Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vqu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ILE 292.A O no hydrogen 2.942 N/A SER 4.A N ASP 2.A OD1 no hydrogen 3.037 N/A SER 4.A OG ASP 2.A OD1 no hydrogen 2.642 N/A GLU 5.A N PHE 190.A O no hydrogen 2.825 N/A MET 7.A N LEU 188.A O no hydrogen 2.765 N/A LEU 9.A N VAL 186.A O no hydrogen 3.077 N/A ASP 10.A N LEU 8.A O no hydrogen 3.003 N/A TRP 13.A NE1 LEU 9.A O no hydrogen 2.906 N/A GLU 14.A N ARG 65.A O no hydrogen 2.789 N/A PHE 15.A N MET 24.A O no hydrogen 2.990 N/A SER 16.A N GLU 63.A O no hydrogen 2.767 N/A SER 16.A OG GLN 17.A O no hydrogen 3.154 N/A SER 16.A OG LYS 22.A O no hydrogen 2.729 N/A GLN 17.A NE2 GLU 60.A OE1 no hydrogen 2.618 N/A SER 18.A N ASP 61.A O no hydrogen 2.943 N/A SER 18.A OG GLU 63.A OE1 no hydrogen 2.810 N/A THR 20.A N GLN 17.A O no hydrogen 3.199 N/A THR 20.A OG1 GLN 17.A O no hydrogen 2.545 N/A MET 24.A N PHE 15.A O no hydrogen 3.065 N/A ALA 26.A N TRP 13.A O no hydrogen 2.827 N/A THR 27.A N ASP 35.A OD1 no hydrogen 3.065 N/A GLY 30.A N VAL 182.A O no hydrogen 2.910 N/A VAL 32.A N SER 180.A O no hydrogen 2.958 N/A HIS 33.A ND1 THR 179.A OG1 no hydrogen 3.060 N/A GLN 34.A N THR 31.A OG1 no hydrogen 3.106 N/A ASP 35.A N THR 31.A O no hydrogen 3.122 N/A LEU 36.A N VAL 32.A O no hydrogen 2.945 N/A ILE 37.A N HIS 33.A O no hydrogen 2.909 N/A SER 38.A N GLN 34.A O no hydrogen 2.949 N/A SER 38.A OG ASP 35.A O no hydrogen 2.724 N/A HIS 39.A N LEU 36.A O no hydrogen 2.725 N/A HIS 39.A NE2 PRO 25.A O no hydrogen 2.802 N/A GLU 40.A N ILE 37.A O no hydrogen 2.911 N/A LEU 41.A N LEU 36.A O no hydrogen 3.015 N/A PHE 46.A N ASN 44.A OD1 no hydrogen 2.681 N/A TYR 47.A N.A ASN 44.A O no hydrogen 3.251 N/A TYR 47.A N.B ASN 44.A O no hydrogen 3.298 N/A GLY 48.A N PHE 542.A O.A no hydrogen 3.148 N/A GLY 48.A N PHE 542.A O.B no hydrogen 2.763 N/A ASN 50.A N TYR 47.A O.A no hydrogen 3.147 N/A ASN 50.A N TYR 47.A O.B no hydrogen 3.196 N/A ASN 50.A ND2 ASN 44.A O no hydrogen 2.814 N/A LYS 52.A N MET 49.A O no hydrogen 3.426 N/A LYS 53.A N ASN 50.A O no hydrogen 3.172 N/A ILE 54.A N GLU 51.A O no hydrogen 3.338 N/A GLN 55.A NE2 GLU 51.A O no hydrogen 2.909 N/A GLN 55.A NE2 ARG 176.A O no hydrogen 2.913 N/A VAL 57.A N ILE 54.A O no hydrogen 3.422 N/A GLU 58.A N GLN 55.A O no hydrogen 3.094 N/A ASN 59.A N TRP 56.A O no hydrogen 3.046 N/A GLU 60.A N VAL 57.A O no hydrogen 3.220 N/A TRP 62.A N PHE 129.A O no hydrogen 2.987 N/A TRP 62.A NE1 VAL 57.A O no hydrogen 3.035 N/A GLU 63.A N SER 16.A O no hydrogen 2.853 N/A TYR 64.A N ILE 127.A O no hydrogen 2.874 N/A TYR 64.A OH ASP 35.A OD2 no hydrogen 2.413 N/A ARG 65.A N GLU 14.A O no hydrogen 2.927 N/A ARG 65.A NE GLU 14.A OE2 no hydrogen 3.234 N/A ARG 65.A NH2 GLU 14.A OE1 no hydrogen 3.242 N/A ARG 65.A NH2 GLU 14.A OE2 no hydrogen 3.476 N/A THR 66.A N LEU 125.A O no hydrogen 2.965 N/A THR 66.A OG1 THR 11.A O no hydrogen 3.398 N/A SER 67.A OG ASN 123.A O no hydrogen 3.540 N/A SER 67.A OG HIS 124.A ND1 no hydrogen 2.891 N/A PHE 68.A N ASN 123.A O no hydrogen 3.035 N/A VAL 70.A N GLY 121.A O no hydrogen 2.960 N/A SER 71.A N GLN 74.A OE1 no hydrogen 2.818 N/A GLN 74.A N SER 71.A OG no hydrogen 3.001 N/A GLN 74.A NE2 GLU 5.A OE1 no hydrogen 3.276 