Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4zw7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N TYR 372.A O no hydrogen 2.932 N/A ARG 5.A N GLU 370.A O no hydrogen 2.895 N/A ARG 5.A NE GLU 370.A OE1 no hydrogen 3.365 N/A ARG 5.A NE GLU 370.A OE2 no hydrogen 3.325 N/A ARG 5.A NH2 GLU 370.A OE1 no hydrogen 3.332 N/A ARG 5.A NH2 GLU 370.A OE2 no hydrogen 2.878 N/A ASP 7.A N TYR 4.A O no hydrogen 2.987 N/A TYR 8.A N ARG 5.A O no hydrogen 3.389 N/A TYR 8.A OH ASP 138.A OD2 no hydrogen 2.571 N/A LYS 9.A NZ ASP 7.A O no hydrogen 3.378 N/A SER 11.A OG PHE 13.A O no hydrogen 3.186 N/A PHE 13.A N SER 11.A OG no hydrogen 2.888 N/A ILE 14.A N ASP 38.A O no hydrogen 2.867 N/A ASN 16.A N ASP 36.A O no hydrogen 2.768 N/A GLN 17.A N ASP 36.A O no hydrogen 3.389 N/A GLN 17.A NE2 VAL 18.A O no hydrogen 3.193 N/A VAL 18.A N LYS 142.A O no hydrogen 2.686 N/A THR 19.A N VAL 34.A O no hydrogen 2.887 N/A LEU 20.A N ASP 144.A O no hydrogen 2.688 N/A ASN 21.A N ARG 32.A O no hydrogen 3.089 N/A ASN 21.A ND2 LEU 20.A O no hydrogen 2.782 N/A ILE 22.A N THR 146.A O no hydrogen 2.837 N/A ASN 23.A N ILE 30.A O no hydrogen 2.700 N/A ILE 24.A N THR 148.A O no hydrogen 2.873 N/A HIS 25.A N GLU 28.A O no hydrogen 2.864 N/A THR 29.A N ILE 100.A O no hydrogen 3.018 N/A ILE 30.A N ASN 23.A O no hydrogen 2.826 N/A VAL 31.A N VAL 98.A O no hydrogen 2.827 N/A ARG 32.A N ASN 21.A O no hydrogen 2.779 N/A ARG 32.A NH2 ASN 21.A OD1 no hydrogen 3.126 N/A SER 33.A N SER 96.A O no hydrogen 2.916 N/A VAL 34.A N THR 19.A O no hydrogen 3.052 N/A LEU 35.A N PHE 94.A O no hydrogen 2.625 N/A ASP 36.A N GLN 17.A O no hydrogen 2.878 N/A MET 37.A N PHE 92.A O no hydrogen 2.761 N/A ASP 38.A N ILE 14.A O no hydrogen 2.825 N/A ILE 39.A N ASP 38.A OD1 no hydrogen 2.638 N/A SER 40.A N GLY 12.A O no hydrogen 3.020 N/A SER 40.A OG SER 11.A O no hydrogen 2.692 N/A HIS 42.A N SER 40.A OG no hydrogen 3.065 N/A ASN 43.A N SER 40.A O no hydrogen 3.154 N/A ASN 43.A ND2 GLY 12.A O no hydrogen 3.156 N/A VAL 44.A N GLU 46.A OE1 no hydrogen 2.930 N/A GLY 45.A N ASN 43.A OD1 no hydrogen 2.912 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.593 N/A LEU 48.A N ILE 82.A O no hydrogen 2.973 N/A PHE 50.A N LEU 80.A O no hydrogen 2.828 N/A ASP 51.A N PHE 133.A O no hydrogen 2.748 N/A GLY 52.A N GLU 78.A O no hydrogen 3.015 N/A VAL 53.A N ARG 128.A O no hydrogen 2.827 N/A GLY 54.A N ASN 77.A O no hydrogen 3.378 N/A LEU 55.A N TYR 75.A OH no hydrogen 3.053 N/A LYS 56.A N ILE 99.A O no hydrogen 3.177 N/A ASN 58.A N GLU 97.A O no hydrogen 2.826 N/A ASN 58.A ND2 GLU 97.A OE2 no hydrogen 2.795 N/A GLU 59.A N GLU 97.A O no hydrogen 3.367 N/A SER 61.A N SER 95.A O no hydrogen 2.811 N/A ILE 62.A N LYS 65.A O no hydrogen 3.100 N/A ASN 63.A N ALA 93.A O no hydrogen 2.721 N/A LYS 65.A N ILE 62.A O no hydrogen 3.065 N/A LEU 67.A N ILE 60.A O no hydrogen 2.900 N/A VAL 68.A N GLU 72.A OE1 no hydrogen 2.694 N/A GLY 70.A N TYR 73.A O no hydrogen 2.702 N/A GLU 72.A N VAL 68.A O no hydrogen 3.072 N/A THR 74.A N THR 81.A O no hydrogen 2.976 N/A TYR 75.A OH GLY 52.A O no hydrogen 2.634 N/A ASP 76.A N PHE 79.A O no hydrogen 3.392 N/A GLU 78.A N ASP 76.A OD1 no hydrogen 2.995 N/A PHE 79.A N ASP 76.A OD1 no hydrogen 2.670 N/A LEU 80.A N PHE 50.A O no hydrogen 2.864 N/A THR 81.A N THR 74.A O no hydrogen 2.868 N/A ILE 82.A N LEU 48.A O no hydrogen 2.847 N/A PHE 83.A N GLU 72.A O no hydrogen 3.230 N/A SER 84.A N ASP 47.A OD1 no hydrogen 2.724 N/A PHE 86.A N PHE 83.A O no hydrogen 2.898 N/A VAL 87.A N SER 84.A O no hydrogen 2.978 N/A PHE 92.A N MET 37.A O no hydrogen 2.981 N/A ALA 93.A N ASN 63.A OD1 no hydrogen 2.983 N/A PHE 94.A N LEU 35.A O no hydrogen 2.854 N/A SER 95.A N SER 61.A O no hydrogen 2.903 N/A SER 96.A N SER 33.A O no hydrogen 2.917 N/A GLU 97.A N GLU 59.A O no hydrogen 2.810 N/A VAL 98.A N VAL 31.A O no hydrogen 2.965 N/A ILE 99.A N LYS 56.A O no hydrogen 2.893 N/A ILE 100.A N THR 29.A O no hydrogen 3.078 N/A THR 104.A N HIS 101.A O no hydrogen 3.213 N/A THR 104.A OG1 HIS 101.A O no hydrogen 3.314 N/A ASN 105.A N PRO 102.A O no hydrogen 3.097 N/A ASN 105.A ND2 THR 109.A O no hydrogen 2.657 N/A ASN 105.A ND2 LEU 111.A O no hydrogen 2.907 N/A GLY 110.A N GLN 121.A O no hydrogen 2.860 N/A TYR 112.A N VAL 119.A O no hydrogen 2.802 N/A TYR 112.A OH ASP 260.A O no hydrogen 2.857 N/A LYS 113.A N PRO 102.A O no hydrogen 3.101 N/A SER 114.A N ILE 117.A O no hydrogen 2.765 N/A SER 114.A OG ASP 260.A OD2 no hydrogen 2.723 N/A LYS 115.A NZ GLU 219.A OE2 no hydrogen 2.793 N/A LYS 115.A NZ GLU 761.A OE2 no hydrogen 2.638 N/A ILE 117.A N SER 114.A O no hydrogen 2.842 N/A ILE 118.A N ALA 193.A O no hydrogen 2.794 N/A VAL 119.A N TYR 112.A O no hydrogen 2.829 N/A SER 120.A N VAL 191.A O no hydrogen 3.200 N/A SER 120.A OG VAL 191.A O no hydrogen 3.552 N/A GLN 121.A N GLY 110.A O no hydrogen 2.859 N/A GLN 121.A NE2 GLU 123.A O no hydrogen 3.024 N/A CYS 122.A SG PHE 189.A O no hydrogen 3.860 N/A GLY 126.A N CYS 122.A O no hydrogen 2.679 N/A ARG 128.A N ASP 135.A OD2 no hydrogen 3.082 N/A ARG 128.A NE ASP 135.A OD2 no hydrogen 2.925 N/A ARG 128.A NH2 ASP 135.A O no hydrogen 3.037 N/A ARG 129.A N GLY 126.A O no hydrogen 2.911 N/A ILE 130.A N PHE 127.A O no hydrogen 2.794 N/A THR 131.A N PHE 127.A O no hydrogen 3.145 N/A PHE 133.A N ASP 51.A O no hydrogen 3.087 N/A ASP 135.A N ASP 51.A OD2 no hydrogen 2.929 N/A ARG 136.A NE ASP 138.A OD1 no hydrogen 2.887 N/A ARG 136.A NH2 LYS 9.A O no hydrogen 2.755 N/A ARG 136.A NH2 ASP 138.A OD2 no hydrogen 2.942 N/A MET 139.A N ARG 136.A O no hydrogen 3.108 N/A ALA 141.A N LYS 184.A O no hydrogen 3.092 N/A LYS 142.A N ASN 16.A O no hydrogen 3.018 N/A TYR 143.A N ASP 180.A O no hydrogen 3.365 N/A ASP 144.A N VAL 18.A O no hydrogen 