hydrogen 3.355 N/A GLY 6.A N SER 3.A O no hydrogen 3.104 N/A VAL 13.A N GLY 9.A O no hydrogen 2.966 N/A THR 14.A N VAL 10.A O no hydrogen 3.033 N/A THR 14.A OG1 VAL 10.A O no hydrogen 2.723 N/A GLU 15.A N GLU 11.A O no hydrogen 3.057 N/A LEU 16.A N ASN 12.A O no hydrogen 2.906 N/A LYS 17.A N VAL 13.A O no hydrogen 2.969 N/A LYS 17.A NZ GLN 103.A OE1 no hydrogen 2.803 N/A LYS 18.A N THR 14.A O no hydrogen 3.068 N/A ASN 19.A N GLU 15.A O no hydrogen 2.959 N/A ASN 19.A ND2 GLU 15.A O no hydrogen 2.961 N/A PHE 20.A N LEU 16.A O no hydrogen 2.871 N/A ASN 21.A N LYS 17.A O no hydrogen 3.115 N/A ARG 22.A N LYS 18.A O no hydrogen 2.978 N/A ARG 22.A NE ASN 19.A OD1 no hydrogen 3.091 N/A ARG 22.A NH2 ASN 19.A OD1 no hydrogen 2.967 N/A ARG 22.A NH2 ASP 50.A OD1 no hydrogen 3.127 N/A HIS 23.A N ASN 19.A O no hydrogen 3.046 N/A LEU 24.A N PHE 20.A O no hydrogen 3.056 N/A HIS 25.A N ASN 21.A O no hydrogen 3.183 N/A PHE 26.A N ARG 22.A O no hydrogen 2.806 N/A THR 27.A N HIS 23.A O no hydrogen 2.898 N/A LEU 28.A N HIS 23.A O no hydrogen 2.924 N/A LYS 30.A N LEU 24.A O no hydrogen 2.992 N/A LYS 30.A NZ ASP 39.A OD1 no hydrogen 2.896 N/A ARG 32.A NE TYR 40.A OH no hydrogen 2.720 N/A ARG 32.A NH1 LEU 104.A O no hydrogen 3.215 N/A ARG 32.A NH2 LEU 104.A O no hydrogen 3.078 N/A ASN 33.A N ASP 31.A OD1 no hydrogen 3.249 N/A VAL 34.A N ASP 31.A O no hydrogen 3.215 N/A ALA 35.A N ASP 31.A O no hydrogen 3.106 N/A THR 36.A N ASP 39.A OD1 no hydrogen 2.673 N/A THR 36.A OG1 ASP 39.A OD1 no hydrogen 2.869 N/A ASP 39.A N THR 36.A OG1 no hydrogen 3.186 N/A TYR 40.A N THR 36.A O no hydrogen 3.192 N/A TYR 41.A N PRO 37.A O no hydrogen 3.051 N/A PHE 42.A N ARG 38.A O no hydrogen 2.969 N/A ALA 43.A N ASP 39.A O no hydrogen 2.943 N/A LEU 44.A N TYR 40.A O no hydrogen 3.119 N/A ALA 45.A N TYR 41.A O no hydrogen 2.854 N/A HIS 46.A N PHE 42.A O no hydrogen 2.908 N/A HIS 46.A ND1 PHE 42.A O no hydrogen 3.046 N/A THR 47.A N ALA 43.A O no hydrogen 2.961 N/A THR 47.A OG1 ALA 43.A O no hydrogen 2.808 N/A VAL 48.A N LEU 44.A O no hydrogen 2.866 N/A ARG 49.A N ALA 45.A O no hydrogen 2.834 N/A ARG 49.A NH1 PRO 177.A O no hydrogen 2.846 N/A ASP 50.A N HIS 46.A O no hydrogen 3.096 N/A HIS 51.A N VAL 48.A O no hydrogen 2.949 N/A LEU 52.A N ARG 49.A O no hydrogen 2.986 N/A VAL 53.A N ASP 50.A O no hydrogen 3.389 N/A ARG 55.A NE ASN 225.A OD1 no hydrogen 2.807 N/A ARG 55.A NH1 HIS 51.A O no hydrogen 2.925 N/A ARG 55.A NH2 ASN 225.A OD1 no hydrogen 3.370 N/A TRP 56.A N LEU 52.A O no hydrogen 2.824 N/A TRP 56.A NE1 THR 229.A OG1 no hydrogen 2.985 N/A ILE 57.A N VAL 53.A O no hydrogen 2.945 N/A ARG 58.A N GLY 54.A O no hydrogen 2.971 N/A THR 59.A N ARG 55.A O no hydrogen 2.906 N/A THR 59.A OG1 ARG 55.A O no hydrogen 2.706 N/A GLN 60.A N TRP 56.A O no hydrogen 3.232 N/A GLN 60.A NE2 VAL 227.A O no hydrogen 3.228 N/A GLN 61.A N ILE 57.A O no hydrogen 3.038 N/A HIS 62.A N ARG 58.A O no hydrogen 2.808 N/A TYR 63.A N THR 59.A O no hydrogen 3.047 N/A TYR 63.A OH ASN 228.A OD1 no hydrogen 2.715 N/A TYR 64.A N GLN 60.A O no hydrogen 3.161 N/A GLU 65.A N GLN 61.A O no hydrogen 2.989 N/A LYS 66.A N HIS 62.A O no hydrogen 2.863 N/A ASP 67.A N TYR 63.A O no hydrogen 2.872 N/A LYS 69.A NZ PRO 303.A O no hydrogen 3.002 N/A LYS 69.A NZ TRP 797.A O no hydrogen 2.678 N/A ARG 70.A N LYS 305.A O no hydrogen 2.838 N/A ILE 71.A N ALA 142.A O no hydrogen 3.003 N/A TYR 72.A N ALA 307.A O no hydrogen 2.740 N/A TYR 73.A N TYR 144.A O no hydrogen 2.918 N/A LEU 74.A N GLN 309.A O no hydrogen 2.962 N/A SER 75.A N TYR 146.A O no hydrogen 3.195 N/A SER 75.A OG GLU 77.A O no hydrogen 2.694 N/A GLU 77.A N SER 75.A OG no hydrogen 3.092 N/A PHE 78.A N LEU 120.A O no hydrogen 2.934 N/A TYR 79.A N GLY 126.A O no hydrogen 2.981 N/A MET 80.A N ALA 118.A O no hydrogen 3.218 N/A GLY 81.A N ALA 118.A O no hydrogen 3.211 N/A ARG 82.A NE GLU 115.A O no hydrogen 2.916 N/A ARG 82.A NH1 GLU 113.A OE1 no hydrogen 3.268 N/A ARG 82.A NH1 GLU 113.A OE2 no hydrogen 3.399 N/A ARG 82.A NH2 GLU 113.A OE2 no hydrogen 3.337 N/A THR 83.A N GLU 115.A OE1 no hydrogen 3.324 N/A THR 83.A N GLU 115.A OE2 no hydrogen 2.725 N/A LEU 84.A N GLU 115.A OE1 no hydrogen 2.980 N/A GLN 85.A NE2 GLU 94.A OE1 no hydrogen 2.770 N/A GLN 85.A NE2 LEU 467.A O no hydrogen 3.234 N/A THR 87.A N THR 83.A O no hydrogen 2.959 N/A THR 87.A OG1 THR 83.A O no hydrogen 2.893 N/A MET 88.A N LEU 84.A O no hydrogen 3.115 N/A VAL 89.A N GLN 85.A O no hydrogen 2.850 N/A ASN 90.A N ASN 86.A O no hydrogen 3.104 N/A ASN 90.A ND2 ASP 134.A OD1 no hydrogen 3.370 N/A ASN 90.A ND2 PRO 220.A O no hydrogen 2.666 N/A LEU 91.A N THR 87.A O no hydrogen 3.053 N/A ALA 92.A N VAL 89.A O no hydrogen 3.261 N/A LEU 93.A N MET 88.A O no hydrogen 2.809 N/A ASN 95.A N ARG 5.A O no hydrogen 3.027 N/A ASN 95.A ND2 ILE 2.A O no hydrogen 2.817 N/A ASN 95.A ND2 GLY 6.A O no hydrogen 2.739 N/A CYS 97.A N LEU 93.A O no hydrogen 2.895 N/A CYS 97.A SG LEU 93.A O no hydrogen 3.440 N/A ASP 98.A N GLU 94.A O no hydrogen 2.946 N/A GLU 99.A N ASN 95.A O no hydrogen 2.848 N/A ALA 100.A N ALA 96.A O no hydrogen 2.859 N/A THR 101.A N CYS 97.A O no hydrogen 2.948 N/A THR 101.A OG1 CYS 97.A O no hydrogen 2.888 N/A THR 101.A OG1 ASP 98.A