N/A GLN 74.A NE2 GLU 5.A OE2 no hydrogen 3.404 N/A LEU 75.A N SER 71.A O no hydrogen 2.904 N/A ASN 76.A N GLU 72.A O no hydrogen 3.150 N/A ASN 76.A ND2 GLU 72.A O no hydrogen 2.950 N/A ARG 77.A N GLN 74.A O no hydrogen 3.022 N/A ARG 77.A NE ASP 192.A OD1 no hydrogen 3.236 N/A ARG 77.A NH1 THR 3.A O no hydrogen 3.421 N/A ARG 77.A NH2 THR 3.A O no hydrogen 2.951 N/A ARG 77.A NH2 ASP 192.A OD2 no hydrogen 2.861 N/A ASP 78.A N ASP 192.A OD1 no hydrogen 3.399 N/A GLY 79.A N TYR 191.A O no hydrogen 3.000 N/A GLN 81.A N ARG 189.A O no hydrogen 2.942 N/A GLN 81.A NE2 THR 195.A OG1 no hydrogen 3.305 N/A LEU 82.A N LEU 112.A O no hydrogen 2.822 N/A ILE 83.A N THR 187.A O no hydrogen 2.743 N/A PHE 84.A N TYR 110.A O no hydrogen 2.875 N/A GLU 85.A N PRO 185.A O no hydrogen 3.100 N/A ASP 88.A N GLY 181.A O no hydrogen 2.805 N/A THR 89.A OG1 ASP 88.A OD1 no hydrogen 2.745 N/A TYR 90.A OH SER 162.A OG no hydrogen 2.689 N/A ALA 91.A N ALA 103.A O no hydrogen 3.246 N/A ASP 92.A N TYR 128.A O no hydrogen 2.931 N/A VAL 93.A N LEU 101.A O no hydrogen 2.856 N/A TYR 94.A N TYR 126.A O.A no hydrogen 2.703 N/A TYR 94.A N TYR 126.A O.B no hydrogen 2.861 N/A LEU 95.A N SER 98.A O no hydrogen 2.787 N/A ASN 96.A N HIS 124.A O no hydrogen 3.032 N/A ASN 96.A ND2 VAL 117.A O no hydrogen 3.056 N/A ASN 96.A ND2 ASN 123.A OD1 no hydrogen 2.685 N/A SER 98.A N LEU 95.A O no hydrogen 2.950 N/A LEU 100.A N VAL 93.A O no hydrogen 2.774 N/A LYS 102.A NZ ASP 92.A OD1 no hydrogen 2.685 N/A ALA 103.A N ALA 91.A O no hydrogen 2.605 N/A ASP 104.A N TYR 110.A OH no hydrogen 3.194 N/A ASN 105.A ND2 ARG 408.A O no hydrogen 3.152 N/A ASN 105.A ND2 GLU 412.A OE1 no hydrogen 2.914 N/A MET 106.A N ARG 163.A O no hydrogen 2.874 N/A PHE 107.A N ASN 105.A OD1 no hydrogen 2.780 N/A VAL 108.A N ASN 105.A O no hydrogen 3.326 N/A TYR 110.A N PHE 84.A O no hydrogen 2.677 N/A LEU 112.A N LEU 82.A O no hydrogen 2.704 N/A VAL 114.A N ILE 80.A O no hydrogen 2.716 N/A LYS 115.A NZ ARG 77.A O no hydrogen 2.821 N/A LYS 115.A NZ ASP 78.A O no hydrogen 3.431 N/A VAL 117.A N VAL 114.A O no hydrogen 3.002 N/A LEU 118.A N VAL 114.A O no hydrogen 3.139 N/A LEU 118.A N LYS 115.A O no hydrogen 3.276 N/A ARG 119.A N ASN 123.A OD1 no hydrogen 2.869 N/A GLY 121.A N VAL 70.A O no hydrogen 2.904 N/A ASN 123.A N PHE 68.A O no hydrogen 2.765 N/A ASN 123.A ND2 PHE 68.A O no hydrogen 3.568 N/A ASN 123.A ND2 ARG 119.A O no hydrogen 2.791 N/A HIS 124.A N ASN 96.A OD1 no hydrogen 2.913 N/A LEU 125.A N THR 66.A O no hydrogen 2.929 N/A TYR 126.A N.A TYR 94.A O no hydrogen 2.904 N/A TYR 126.A N.B TYR 94.A O no hydrogen 2.878 N/A TYR 126.A OH.B GLU 63.A OE2 no hydrogen 2.235 N/A ILE 127.A N TYR 64.A O no hydrogen 2.732 N/A TYR 128.A N ASP 92.A O no hydrogen 2.929 N/A TYR 128.A OH ASP 61.A OD2 no hydrogen 2.645 N/A PHE 129.A N TRP 62.A O no hydrogen 2.825 N/A HIS 130.A N TYR 90.A O no hydrogen 2.913 N/A HIS 130.A NE2 ASP 92.A OD2 no hydrogen 2.872 N/A SER 131.A N ASP 61.A OD1 no hydrogen 2.779 N/A SER 131.A OG GLU 58.A O no hydrogen 2.461 N/A ILE 133.A N SER 131.A OG no hydrogen 3.177 N/A ARG 134.A N SER 131.A OG no hydrogen 3.218 N/A ARG 134.A NE ASN 59.A O no hydrogen 3.394 N/A GLN 135.A N SER 131.A O no hydrogen 2.734 N/A THR 136.A N ILE 133.A