2.849 N/A VAL 145.A N PHE 178.A O no hydrogen 2.685 N/A THR 146.A N LEU 20.A O no hydrogen 2.706 N/A VAL 147.A N ALA 176.A O no hydrogen 2.844 N/A THR 148.A N ILE 22.A O no hydrogen 2.915 N/A THR 148.A OG1 ASN 23.A OD1 no hydrogen 2.448 N/A ALA 149.A N HIS 174.A O no hydrogen 2.831 N/A LYS 151.A N GLY 172.A O no hydrogen 2.956 N/A LYS 151.A NZ GLU 168.A OE2 no hydrogen 2.898 N/A LYS 153.A N ASP 150.A OD2 no hydrogen 2.858 N/A TYR 154.A N ASP 150.A O no hydrogen 2.876 N/A VAL 156.A N GLY 194.A O no hydrogen 3.022 N/A LEU 158.A N VAL 192.A O no hydrogen 2.796 N/A SER 159.A OG ALA 190.A O no hydrogen 2.791 N/A ASN 160.A ND2 LEU 188.A O no hydrogen 3.054 N/A ASN 160.A ND2 LYS 269.A O no hydrogen 2.954 N/A ASP 162.A N ASN 179.A O no hydrogen 2.975 N/A LYS 163.A NZ GLU 166.A OE2 no hydrogen 2.513 N/A VAL 164.A N ARG 177.A O no hydrogen 2.715 N/A ASN 165.A N ARG 177.A O no hydrogen 3.412 N/A PHE 167.A N GLY 175.A O no hydrogen 3.157 N/A ILE 169.A N ARG 173.A O no hydrogen 2.735 N/A ARG 173.A N ILE 169.A O no hydrogen 3.151 N/A ARG 173.A NH1 ILE 24.A O no hydrogen 2.835 N/A ARG 173.A NH2 ILE 24.A O no hydrogen 2.883 N/A ARG 173.A NH2 THR 148.A OG1 no hydrogen 3.107 N/A HIS 174.A N ALA 149.A O no hydrogen 2.943 N/A GLY 175.A N PHE 167.A O no hydrogen 2.971 N/A ALA 176.A N VAL 147.A O no hydrogen 2.805 N/A ARG 177.A N ASN 165.A O no hydrogen 2.870 N/A ARG 177.A NE ASP 144.A OD1 no hydrogen 2.995 N/A ARG 177.A NH2 ASP 144.A OD2 no hydrogen 2.743 N/A PHE 178.A N VAL 145.A O no hydrogen 2.687 N/A ASN 179.A N ASP 162.A O no hydrogen 2.894 N/A ASP 180.A N TYR 143.A O no hydrogen 2.824 N/A LYS 184.A N ALA 141.A O no hydrogen 3.015 N/A LYS 184.A NZ ASP 180.A OD2 no hydrogen 2.803 N/A CYS 186.A SG ASP 135.A OD1 no hydrogen 3.067 N/A TYR 187.A OH THR 312.A OG1.B no hydrogen 3.413 N/A LEU 188.A N PRO 185.A O no hydrogen 3.186 N/A PHE 189.A N CYS 186.A O no hydrogen 2.950 N/A ALA 190.A N ASN 160.A OD1 no hydrogen 2.899 N/A VAL 191.A N SER 120.A OG no hydrogen 3.044 N/A VAL 192.A N LEU 158.A O no hydrogen 2.853 N/A ALA 193.A N ILE 118.A O no hydrogen 2.852 N/A GLY 194.A N VAL 156.A O no hydrogen 3.061 N/A LYS 197.A N SER 218.A O no hydrogen 2.887 N/A LEU 199.A N VAL 216.A O no hydrogen 3.021 N/A ALA 201.A N LEU 214.A O no hydrogen 2.967 N/A TYR 203.A N VAL 212.A O no hydrogen 2.735 N/A TYR 203.A OH GLU 241.A OE1 no hydrogen 2.903 N/A THR 205.A N LYS 210.A O no hydrogen 2.972 N/A THR 205.A OG1 THR 208.A OG1 no hydrogen 3.135 N/A THR 205.A OG1 GLU 247.A OE2 no hydrogen 3.048 N/A LYS 206.A N GLU 241.A OE2 no hydrogen 2.942 N/A LYS 206.A NZ ASP 242.A OD1 no hydrogen 2.681 N/A TYR 207.A N GLU 247.A OE2 no hydrogen 2.350 N/A THR 208.A N GLU 247.A OE2 no hydrogen 2.907 N/A THR 208.A OG1 THR 205.A OG1 no hydrogen 3.135 N/A THR 208.A OG1 GLU 247.A OE1 no hydrogen 2.791 N/A LYS 209.A NZ LYS 206.A O no hydrogen 3.427 N/A LYS 210.A N THR 205.A OG1 no hydrogen 2.916 N/A VAL 212.A N TYR 203.A O no hydrogen 2.646 N/A GLU 213.A N SER 251.A O no hydrogen 2.820 N/A LEU 214.A N ALA 201.A O no hydrogen 2.830 N/A TYR 215.A N LEU 253.A O no hydrogen 2.936 N/A VAL 216.A N LEU 199.A O no hydrogen 2.892 N/A PHE 217.A N LEU 255.A O no hydrogen 2.728 N/A SER 218.A N LYS 197.A O no hydrogen 2.987 N/A SER 218.A OG GLU 219.A O no hydrogen 2.949 N/A LYS 221.A NZ TYR 222.A OH no hydrogen 3.202 N/A LYS 221.A NZ ASP 759.A O no hydrogen 2.792 N/A TYR 222.A N GLU 219.A O no hydrogen 3.047 N/A VAL 223.A N GLU 220.A O no hydrogen 3.326 N/A LYS 225.A N TYR 222.A O no hydrogen 2.828 N/A LYS 225.A NZ ASP 760.A OD2 no hydrogen 2.771 N/A LEU 226.A N VAL 223.A O no hydrogen 3.385 N/A TRP 228.A NE1 TYR 291.A O no hydrogen 2.904 N/A LEU 230.A N LEU 226.A O no hydrogen 3.333 N/A GLU 231.A N GLN 227.A O no hydrogen 3.091 N/A CYS 232.A N TRP 228.A O no hydrogen 2.769 N/A CYS 232.A SG TRP 228.A O no hydrogen 3.248 N/A LEU 233.A N ALA 229.A O no hydrogen 2.919 N/A LYS 234.A N LEU 230.A O no hydrogen 3.129 N/A LYS 235.A N GLU 231.A O no hydrogen 2.967 N/A SER 236.A N CYS 232.A O no hydrogen 2.847 N/A SER 236.A OG CYS 232.A O no hydrogen 2.611 N/A MET 237.A N LEU 233.A O no hydrogen 2.958 N/A ALA 238.A N LYS 234.A O no hydrogen 3.043 N/A PHE 239.A N LYS 235.A O no hydrogen 2.964 N/A ASP 240.A N SER 236.A O no hydrogen 3.101 N/A GLU 241.A N MET 237.A O no hydrogen 3.099 N/A ASP 242.A N ALA 238.A O no hydrogen 2.758 N/A TYR 243.A N PHE 239.A O no hydrogen 2.769 N/A PHE 244.A N ASP 240.A O no hydrogen 3.165 N/A LEU 246.A N ASP 240.A O no hydrogen 2.936 N/A TYR 248.A OH ARG 252.A O no hydrogen 3.109 N/A ASP 249.A N ASP 249.A OD1 no hydrogen 2.544 N/A ARG 252.A NE ASN 254.A OD1 no hydrogen 2.740 N/A ARG 252.A NH2 ASN 254.A OD1 no hydrogen 2.993 N/A LEU 253.A N GLU 213.A O no hydrogen 2.862 N/A ASN 254.A N GLY 270.A O no hydrogen 2.909 N/A ASN 254.A ND2 GLY 270.A O no hydrogen 3.079 N/A LEU 255.A N TYR 215.A O no hydrogen 2.831 N/A VAL 256.A N ASN 272.A O no hydrogen 2.884 N/A ALA 257.A N PHE 217.A O no hydrogen 3.005 N/A VAL 258.A N PHE 274.A O no hydrogen 2.960 N/A SER 259.A OG GLU 761.A OE1 no hydrogen 2.724 N/A SER 259.A OG GLU 761.A OE2 no hydrogen 3.164 N/A ASP 260.A N SER 114.A OG no hydrogen 2.852 N/A ASN 262.A ND2 ALA 107.A O no hydrogen 3.175 N/A MET 266.A N ILE 273.A O no hydrogen 2.787 N/A GLU 267.A N GLU 267.A OE1 no hydrogen 2.822 N/A ASN 268.A ND2 LEU 271.A O no hydrogen 3.207 N/A LEU 271.A N ASN 268.A O no hydrogen 2.805 N/A ASN 272.A N ASN 254.A O no hydrogen 2.790 N/A ILE 273.A N MET 266.A O no hydrogen 3.100 N/A PHE 274.A N VAL 256.A O no hydrogen 2.746 N/A ASN 275.A N GLY 264.A O no hydrogen 2.803 N/A ASN 275.A ND2 VAL 263.A O no hydrogen 3.258 N/A ASN 275.A ND2 ASN 798.A OD1 no hydrogen 2.923 N/A ALA 276.A N VAL 258.A O no hydrogen 