O no hydrogen 3.146 N/A TYR 102.A N ASP 98.A O no hydrogen 2.993 N/A GLN 103.A N GLU 99.A O no hydrogen 2.999 N/A GLN 103.A NE2 GLU 99.A OE1 no hydrogen 2.703 N/A LEU 104.A N ALA 100.A O no hydrogen 3.254 N/A LEU 104.A N THR 101.A O no hydrogen 3.059 N/A GLY 105.A N TYR 102.A O no hydrogen 2.919 N/A LEU 106.A N THR 101.A O no hydrogen 2.840 N/A GLU 109.A N ASP 107.A OD2 no hydrogen 3.110 N/A LEU 111.A N ASP 107.A O no hydrogen 3.187 N/A GLU 112.A N MET 108.A O no hydrogen 2.855 N/A ILE 114.A N LEU 111.A O no hydrogen 3.120 N/A GLU 115.A N GLU 112.A O no hydrogen 3.340 N/A ALA 118.A N GLY 81.A O no hydrogen 2.999 N/A ASN 122.A N GLU 77.A OE2 no hydrogen 2.791 N/A ASN 122.A ND2 GLU 77.A OE1 no hydrogen 2.903 N/A ASN 122.A ND2 TYR 263.A O no hydrogen 2.966 N/A ARG 127.A N GLY 123.A O no hydrogen 2.983 N/A ARG 127.A NH2 TYR 79.A O no hydrogen 3.313 N/A ARG 127.A NH2 MET 80.A O no hydrogen 3.522 N/A LEU 128.A N GLY 124.A O no hydrogen 2.880 N/A ALA 129.A N LEU 125.A O no hydrogen 3.271 N/A ALA 130.A N GLY 126.A O no hydrogen 3.390 N/A CYS 131.A N ARG 127.A O no hydrogen 2.964 N/A CYS 131.A SG ARG 127.A O no hydrogen 3.673 N/A PHE 132.A N LEU 128.A O no hydrogen 2.873 N/A LEU 133.A N ALA 129.A O no hydrogen 3.024 N/A ASP 134.A N ALA 130.A O no hydrogen 3.223 N/A SER 135.A N CYS 131.A O no hydrogen 3.013 N/A SER 135.A OG CYS 131.A O no hydrogen 3.541 N/A SER 135.A OG SER 785.A OG no hydrogen 2.703 N/A SER 135.A OG ASP 786.A OD1 no hydrogen 2.739 N/A MET 136.A N PHE 132.A O no hydrogen 2.840 N/A ALA 137.A N LEU 133.A O no hydrogen 3.151 N/A THR 138.A N ASP 134.A O no hydrogen 2.997 N/A THR 138.A OG1 ASP 134.A O no hydrogen 3.083 N/A LEU 139.A N SER 135.A O no hydrogen 2.830 N/A GLY 140.A N ALA 137.A O no hydrogen 3.177 N/A LEU 141.A N MET 136.A O no hydrogen 2.961 N/A TYR 144.A N ILE 71.A O no hydrogen 2.900 N/A TYR 144.A OH GLN 60.A OE1 no hydrogen 3.414 N/A GLY 145.A N THR 229.A O no hydrogen 3.221 N/A TYR 146.A N TYR 73.A O no hydrogen 3.024 N/A TYR 146.A OH ASP 289.A OD1 no hydrogen 2.559 N/A GLY 147.A N ARG 231.A O no hydrogen 3.194 N/A ARG 149.A N TRP 233.A O no hydrogen 2.895 N/A ARG 149.A NE GLU 179.A OE2 no hydrogen 2.825 N/A ARG 149.A NH1 GLU 179.A OE1 no hydrogen 2.790 N/A ARG 149.A NH1 GLU 179.A OE2 no hydrogen 3.521 N/A TYR 150.A OH LEU 76.A O no hydrogen 2.712 N/A GLU 151.A N SER 259.A O no hydrogen 3.043 N/A PHE 152.A N ARG 260.A O no hydrogen 2.831 N/A GLY 153.A N ASP 169.A OD1 no hydrogen 3.267 N/A ILE 154.A N GLY 119.A O no hydrogen 2.902 N/A ASN 156.A N GLU 167.A O no hydrogen 2.938 N/A GLN 157.A N ASN 620.A OD1 no hydrogen 2.938 N/A GLN 157.A NE2 GLN 164.A OE1 no hydrogen 2.752 N/A GLN 157.A NE2 GLY 580.A O no hydrogen 3.186 N/A LYS 158.A N MET 165.A O no hydrogen 3.002 N/A LYS 158.A NZ GLU 167.A OE2 no hydrogen 2.856 N/A ILE 159.A N GLU 619.A OE1 no hydrogen 3.042 N/A CYS 160.A N TRP 163.A O no hydrogen 2.849 N/A TRP 163.A N CYS 160.A O no hydrogen 3.072 N/A GLN 164.A NE2 GLU 166.A OE2 no hydrogen 2.853 N/A GLN 164.A NE2 ALA 582.A O no hydrogen 2.794 N/A MET 165.A N LYS 158.A O no hydrogen 2.721 N/A GLU 167.A N ASN 156.A O no hydrogen 2.931 N/A TRP 171.A NE1 TYR 150.A O no hydrogen 2.959 N/A ARG 173.A N ASP 170.A O no hydrogen 3.261 N/A GLY 175.A N LEU 172.A O no hydrogen 2.863 N/A ASN 176.A ND2 GLU 179.A OE2 no hydrogen 3.233 N/A TRP 178.A N ASN 176.A OD1 no hydrogen 3.117 N/A LYS 180.A N ASP 216.A O no hydrogen 2.801 N/A LYS 180.A NZ ALA 181.A O no hydrogen 2.676 N/A ARG 182.A N PRO 214.A O no hydrogen 2.856 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.818 N/A PHE 185.A N ARG 182.A O no hydrogen 3.017 N/A THR 186.A N PRO 183.A O no hydrogen 3.189 N/A THR 186.A OG1 PRO 183.A O no hydrogen 2.688 N/A LEU 187.A N ALA 212.A O no hydrogen 3.021 N/A VAL 189.A N VAL 210.A O no hydrogen 2.791 N/A HIS 190.A ND1 THR 207.A OG1 no hydrogen 2.648 N/A PHE 191.A N GLN 208.A O no hydrogen 2.841 N/A TYR 192.A N LEU 368.A O no hydrogen 2.820 N/A TYR 192.A OH GLU 273.A OE1 no hydrogen 2.931 N/A ARG 194.A N VAL 205.A O no hydrogen 2.940 N/A ARG 194.A NE ASP 206.A OD2 no hydrogen 3.144 N/A ARG 194.A NH1 GLU 196.A OE2 no hydrogen 3.249 N/A ARG 194.A NH1 ASP 206.A OD2 no hydrogen 3.270 N/A ARG 194.A NH2 GLU 196.A OE2 no hydrogen 2.727 N/A GLU 196.A N LYS 203.A O no hydrogen 2.840 N/A THR 198.A N GLY 201.A O no hydrogen 2.964 N/A THR 198.A OG1 GLY 201.A O no hydrogen 2.767 N/A GLY 201.A N THR 198.A O no hydrogen 3.253 N/A LYS 203.A N GLU 196.A O no hydrogen 2.730 N/A TRP 204.A NE1 TYR 192.A O no hydrogen 2.715 N/A VAL 205.A N ARG 194.A O no hydrogen 2.948 N/A THR 207.A OG1 HIS 190.A ND1 no hydrogen 2.648 N/A GLN 208.A N PHE 191.A O no hydrogen 2.847 N/A VAL 210.A N VAL 189.A O no hydrogen 2.883 N/A LEU 211.A N LYS 236.A O no hydrogen 2.746 N/A ALA 212.A N LEU 187.A O no hydrogen 2.753 N/A MET 213.A N SER 234.A O no hydrogen 2.796 N/A TYR 215.A N LEU 232.A O no hydrogen 2.866 N/A ASP 216.A N LYS 180.A O no hydrogen 2.845 N/A THR 217.A N MET 230.A O no hydrogen 2.839 N/A THR 217.A OG1 TRP 178.A O no hydrogen 3.557 N/A VAL 219.A N ASN 228.A O no hydrogen 2.777 N/A GLY 221.A N VAL 226.A O no hydrogen 2.855 N/A TYR 222.A N THR 138.A OG1 no hydrogen 2.932 