O no hydrogen 3.074 N/A THR 136.A OG1 PRO 132.A O no hydrogen 2.573 N/A THR 136.A OG1 ILE 133.A O no hydrogen 3.443 N/A LEU 137.A N ILE 133.A O no hydrogen 2.841 N/A TYR 140.A N THR 136.A O no hydrogen 2.891 N/A ALA 141.A N LEU 137.A O no hydrogen 2.990 N/A SER 142.A N PRO 138.A O no hydrogen 3.158 N/A SER 142.A OG GLN 139.A O no hydrogen 2.769 N/A ASN 143.A N TYR 140.A O no hydrogen 2.908 N/A ASN 143.A ND2 PHE 145.A O no hydrogen 2.819 N/A ASN 146.A ND2 GLU 155.A O no hydrogen 2.938 N/A ALA 149.A N TYR 147.A O no hydrogen 2.815 N/A ASP 152.A N ALA 149.A O no hydrogen 2.996 N/A HIS 153.A N TYR 169.A O no hydrogen 2.990 N/A HIS 154.A N ASP 152.A O no hydrogen 3.003 N/A LYS 156.A N HIS 154.A ND1 no hydrogen 2.788 N/A HIS 157.A N ASN 146.A OD1 no hydrogen 2.860 N/A HIS 157.A ND1 TYR 147.A O no hydrogen 2.803 N/A LEU 158.A N LYS 156.A O no hydrogen 3.103 N/A SER 159.A N ASP 152.A OD2 no hydrogen 2.915 N/A SER 159.A OG ASP 152.A OD2 no hydrogen 2.680 N/A PHE 161.A N LEU 158.A O no hydrogen 3.135 N/A SER 162.A N SER 159.A O no hydrogen 3.177 N/A SER 162.A OG TYR 90.A OH no hydrogen 2.689 N/A ARG 163.A NE GLU 412.A OE1 no hydrogen 2.826 N/A ARG 163.A NH1 MET 393.A O no hydrogen 3.257 N/A ARG 163.A NH2 MET 393.A O no hydrogen 2.880 N/A ARG 163.A NH2 GLU 412.A OE2 no hydrogen 2.606 N/A LYS 164.A NZ ASP 88.A OD1 no hydrogen 2.562 N/A LYS 164.A NZ THR 179.A O no hydrogen 2.644 N/A TYR 167.A N GLY 369.A O no hydrogen 2.983 N/A TYR 167.A OH ASP 338.A O no hydrogen 2.639 N/A SER 168.A N ALA 165.A O no hydrogen 3.046 N/A SER 168.A OG ALA 165.A O no hydrogen 2.735 N/A TYR 169.A N PRO 166.A O no hydrogen 3.349 N/A GLY 170.A N TYR 167.A O no hydrogen 2.774 N/A TRP 171.A N GLY 174.A O no hydrogen 3.381 N/A GLY 174.A N TRP 171.A O no hydrogen 2.971 N/A ARG 176.A N GLU 51.A OE2 no hydrogen 2.857 N/A ARG 176.A NE GLU 58.A OE2 no hydrogen 3.018 N/A ARG 176.A NH1 ASP 152.A OD1 no hydrogen 2.865 N/A ARG 176.A NH1 TYR 169.A O no hydrogen 3.043 N/A ARG 176.A NH2 GLU 58.A OE1 no hydrogen 2.977 N/A ARG 176.A NH2 GLU 58.A OE2 no hydrogen 3.461 N/A MET 177.A N SER 168.A O no hydrogen 3.013 N/A THR 179.A OG1 HIS 33.A ND1 no hydrogen 3.060 N/A THR 179.A OG1 SER 180.A O no hydrogen 3.545 N/A SER 180.A N THR 179.A OG1 no hydrogen 2.821 N/A GLY 181.A N ASP 88.A O no hydrogen 2.795 N/A TRP 183.A N GLY 86.A O no hydrogen 3.145 N/A TRP 183.A NE1 MET 106.A O no hydrogen 2.982 N/A ARG 184.A NH2 TYR 372.A O no hydrogen 2.885 N/A THR 187.A N ILE 83.A O no hydrogen 2.966 N/A LEU 188.A N MET 7.A O no hydrogen 2.874 N/A ARG 189.A N GLN 81.A O no hydrogen 2.722 N/A ARG 189.A NH1 SER 4.A OG no hydrogen 2.786 N/A PHE 190.A N GLU 5.A O no hydrogen 2.903 N/A TYR 191.A N GLY 79.A O no hydrogen 3.012 N/A ILE 193.A N ASP 78.A OD2 no hydrogen 2.934 N/A ALA 194.A N ASP 192.A O no hydrogen 2.776 N/A THR 195.A N ASN 220.A O no hydrogen 3.169 N/A SER 197.A N ILE 218.A O no hydrogen 2.701 N/A SER 197.A OG.B ILE 218.A O no hydrogen 3.175 N/A ASP 198.A N ILE 218.A O no hydrogen 3.314 N/A TYR 199.A OH ASN 215.A OD1 no hydrogen 2.756 N/A TYR 200.A N GLU 216.A O.A no hydrogen 2.858 N/A TYR 200.A N GLU 216.A O.B no hydrogen 2.800 N/A VAL 201.A N ASN 422.A OD1 no hydrogen 2.877 N/A ARG 202.A N SER 214.A O no hydrogen 2.952 