2.814 N/A ASN 277.A N ASN 275.A OD1 no hydrogen 2.856 N/A SER 278.A N ASN 275.A O no hydrogen 2.781 N/A SER 278.A OG ASN 277.A OD1 no hydrogen 3.030 N/A LEU 279.A N ALA 276.A O no hydrogen 3.211 N/A LEU 280.A N ALA 276.A O no hydrogen 2.996 N/A ALA 281.A N LYS 225.A O no hydrogen 2.964 N/A SER 282.A N SER 286.A OG no hydrogen 3.114 N/A LYS 283.A N GLU 688.A OE2 no hydrogen 2.547 N/A LYS 283.A NZ TYR 684.A O no hydrogen 2.708 N/A LYS 283.A NZ ASP 687.A O no hydrogen 2.865 N/A LYS 283.A NZ HIS 690.A O no hydrogen 2.585 N/A ASN 285.A N SER 282.A O no hydrogen 3.143 N/A ASN 285.A N SER 282.A OG no hydrogen 3.219 N/A SER 286.A OG SER 282.A O no hydrogen 3.313 N/A ASP 288.A N SER 731.A OG no hydrogen 2.767 N/A SER 290.A N ILE 287.A O no hydrogen 3.135 N/A TYR 291.A N ASP 288.A O no hydrogen 3.083 N/A TYR 291.A OH GLU 688.A OE1 no hydrogen 2.740 N/A ARG 293.A N PHE 289.A O no hydrogen 3.055 N/A ARG 293.A NE SER 278.A OG no hydrogen 2.953 N/A ILE 294.A N SER 290.A O no hydrogen 2.899 N/A LEU 295.A N TYR 291.A O no hydrogen 3.114 N/A THR 296.A N ALA 292.A O no hydrogen 2.922 N/A THR 296.A OG1.A ALA 292.A O no hydrogen 2.949 N/A THR 296.A OG1.A ARG 293.A O no hydrogen 2.330 N/A THR 296.A OG1.B ALA 292.A O no hydrogen 3.120 N/A THR 296.A OG1.B GLU 330.A OE2 no hydrogen 2.842 N/A VAL 297.A N ARG 293.A O no hydrogen 2.892 N/A VAL 298.A N ILE 294.A O no hydrogen 2.839 N/A GLY 299.A N LEU 295.A O no hydrogen 2.963 N/A HIS 300.A N THR 296.A O no hydrogen 2.791 N/A GLU 301.A N VAL 297.A O no hydrogen 2.961 N/A TYR 302.A N VAL 298.A O no hydrogen 2.930 N/A PHE 303.A N GLY 299.A O no hydrogen 2.807 N/A HIS 304.A N HIS 300.A O no hydrogen 3.218 N/A HIS 304.A ND1 THR 307.A O no hydrogen 2.800 N/A GLN 305.A N TYR 302.A O no hydrogen 2.922 N/A GLN 305.A NE2 ASP 249.A OD1 no hydrogen 3.016 N/A TYR 306.A N PHE 303.A O no hydrogen 3.330 N/A TYR 306.A OH GLU 247.A O no hydrogen 2.996 N/A THR 307.A N PHE 303.A O no hydrogen 3.225 N/A THR 307.A OG1 PHE 303.A O no hydrogen 3.116 N/A THR 307.A OG1 THR 326.A OG1 no hydrogen 2.842 N/A GLY 308.A N TYR 306.A O no hydrogen 2.997 N/A ASN 309.A N HIS 304.A O no hydrogen 2.812 N/A ASN 309.A ND2 GLU 267.A O no hydrogen 3.026 N/A ASN 309.A ND2 GLN 305.A OE1 no hydrogen 3.077 N/A ARG 310.A N GLN 305.A O no hydrogen 2.827 N/A ARG 310.A NE ASP 415.A OD1 no hydrogen 3.159 N/A ARG 310.A NH2 ASP 415.A OD2 no hydrogen 2.840 N/A VAL 311.A N TYR 306.A O no hydrogen 3.018 N/A THR 312.A N ASN 417.A O no hydrogen 2.986 N/A THR 312.A OG1.A ASN 309.A O no hydrogen 3.446 N/A THR 312.A OG1.B TYR 187.A OH no hydrogen 3.413 N/A THR 312.A OG1.B GLY 308.A O no hydrogen 3.353 N/A LEU 313.A N THR 312.A OG1.B no hydrogen 2.586 N/A ARG 314.A N ALA 419.A O no hydrogen 3.250 N/A ARG 314.A NE ASP 315.A OD2 no hydrogen 2.606 N/A ARG 314.A NH2 ASP 315.A OD2 no hydrogen 2.827 N/A PHE 317.A N ASP 315.A OD1 no hydrogen 3.034 N/A GLN 318.A N ASP 315.A O no hydrogen 3.239 N/A GLN 318.A NE2 ASP 315.A OD1 no hydrogen 3.180 N/A GLN 318.A NE2 ASP 315.A OD2 no hydrogen 3.494 N/A LEU 319.A N TRP 316.A O no hydrogen 3.044 N/A THR 320.A OG1 VAL 383.A O no hydrogen 2.907 N/A LEU 321.A N GLN 318.A O no hydrogen 2.794 N/A LYS 322.A N LEU 319.A O no hydrogen 3.077 N/A LYS 322.A NZ GLU 123.A OE1 no hydrogen 3.291 N/A LYS 322.A NZ GLU 123.A OE2 no hydrogen 2.660 N/A LYS 322.A NZ GLU 267.A OE2 no hydrogen 2.926 N/A LYS 322.A NZ GLU 323.A OE2 no hydrogen 2.628 N/A GLU 323.A N LEU 319.A O no hydrogen 2.856 N/A GLY 324.A N THR 320.A O no hydrogen 2.661 N/A THR 326.A N LYS 322.A O no hydrogen 3.125 N/A THR 326.A OG1 HIS 304.A ND1 no hydrogen 3.137 N/A THR 326.A OG1 THR 307.A OG1 no hydrogen 2.842 N/A THR 326.A OG1 LYS 322.A O no hydrogen 2.719 N/A VAL 327.A N GLU 323.A O no hydrogen 2.933 N/A HIS 328.A N GLY 324.A O no hydrogen 3.051 N/A ARG 329.A N LEU 325.A O no hydrogen 2.925 N/A ARG 329.A NE THR 307.A OG1 no hydrogen 3.000 N/A ARG 329.A NH1 ASP 240.A OD1 no hydrogen 2.930 N/A ARG 329.A NH2 ASP 240.A OD1 no hydrogen 3.352 N/A ARG 329.A NH2 ASP 240.A OD2 no hydrogen 2.906 N/A ARG 329.A NH2 PHE 303.A O no hydrogen 2.928 N/A GLU 330.A N THR 326.A O no hydrogen 2.784 N/A ASN 331.A N VAL 327.A O no hydrogen 2.748 N/A LEU 332.A N HIS 328.A O no hydrogen 3.008 N/A PHE 333.A N ARG 329.A O no hydrogen 3.097 N/A SER 334.A N GLU 330.A O no hydrogen 2.883 N/A SER 334.A OG GLU 330.A O no hydrogen 3.312 N/A SER 334.A OG GLU 330.A OE2 no hydrogen 2.561 N/A GLU 335.A N ASN 331.A O no hydrogen 2.934 N/A GLU 336.A N LEU 332.A O no hydrogen 3.099 N/A MET 337.A N PHE 333.A O no hydrogen 2.847 N/A THR 338.A N SER 334.A O no hydrogen 2.844 N/A THR 338.A OG1 SER 334.A O no hydrogen 3.001 N/A THR 338.A OG1 THR 343.A OG1 no hydrogen 2.627 N/A LYS 339.A N GLU 335.A O no hydrogen 3.121 N/A LYS 339.A NZ GLU 336.A OE1 no hydrogen 3.554 N/A LYS 339.A NZ GLU 336.A OE2 no hydrogen 3.159 N/A THR 340.A OG1 THR 342.A OG1 no hydrogen 3.401 N/A THR 340.A OG1 THR 343.A OG1 no hydrogen 3.318 N/A THR 342.A OG1 THR 340.A OG1 no hydrogen 3.401 N/A THR 343.A N THR 340.A O no hydrogen 3.383 N/A THR 343.A OG1 THR 338.A OG1 no hydrogen 2.627 N/A THR 343.A OG1 THR 340.A OG1 no hydrogen 3.318 N/A ARG 344.A NE GLY 539.A O no hydrogen 2.900 N/A ARG 344.A NH1 GLU 389.A OE1 no hydrogen 3.541 N/A ARG 344.A NH1 GLU 389.A OE2 no hydrogen 2.882 N/A ARG 344.A NH2 GLU 389.A OE1 no hydrogen 2.777 N/A ARG 344.A NH2 GLY 539.A O no hydrogen 2.970 N/A ARG 344.A NH2 PHE 540.A O no hydrogen 2.939 N/A LEU 345.A N VAL 341.A O no hydrogen 3.216 N/A SER 346.A N THR 342.A O no hydrogen 2.816 N/A SER 346.A OG THR 342.A O no hydrogen 3.213 N/A SER 346.A OG THR 343.A O no hydrogen 2.843 N/A HIS 347.A N THR 343.A O no hydrogen 3.413 N/A VAL 348.A N ARG 344.A O no hydrogen 3.143 N/A