N/A ARG 223.A N ASN 90.A O no hydrogen 2.873 N/A ARG 223.A NE VAL 89.A O no hydrogen 3.096 N/A ARG 223.A NH1 VAL 4.A O no hydrogen 3.078 N/A ARG 223.A NH1 VAL 89.A O no hydrogen 3.157 N/A ASN 225.A ND2 LEU 806.A O no hydrogen 2.910 N/A VAL 227.A N THR 59.A OG1 no hydrogen 3.029 N/A ASN 228.A N VAL 219.A O no hydrogen 2.893 N/A ASN 228.A ND2 LEU 141.A O no hydrogen 2.942 N/A MET 230.A N THR 217.A O no hydrogen 2.855 N/A ARG 231.A N GLY 145.A O no hydrogen 2.794 N/A ARG 231.A NE ASP 216.A OD2 no hydrogen 2.761 N/A ARG 231.A NH1 ASP 216.A OD1 no hydrogen 2.885 N/A ARG 231.A NH1 ASP 216.A OD2 no hydrogen 3.435 N/A ARG 231.A NH2 ASP 289.A OD1 no hydrogen 2.716 N/A LEU 232.A N TYR 215.A O no hydrogen 2.927 N/A TRP 233.A N GLY 147.A O no hydrogen 2.947 N/A TRP 233.A NE1 THR 286.A OG1 no hydrogen 3.169 N/A SER 234.A N MET 213.A O no hydrogen 2.824 N/A ALA 235.A N SER 259.A OG no hydrogen 2.882 N/A LYS 236.A N LEU 211.A O no hydrogen 2.889 N/A ALA 237.A N GLU 256.A OE2 no hydrogen 2.967 N/A PHE 241.A N PRO 238.A O no hydrogen 3.171 N/A LEU 243.A N ASP 240.A O no hydrogen 2.846 N/A GLN 247.A NE2 ASP 251.A OD1 no hydrogen 3.073 N/A ALA 248.A N GLY 244.A O no hydrogen 3.047 N/A VAL 249.A N TYR 245.A O no hydrogen 3.202 N/A LEU 250.A N ILE 246.A O no hydrogen 2.942 N/A ASP 251.A N GLN 247.A O no hydrogen 2.793 N/A ARG 252.A N VAL 249.A O no hydrogen 3.203 N/A ARG 252.A NH1 ALA 237.A O no hydrogen 3.288 N/A ASN 253.A N LEU 250.A O no hydrogen 3.420 N/A LEU 254.A N ASP 251.A O no hydrogen 3.031 N/A GLU 256.A N ARG 252.A O no hydrogen 3.213 N/A ASN 257.A N ASN 253.A O no hydrogen 2.852 N/A ILE 258.A N ALA 255.A O no hydrogen 3.512 N/A ARG 260.A N ASN 257.A O no hydrogen 3.090 N/A ARG 260.A NE ASN 257.A OD1 no hydrogen 3.179 N/A ARG 260.A NH1 ASN 257.A OD1 no hydrogen 2.996 N/A ARG 260.A NH2 GLU 151.A OE1 no hydrogen 2.919 N/A LEU 262.A N PHE 152.A O no hydrogen 3.121 N/A ASN 267.A ND2 ASP 266.A OD2.A no hydrogen 3.106 N/A PHE 269.A N GLU 355.A O no hydrogen 2.958 N/A LYS 272.A N GLU 270.A O no hydrogen 2.888 N/A LYS 272.A NZ GLU 270.A OE1 no hydrogen 2.781 N/A ARG 275.A NE GLU 279.A OE1 no hydrogen 3.253 N/A LEU 276.A N LYS 272.A O no hydrogen 3.227 N/A LYS 277.A N GLU 273.A O no hydrogen 2.943 N/A LYS 277.A NZ TYR 192.A OH no hydrogen 3.151 N/A GLN 278.A N LEU 274.A O no hydrogen 2.996 N/A GLN 278.A NE2 ILE 258.A O no hydrogen 2.925 N/A GLN 278.A NE2 VAL 261.A O no hydrogen 2.964 N/A GLU 279.A N ARG 275.A O no hydrogen 3.028 N/A TYR 280.A N LEU 276.A O no hydrogen 3.021 N/A TYR 280.A OH GLU 321.A OE2 no hydrogen 2.867 N/A PHE 281.A N LYS 277.A O no hydrogen 2.896 N/A VAL 282.A N GLN 278.A O no hydrogen 3.119 N/A VAL 283.A N GLU 279.A O no hydrogen 3.403 N/A ALA 284.A N TYR 280.A O no hydrogen 2.754 N/A ALA 285.A N PHE 281.A O no hydrogen 3.261 N/A THR 286.A N VAL 282.A O no hydrogen 3.051 N/A THR 286.A OG1 VAL 282.A O no hydrogen 2.640 N/A LEU 287.A N VAL 283.A O no hydrogen 2.921 N/A GLN 288.A N ALA 284.A O no hydrogen 3.268 N/A GLN 288.A NE2 PRO 188.A O no hydrogen 2.819 N/A GLN 288.A NE2 ALA 284.A O no hydrogen 3.343 N/A ASP 289.A N ALA 285.A O no hydrogen 3.176 N/A ILE 290.A N THR 286.A O no hydrogen 2.874 N/A ILE 291.A N LEU 287.A O no hydrogen 2.910 N/A ARG 292.A N GLN 288.A O no hydrogen 2.924 N/A ARG 292.A NH1 PHE 185.A O no hydrogen 3.356 N/A ARG 292.A NH1 ASP 289.A OD2 no hydrogen 2.910 N/A ARG 293.A N ASP 289.A O no hydrogen 3.036 N/A ARG 293.A NH1 TYR 146.A OH no hydrogen 3.429 N/A ARG 293.A NH2 TYR 72.A OH no hydrogen 3.369 N/A ARG 293.A NH2 TYR 146.A OH no hydrogen 3.005 N/A PHE 294.A N ILE 290.A O no hydrogen 2.960 N/A LYS 295.A N ILE 291.A O no hydrogen 2.949 N/A LYS 295.A NZ GLU 330.A OE2 no hydrogen 2.710 N/A SER 296.A N ARG 292.A O no hydrogen 3.160 N/A SER 296.A OG ARG 292.A O no hydrogen 2.913 N/A SER 297.A OG ASP 67.A OD1 no hydrogen 2.967 N/A ASP 300.A N ASN 298.A OD1 no hydrogen 3.372 N/A PHE 302.A N PHE 299.A O no hydrogen 3.092 N/A ASP 304.A N ALA 301.A O no hydrogen 3.018 N/A LYS 305.A N PHE 302.A O no hydrogen 3.067 N/A LYS 305.A NZ ASP 67.A O no hydrogen 2.784 N/A LYS 305.A NZ ASP 67.A OD2 no hydrogen 3.504 N/A ALA 307.A N ARG 70.A O no hydrogen 2.927 N/A ILE 308.A N THR 344.A O no hydrogen 2.978 N/A GLN 309.A N TYR 72.A O no hydrogen 2.830 N/A GLN 309.A NE2 THR 348.A OG1 no hydrogen 3.000 N/A LEU 310.A N ALA 346.A O no hydrogen 2.865 N/A ASN 311.A N LEU 74.A O no hydrogen 3.114 N/A ASN 311.A ND2 SER 75.A OG no hydrogen 2.984 N/A ASN 311.A ND2 LEU 125.A O no hydrogen 3.613 N/A ASP 312.A N THR 348.A O no hydrogen 2.940 N/A THR 313.A N ASP 312.A OD2 no hydrogen 2.699 N/A THR 313.A OG1 ASP 312.A OD2 no hydrogen 3.436 N/A THR 313.A OG1 GLU 358.A OE1 no hydrogen 2.628 N/A SER 316.A N THR 313.A O no hydrogen 2.820 N/A SER 316.A OG THR 313.A O no hydrogen 2.835 N/A ALA 318.A N PRO 315.A O no hydrogen 3.033 N/A ILE 319.A N SER 316.A O no hydrogen 3.090 N/A GLU 321.A N LEU 317.A O no hydrogen 2.891 N/A LEU 322.A N ALA 318.A O no hydrogen 2.868 N/A MET 323.A N ILE 319.A O no hydrogen 3.231 N/A ARG 324.A N PRO 320.A O no hydrogen 2.849 N/A ARG 324.A NE GLU 321.A OE2 no hydrogen 2.852 N/A ARG 324.A NH1 GLU 321.A OE1 no hydrogen 2.857 N/A ARG 324.A NH1 