N/A ARG 202.A NE GLU 216.A OE2.A no hydrogen 2.961 N/A ARG 202.A NE GLU 216.A OE2.B no hydrogen 3.212 N/A ARG 202.A NH2 GLU 216.A OE1.A no hydrogen 2.970 N/A ARG 202.A NH2 GLU 216.A OE2.A no hydrogen 3.426 N/A ARG 202.A NH2 GLU 216.A OE2.B no hydrogen 2.535 N/A GLN 203.A NE2 ARG 303.A O no hydrogen 2.679 N/A LEU 204.A N ARG 212.A O no hydrogen 2.748 N/A SER 205.A N ARG 212.A O no hydrogen 3.406 N/A THR 207.A N ASN 210.A O no hydrogen 2.999 N/A THR 207.A OG1 ASN 210.A O no hydrogen 3.410 N/A ASN 210.A N THR 207.A O no hydrogen 3.321 N/A ASN 210.A N THR 207.A OG1 no hydrogen 3.093 N/A ASN 210.A ND2 GLU 263.A OE1 no hydrogen 3.128 N/A ALA 211.A N VAL 264.A O no hydrogen 2.825 N/A ARG 212.A N SER 205.A O no hydrogen 2.920 N/A ARG 212.A NH1 SER 205.A OG no hydrogen 2.868 N/A LEU 213.A N ALA 262.A O no hydrogen 2.800 N/A SER 214.A N ARG 202.A O no hydrogen 2.786 N/A SER 214.A OG GLU 216.A OE2.A no hydrogen 2.817 N/A ASN 215.A N LEU 260.A O no hydrogen 2.763 N/A ASN 215.A ND2 LEU 260.A O no hydrogen 2.846 N/A GLU 216.A N.A TYR 200.A O no hydrogen 2.791 N/A GLU 216.A N.B TYR 200.A O no hydrogen 2.790 N/A LEU 217.A N ILE 258.A O no hydrogen 2.723 N/A ILE 218.A N ASP 198.A O no hydrogen 2.937 N/A VAL 219.A N ASN 256.A O no hydrogen 2.969 N/A ASN 220.A N THR 195.A O no hydrogen 2.892 N/A GLN 221.A N GLY 254.A O no hydrogen 2.857 N/A GLN 221.A NE2 GLN 225.A O no hydrogen 2.833 N/A GLN 221.A NE2 LEU 251.A O no hydrogen 3.096 N/A ILE 222.A N ILE 193.A O no hydrogen 2.789 N/A VAL 223.A N GLN 221.A OE1 no hydrogen 2.989 N/A LYS 226.A NZ GLN 252.A OE1 no hydrogen 3.028 N/A ILE 227.A N LEU 251.A O no hydrogen 3.018 N/A ALA 229.A N VAL 249.A O no hydrogen 2.924 N/A GLU 230.A N ALA 288.A O no hydrogen 2.819 N/A VAL 231.A N GLN 247.A O no hydrogen 2.782 N/A ARG 232.A N GLN 286.A O no hydrogen 3.003 N/A ARG 232.A NH1 GLU 230.A OE1 no hydrogen 2.576 N/A VAL 233.A N VAL 245.A O no hydrogen 2.923 N/A ASN 234.A N SER 284.A O no hydrogen 2.760 N/A ASN 234.A ND2 THR 241.A OG1 no hydrogen 3.016 N/A ASN 234.A ND2 GLU 244.A OE2 no hydrogen 2.806 N/A VAL 235.A N THR 243.A O no hydrogen 2.774 N/A SER 236.A N ASP 282.A O no hydrogen 2.869 N/A SER 236.A OG.B ASN 234.A OD1 no hydrogen 2.664 N/A LEU 237.A N THR 240.A O no hydrogen 2.888 N/A THR 240.A N LEU 237.A O no hydrogen 3.016 N/A VAL 242.A N VAL 235.A O no hydrogen 2.610 N/A THR 243.A N VAL 235.A O no hydrogen 3.157 N/A VAL 245.A N VAL 233.A O no hydrogen 3.019 N/A GLN 247.A N VAL 231.A O no hydrogen 2.788 N/A GLN 247.A NE2 THR 259.A O no hydrogen 2.892 N/A GLN 248.A NE2 GLU 230.A OE2 no hydrogen 2.603 N/A VAL 249.A N ALA 229.A O no hydrogen 3.034 N/A LEU 251.A N ILE 227.A O no hydrogen 2.874 N/A GLN 252.A N ASN 256.A OD1 no hydrogen 2.858 N/A GLN 252.A NE2 THR 250.A O no hydrogen 3.334 N/A GLY 254.A N GLN 221.A O no hydrogen 2.930 N/A ASN 256.A N VAL 219.A O no hydrogen 2.789 N/A ASN 256.A ND2 VAL 219.A O no hydrogen 3.527 N/A ASN 256.A ND2 GLN 252.A O no hydrogen 2.840 N/A ILE 258.A N LEU 217.A O no hydrogen 2.964 N/A LEU 260.A N ASN 215.A O no hydrogen 2.908 N/A ALA 262.A N LEU 213.A O no hydrogen 3.029 N/A VAL 264.A N ALA 211.A O no hydrogen 2.839 N/A ASN 266.A N GLU 209.A O no hydrogen 2.824 N/A VAL 268.A N TYR 281.A OH no hydrogen 