ASP 349.A N LEU 345.A O no hydrogen 2.809 N/A LEU 350.A N SER 346.A O no hydrogen 3.012 N/A LEU 351.A N HIS 347.A O no hydrogen 2.890 N/A ARG 352.A N VAL 348.A O no hydrogen 2.898 N/A ARG 352.A NH1 ASN 570.A OD1 no hydrogen 2.881 N/A ARG 352.A NH2 ASN 570.A OD1 no hydrogen 2.826 N/A SER 353.A N LEU 350.A O no hydrogen 3.260 N/A SER 353.A OG ASP 349.A O no hydrogen 2.719 N/A SER 353.A OG LEU 350.A O no hydrogen 3.122 N/A VAL 354.A N LEU 350.A O no hydrogen 2.903 N/A GLN 355.A NE2 ASP 359.A OD2 no hydrogen 3.099 N/A GLN 355.A NE2 THR 382.A OG1 no hydrogen 3.036 N/A PHE 356.A N LEU 351.A O no hydrogen 2.869 N/A LEU 357.A N SER 353.A O no hydrogen 3.100 N/A GLU 358.A N VAL 354.A O no hydrogen 3.151 N/A ASP 359.A N GLN 355.A O no hydrogen 2.981 N/A SER 360.A N PHE 356.A O no hydrogen 3.190 N/A SER 360.A N LEU 357.A O no hydrogen 3.273 N/A SER 360.A OG PHE 356.A O no hydrogen 3.327 N/A SER 360.A OG LEU 357.A O no hydrogen 3.390 N/A SER 360.A OG ASN 639.A OD1 no hydrogen 3.466 N/A SER 361.A N GLU 358.A O no hydrogen 3.075 N/A SER 361.A OG GLU 358.A O no hydrogen 2.651 N/A LEU 363.A N SER 361.A OG no hydrogen 2.940 N/A SER 364.A N SER 361.A O no hydrogen 3.111 N/A SER 364.A OG ASP 359.A O no hydrogen 3.045 N/A SER 364.A OG ASP 359.A OD1 no hydrogen 2.734 N/A HIS 365.A ND1 LEU 363.A O no hydrogen 2.786 N/A HIS 365.A NE2 THR 380.A OG1 no hydrogen 2.755 N/A ARG 368.A N PHE 450.A O no hydrogen 3.113 N/A ARG 368.A NH1 GLN 318.A OE1 no hydrogen 3.085 N/A ARG 368.A NH1 GLU 422.A OE1 no hydrogen 2.580 N/A ARG 368.A NH1 GLU 422.A OE2 no hydrogen 3.540 N/A ARG 368.A NH2 GLU 422.A OE1 no hydrogen 3.398 N/A ARG 368.A NH2 GLU 422.A OE2 no hydrogen 2.938 N/A TYR 372.A N HIS 3.A O no hydrogen 3.025 N/A SER 374.A OG ASN 877.A OD1 no hydrogen 2.526 N/A ASN 377.A N SER 374.A O no hydrogen 3.238 N/A ASN 377.A ND2 ASN 877.A O no hydrogen 2.899 N/A ASN 377.A ND2 GLU 880.A OE1 no hydrogen 2.704 N/A PHE 378.A N MET 375.A O no hydrogen 3.137 N/A TYR 379.A OH GLU 123.A OE2 no hydrogen 2.682 N/A THR 380.A N PHE 378.A O no hydrogen 2.979 N/A THR 380.A OG1 HIS 365.A NE2 no hydrogen 2.755 N/A THR 381.A OG1 ASP 385.A OD2 no hydrogen 2.601 N/A THR 382.A N GLU 358.A OE1 no hydrogen 3.090 N/A THR 382.A OG1 GLU 358.A OE1 no hydrogen 2.637 N/A VAL 383.A N THR 380.A OG1 no hydrogen 3.185 N/A TYR 384.A N THR 380.A O no hydrogen 2.915 N/A ASP 385.A N THR 381.A O no hydrogen 2.696 N/A LYS 386.A N THR 381.A O no hydrogen 3.290 N/A LYS 386.A NZ GLY 454.A O no hydrogen 3.098 N/A GLY 387.A N THR 382.A O no hydrogen 2.960 N/A SER 388.A N TYR 384.A O no hydrogen 2.860 N/A SER 388.A OG.A ASP 385.A O no hydrogen 2.567 N/A GLU 389.A N ASP 385.A O no hydrogen 3.116 N/A VAL 390.A N LYS 386.A O no hydrogen 2.908 N/A MET 391.A N GLY 387.A O no hydrogen 2.934 N/A ARG 392.A N SER 388.A O no hydrogen 2.724 N/A MET 393.A N GLU 389.A O no hydrogen 2.969 N/A TYR 394.A OH ASN 425.A OD1 no hydrogen 2.578 N/A THR 396.A N ARG 392.A O no hydrogen 3.124 N/A THR 396.A OG1 ARG 392.A O no hydrogen 3.524 N/A ILE 397.A N MET 393.A O no hydrogen 2.837 N/A LEU 398.A N TYR 394.A O no hydrogen 2.832 N/A GLY 399.A N LEU 395.A O no hydrogen 2.768 N/A TYR 403.A N GLY 399.A O no hydrogen 2.861 N/A LYS 404.A N GLU 400.A O no hydrogen 2.939 N/A LYS 404.A NZ GLU 400.A OE2 no hydrogen 3.225 N/A LYS 405.A N GLU 401.A O no hydrogen 3.116 N/A GLY 406.A N TYR 402.A O no hydrogen 2.938 N/A PHE 407.A N TYR 403.A O no hydrogen 2.845 N/A ASP 408.A N LYS 404.A O no hydrogen 3.044 N/A ILE 409.A N LYS 405.A O no hydrogen 3.017 N/A TYR 410.A N GLY 406.A O no hydrogen 3.005 N/A ILE 411.A N PHE 407.A O no hydrogen 2.949 N/A LYS 412.A N ASP 408.A O no hydrogen 2.813 N/A LYS 412.A NZ ASP 408.A OD1 no hydrogen 3.245 N/A LYS 412.A NZ ASP 408.A OD2 no hydrogen 3.238 N/A LYS 413.A N ILE 409.A O no hydrogen 2.990 N/A LYS 413.A NZ TYR 426.A OH no hydrogen 3.302 N/A ASN 414.A N TYR 410.A O no hydrogen 3.193 N/A ASN 414.A N ILE 411.A O no hydrogen 3.362 N/A ASN 414.A ND2 TYR 410.A O no hydrogen 2.641 N/A ASP 415.A N ILE 411.A O no hydrogen 2.950 N/A GLY 416.A N ARG 310.A O no hydrogen 2.716 N/A ASN 417.A N ASN 414.A O no hydrogen 2.887 N/A ALA 419.A N THR 312.A O no hydrogen 2.724 N/A THR 420.A N ASP 423.A OD2 no hydrogen 2.891 N/A THR 420.A OG1 GLU 422.A OE1 no hydrogen 3.492 N/A THR 420.A OG1 ASP 423.A OD2 no hydrogen 3.500 N/A CYS 421.A N GLN 318.A OE1 no hydrogen 2.989 N/A CYS 421.A SG GLN 318.A OE1 no hydrogen 3.723 N/A GLU 422.A N GLU 422.A OE1 no hydrogen 2.788 N/A ASN 425.A N CYS 421.A O no hydrogen 3.100 N/A ASN 425.A ND2 LEU 443.A O no hydrogen 3.117 N/A TYR 426.A N GLU 422.A O no hydrogen 2.814 N/A ALA 427.A N ASP 423.A O no hydrogen 3.166 N/A MET 428.A N PHE 424.A O no hydrogen 2.965 N/A GLU 429.A N ASN 425.A O no hydrogen 2.755 N/A GLN 430.A N TYR 426.A O no hydrogen 3.049 N/A ALA 431.A N ALA 427.A O no hydrogen 3.360 N/A TYR 432.A N MET 428.A O no hydrogen 2.870 N/A TYR 432.A OH GLU 515.A OE1 no hydrogen 3.149 N/A LYS 433.A N GLU 429.A O no hydrogen 2.745 N/A LYS 433.A NZ ASN 439.A O no hydrogen 2.576 N/A LYS 433.A NZ ALA 441.A O no hydrogen 2.416 N/A MET 434.A N GLN 430.A O no hydrogen 3.115 N/A LYS 435.A N ALA 431.A O no hydrogen 2.848 N/A LYS 435.A NZ LEU 398.A O no hydrogen 3.133 N/A LYS 436.A N TYR 432.A O no hydrogen 3.024 N/A LYS 436.A NZ GLU 515.A OE2 no hydrogen 3.410 N/A ALA 437.A N MET 434.A O no hydrogen 3.223 N/A ASP 438.A N LYS 433.A O no hydrogen 3.189 N/A ALA 441.A N ASP 438.A O no hydrogen 3.150 N/A LEU 443.A N GLU 429.A OE1 no hydrogen 2.886 N/A ASN 444.A N ASN 442.A OD1 no hydrogen 2.794 N/A GLN 445.A NE2 PRO 490.A O no hydrogen 2.703 N/A GLN 445.A NE2 THR 517.A O no hydrogen 2.900 N/A TYR 446.A N LEU 443.A O no hydrogen 3.026 N/A TYR 446.A OH VAL 