GLU 321.A OE2 no hydrogen 3.540 N/A VAL 325.A N GLU 321.A O no hydrogen 2.977 N/A LEU 326.A N LEU 322.A O no hydrogen 2.926 N/A VAL 327.A N MET 323.A O no hydrogen 2.828 N/A ASP 328.A N ARG 324.A O no hydrogen 2.788 N/A LEU 329.A N VAL 325.A O no hydrogen 3.117 N/A GLU 330.A N VAL 325.A O no hydrogen 2.930 N/A LEU 332.A N LEU 326.A O no hydrogen 2.914 N/A LYS 336.A N ASP 333.A OD2 no hydrogen 3.070 N/A LYS 336.A NZ ASP 300.A OD2 no hydrogen 2.694 N/A ALA 337.A N ASP 333.A O no hydrogen 3.061 N/A TRP 338.A N TRP 334.A O no hydrogen 2.839 N/A GLU 339.A N ASP 335.A O no hydrogen 3.106 N/A VAL 340.A N LYS 336.A O no hydrogen 3.027 N/A THR 341.A N ALA 337.A O no hydrogen 2.883 N/A THR 341.A OG1 ALA 337.A O no hydrogen 2.934 N/A VAL 342.A N TRP 338.A O no hydrogen 2.967 N/A LYS 343.A N GLU 339.A O no hydrogen 3.190 N/A THR 344.A N VAL 340.A O no hydrogen 3.043 N/A THR 344.A N THR 341.A O no hydrogen 3.117 N/A THR 344.A OG1 VAL 340.A O no hydrogen 2.800 N/A CYS 345.A N THR 341.A O no hydrogen 3.016 N/A CYS 345.A SG THR 341.A O no hydrogen 3.607 N/A ALA 346.A N ILE 308.A O no hydrogen 3.022 N/A TYR 347.A N ALA 424.A O no hydrogen 2.949 N/A THR 348.A N LEU 310.A O no hydrogen 3.077 N/A THR 348.A OG1 ASN 426.A OD1 no hydrogen 2.756 N/A ASN 349.A N ASN 426.A O no hydrogen 2.986 N/A ASN 349.A ND2 TYR 347.A OH no hydrogen 3.252 N/A ASN 349.A ND2 THR 351.A O no hydrogen 3.251 N/A HIS 350.A N ASP 312.A OD1 no hydrogen 3.307 N/A HIS 350.A NE2 ASN 311.A OD1 no hydrogen 2.584 N/A THR 351.A N ASN 349.A OD1 no hydrogen 3.180 N/A THR 351.A OG1 ASN 267.A OD1 no hydrogen 3.404 N/A LEU 353.A N THR 351.A OG1 no hydrogen 3.185 N/A GLU 355.A N GLU 355.A OE1 no hydrogen 2.773 N/A ALA 356.A N LEU 353.A O no hydrogen 3.095 N/A LEU 357.A N PRO 354.A O no hydrogen 3.269 N/A ARG 359.A NH1 PRO 354.A O no hydrogen 3.169 N/A ARG 359.A NH2 GLU 405.A OE1 no hydrogen 3.424 N/A TRP 360.A N ILE 412.A O no hydrogen 3.063 N/A VAL 362.A N LYS 410.A O no hydrogen 2.917 N/A LEU 364.A N PRO 361.A O no hydrogen 3.247 N/A GLU 366.A N VAL 362.A O no hydrogen 2.833 N/A THR 367.A N HIS 363.A O no hydrogen 3.295 N/A THR 367.A OG1 HIS 363.A O no hydrogen 2.959 N/A LEU 368.A N LEU 364.A O no hydrogen 2.935 N/A LEU 369.A N LEU 365.A O no hydrogen 2.795 N/A ARG 371.A NE GLN 374.A OE1 no hydrogen 3.324 N/A ARG 371.A NH1 GLN 374.A OE1 no hydrogen 3.260 N/A ARG 371.A NH2 ASP 328.A OD1 no hydrogen 2.929 N/A HIS 372.A NE2 GLU 321.A OE2 no hydrogen 2.588 N/A LEU 373.A N LEU 369.A O no hydrogen 3.113 N/A GLN 374.A N PRO 370.A O no hydrogen 3.344 N/A ILE 375.A N ARG 371.A O no hydrogen 3.051 N/A ILE 376.A N HIS 372.A O no hydrogen 2.895 N/A TYR 377.A N LEU 373.A O no hydrogen 2.953 N/A GLU 378.A N GLN 374.A O no hydrogen 3.121 N/A ILE 379.A N ILE 375.A O no hydrogen 2.903 N/A ASN 380.A N ILE 376.A O no hydrogen 2.937 N/A ASN 380.A ND2 SER 402.A OG no hydrogen 3.294 N/A GLN 381.A N TYR 377.A O no hydrogen 2.977 N/A ARG 382.A N GLU 378.A O no hydrogen 3.166 N/A ARG 382.A NE GLU 378.A OE1 no hydrogen 2.744 N/A ARG 382.A NH1 GLU 378.A OE1 no hydrogen 3.379 N/A PHE 383.A N ILE 379.A O no hydrogen 2.898 N/A LEU 384.A N ASN 380.A O no hydrogen 2.815 N/A ASN 385.A N GLN 381.A O no hydrogen 3.005 N/A ARG 386.A N ARG 382.A O no hydrogen 3.271 N/A VAL 387.A N PHE 383.A O no hydrogen 3.081 N/A ALA 388.A N LEU 384.A O no hydrogen 2.916 N/A ALA 389.A N ASN 385.A O no hydrogen 3.120 N/A ALA 390.A N ARG 386.A O no hydrogen 3.084 N/A PHE 391.A N VAL 387.A O no hydrogen 2.848 N/A ASP 394.A N PHE 391.A O no hydrogen 3.145 N/A VAL 395.A N GLY 393.A O no hydrogen 2.938 N/A ARG 397.A N ASP 394.A OD2 no hydrogen 3.223 N/A ARG 397.A NE ASP 394.A OD1 no hydrogen 3.033 N/A ARG 397.A NH1 GLU 446.A OE1 no hydrogen 2.750 N/A ARG 397.A NH2 GLU 446.A OE1 no hydrogen 2.878 N/A LEU 398.A N ASP 394.A O no hydrogen 3.377 N/A ARG 399.A N VAL 395.A O no hydrogen 3.377 N/A ARG 399.A NE ASP 396.A OD1 no hydrogen 2.748 N/A ARG 399.A NE ASP 396.A OD2 no hydrogen 3.407 N/A ARG 399.A NH1 ASP 396.A OD2 no hydrogen 3.212 N/A ARG 400.A N ASP 396.A O no hydrogen 2.997 N/A ARG 400.A NE ASP 443.A OD2 no hydrogen 2.699 N/A ARG 400.A NH1 ASP 443.A OD1 no hydrogen 2.840 N/A ARG 400.A NH1 ASP 443.A OD2 no hydrogen 3.421 N/A ARG 400.A NH2 ASP 396.A OD2 no hydrogen 2.987 N/A MET 401.A N ARG 397.A O no hydrogen 2.852 N/A SER 402.A OG VAL 404.A O no hydrogen 2.781 N/A LEU 403.A N ASN 380.A OD1 no hydrogen 2.741 N/A VAL 404.A N SER 402.A OG no hydrogen 2.965 N/A GLU 405.A N ARG 411.A O no hydrogen 2.733 N/A ARG 411.A N GLU 405.A O no hydrogen 3.086 N/A ARG 411.A NH2 ARG 359.A O no hydrogen 3.082 N/A ILE 412.A N TRP 360.A O no hydrogen 2.816 N/A ASN 413.A N LEU 403.A O no hydrogen 2.828 N/A MET 414.A N GLU 358.A O no hydrogen 3.148 N/A HIS 416.A N ASN 413.A OD1 no hydrogen 3.216 N/A HIS 416.A ND1 SER 402.A O no hydrogen 2.961 N/A LEU 417.A N ASN 413.A O no hydrogen 3.233 N/A CYS 418.A N MET 414.A O no hydrogen 2.987 N/A CYS 418.A SG MET 414.A O no hydrogen 3.399 N/A ILE 419.A N ALA 415.A O no hydrogen 3.027 N/A ALA 420.A N HIS 416.A O no hydrogen 3.094 N/A GLY 421.A N LEU 417.A O no hydrogen 3.061 N/A SER 422.A N ILE 419.A O no hydrogen 3.475 N/A SER 422.A OG CYS 418.A O