2.918 N/A ARG 269.A NH1 ASN 323.A OD1 no hydrogen 3.165 N/A ARG 269.A NH2 ASP 208.A OD1 no hydrogen 3.000 N/A TRP 270.A N LEU 302.A O no hydrogen 2.919 N/A TRP 270.A NE1 ASP 382.A O no hydrogen 2.917 N/A MET 271.A N THR 277.A O no hydrogen 3.022 N/A ASN 273.A N GLY 385.A O no hydrogen 2.764 N/A ASN 273.A ND2 LYS 357.A O no hydrogen 3.531 N/A ASN 273.A ND2 MET 361.A O no hydrogen 2.802 N/A TRP 275.A N PRO 272.A O no hydrogen 2.909 N/A TRP 275.A NE1 ASP 669.A O no hydrogen 2.787 N/A TYR 281.A N ILE 300.A O no hydrogen 2.841 N/A ASP 282.A N SER 236.A O no hydrogen 2.756 N/A PHE 283.A N HIS 298.A O no hydrogen 2.933 N/A SER 284.A N ASN 234.A O no hydrogen 2.890 N/A SER 284.A OG GLU 295.A OE2 no hydrogen 2.628 N/A ALA 285.A N GLN 296.A O no hydrogen 2.848 N/A GLN 286.A N ARG 232.A O no hydrogen 2.798 N/A ILE 287.A N ALA 294.A O no hydrogen 2.710 N/A ALA 288.A N GLU 230.A O no hydrogen 2.964 N/A CYS 289.A N ARG 291.A O no hydrogen 2.879 N/A CYS 289.A SG PRO 228.A O no hydrogen 3.947 N/A ARG 291.A NE CYS 289.A O no hydrogen 3.433 N/A VAL 293.A N ILE 287.A O no hydrogen 2.803 N/A GLU 295.A N ASP 2.A OD2 no hydrogen 2.786 N/A GLN 296.A N ALA 285.A O no hydrogen 2.939 N/A GLN 296.A NE2 SER 297.A O no hydrogen 3.262 N/A SER 297.A OG.B GLU 295.A OE2 no hydrogen 2.578 N/A HIS 298.A N PHE 283.A O no hydrogen 2.885 N/A HIS 298.A NE2 TYR 199.A O no hydrogen 2.653 N/A ARG 299.A NH1 GLU 383.A OE1 no hydrogen 2.916 N/A ARG 299.A NH2 GLU 383.A OE1 no hydrogen 2.772 N/A ILE 300.A N TYR 281.A O no hydrogen 2.916 N/A ARG 303.A NE ALA 424.A O no hydrogen 2.653 N/A ARG 303.A NH1 ARG 303.A O no hydrogen 3.148 N/A ARG 303.A NH2 ALA 424.A O no hydrogen 2.983 N/A THR 304.A N ASN 323.A OD1 no hydrogen 3.190 N/A ARG 306.A N GLU 321.A O no hydrogen 2.943 N/A ARG 306.A NH1 GLU 321.A OE1.B no hydrogen 2.538 N/A ARG 306.A NH1 GLU 321.A OE2.A no hydrogen 3.322 N/A VAL 308.A N TYR 319.A O no hydrogen 2.790 N/A ASN 309.A ND2 SER 317.A O no hydrogen 2.905 N/A ASN 309.A ND2 TYR 487.A OH no hydrogen 2.804 N/A GLU 310.A N SER 317.A OG no hydrogen 3.332 N/A ASP 312.A N GLY 315.A O no hydrogen 2.893 N/A LYS 313.A NZ ASP 314.A OD2 no hydrogen 3.471 N/A ASP 314.A N ASP 312.A OD1 no hydrogen 2.989 N/A GLY 315.A N ASP 312.A O no hydrogen 2.999 N/A GLU 316.A N GLY 498.A O no hydrogen 2.859 N/A SER 317.A N GLU 310.A O no hydrogen 3.030 N/A SER 317.A OG VAL 308.A O no hydrogen 3.414 N/A SER 317.A OG GLU 310.A O no hydrogen 3.503 N/A TYR 319.A N VAL 308.A O no hydrogen 3.014 N/A GLU 321.A N ARG 306.A O no hydrogen 2.825 N/A VAL 322.A N ILE 325.A O no hydrogen 2.800 N/A ASN 323.A N THR 304.A O no hydrogen 2.908 N/A ASN 323.A ND2 TRP 270.A O no hydrogen 2.981 N/A ILE 325.A N VAL 322.A O no hydrogen 2.966 N/A MET 327.A N PHE 320.A O no hydrogen 2.764 N/A ALA 329.A N MET 612.A O no hydrogen 3.146 N/A LYS 330.A N ASN 362.A OD1 no hydrogen 2.844 N/A LYS 330.A NZ PHE 648.A O no hydrogen 2.745 N/A LYS 330.A NZ ASP 669.A OD2 no hydrogen 2.737 N/A GLY 331.A N THR 614.A O no hydrogen 3.107 N/A ASN 333.A N TYR 616.A O no hydrogen 2.840 N/A ASN 333.A ND2 SER 526.A O no hydrogen 2.719 N/A ASN 333.A ND2 TYR 616.A O no hydrogen 3.240 N/A TYR 334.A N ARG 365.A O no hydrogen 2.750 N/A TYR 334.A OH GLU 373.A OE2 no hydrogen 