390.A O no hydrogen 2.602 N/A LEU 447.A N ASN 444.A O no hydrogen 3.269 N/A LEU 448.A N GLN 445.A O no hydrogen 3.060 N/A TRP 449.A N TYR 446.A O no hydrogen 2.968 N/A TRP 449.A NE1 PHE 492.A O no hydrogen 2.805 N/A PHE 450.A N LEU 447.A O no hydrogen 2.922 N/A SER 451.A N LEU 448.A O no hydrogen 3.149 N/A GLN 452.A N LEU 448.A O no hydrogen 2.813 N/A GLN 452.A NE2 LYS 489.A O no hydrogen 3.512 N/A SER 453.A N GLN 485.A OE1 no hydrogen 3.263 N/A SER 453.A OG ASP 482.A OD2 no hydrogen 2.631 N/A GLY 454.A N ASP 359.A OD1 no hydrogen 2.900 N/A HIS 457.A N TYR 478.A O no hydrogen 2.655 N/A HIS 457.A ND1 GLU 547.A OE2 no hydrogen 2.927 N/A VAL 458.A N TYR 545.A O no hydrogen 2.870 N/A SER 459.A N ASN 476.A O no hydrogen 2.878 N/A LYS 461.A N HIS 474.A O no hydrogen 2.856 N/A TYR 462.A OH ASP 548.A O no hydrogen 2.638 N/A ASN 463.A N SER 472.A O no hydrogen 3.148 N/A TYR 464.A OH ILE 528.A O no hydrogen 2.811 N/A ASP 465.A N GLN 470.A O no hydrogen 2.950 N/A LYS 468.A N ASP 465.A OD1 no hydrogen 2.680 N/A LYS 469.A NZ ALA 466.A O no hydrogen 2.864 N/A GLN 470.A N ASP 465.A O no hydrogen 3.271 N/A GLN 470.A NE2 ASN 526.A OD1 no hydrogen 2.919 N/A TYR 471.A N PHE 525.A O no hydrogen 2.777 N/A SER 472.A N ASN 463.A O no hydrogen 2.841 N/A ILE 473.A N PHE 523.A O no hydrogen 2.783 N/A HIS 474.A N LYS 461.A O no hydrogen 2.768 N/A HIS 474.A ND1.A THR 522.A OG1 no hydrogen 2.923 N/A HIS 474.A ND1.B THR 522.A OG1 no hydrogen 2.940 N/A VAL 475.A N ASP 521.A O no hydrogen 2.825 N/A ASN 476.A N SER 459.A O no hydrogen 2.927 N/A GLN 477.A N GLU 519.A O no hydrogen 2.880 N/A GLN 477.A NE2 LEU 491.A O no hydrogen 2.940 N/A GLN 477.A NE2 LYS 518.A O no hydrogen 2.867 N/A TYR 478.A N HIS 457.A O no hydrogen 2.944 N/A ASP 482.A N GLN 485.A O no hydrogen 3.153 N/A ASN 484.A N ASP 482.A OD1 no hydrogen 2.925 N/A ASN 484.A ND2 SER 364.A O no hydrogen 2.869 N/A ASN 484.A ND2 SER 453.A OG no hydrogen 2.879 N/A GLN 485.A N ASP 482.A OD1 no hydrogen 3.138 N/A GLN 485.A NE2 SER 451.A O no hydrogen 2.929 N/A LYS 488.A NZ SER 453.A O no hydrogen 2.925 N/A LYS 488.A NZ ASP 482.A OD1 no hydrogen 2.852 N/A LYS 488.A NZ ASP 482.A OD2 no hydrogen 3.182 N/A LYS 488.A NZ GLN 485.A OE1 no hydrogen 2.599 N/A LYS 489.A N GLN 452.A OE1 no hydrogen 2.914 N/A LEU 491.A N GLN 477.A OE1 no hydrogen 2.862 N/A ILE 493.A N LEU 516.A O no hydrogen 2.802 N/A ILE 495.A N LEU 514.A O no hydrogen 2.683 N/A SER 496.A N SER 541.A OG no hydrogen 3.050 N/A VAL 497.A N THR 512.A O no hydrogen 2.934 N/A GLY 498.A N SER 535.A O no hydrogen 2.921 N/A ILE 500.A N ILE 533.A O no hydrogen 2.884 N/A ASN 501.A N LYS 506.A O no hydrogen 2.932 N/A GLU 503.A N ASN 501.A OD1 no hydrogen 2.806 N/A GLY 505.A N ASN 501.A O no hydrogen 2.742 N/A LYS 506.A N ASN 504.A OD1 no hydrogen 2.836 N/A MET 508.A N LEU 499.A O no hydrogen 2.784 N/A THR 512.A OG1 SER 510.A O no hydrogen 2.848 N/A LEU 514.A N ILE 495.A O no hydrogen 2.814 N/A LEU 516.A N ILE 493.A O no hydrogen 2.957 N/A ASP 521.A N VAL 475.A O no hydrogen 2.982 N/A THR 522.A N ASP 521.A OD1 no hydrogen 2.928 N/A THR 522.A OG1 HIS 474.A ND1.A no hydrogen 2.923 N/A THR 522.A OG1 HIS 474.A ND1.B no hydrogen 2.940 N/A PHE 523.A N ILE 473.A O no hydrogen 2.841 N/A PHE 525.A N TYR 471.A O no hydrogen 2.675 N/A ILE 528.A N LYS 469.A O no hydrogen 2.759 N/A ILE 533.A N ILE 500.A O no hydrogen 2.860 N/A SER 535.A N GLY 498.A O no hydrogen 2.767 N/A SER 535.A OG ASP 562.A OD1 no hydrogen 3.421 N/A SER 535.A OG ASP 562.A OD2 no hydrogen 2.583 N/A ARG 538.A N SER 496.A O no hydrogen 2.896 N/A ARG 538.A NE SER 535.A OG no hydrogen 2.706 N/A ARG 538.A NH1 GLU 507.A OE1 no hydrogen 3.038 N/A ARG 538.A NH2 GLU 507.A OE1 no hydrogen 3.114 N/A ARG 538.A NH2 GLU 507.A OE2 no hydrogen 3.321 N/A ARG 538.A NH2 ASP 562.A OD1 no hydrogen 2.879 N/A GLY 539.A N ASP 564.A OD2 no hydrogen 2.955 N/A SER 541.A OG PRO 494.A O no hydrogen 2.770 N/A TYR 545.A N PRO 456.A O no hydrogen 2.823 N/A GLU 547.A N VAL 458.A O no hydrogen 2.872 N/A LEU 550.A N ASP 548.A OD1 no hydrogen 2.919 N/A THR 551.A N GLU 554.A OE1 no hydrogen 2.926 N/A THR 551.A OG1 GLU 554.A OE1 no hydrogen 3.437 N/A GLU 554.A N THR 551.A OG1 no hydrogen 3.114 N/A ARG 555.A N THR 551.A O no hydrogen 3.019 N/A ARG 555.A NE ASP 548.A OD1 no hydrogen 3.300 N/A ARG 555.A NE ASP 548.A OD2 no hydrogen 3.352 N/A ARG 555.A NH1 ASP 552.A OD1 no hydrogen 3.146 N/A ARG 555.A NH2 ASP 548.A OD1 no hydrogen 2.747 N/A ILE 556.A N ASP 552.A O no hydrogen 2.759 N/A LEU 557.A N GLU 553.A O no hydrogen 3.089 N/A LEU 558.A N GLU 554.A O no hydrogen 2.951 N/A LEU 559.A N ARG 555.A O no hydrogen 2.768 N/A LYS 560.A N ILE 556.A O no hydrogen 2.941 N/A TYR 561.A N LEU 557.A O no hydrogen 2.830 N/A TYR 561.A N LEU 558.A O no hydrogen 3.201 N/A ASP 562.A N LEU 558.A O no hydrogen 2.841 N/A SER 563.A N ASP 562.A OD1 no hydrogen 2.687 N/A SER 563.A OG GLU 507.A OE2 no hydrogen 2.553 N/A VAL 567.A N ASP 564.A OD2 no hydrogen 3.024 N/A ARG 568.A N ASP 564.A O no hydrogen 3.030 N/A ARG 568.A NE LEU 559.A O no hydrogen 2.846 N/A ARG 568.A NH2 LEU 559.A O no hydrogen 3.018 N/A TYR 569.A N ALA 565.A O no hydrogen 2.939 N/A TYR 569.A OH ASP 349.A OD1 no hydrogen 2.441 N/A ASN 570.A N PHE 566.A O no hydrogen 2.657 N/A SER 571.A N VAL 567.A O no hydrogen 2.799 N/A SER 571.A OG VAL 567.A O no hydrogen 2.713 N/A CYS 572.A N ARG 568.A O no hydrogen 3.049 N/A CYS 572.A SG ILE 628.A O no hydrogen 3.868 N/A THR 573.A N TYR 569.A O no hydrogen 2.924 N/A THR 573.A OG1 TYR 569.A O no hydrogen 2.875 N/A ASN 574.A N ASN 570.A O no hydrogen 2.755 N/A ASN 574.A ND2 ASP 548.A OD2 no hydrogen 2.919 N/A ILE 575.A N SER 571.A O no hydrogen 2.985 N/A TYR 576.A N CYS 572.A O no hydrogen 2.944 N/A TYR 576.A OH ILE 628.A