no hydrogen 2.781 N/A HIS 423.A N CYS 345.A O no hydrogen 3.034 N/A HIS 423.A ND1 VAL 342.A O no hydrogen 3.227 N/A HIS 423.A NE2 ILE 796.A O no hydrogen 3.268 N/A VAL 425.A N LYS 451.A O no hydrogen 2.791 N/A ASN 426.A N TYR 347.A O no hydrogen 3.004 N/A ASN 426.A ND2 GLY 427.A O no hydrogen 2.990 N/A ASN 426.A ND2 TYR 792.A OH no hydrogen 3.053 N/A GLY 427.A N GLN 453.A O no hydrogen 3.289 N/A ARG 430.A N GLU 670.A OE2 no hydrogen 2.775 N/A ARG 430.A NH1 GLU 673.A OE1 no hydrogen 2.928 N/A ARG 430.A NH1 GLU 673.A OE2 no hydrogen 3.013 N/A ARG 430.A NH2 GLU 673.A OE1 no hydrogen 2.785 N/A SER 433.A N ALA 429.A O no hydrogen 2.885 N/A SER 433.A OG ALA 429.A O no hydrogen 3.321 N/A SER 433.A OG GLN 453.A O no hydrogen 3.500 N/A GLU 434.A N ARG 430.A O no hydrogen 3.064 N/A ILE 435.A N ILE 431.A O no hydrogen 2.965 N/A LEU 436.A N HIS 432.A O no hydrogen 3.001 N/A LYS 437.A N SER 433.A O no hydrogen 3.300 N/A LYS 437.A NZ GLU 434.A OE2 no hydrogen 2.868 N/A LYS 438.A N GLU 434.A O no hydrogen 2.962 N/A LYS 438.A NZ GLU 434.A OE1 no hydrogen 3.070 N/A THR 439.A N ILE 435.A O no hydrogen 2.813 N/A THR 439.A OG1 ILE 435.A O no hydrogen 2.726 N/A PHE 441.A N LEU 436.A O no hydrogen 3.013 N/A LYS 442.A N THR 439.A O no hydrogen 3.194 N/A LYS 442.A NZ GLU 446.A OE2 no hydrogen 2.883 N/A TYR 445.A N PHE 441.A O no hydrogen 2.962 N/A GLU 446.A N LYS 442.A O no hydrogen 3.039 N/A LEU 447.A N ASP 443.A O no hydrogen 3.205 N/A GLU 448.A N PHE 444.A O no hydrogen 2.908 N/A LYS 451.A N GLU 448.A O no hydrogen 3.239 N/A LYS 451.A NZ ILE 419.A O no hydrogen 2.752 N/A LYS 451.A NZ ALA 420.A O no hydrogen 3.480 N/A LYS 451.A NZ GLU 448.A OE1 no hydrogen 2.680 N/A LYS 451.A NZ GLU 448.A OE2 no hydrogen 3.325 N/A PHE 452.A N PRO 449.A O no hydrogen 3.300 N/A GLN 453.A N VAL 425.A O no hydrogen 2.812 N/A GLN 453.A NE2 GLU 795.A O no hydrogen 3.354 N/A ASN 454.A ND2 GLY 427.A O no hydrogen 3.652 N/A ASN 454.A ND2 SER 433.A OG no hydrogen 2.704 N/A LYS 455.A N GLY 427.A O no hydrogen 3.108 N/A LYS 455.A NZ GLN 453.A OE1 no hydrogen 2.719 N/A LYS 455.A NZ ASN 454.A O no hydrogen 2.861 N/A LYS 455.A NZ GLU 795.A OE2 no hydrogen 2.688 N/A THR 456.A OG1 ASN 454.A OD1 no hydrogen 3.057 N/A THR 456.A OG1 GLU 670.A OE1 no hydrogen 2.695 N/A THR 456.A OG1 GLU 670.A OE2 no hydrogen 3.349 N/A ASN 457.A N VAL 428.A O no hydrogen 2.862 N/A ILE 459.A N PHE 783.A O no hydrogen 2.864 N/A THR 460.A OG1 ASP 134.A OD2 no hydrogen 2.594 N/A ARG 462.A N THR 460.A OG1 no hydrogen 3.217 N/A ARG 462.A NE ASP 134.A OD2 no hydrogen 3.093 N/A ARG 462.A NH1 ASP 134.A OD2 no hydrogen 2.800 N/A ARG 462.A NH1 ASP 786.A OD1 no hydrogen 2.859 N/A ARG 462.A NH2 ILE 485.A O no hydrogen 3.014 N/A ARG 462.A NH2 ASP 786.A OD2 no hydrogen 2.746 N/A ARG 463.A NH1 ARG 82.A O no hydrogen 2.964 N/A ARG 463.A NH2 ARG 82.A O no hydrogen 3.184 N/A ARG 463.A NH2 GLU 627.A OE1 no hydrogen 2.772 N/A TRP 464.A N THR 460.A O no hydrogen 3.082 N/A VAL 466.A N PRO 461.A O no hydrogen 3.227 N/A LEU 467.A N ARG 462.A O no hydrogen 2.888 N/A CYS 468.A SG ARG 463.A O no hydrogen 3.481 N/A CYS 468.A SG ASN 656.A OD1 no hydrogen 4.036 N/A ASN 469.A N LEU 465.A O no hydrogen 2.740 N/A ASN 469.A ND2 ASN 656.A OD1 no hydrogen 2.813 N/A ALA 473.A N ASN 469.A O no hydrogen 3.066 N/A GLU 474.A N PRO 470.A O no hydrogen 2.881 N/A ILE 475.A N GLY 471.A O no hydrogen 3.312 N/A ILE 476.A N LEU 472.A O no hydrogen 3.150 N/A ALA 477.A N ALA 473.A O no hydrogen 2.943 N/A GLU 478.A N GLU 474.A O no hydrogen 2.881 N/A ARG 479.A N ILE 476.A O no hydrogen 3.100 N/A ILE 480.A N ILE 476.A O no hydrogen 3.021 N/A GLY 481.A N ALA 477.A O no hydrogen 2.900 N/A TYR 484.A OH ALA 473.A O no hydrogen 2.818 N/A ILE 485.A N GLU 482.A O no hydrogen 3.225 N/A SER 486.A N GLU 483.A O no hydrogen 3.386 N/A ASP 487.A N TYR 484.A O no hydrogen 3.102 N/A GLN 490.A N ASP 487.A O no hydrogen 3.071 N/A GLN 490.A NE2 GLU 483.A OE1 no hydrogen 2.878 N/A GLN 490.A NE2 ASP 487.A OD1 no hydrogen 3.231 N/A LEU 491.A N LEU 488.A O no hydrogen 3.026 N/A ARG 492.A N ASP 489.A O no hydrogen 3.111 N/A ARG 492.A NH2 GLU 674.A OE1 no hydrogen 3.216 N/A LYS 493.A N GLN 490.A O no hydrogen 3.049 N/A LYS 493.A NZ GLN 490.A OE1 no hydrogen 2.739 N/A LEU 494.A N LEU 491.A O no hydrogen 2.934 N/A LEU 495.A N ARG 492.A O no hydrogen 2.966 N/A SER 496.A N LYS 493.A O no hydrogen 3.228 N/A SER 496.A OG LYS 493.A O no hydrogen 3.522 N/A TYR 497.A N LEU 494.A O no hydrogen 2.918 N/A VAL 498.A N LEU 495.A O no hydrogen 3.474 N/A ASP 500.A N TYR 497.A O no hydrogen 2.991 N/A PHE 503.A N ASP 500.A OD2 no hydrogen 3.094 N/A ILE 504.A N ASP 500.A O no hydrogen 2.985 N/A ARG 505.A N GLU 501.A O no hydrogen 3.171 N/A ASP 506.A N ALA 502.A O no hydrogen 3.007 N/A VAL 507.A N PHE 503.A O no hydrogen 2.844 N/A ALA 508.A N ILE 504.A O no hydrogen 3.123 N/A LYS 509.A N ARG 505.A O no hydrogen 2.901 N/A LYS 509.A NZ ASP 506.A O no hydrogen 3.434 N/A VAL 510.A N ASP 506.A O no hydrogen 2.943 N/A LYS 511.A N VAL 507.A O no hydrogen 3.216 N/A LYS 511.A NZ PRO 631.A O no hydrogen 2.744 N/A LYS 511.A NZ ALA 633.A O no hydrogen 2.774 N/A LYS 511.A NZ ASN 656.A O no hydrogen 2.823 N/A GLN 512.A N ALA 508.A O no