2.745 N/A ILE 335.A N ASN 620.A OD1 no hydrogen 2.922 N/A GLN 337.A NE2 TYR 334.A OH no hydrogen 2.706 N/A ALA 339.A N SER 622.A O no hydrogen 3.109 N/A LEU 340.A N ASP 338.A OD1 no hydrogen 2.964 N/A ASN 343.A N LEU 340.A O no hydrogen 3.025 N/A ASN 343.A ND2 GLN 34.A OE1 no hydrogen 2.960 N/A VAL 344.A N LEU 341.A O no hydrogen 3.190 N/A ARG 348.A N THR 345.A OG1 no hydrogen 3.109 N/A ARG 348.A NH1 GLN 337.A O no hydrogen 3.278 N/A ARG 348.A NH1 ASP 338.A OD2 no hydrogen 2.831 N/A ARG 348.A NH2 ASP 338.A OD2 no hydrogen 3.492 N/A TYR 349.A N THR 345.A O no hydrogen 3.090 N/A TYR 349.A OH GLU 373.A OE1 no hydrogen 2.621 N/A TYR 349.A OH GLU 373.A OE2 no hydrogen 3.412 N/A GLN 350.A N THR 346.A O no hydrogen 2.885 N/A THR 351.A N GLU 347.A O no hydrogen 2.813 N/A THR 351.A OG1 GLU 347.A O no hydrogen 3.021 N/A LEU 352.A N ARG 348.A O no hydrogen 3.095 N/A PHE 353.A N TYR 349.A O no hydrogen 3.156 N/A ARG 354.A N GLN 350.A O no hydrogen 3.008 N/A ARG 354.A NE GLU 358.A OE2 no hydrogen 3.041 N/A ASP 355.A N THR 351.A O no hydrogen 2.906 N/A MET 356.A N LEU 352.A O no hydrogen 3.110 N/A LYS 357.A N PHE 353.A O no hydrogen 2.910 N/A GLU 358.A N ARG 354.A O no hydrogen 2.856 N/A ALA 359.A N ASP 355.A O no hydrogen 3.170 N/A ASN 360.A N LYS 357.A O no hydrogen 2.936 N/A ASN 360.A ND2 LYS 645.A O no hydrogen 2.907 N/A MET 361.A N MET 356.A O no hydrogen 3.118 N/A ASN 362.A N LYS 330.A O no hydrogen 2.885 N/A ASN 362.A ND2 PHE 328.A O no hydrogen 2.845 N/A MET 363.A N LYS 330.A O no hydrogen 3.356 N/A VAL 364.A N LEU 387.A O no hydrogen 2.895 N/A ARG 365.A N ALA 332.A O no hydrogen 2.977 N/A ARG 365.A NE ASP 391.A OD1 no hydrogen 3.163 N/A ARG 365.A NE ASP 391.A OD2 no hydrogen 3.337 N/A ARG 365.A NH1 ASN 333.A OD1 no hydrogen 2.964 N/A ARG 365.A NH1 ASN 433.A OD1 no hydrogen 3.562 N/A ARG 365.A NH1 GLU 527.A OE2 no hydrogen 3.270 N/A ARG 365.A NH2 ASP 391.A OD2 no hydrogen 2.801 N/A ARG 365.A NH2 ASN 433.A OD1 no hydrogen 2.671 N/A ILE 366.A N TRP 389.A O no hydrogen 2.747 N/A TRP 367.A N TYR 334.A O no hydrogen 3.410 N/A GLY 368.A N ASP 391.A OD2 no hydrogen 2.730 N/A GLY 370.A N TRP 367.A O no hydrogen 3.400 N/A THR 371.A OG1 TYR 372.A O no hydrogen 3.347 N/A TYR 372.A OH GLU 412.A OE2 no hydrogen 2.729 N/A GLU 373.A N TYR 378.A OH no hydrogen 2.836 N/A ASN 374.A N GLU 373.A OE1 no hydrogen 2.943 N/A PHE 377.A N ASN 374.A OD1 no hydrogen 2.886 N/A TYR 378.A OH GLN 390.A OE1 no hydrogen 2.381 N/A ASP 379.A N ASN 375.A O no hydrogen 2.897 N/A LEU 380.A N LEU 376.A O no hydrogen 2.931 N/A ALA 381.A N PHE 377.A O no hydrogen 3.085 N/A ASP 382.A N TYR 378.A O no hydrogen 2.845 N/A GLU 383.A N ASP 379.A O no hydrogen 3.015 N/A ASN 384.A N LEU 380.A O no hydrogen 2.896 N/A ASN 384.A ND2 LEU 380.A O no hydrogen 2.762 N/A GLY 385.A N ASP 382.A O no hydrogen 3.385 N/A ILE 386.A N ALA 381.A O no hydrogen 2.977 N/A LEU 387.A N ASN 362.A O no hydrogen 2.814 N/A VAL 388.A N SER 425.A O no hydrogen 2.633 N/A TRP 389.A N VAL 364.A O no hydrogen 2.935 N/A TRP 389.A NE1 ASP 391.A OD1 no hydrogen 3.003 N/A GLN 390.A N MET 428.A O no hydrogen 3.031 N/A GLN 390.A NE2 ASP 391.A O no hydrogen 2.713 N/A ASP 391.A N ILE 366.A O no hydrogen 3.071 N/A PHE 392.A N CYS 430.A O no hydrogen 