O no hydrogen 2.695 N/A MET 577.A N THR 573.A O no hydrogen 2.863 N/A LYS 578.A N ASN 574.A O no hydrogen 3.101 N/A GLN 579.A N ILE 575.A O no hydrogen 3.168 N/A GLN 579.A NE2 ASN 583.A OD1 no hydrogen 2.607 N/A GLN 579.A NE2 THR 601.A O no hydrogen 2.740 N/A ILE 580.A N TYR 576.A O no hydrogen 2.815 N/A LEU 581.A N MET 577.A O no hydrogen 2.852 N/A MET 582.A N LYS 578.A O no hydrogen 3.067 N/A ASN 583.A N GLN 579.A O no hydrogen 2.876 N/A ASN 583.A ND2 GLU 586.A OE1 no hydrogen 2.938 N/A ASN 583.A ND2 THR 601.A O no hydrogen 3.028 N/A TYR 584.A N ILE 580.A O no hydrogen 2.704 N/A ASN 585.A N LEU 581.A O no hydrogen 3.090 N/A ASN 585.A ND2.A LEU 581.A O no hydrogen 3.042 N/A GLU 586.A N MET 582.A O no hydrogen 3.040 N/A PHE 587.A N ASN 583.A O no hydrogen 2.873 N/A LEU 588.A N TYR 584.A O no hydrogen 2.812 N/A LYS 589.A N ASN 585.A O no hydrogen 2.957 N/A ALA 590.A N GLU 586.A O no hydrogen 3.166 N/A LYS 591.A N PHE 587.A O no hydrogen 2.989 N/A LYS 591.A NZ ASP 645.A OD2 no hydrogen 2.815 N/A ASN 592.A N LEU 588.A O no hydrogen 2.806 N/A GLU 593.A N LYS 589.A O no hydrogen 2.763 N/A LYS 594.A N LYS 591.A O no hydrogen 3.140 N/A LEU 595.A N ALA 590.A O no hydrogen 2.896 N/A THR 601.A N GLU 586.A OE1 no hydrogen 2.935 N/A THR 601.A OG1 GLU 586.A OE2 no hydrogen 2.636 N/A VAL 603.A N GLN 659.A OE1 no hydrogen 2.982 N/A PHE 607.A N ASN 604.A OD1 no hydrogen 2.892 N/A ILE 608.A N ASN 604.A O no hydrogen 3.076 N/A ASP 609.A N ALA 605.A O no hydrogen 2.921 N/A ALA 610.A N GLN 606.A O no hydrogen 2.959 N/A ILE 611.A N PHE 607.A O no hydrogen 3.010 N/A LYS 612.A N ILE 608.A O no hydrogen 3.010 N/A LYS 612.A NZ GLU 616.A OE1 no hydrogen 3.246 N/A LYS 612.A NZ GLU 616.A OE2 no hydrogen 3.365 N/A TYR 613.A N ASP 609.A O no hydrogen 2.929 N/A LEU 614.A N ALA 610.A O no hydrogen 3.020 N/A LEU 615.A N ILE 611.A O no hydrogen 2.887 N/A GLU 616.A N LYS 612.A O no hydrogen 2.902 N/A ASP 617.A N LEU 614.A O no hydrogen 3.179 N/A HIS 619.A N ASP 617.A OD1 no hydrogen 3.308 N/A ALA 620.A N ASP 617.A O no hydrogen 3.110 N/A PHE 624.A N ASP 621.A OD2 no hydrogen 2.848 N/A LYS 625.A N ASP 621.A O no hydrogen 2.865 N/A LYS 625.A NZ LEU 615.A O no hydrogen 2.854 N/A LYS 625.A NZ ASP 617.A O no hydrogen 2.814 N/A SER 626.A N ALA 622.A O no hydrogen 3.080 N/A SER 626.A OG GLY 623.A O no hydrogen 2.672 N/A TYR 627.A N GLY 623.A O no hydrogen 3.330 N/A ILE 628.A N PHE 624.A O no hydrogen 3.228 N/A SER 630.A N TYR 627.A O no hydrogen 3.181 N/A SER 630.A OG SER 626.A O no hydrogen 2.862 N/A LEU 631.A N TYR 657.A OH no hydrogen 2.964 N/A TYR 636.A N GLN 633.A O no hydrogen 2.973 N/A ILE 637.A N GLN 633.A O no hydrogen 3.006 N/A ILE 638.A N ASP 634.A O no hydrogen 2.961 N/A ASN 639.A N TYR 636.A O no hydrogen 3.211 N/A PHE 640.A N ILE 637.A O no hydrogen 2.936 N/A VAL 641.A N ILE 638.A O no hydrogen 3.373 N/A LEU 644.A N LYS 852.A O no hydrogen 2.925 N/A ASP 645.A N TYR 584.A OH no hydrogen 2.858 N/A VAL 648.A N ASP 645.A OD1 no hydrogen 3.125 N/A LEU 649.A N ASP 645.A O no hydrogen 3.039 N/A ALA 650.A N THR 646.A O no hydrogen 2.862 N/A ASP 651.A N ASP 647.A O no hydrogen 2.936 N/A THR 652.A N VAL 648.A O no hydrogen 2.872 N/A THR 652.A OG1 VAL 648.A O no hydrogen 2.929 N/A LYS 653.A N LEU 649.A O no hydrogen 2.920 N/A LYS 653.A NZ ASP 634.A OD1 no hydrogen 2.853 N/A LYS 653.A NZ ASP 634.A OD2 no hydrogen 3.222 N/A GLU 654.A N ALA 650.A O no hydrogen 3.081 N/A TYR 655.A N ASP 651.A O no hydrogen 2.966 N/A ILE 656.A N THR 652.A O no hydrogen 3.065 N/A TYR 657.A N LYS 653.A O no hydrogen 2.890 N/A LYS 658.A N GLU 654.A O no hydrogen 2.983 N/A LYS 658.A NZ ASP 662.A OD1 no hydrogen 2.998 N/A LYS 658.A NZ ASP 662.A OD2 no hydrogen 3.465 N/A GLN 659.A N TYR 655.A O no hydrogen 2.886 N/A ILE 660.A N ILE 656.A O no hydrogen 3.166 N/A GLY 661.A N TYR 657.A O no hydrogen 2.843 N/A ASP 662.A N LYS 658.A O no hydrogen 2.811 N/A LYS 663.A N ILE 660.A O no hydrogen 3.088 N/A LEU 664.A N ILE 660.A O no hydrogen 2.845 N/A ASN 665.A N GLY 661.A O no hydrogen 2.866 N/A TYR 668.A N LEU 664.A O no hydrogen 2.803 N/A TYR 669.A N ASN 665.A O no hydrogen 2.855 N/A TYR 669.A OH GLU 720.A OE2 no hydrogen 2.924 N/A LYS 670.A N ASP 666.A O no hydrogen 3.023 N/A MET 671.A N VAL 667.A O no hydrogen 2.985 N/A PHE 672.A N TYR 668.A O no hydrogen 2.840 N/A LYS 673.A N TYR 669.A O no hydrogen 3.007 N/A LYS 673.A NZ GLU 720.A OE2 no hydrogen 3.294 N/A SER 674.A N LYS 670.A O no hydrogen 2.895 N/A SER 674.A OG LYS 670.A O no hydrogen 3.401 N/A SER 674.A OG MET 671.A O no hydrogen 3.309 N/A LEU 675.A N MET 671.A O no hydrogen 2.916 N/A GLU 676.A N LYS 673.A O no hydrogen 3.464 N/A ALA 679.A N LEU 675.A O no hydrogen 2.907 N/A ASP 680.A N GLU 676.A O no hydrogen 2.867 N/A THR 683.A N ASP 681.A OD1 no hydrogen 3.336 N/A THR 683.A OG1 ASP 681.A OD1 no hydrogen 2.804 N/A THR 683.A OG1 ASP 681.A OD2 no hydrogen 3.251 N/A PHE 685.A N LEU 682.A O no hydrogen 3.068 N/A ASP 687.A N TYR 684.A O no hydrogen 3.000 N/A SER 689.A N ASP 687.A OD1 no hydrogen 2.883 N/A SER 689.A OG ASP 687.A OD1 no hydrogen 2.713 N/A HIS 690.A N ASP 687.A O no hydrogen 3.197 N/A GLN 695.A N ASP 692.A OD1 no hydrogen 2.917 N/A GLN 695.A NE2 ALA 679.A O no hydrogen 3.054 N/A GLN 695.A NE2 ASP 681.A O no hydrogen 3.057 N/A MET 696.A N ASP 692.A O no hydrogen 3.070 N/A ASN 697.A N PHE 693.A O no hydrogen 3.017 N/A ASN 697.A ND2 THR 342.A OG1 no hydrogen 3.087 N/A MET 698.A N ASP 694.A O no hydrogen 2.958 N/A ARG 699.A N GLN 695.A O no hydrogen 3.059 N/A ARG 699.A NE ASP 288.A OD1 no hydrogen 3.475 N/A ARG 699.A NE ASP 288.A OD2 no hydrogen 2.890 N/A ARG 699.A NH1 ALA 679.A O no hydrogen 2.840 N/A ARG 699.A NH2 ASP 288.A OD1 no hydrogen 2.903 N/A ARG 699.A NH2 ASP 288.A OD2 