hydrogen 3.121 N/A GLU 513.A N LYS 509.A O no hydrogen 2.972 N/A ASN 514.A N VAL 510.A O no hydrogen 3.023 N/A ASN 514.A ND2 ASN 469.A OD1 no hydrogen 2.976 N/A ASN 514.A ND2 PRO 631.A O no hydrogen 3.278 N/A LYS 515.A N LYS 511.A O no hydrogen 2.894 N/A LYS 515.A NZ SER 534.A O no hydrogen 2.799 N/A LYS 515.A NZ ASP 634.A OD2 no hydrogen 2.793 N/A LEU 516.A N GLN 512.A O no hydrogen 2.858 N/A LYS 517.A N GLU 513.A O no hydrogen 2.945 N/A PHE 518.A N ASN 514.A O no hydrogen 2.963 N/A ALA 519.A N LYS 515.A O no hydrogen 2.889 N/A ALA 520.A N LEU 516.A O no hydrogen 2.995 N/A TYR 521.A N LYS 517.A O no hydrogen 2.936 N/A LEU 522.A N PHE 518.A O no hydrogen 3.036 N/A GLU 523.A N ALA 519.A O no hydrogen 3.288 N/A ARG 524.A N ALA 520.A O no hydrogen 3.076 N/A GLU 525.A N TYR 521.A O no hydrogen 3.131 N/A TYR 526.A N LEU 522.A O no hydrogen 2.973 N/A LYS 527.A N GLU 523.A O no hydrogen 2.889 N/A LYS 527.A NZ GLU 523.A O no hydrogen 3.533 N/A HIS 529.A ND1 GLU 523.A OE2 no hydrogen 2.833 N/A ASN 533.A N ASN 531.A OD1 no hydrogen 3.184 N/A SER 534.A N ASN 531.A O no hydrogen 3.208 N/A SER 534.A OG ASN 531.A O no hydrogen 2.518 N/A SER 534.A OG THR 575.A OG1 no hydrogen 2.640 N/A LEU 535.A N PRO 573.A O no hydrogen 2.855 N/A PHE 536.A N ASP 634.A OD2 no hydrogen 2.956 N/A ASP 537.A N THR 575.A O no hydrogen 2.794 N/A VAL 538.A N LEU 635.A O no hydrogen 2.972 N/A GLN 539.A N MET 577.A O no hydrogen 2.884 N/A LYS 541.A N GLY 579.A O no hydrogen 3.159 N/A LYS 541.A NZ GLN 638.A OE1 no hydrogen 2.702 N/A ARG 542.A NE LYS 581.A O no hydrogen 3.064 N/A ARG 542.A NH1 PRO 264.A O no hydrogen 2.819 N/A ARG 542.A NH2 ASN 122.A O no hydrogen 3.207 N/A ARG 542.A NH2 ASN 122.A OD1 no hydrogen 2.762 N/A ILE 543.A N LYS 581.A O no hydrogen 2.942 N/A HIS 544.A N GLN 549.A OE1 no hydrogen 3.452 N/A HIS 544.A NE2.B ASP 266.A O no hydrogen 2.799 N/A GLU 545.A N TYR 586.A OH no hydrogen 3.155 N/A TYR 546.A N HIS 544.A ND1.A no hydrogen 3.112 N/A TYR 546.A OH GLU 645.A OE1 no hydrogen 2.587 N/A LYS 547.A N HIS 544.A O no hydrogen 3.143 N/A LYS 547.A NZ GLU 645.A OE1 no hydrogen 3.429 N/A LYS 547.A NZ GLU 645.A OE2 no hydrogen 2.739 N/A ARG 548.A N GLU 545.A O no hydrogen 3.132 N/A ARG 548.A NE ILE 639.A O no hydrogen 2.872 N/A ARG 548.A NH1 PHE 743.A O no hydrogen 3.400 N/A ARG 548.A NH1 ASP 748.A OD2 no hydrogen 2.779 N/A ARG 548.A NH2 ILE 639.A O no hydrogen 3.117 N/A ARG 548.A NH2 ASP 748.A OD2 no hydrogen 2.764 N/A GLN 549.A N GLN 549.A OE1 no hydrogen 2.958 N/A GLN 549.A NE2 ARG 542.A O no hydrogen 3.171 N/A LEU 551.A N ARG 548.A O no hydrogen 2.960 N/A ASN 552.A N ARG 548.A O no hydrogen 3.450 N/A CYS 553.A N GLN 549.A O no hydrogen 2.946 N/A CYS 553.A SG GLN 549.A O no hydrogen 3.477 N/A LEU 554.A N LEU 550.A O no hydrogen 3.068 N/A HIS 555.A N LEU 551.A O no hydrogen 3.107 N/A VAL 556.A N ASN 552.A O no hydrogen 2.981 N/A ILE 557.A N CYS 553.A O no hydrogen 3.013 N/A THR 558.A N LEU 554.A O no hydrogen 2.985 N/A THR 558.A OG1 LEU 554.A O no hydrogen 2.705 N/A THR 558.A OG1 TYR 749.A OH no hydrogen 2.649 N/A LEU 559.A N HIS 555.A O no hydrogen 3.006 N/A TYR 560.A N VAL 556.A O no hydrogen 3.068 N/A TYR 560.A OH ASP 606.A OD2 no hydrogen 2.711 N/A ASN 561.A N ILE 557.A O no hydrogen 2.878 N/A ASN 561.A ND2 GLN 716.A OE1 no hydrogen 2.862 N/A ARG 562.A N THR 558.A O no hydrogen 2.945 N/A ARG 562.A NE GLU 709.A OE2 no hydrogen 2.854 N/A ARG 562.A NH1 GLU 709.A OE1 no hydrogen 2.715 N/A ARG 562.A NH2 GLU 757.A OE2 no hydrogen 2.856 N/A ILE 563.A N LEU 559.A O no hydrogen 3.036 N/A LYS 564.A N TYR 560.A O no hydrogen 2.958 N/A LYS 564.A NZ ASP 606.A OD2 no hydrogen 2.747 N/A LYS 565.A N ASN 561.A O no hydrogen 2.989 N/A GLU 566.A N ARG 562.A O no hydrogen 3.044 N/A LYS 569.A N GLU 566.A O no hydrogen 3.295 N/A LYS 569.A NZ GLU 566.A OE1 no hydrogen 3.087 N/A ARG 574.A N ARG 612.A O no hydrogen 2.976 N/A ARG 574.A NH1 ASP 537.A OD1 no hydrogen 2.811 N/A ARG 574.A NH1 GLN 756.A OE1 no hydrogen 2.725 N/A ARG 574.A NH2 GLN 756.A OE1 no hydrogen 3.086 N/A ARG 574.A NH2 SER 760.A OG no hydrogen 2.920 N/A THR 575.A N LEU 535.A O no hydrogen 2.796 N/A THR 575.A OG1 SER 534.A OG no hydrogen 2.640 N/A VAL 576.A N ARG 614.A O no hydrogen 2.836 N/A MET 577.A N ASP 537.A O no hydrogen 2.712 N/A ILE 578.A N ILE 616.A O no hydrogen 3.034 N/A GLY 579.A N GLN 539.A O no hydrogen 3.042 N/A LYS 581.A NZ PHE 155.A O no hydrogen 2.639 N/A LYS 581.A NZ ASN 620.A OD1 no hydrogen 3.038 N/A ALA 582.A N GLN 164.A OE1 no hydrogen 3.091 N/A TYR 586.A N ALA 583.A O no hydrogen 3.032 N/A TYR 586.A OH GLU 545.A OE2 no hydrogen 2.805 N/A LYS 590.A N TYR 586.A O no hydrogen 3.166 N/A LYS 590.A NZ GLU 166.A OE2 no hydrogen 2.573 N/A LYS 590.A NZ PRO 584.A O no hydrogen 3.521 N/A MET 591.A N HIS 587.A O no hydrogen 2.984 N/A ILE 592.A N MET 588.A O no hydrogen 2.985 N/A ILE 593.A N ALA 589.A O no hydrogen 3.248 N/A LYS 594.A N LYS 590.A O no hydrogen 3.219 N/A LYS 594.A NZ GLY 161.A O no hydrogen 2.783 N/A LEU 595.A N MET 591.A O no hydrogen 2.871 N/A ILE 596.A N ILE 592.A O no hydrogen 2.993 N/A THR 597.A N ILE 593.A O no hydrogen 3.079 N/A THR 597.A OG1 GLY 162.A O no hydrogen 3.210 N/A THR 597.A OG1 ILE 593.A O