2.855 N/A MET 393.A N TYR 372.A OH no hydrogen 3.128 N/A PHE 394.A N PHE 392.A O no hydrogen 2.881 N/A ALA 395.A N TYR 399.A OH no hydrogen 3.085 N/A CYS 396.A N ASN 433.A O no hydrogen 2.824 N/A CYS 396.A SG GLU 434.A OE1 no hydrogen 3.306 N/A THR 397.A OG1 PRO 398.A O no hydrogen 2.812 N/A THR 404.A OG1 ASP 402.A OD2 no hydrogen 3.294 N/A PHE 405.A N ASP 402.A OD2 no hydrogen 3.086 N/A LEU 406.A N ASP 402.A O no hydrogen 2.972 N/A LYS 407.A N PRO 403.A O no hydrogen 2.958 N/A ARG 408.A N THR 404.A O no hydrogen 3.122 N/A ARG 408.A NE.A ASP 104.A OD2 no hydrogen 3.287 N/A ARG 408.A NH1.A PHE 161.A O no hydrogen 2.950 N/A VAL 409.A N PHE 405.A O no hydrogen 2.986 N/A GLU 410.A N LEU 406.A O no hydrogen 2.913 N/A ALA 411.A N LYS 407.A O no hydrogen 3.121 N/A GLU 412.A N ARG 408.A O no hydrogen 3.249 N/A ALA 413.A N VAL 409.A O no hydrogen 2.896 N/A VAL 414.A N GLU 410.A O no hydrogen 2.896 N/A TYR 415.A N ALA 411.A O no hydrogen 3.044 N/A ASN 416.A N GLU 412.A O no hydrogen 2.984 N/A ASN 416.A ND2 PHE 107.A O no hydrogen 2.760 N/A ASN 416.A ND2 GLU 412.A O no hydrogen 2.895 N/A ILE 417.A N ALA 413.A O no hydrogen 2.861 N/A ARG 418.A N VAL 414.A O no hydrogen 3.034 N/A ARG 419.A N TYR 415.A O no hydrogen 2.917 N/A ARG 419.A NE ASN 416.A OD1 no hydrogen 3.074 N/A ARG 419.A NH1 GLU 373.A O no hydrogen 2.776 N/A ARG 419.A NH1 ASN 375.A OD1 no hydrogen 3.013 N/A ARG 419.A NH2 TYR 372.A O no hydrogen 3.364 N/A ARG 419.A NH2 GLU 373.A O no hydrogen 2.822 N/A ARG 419.A NH2 ASN 416.A OD1 no hydrogen 2.809 N/A LEU 420.A N ASN 416.A O no hydrogen 2.917 N/A LEU 420.A N ILE 417.A O no hydrogen 3.162 N/A ARG 421.A NH1 PHE 475.A O no hydrogen 2.763 N/A ARG 421.A NH2 ASP 198.A OD2 no hydrogen 2.834 N/A ASN 422.A ND2 TYR 199.A O no hydrogen 3.085 N/A HIS 423.A N LEU 420.A O no hydrogen 3.213 N/A HIS 423.A ND1 ASP 382.A OD2 no hydrogen 2.667 N/A SER 425.A N ASP 382.A OD1 no hydrogen 3.011 N/A SER 425.A OG ASP 382.A OD1 no hydrogen 2.859 N/A LEU 426.A N HIS 423.A O no hydrogen 3.044 N/A ALA 427.A N VAL 388.A O no hydrogen 2.963 N/A TRP 429.A N PHE 480.A O no hydrogen 2.863 N/A TRP 429.A NE1 ASP 476.A OD2 no hydrogen 2.709 N/A CYS 430.A N GLN 390.A O no hydrogen 2.882 N/A CYS 430.A SG ASN 432.A O no hydrogen 3.293 N/A CYS 430.A SG VAL 482.A O no hydrogen 4.045 N/A GLY 431.A N VAL 482.A O no hydrogen 2.727 N/A ASN 432.A ND2 TYR 460.A OH no hydrogen 3.133 N/A ASN 433.A N PHE 394.A O no hydrogen 2.957 N/A GLU 434.A N SER 485.A O no hydrogen 2.783 N/A ILE 435.A N ASN 432.A OD1 no hydrogen 3.073 N/A ALA 438.A N GLU 434.A O no hydrogen 2.842 N/A LEU 439.A N ILE 435.A O no hydrogen 2.874 N/A LYS 440.A N LEU 436.A O no hydrogen 2.947 N/A LYS 440.A NZ TYR 441.A OH no hydrogen 3.519 N/A TYR 441.A N GLU 437.A O no hydrogen 2.939 N/A TRP 442.A N ALA 438.A O no hydrogen 3.240 N/A LYS 446.A N GLY 443.A O no hydrogen 3.453 N/A LYS 447.A N PHE 444.A O no hydrogen 2.707 N/A THR 449.A OG1 GLU 451.A OE1 no hydrogen 3.408 N/A VAL 452.A N THR 449.A OG1 no hydrogen 3.219 N/A TYR 453.A N THR 449.A O no hydrogen 3.013 N/A TYR 453.A OH LEU 439.A O no hydrogen 2.749 N/A GLN 454.A N PRO 450.A O no hydrogen 2.843 N/A GLY 455.A N GLU 451.A O no hydrogen 2.872 N/A LEU 456.A N VAL 452.A O no hydrogen 2.888 N/A