no hydrogen 3.391 N/A THR 700.A N MET 696.A O no hydrogen 2.885 N/A THR 700.A OG1 MET 696.A O no hydrogen 3.202 N/A LEU 701.A N ASN 697.A O no hydrogen 2.940 N/A ARG 702.A N MET 698.A O no hydrogen 2.971 N/A ARG 702.A NE PHE 672.A O no hydrogen 2.777 N/A ARG 702.A NH2 PHE 672.A O no hydrogen 2.896 N/A ASN 703.A N ARG 699.A O no hydrogen 2.899 N/A ASN 703.A ND2 ASN 732.A OD1 no hydrogen 3.212 N/A THR 704.A N THR 700.A O no hydrogen 2.832 N/A THR 704.A OG1 THR 700.A O no hydrogen 2.859 N/A LEU 705.A N LEU 701.A O no hydrogen 2.892 N/A LEU 706.A N ARG 702.A O no hydrogen 2.811 N/A SER 707.A N ASN 703.A O no hydrogen 3.053 N/A LEU 708.A N THR 704.A O no hydrogen 3.041 N/A LEU 709.A N LEU 705.A O no hydrogen 2.847 N/A SER 710.A N LEU 706.A O no hydrogen 2.837 N/A SER 710.A OG LEU 706.A O no hydrogen 2.639 N/A LYS 711.A N SER 707.A O no hydrogen 3.049 N/A ALA 712.A N LEU 708.A O no hydrogen 3.149 N/A GLN 713.A N SER 710.A O no hydrogen 3.046 N/A GLN 713.A NE2 SER 710.A O no hydrogen 3.009 N/A GLN 713.A NE2 TYR 742.A O no hydrogen 3.451 N/A TYR 714.A N LEU 709.A O no hydrogen 3.067 N/A TYR 714.A OH ASP 666.A OD1 no hydrogen 2.577 N/A ILE 717.A N TYR 714.A O no hydrogen 3.031 N/A ASN 719.A N ASN 716.A O no hydrogen 3.148 N/A ILE 721.A N ILE 717.A O no hydrogen 3.082 N/A ILE 722.A N LEU 718.A O no hydrogen 2.983 N/A GLU 723.A N ASN 719.A O no hydrogen 3.111 N/A HIS 724.A N GLU 720.A O no hydrogen 2.775 N/A HIS 724.A NE2 ASN 703.A OD1 no hydrogen 2.623 N/A SER 725.A N ILE 721.A O no hydrogen 3.045 N/A SER 725.A N ILE 722.A O no hydrogen 3.187 N/A SER 725.A OG ILE 722.A O no hydrogen 2.584 N/A LYS 726.A N GLU 723.A O no hydrogen 2.933 N/A LYS 726.A NZ GLU 723.A OE2 no hydrogen 2.940 N/A SER 727.A N HIS 724.A O no hydrogen 3.111 N/A TYR 729.A N SER 727.A OG no hydrogen 3.387 N/A TYR 729.A OH ASP 681.A O no hydrogen 2.870 N/A ASN 732.A ND2 ASP 680.A OD1 no hydrogen 2.962 N/A ASN 732.A ND2 SER 727.A OG no hydrogen 3.004 N/A TRP 733.A N TYR 729.A O no hydrogen 3.063 N/A LEU 734.A N PRO 730.A O no hydrogen 2.846 N/A THR 735.A N SER 731.A O no hydrogen 3.176 N/A THR 735.A OG1 SER 731.A O no hydrogen 2.568 N/A SER 736.A N ASN 732.A O no hydrogen 2.871 N/A SER 736.A OG TRP 733.A O no hydrogen 2.640 N/A LEU 737.A N TRP 733.A O no hydrogen 3.381 N/A SER 738.A N LEU 734.A O no hydrogen 3.235 N/A SER 738.A OG THR 735.A O no hydrogen 3.148 N/A VAL 739.A N THR 735.A O no hydrogen 2.981 N/A SER 740.A N SER 736.A O no hydrogen 3.087 N/A SER 740.A N LEU 737.A O no hydrogen 3.242 N/A SER 740.A OG LEU 737.A O no hydrogen 2.775 N/A ALA 741.A N SER 738.A O no hydrogen 3.227 N/A TYR 742.A OH ASP 775.A OD2 no hydrogen 2.817 N/A PHE 743.A N SER 740.A O no hydrogen 2.855 N/A LYS 745.A NZ GLU 748.A OE1 no hydrogen 3.053 N/A LYS 745.A NZ GLU 748.A OE2 no hydrogen 3.423 N/A TYR 746.A N PHE 743.A O no hydrogen 3.449 N/A TYR 746.A OH SER 774.A OG no hydrogen 2.920 N/A LEU 749.A N LYS 745.A O no hydrogen 3.034 N/A TYR 750.A N TYR 746.A O no hydrogen 2.778 N/A ASP 751.A N PHE 747.A O no hydrogen 3.179 N/A LYS 752.A N GLU 748.A O no hydrogen 3.056 N/A THR 753.A N LEU 749.A O no hydrogen 2.797 N/A THR 753.A OG1 LEU 749.A O no hydrogen 2.717 N/A THR 753.A OG1 TYR 750.A O no hydrogen 3.187 N/A TYR 754.A N TYR 750.A O no hydrogen 2.934 N/A LYS 755.A N ASP 751.A O no hydrogen 3.028 N/A LEU 756.A N LYS 752.A O no hydrogen 3.255 N/A SER 757.A N THR 753.A O no hydrogen 2.964 N/A SER 757.A N TYR 754.A O no hydrogen 2.945 N/A SER 757.A OG THR 753.A O no hydrogen 2.716 N/A LYS 758.A N TYR 754.A O no hydrogen 2.846 N/A LYS 758.A NZ LYS 755.A O no hydrogen 3.305 N/A ASP 760.A N SER 757.A O no hydrogen 3.281 N/A GLU 761.A N TYR 222.A OH no hydrogen 2.908 N/A LEU 762.A N ASP 760.A OD1 no hydrogen 2.867 N/A LEU 763.A N ASP 760.A OD1 no hydrogen 2.980 N/A LEU 764.A N ASP 760.A O no hydrogen 2.933 N/A GLN 765.A N GLU 761.A O no hydrogen 3.372 N/A GLN 765.A NE2 ASP 799.A OD1 no hydrogen 2.914 N/A GLU 766.A N LEU 762.A O no hydrogen 3.069 N/A TRP 767.A N LEU 763.A O no hydrogen 2.823 N/A TRP 767.A NE1 THR 753.A OG1 no hydrogen 2.925 N/A LEU 768.A N LEU 764.A O no hydrogen 2.807 N/A LYS 769.A N GLN 765.A O no hydrogen 2.977 N/A LYS 769.A NZ GLU 766.A OE2 no hydrogen 3.134 N/A THR 770.A N GLU 766.A O no hydrogen 3.021 N/A THR 770.A OG1 GLU 766.A O no hydrogen 2.857 N/A VAL 771.A N TRP 767.A O no hydrogen 2.936 N/A SER 772.A N LEU 768.A O no hydrogen 2.763 N/A SER 772.A OG VAL 803.A O no hydrogen 2.586 N/A ARG 773.A N LYS 769.A O no hydrogen 2.927 N/A SER 774.A N VAL 771.A O no hydrogen 2.994 N/A SER 774.A OG TYR 746.A OH no hydrogen 2.920 N/A SER 774.A OG THR 770.A O no hydrogen 2.823 N/A SER 774.A OG VAL 771.A O no hydrogen 3.388 N/A ARG 776.A N SER 774.A O no hydrogen 2.808 N/A ARG 776.A NE ASP 778.A OD1 no hydrogen 3.003 N/A ARG 776.A NH1 ALA 741.A O no hydrogen 2.875 N/A ARG 776.A NH2 ASP 778.A OD1 no hydrogen 3.537 N/A ARG 776.A NH2 ASP 778.A OD2 no hydrogen 3.228 N/A TYR 780.A OH ARG 813.A O no hydrogen 2.789 N/A ILE 782.A N ASP 778.A O no hydrogen 2.996 N/A LEU 783.A N ILE 779.A O no hydrogen 2.882 N/A LYS 784.A N TYR 780.A O no hydrogen 3.187 N/A LYS 784.A NZ GLU 787.A OE1 no hydrogen 3.330 N/A LYS 784.A NZ GLU 787.A OE2 no hydrogen 3.350 N/A LYS 785.A N GLU 781.A O no hydrogen 3.080 N/A LYS 785.A NZ.A GLU 789.A OE1 no hydrogen 2.867 N/A LYS 785.A NZ.A GLU 789.A OE2 no hydrogen 2.830 N/A LEU 786.A N ILE 782.A O no hydrogen 3.002 N/A GLU 787.A N LEU 783.A O no hydrogen 2.952 N/A ASN 788.A N LYS 784.A O no hydrogen 3.045 N/A GLU 789.A N LYS 785.A O no hydrogen 2.857 N/A VAL 790.A N LEU 786.A O no hydrogen 2.918 N/A LEU 791.A N LEU 786.A O no hydrogen 2.848 N/A LYS 792.A N GLU 787.A O no hydrogen 2.783 N/A LYS 792.A NZ ASN 788.A O