no hydrogen 3.556 N/A THR 597.A OG1 LYS 594.A O no hydrogen 3.007 N/A ALA 598.A N LYS 594.A O no hydrogen 2.887 N/A ILE 599.A N LEU 595.A O no hydrogen 2.848 N/A GLY 600.A N ILE 596.A O no hydrogen 3.087 N/A ASP 601.A N THR 597.A O no hydrogen 2.932 N/A VAL 602.A N ALA 598.A O no hydrogen 3.345 N/A VAL 602.A N ILE 599.A O no hydrogen 3.107 N/A VAL 603.A N ILE 599.A O no hydrogen 2.855 N/A ASN 604.A N GLY 600.A O no hydrogen 2.840 N/A ASN 604.A ND2 VAL 615.A O no hydrogen 2.879 N/A HIS 605.A ND1 ASP 601.A O no hydrogen 3.004 N/A ASP 606.A N VAL 603.A O no hydrogen 3.451 N/A VAL 608.A N ASP 606.A OD1 no hydrogen 3.020 N/A VAL 609.A N ASP 606.A O no hydrogen 3.153 N/A GLY 610.A N ASP 606.A O no hydrogen 3.498 N/A ARG 612.A N VAL 609.A O no hydrogen 3.350 N/A ARG 612.A NE VAL 609.A O no hydrogen 3.023 N/A ARG 612.A NH1 PRO 567.A O no hydrogen 2.856 N/A ARG 612.A NH2 PRO 567.A O no hydrogen 2.940 N/A ARG 612.A NH2 VAL 608.A O no hydrogen 2.812 N/A ARG 614.A N ARG 574.A O no hydrogen 3.206 N/A VAL 615.A N ASN 604.A OD1 no hydrogen 2.938 N/A ILE 616.A N VAL 576.A O no hydrogen 2.929 N/A LEU 618.A N ILE 578.A O no hydrogen 2.757 N/A ASN 620.A N GLN 157.A OE1 no hydrogen 2.877 N/A ASN 620.A ND2 ASN 156.A OD1 no hydrogen 3.201 N/A ARG 622.A NH2 ASN 620.A O no hydrogen 2.894 N/A SER 624.A N ASP 117.A OD2 no hydrogen 3.008 N/A SER 624.A OG ASP 117.A OD1 no hydrogen 3.200 N/A SER 624.A OG ASP 117.A OD2 no hydrogen 3.557 N/A ALA 626.A N ARG 622.A O no hydrogen 2.917 N/A GLU 627.A N VAL 623.A O no hydrogen 3.052 N/A LYS 628.A N LEU 625.A O no hydrogen 2.991 N/A LYS 628.A NZ GLU 113.A OE1 no hydrogen 2.796 N/A LYS 628.A NZ GLU 113.A OE2 no hydrogen 3.148 N/A VAL 629.A N LEU 625.A O no hydrogen 2.948 N/A ILE 630.A N ALA 626.A O no hydrogen 3.063 N/A ALA 632.A N VAL 629.A O no hydrogen 2.985 N/A ALA 633.A N ILE 630.A O no hydrogen 3.172 N/A ASP 634.A N PHE 536.A O no hydrogen 2.992 N/A LEU 635.A N PHE 536.A O no hydrogen 3.040 N/A SER 636.A N LEU 659.A O no hydrogen 2.805 N/A GLU 637.A N VAL 538.A O no hydrogen 3.092 N/A GLN 638.A N ILE 661.A O no hydrogen 2.943 N/A GLN 638.A NE2 SER 636.A OG no hydrogen 2.804 N/A SER 640.A OG ASP 665.A OD1 no hydrogen 2.542 N/A THR 641.A N TYR 546.A O no hydrogen 3.412 N/A THR 641.A OG1 PHE 743.A O no hydrogen 2.666 N/A GLY 643.A N ASP 665.A OD2 no hydrogen 2.752 N/A THR 644.A N THR 641.A O no hydrogen 3.151 N/A THR 644.A N ASP 665.A OD1 no hydrogen 3.407 N/A THR 644.A OG1 THR 641.A O no hydrogen 2.672 N/A GLU 645.A N ASP 665.A OD1 no hydrogen 2.842 N/A SER 647.A OG VAL 428.A O no hydrogen 3.372 N/A SER 647.A OG ASN 457.A OD1 no hydrogen 3.482 N/A SER 647.A OG GLY 648.A O no hydrogen 2.866 N/A MET 652.A N THR 649.A O no hydrogen 3.062 N/A MET 654.A N ASN 651.A O no hydrogen 3.172 N/A LEU 655.A N MET 652.A O no hydrogen 3.064 N/A ASN 656.A N PHE 653.A O no hydrogen 3.203 N/A ASN 656.A ND2 TRP 464.A O no hydrogen 2.763 N/A ALA 658.A N PHE 653.A O no hydrogen 3.152 N/A LEU 659.A N ASP 634.A O no hydrogen 2.816 N/A ILE 661.A N SER 636.A O no hydrogen 2.965 N/A GLY 662.A N PHE 681.A O no hydrogen 2.974 N/A THR 663.A N GLN 638.A O no hydrogen 3.219 N/A THR 663.A OG1 SER 640.A O no hydrogen 2.622 N/A ASP 665.A N THR 663.A O no hydrogen 2.876 N/A ALA 667.A N SER 647.A O no hydrogen 2.905 N/A ASN 668.A N ASP 665.A O no hydrogen 3.010 N/A ASN 668.A ND2 GLN 638.A O no hydrogen 3.149 N/A ASN 668.A ND2 THR 663.A O no hydrogen 2.940 N/A MET 671.A N ALA 667.A O no hydrogen 2.870 N/A ALA 672.A N ASN 668.A O no hydrogen 2.935 N/A GLU 673.A N VAL 669.A O no hydrogen 3.077 N/A GLU 674.A N GLU 670.A O no hydrogen 2.877 N/A ALA 675.A N MET 671.A O no hydrogen 2.934 N/A GLY 676.A N ALA 672.A O no hydrogen 2.791 N/A ASN 679.A N GLY 676.A O no hydrogen 2.927 N/A ASN 679.A ND2 ALA 675.A O no hydrogen 2.903 N/A PHE 680.A N GLU 677.A O no hydrogen 3.359 N/A PHE 681.A N THR 660.A O no hydrogen 2.984 N/A PHE 683.A N GLY 662.A O no hydrogen 3.222 N/A GLY 684.A N GLU 751.A OE2 no hydrogen 2.845 N/A MET 685.A N ASP 748.A OD1 no hydrogen 2.900 N/A ARG 686.A N ASP 689.A OD1 no hydrogen 2.836 N/A ARG 686.A NH2 GLY 684.A O no hydrogen 2.876 N/A VAL 690.A N ARG 686.A O no hydrogen 3.074 N/A ASP 691.A N VAL 687.A O no hydrogen 3.009 N/A ARG 692.A N GLU 688.A O no hydrogen 2.971 N/A LEU 693.A N ASP 689.A O no hydrogen 3.021 N/A ASP 694.A N VAL 690.A O no hydrogen 2.973 N/A GLN 695.A N ASP 691.A O no hydrogen 3.122 N/A ARG 696.A N ARG 692.A O no hydrogen 3.301 N/A GLY 697.A N LEU 693.A O no hydrogen 2.773 N/A GLN 701.A NE2 ASP 705.A OD1 no hydrogen 3.203 N/A GLU 702.A N ASN 699.A O no hydrogen 3.179 N/A TYR 704.A N ALA 700.A O no hydrogen 3.179 N/A ASP 705.A N GLN 701.A O no hydrogen 2.811 N/A ARG 706.A N GLU 702.A O no hydrogen 3.170 N/A ARG 706.A N TYR 703.A O no hydrogen 3.196 N/A ILE 707.A N TYR 703.A O no hydrogen 3.014 N/A ARG 711.A N ILE 707.A O no hydrogen 3.085 N/A ARG 711.A NE TYR 704.A O no hydrogen 3.230 N/A ARG 711.A NH1 TYR 704.A O no hydrogen 3.387 N/A GLN 712.A N PRO 708.A O no hydrogen 3.071 N/A ILE 713.A N GLU 709.A O no hydrogen 3.401 N/A ILE 714.A N LEU 710.A O no hydrogen 3.095 N/A GLU 715.A N ARG 711.A O no hydrogen 2.936 N/A GLN 716.A N GLN 712.A O no hydrogen 2.889 N/A GLN 716.A NE2 ASN 561.A OD1 no hydrogen 2.986 N/A LEU 717.A N ILE 713.A O no hydrogen 2.933 N/A SER 718.A N ILE 714.A O no hydrogen 2.907 N/A SER 718.A OG ILE 714.A O no hydrogen 2.969 N/A SER 719.A N GLU 715.A O no hydrogen 2.946 N/A SER 719.A OG GLU 715.A O no hydrogen 2.971 N/A SER 719.A OG GLN 716.A O no hydrogen 3.426 N/A PHE 721.A N GLN 716.A O no hydrogen 3.039 N/A SER 723.A N GLY 720.A O no hydrogen 3.095 N/A SER 723.A OG GLN 726.A O no hydrogen 2.919 N/A GLN 726.A N SER 723.A O no hydrogen 3.131 N/A LEU 729.A N GLN 726.A O no hydrogen 3.035 N/A LYS 731.A N ASP 728.A O no hydrogen 3.159 N/A VAL 734.A N PHE 730.A O no hydrogen 3.101 N/A ASN 735.A N LYS 731.A O no hydrogen 2.904 N/A MET 736.A N ASP 732.A O no hydrogen 3.041 N/A LEU 737.A N ILE 733.A O no hydrogen 3.002 N/A MET 738.A N VAL 734.A O no hydrogen 2.914 N/A HIS 739.A N ASN 735.A O no hydrogen 2.900 N/A HIS 740.A N MET 736.A O no hydrogen 2.894 N/A ARG 742.A NH1 GLU 355.A OE2 no hydrogen 2.757 N/A ARG 742.A NH2 GLU 355.A OE1 no hydrogen 3.068 N/A ARG 742.A NH2 GLU 355.A OE2 no hydrogen 3.446 N/A PHE 743.A N ASP 741.A OD1 no hydrogen 2.953 N/A LYS 744.A NZ ASP 694.A OD1 no hydrogen 2.711 N/A VAL 745.A N ASP 741.A OD2 no hydrogen 2.803 N/A ALA 747.A N LYS 744.A O no hydrogen 3.230 N/A ASP 748.A N VAL 745.A O no hydrogen 3.369 N/A TYR 749.A N PHE 746.A O no hydrogen 3.121 N/A TYR 749.A OH THR 558.A OG1 no hydrogen 2.649 N/A TYR 752.A N ASP 748.A O no hydrogen 3.007 N/A TYR 752.A OH GLU 637.A OE1 no hydrogen 3.408 N/A TYR 752.A OH GLU 637.A OE2 no hydrogen 2.744 N/A VAL 753.A N TYR 749.A O no hydrogen 3.011 N/A LYS 754.A N GLU 750.A O no hydrogen 3.136 N/A CYS 755.A N GLU 751.A O no hydrogen 2.979 N/A CYS 755.A SG ILE 682.A O no hydrogen 4.012 N/A GLN 756.A N TYR 752.A O no hydrogen 2.916 N/A GLN 756.A NE2 GLU 637.A OE1 no hydrogen 3.063 N/A GLN 756.A NE2 TYR 752.A OH no hydrogen 3.191 N/A GLU 757.A N VAL 753.A O no hydrogen 3.048 N/A ARG 758.A N LYS 754.A O no hydrogen 3.220 N/A VAL 759.A N CYS 755.A O no hydrogen 3.076 N/A SER 760.A N GLN 756.A O no hydrogen 3.123 N/A SER 760.A OG GLN 756.A O no hydrogen 3.451 N/A ALA 761.A N GLU 757.A O no hydrogen 3.056 N/A LEU 762.A N ARG 758.A O no hydrogen 3.139 N/A TYR 763.A N VAL 759.A O no hydrogen 3.045 N/A LYS 764.A N SER 760.A O no hydrogen 3.258 N/A ASN 765.A N LEU 762.A O no hydrogen 2.996 N/A ARG 767.A NH2 GLU 501.A OE1 no hydrogen 2.834 N/A GLU 768.A N ASN 765.A OD1 no hydrogen 3.336 N/A TRP 769.A N ASN 765.A O no hydrogen 2.915 N/A THR 770.A N PRO 766.A O no hydrogen 3.016 N/A THR 770.A OG1 PRO 766.A O no hydrogen 2.986 N/A ARG 771.A N ARG 767.A O no hydrogen 3.093 N/A ARG 771.A NE VAL 498.A O no hydrogen 3.255 N/A ARG 771.A NH1 ASP 499.A OD2 no hydrogen 2.845 N/A ARG 771.A NH2 GLU 768.A OE2 no hydrogen 2.727 N/A MET 772.A N GLU 768.A O no hydrogen 3.160 N/A VAL 773.A N TRP 769.A O no hydrogen 3.037 N/A ILE 774.A N THR 770.A O no hydrogen 2.864 N/A ARG 775.A N ARG 771.A O no hydrogen 3.085 N/A ASN 776.A N MET 772.A O no hydrogen 3.050 N/A ASN 776.A ND2 ASN 679.A O no hydrogen 3.006 N/A ASN 776.A ND2 MET 772.A O no hydrogen 2.996 N/A ILE 777.A N VAL 773.A O no hydrogen 2.951 N/A ALA 778.A N ILE 774.A O no hydrogen 2.948 N/A THR 779.A N ASN 776.A O no hydrogen 3.116 N/A THR 779.A OG1 ARG 775.A O no hydrogen 2.932 N/A THR 779.A OG1 ASN 776.A O no hydrogen 3.360 N/A SER 780.A N ILE 777.A O no hydrogen 3.202 N/A SER 780.A OG ILE 777.A O no hydrogen 2.704 N/A LYS 782.A NZ GLU 670.A OE1 no hydrogen 2.781 N/A PHE 783.A N SER 780.A O no hydrogen 2.968 N/A SER 784.A N GLY 781.A O no hydrogen 3.166 N/A SER 785.A N ILE 459.A O no hydrogen 2.851 N/A SER 785.A OG SER 135.A OG no hydrogen 2.703 N/A ASP 786.A N SER 784.A OG no hydrogen 3.036 N/A ARG 787.A N SER 784.A O no hydrogen 3.072 N/A ARG 787.A NE LYS 782.A O no hydrogen 2.658 N/A ARG 787.A NH1 THR 456.A O no hydrogen 3.175 N/A ARG 787.A NH1 ASN 457.A O no hydrogen 3.121 N/A ARG 787.A NH1 LYS 782.A O no hydrogen 2.757 N/A ARG 787.A NH2 THR 456.A O no hydrogen 2.860 N/A ARG 787.A NH2 GLN 791.A OE1 no hydrogen 2.982 N/A THR 788.A N SER 784.A O no hydrogen 3.442 N/A THR 788.A OG1 THR 456.A O no hydrogen 2.972 N/A ILE 789.A N SER 785.A O no hydrogen 2.912 N/A ALA 790.A N ASP 786.A O no hydrogen 3.060 N/A GLN 791.A N ARG 787.A O no hydrogen 3.107 N/A TYR 792.A N THR 788.A O no hydrogen 3.043 N/A ALA 793.A N ILE 789.A O no hydrogen 2.827 N/A ARG 794.A N ALA 790.A O no hydrogen 3.041 N/A ARG 794.A NE GLU 800.A OE1 no hydrogen 3.239 N/A GLU 795.A N GLN 791.A O no hydrogen 2.833 N/A ILE 796.A N TYR 792.A O no hydrogen 2.856 N/A TRP 797.A N TYR 792.A O no hydrogen 2.886 N/A TRP 797.A NE1 GLN 309.A OE1 no hydrogen 2.781 N/A VAL 799.A N ALA 793.A O no hydrogen 2.945 N/A SER 802.A N LEU 139.A O no hydrogen 2.808 N/A ARG 803.A NE THR 138.A O no hydrogen 3.223 N/A ARG 803.A NH1 THR 138.A O no hydrogen 2.818 N/A ARG 803.A NH1 ASN 224.A OD1 no hydrogen 3.370 N/A ARG 803.A NH2 SER 486.A OG no hydrogen 2.947 N/A GLN 804.A N SER 802.A OG no hydrogen 3.330 N/A GLN 804.A NE2 SER 802.A OG no hydrogen 3.368 N/A ARG 805.A NH1 ARG 803.A O no hydrogen 3.009 N/A LEU 806.A N ASN 224.A O no hydrogen 3.082 N/A