no hydrogen 2.787 N/A ASP 793.A N ASP 793.A OD1.B no hydrogen 2.686 N/A SER 794.A N LEU 791.A O no hydrogen 3.200 N/A SER 794.A OG ASP 799.A OD2 no hydrogen 2.779 N/A ASN 796.A N SER 794.A OG no hydrogen 3.103 N/A ASN 796.A ND2 SER 259.A O no hydrogen 3.520 N/A ASN 798.A N ASN 796.A OD1 no hydrogen 2.897 N/A ASN 798.A ND2 ASN 275.A OD1 no hydrogen 2.927 N/A ASN 798.A ND2 GLN 765.A OE1 no hydrogen 3.428 N/A ASP 799.A N ASN 796.A O no hydrogen 2.889 N/A ILE 800.A N ASN 796.A O no hydrogen 3.177 N/A ARG 801.A N PRO 797.A O no hydrogen 2.875 N/A ARG 801.A NH1 PHE 261.A O no hydrogen 3.094 N/A ARG 801.A NH1 ASN 798.A OD1 no hydrogen 2.924 N/A ARG 801.A NH2 ASN 262.A O no hydrogen 2.816 N/A ARG 801.A NH2 GLN 842.A OE1 no hydrogen 2.719 N/A ALA 802.A N ASN 798.A O no hydrogen 3.117 N/A VAL 803.A N ASP 799.A O no hydrogen 3.124 N/A TYR 804.A N ILE 800.A O no hydrogen 3.281 N/A TYR 804.A OH GLU 787.A OE2 no hydrogen 2.441 N/A LEU 805.A N ARG 801.A O no hydrogen 3.141 N/A PHE 807.A N SER 772.A OG no hydrogen 2.928 N/A THR 808.A N TYR 804.A O no hydrogen 3.241 N/A THR 808.A N LEU 805.A O no hydrogen 3.029 N/A THR 808.A OG1 LEU 805.A O no hydrogen 2.572 N/A ASN 809.A N PRO 806.A O no hydrogen 2.991 N/A ASN 810.A N PHE 807.A O no hydrogen 2.850 N/A ARG 812.A NH1 ASP 651.A OD1 no hydrogen 2.937 N/A ARG 812.A NH2 ASP 651.A OD1 no hydrogen 3.090 N/A ARG 813.A N ASN 810.A OD1 no hydrogen 2.905 N/A PHE 814.A N ASN 810.A O no hydrogen 2.814 N/A HIS 815.A ND1 TYR 822.A OH no hydrogen 2.845 N/A ASP 816.A N ARG 813.A O no hydrogen 3.076 N/A SER 818.A N ASP 816.A OD2 no hydrogen 3.172 N/A SER 818.A OG ASP 816.A OD2 no hydrogen 2.694 N/A GLY 819.A N ASP 816.A O no hydrogen 2.806 N/A LYS 820.A N SER 818.A OG no hydrogen 3.175 N/A TYR 822.A OH HIS 815.A ND1 no hydrogen 2.845 N/A LYS 823.A N GLY 819.A O no hydrogen 2.907 N/A LEU 824.A N LYS 820.A O no hydrogen 2.958 N/A ILE 825.A N GLY 821.A O no hydrogen 3.062 N/A ALA 826.A N TYR 822.A O no hydrogen 3.075 N/A GLU 827.A N LYS 823.A O no hydrogen 3.014 N/A VAL 828.A N LEU 824.A O no hydrogen 3.131 N/A ILE 829.A N ILE 825.A O no hydrogen 2.834 N/A THR 830.A N ALA 826.A O no hydrogen 2.983 N/A THR 830.A OG1 ALA 826.A O no hydrogen 3.083 N/A LYS 831.A N GLU 827.A O no hydrogen 3.037 N/A LYS 831.A NZ ASP 793.A OD1.A no hydrogen 3.402 N/A THR 832.A N VAL 828.A O no hydrogen 2.937 N/A THR 832.A OG1 VAL 828.A O no hydrogen 2.665 N/A ASP 833.A N ILE 829.A O no hydrogen 2.776 N/A LYS 834.A N LYS 831.A O no hydrogen 3.406 N/A PHE 835.A N THR 832.A O no hydrogen 3.084 N/A ASN 836.A N THR 832.A O no hydrogen 2.840 N/A ASN 836.A ND2 TYR 106.A O no hydrogen 3.577 N/A ASN 836.A ND2 ASN 262.A OD1 no hydrogen 2.969 N/A VAL 839.A N ASN 836.A OD1 no hydrogen 3.010 N/A ALA 840.A N ASN 836.A O no hydrogen 2.985 N/A THR 841.A N PRO 837.A O no hydrogen 2.997 N/A THR 841.A OG1 PRO 837.A O no hydrogen 3.087 N/A GLN 842.A N MET 838.A O no hydrogen 3.117 N/A GLN 842.A NE2 ASN 262.A O no hydrogen 2.927 N/A LEU 843.A N VAL 839.A O no hydrogen 2.939 N/A CYS 844.A N THR 841.A O no hydrogen 3.061 N/A CYS 844.A SG ALA 840.A O no hydrogen 3.704 N/A GLU 845.A N GLN 842.A O no hydrogen 3.215 N/A PHE 847.A N CYS 844.A O no hydrogen 2.791 N/A LYS 848.A N GLU 845.A O no hydrogen 3.019 N/A LYS 848.A NZ GLU 358.A OE2 no hydrogen 2.757 N/A TRP 850.A N PHE 847.A O no hydrogen 3.054 N/A TRP 850.A NE1 LEU 885.A O no hydrogen 2.807 N/A LYS 852.A N LEU 849.A O no hydrogen 2.797 N/A LYS 852.A NZ SER 360.A O no hydrogen 3.105 N/A LEU 853.A N TRP 850.A O no hydrogen 3.523 N/A ASP 854.A N LEU 644.A O no hydrogen 2.881 N/A LYS 856.A NZ GLU 859.A OE1 no hydrogen 3.032 N/A ARG 857.A N ASP 854.A OD2 no hydrogen 3.058 N/A ARG 857.A NE HIS 815.A O no hydrogen 2.795 N/A ARG 857.A NH1 ASP 854.A OD1 no hydrogen 2.757 N/A ARG 857.A NH2 ASP 647.A OD2 no hydrogen 2.728 N/A ARG 857.A NH2 HIS 815.A O no hydrogen 3.163 N/A GLN 858.A N ASP 854.A O no hydrogen 2.974 N/A GLN 858.A NE2 LEU 853.A O no hydrogen 2.763 N/A GLU 859.A N THR 855.A O no hydrogen 3.186 N/A LEU 860.A N LYS 856.A O no hydrogen 3.030 N/A MET 861.A N ARG 857.A O no hydrogen 2.837 N/A LEU 862.A N GLN 858.A O no hydrogen 2.841 N/A ASN 863.A N GLU 859.A O no hydrogen 2.940 N/A GLU 864.A N LEU 860.A O no hydrogen 3.264 N/A MET 865.A N MET 861.A O no hydrogen 2.973 N/A ASN 866.A N LEU 862.A O no hydrogen 2.899 N/A THR 867.A N ASN 863.A O no hydrogen 2.871 N/A THR 867.A OG1 ASN 863.A O no hydrogen 2.964 N/A MET 868.A N GLU 864.A O no hydrogen 2.939 N/A LEU 869.A N MET 865.A O no hydrogen 2.871 N/A GLN 870.A N ASN 866.A O no hydrogen 3.107 N/A GLN 870.A N THR 867.A O no hydrogen 3.115 N/A GLU 871.A N MET 868.A O no hydrogen 3.065 N/A ILE 874.A N GLU 871.A O no hydrogen 3.163 N/A SER 875.A N ASP 833.A OD2 no hydrogen 2.840 N/A SER 875.A OG ASP 833.A OD1 no hydrogen 2.533 N/A SER 875.A OG ASP 833.A OD2 no hydrogen 3.300 N/A ASN 877.A ND2 GLU 376.A OE1 no hydrogen 2.697 N/A LEU 878.A N SER 875.A OG no hydrogen 3.036 N/A LYS 879.A N SER 875.A O no hydrogen 3.046 N/A GLU 880.A N ASN 876.A O no hydrogen 3.042 N/A TYR 881.A N ASN 877.A O no hydrogen 3.136 N/A LEU 882.A N LEU 878.A O no hydrogen 2.910 N/A LEU 883.A N LYS 879.A O no hydrogen 2.827 N/A ARG 884.A N GLU 880.A O no hydrogen 3.043 N/A ARG 884.A NE GLU 880.A OE2 no hydrogen 3.044 N/A ARG 884.A NH2 GLU 880.A OE1 no hydrogen 3.245 N/A ARG 884.A NH2 GLU 880.A OE2 no hydrogen 3.311 N/A LEU 885.A N TYR 881.A O no hydrogen 2.896 N/A THR 886.A N LEU 882.A O no hydrogen 3.026 N/A THR 886.A OG1 LEU 882.A O no hydrogen 2.838 N/A ASN 887.A N ARG 884.A O no hydrogen 3.217 N/A ASN 887.A ND2 ARG 884.A O no hydrogen 3.424 N/A LYS 888.A N LEU 883.A O no hydrogen 2.864 N/A LYS 888.A NZ ASN 866.A OD1 no hydrogen 2.211 N/A