MET 457.A N TYR 453.A O no hydrogen 2.991 N/A HIS 458.A N GLN 454.A O no hydrogen 2.954 N/A HIS 458.A ND1 GLN 454.A O no hydrogen 2.529 N/A GLY 459.A N GLY 455.A O no hydrogen 2.915 N/A TYR 460.A N LEU 456.A O no hydrogen 2.953 N/A TYR 460.A OH HIS 483.A ND1 no hydrogen 2.649 N/A LYS 462.A N HIS 458.A O no hydrogen 3.238 N/A LEU 463.A N GLY 459.A O no hydrogen 3.331 N/A LEU 463.A N TYR 460.A O no hydrogen 3.261 N/A PHE 464.A N TYR 460.A O no hydrogen 2.786 N/A ARG 465.A N ASP 461.A O no hydrogen 2.929 N/A ARG 465.A NE ASP 461.A OD1 no hydrogen 2.790 N/A LEU 467.A N LYS 462.A O no hydrogen 2.999 N/A LEU 468.A N LEU 463.A O no hydrogen 2.892 N/A SER 470.A N GLU 466.A O no hydrogen 2.994 N/A SER 470.A OG.A GLU 466.A O no hydrogen 2.485 N/A SER 470.A OG.B GLU 466.A O no hydrogen 2.996 N/A SER 470.A OG.B LEU 467.A O no hydrogen 2.881 N/A THR 471.A N LEU 467.A O no hydrogen 2.995 N/A THR 471.A OG1 LEU 467.A O no hydrogen 2.801 N/A VAL 472.A N LEU 468.A O no hydrogen 2.995 N/A LYS 473.A N PRO 469.A O no hydrogen 2.871 N/A GLU 474.A N SER 470.A O no hydrogen 2.911 N/A PHE 475.A N THR 471.A O no hydrogen 2.923 N/A ASP 476.A N VAL 472.A O no hydrogen 2.756 N/A ARG 479.A N ASP 476.A O no hydrogen 2.992 N/A ARG 479.A NE LEU 426.A O no hydrogen 2.904 N/A ARG 479.A NH1 ARG 421.A O no hydrogen 2.909 N/A ARG 479.A NH1 ASP 476.A OD1 no hydrogen 2.783 N/A ARG 479.A NH1 ASP 476.A OD2 no hydrogen 3.431 N/A ARG 479.A NH2 ARG 421.A O no hydrogen 3.456 N/A ARG 479.A NH2 LEU 426.A O no hydrogen 3.474 N/A TYR 481.A OH PHE 464.A O no hydrogen 2.702 N/A VAL 482.A N TRP 429.A O no hydrogen 3.076 N/A HIS 483.A ND1 TYR 460.A OH no hydrogen 2.649 N/A SER 484.A OG ASN 432.A OD1 no hydrogen 2.563 N/A SER 485.A N ASN 432.A O no hydrogen 3.045 N/A SER 485.A OG ASP 501.A OD2 no hydrogen 2.808 N/A SER 485.A OG HIS 503.A NE2 no hydrogen 2.795 N/A TYR 487.A N ASP 501.A OD1 no hydrogen 3.174 N/A TYR 487.A OH GLU 316.A OE1 no hydrogen 2.716 N/A ASN 490.A N SER 496.A OG no hydrogen 3.045 N/A ASN 490.A ND2 GLU 437.A OE2 no hydrogen 2.979 N/A GLY 492.A N ASN 490.A OD1 no hydrogen 3.047 N/A ARG 493.A N ASN 490.A O no hydrogen 3.135 N/A ARG 493.A NH1 ASN 490.A OD1 no hydrogen 2.746 N/A GLU 495.A N GLU 495.A OE1 no hydrogen 2.923 N/A SER 496.A N ARG 493.A O no hydrogen 2.931 N/A SER 496.A OG ARG 493.A O no hydrogen 2.508 N/A TRP 497.A N PRO 494.A O no hydrogen 3.221 N/A TRP 497.A NE1 ASN 490.A O no hydrogen 2.930 N/A THR 499.A N SER 496.A O no hydrogen 2.991 N/A GLY 500.A N GLU 316.A O no hydrogen 2.874 N/A SER 502.A N PHE 524.A O no hydrogen 2.800 N/A HIS 503.A ND1 GLU 434.A OE2 no hydrogen 2.803 N/A HIS 503.A NE2 SER 485.A OG no hydrogen 2.795 N/A ASN 504.A N GLU 527.A O no hydrogen 3.021 N/A TRP 505.A NE1 GLU 527.A OE1 no hydrogen 2.998 N/A GLY 506.A N ASN 504.A OD1 no hydrogen 3.006 N/A TRP 508.A N TYR 571.A OH no hydrogen 2.940 N/A TRP 508.A NE1 SER 561.A OG no hydrogen 3.322 N/A TYR 509.A OH SER 561.A OG no hydrogen 2.804 N/A GLY 510.A N TRP 505.A O no hydrogen 2.991 N/A LYS 511.A N TRP 508.A O no hydrogen 3.051 N/A LYS 512.A N GLY 506.A O no hydrogen 2.933 N/A LYS 512.A NZ ASP 520.A OD2 no hydrogen 2.762 N/A SER 516.A N PRO 513.A O no hydrogen 2.856 N/A SER 516.A OG PRO 513.A O no hydrogen 2.901 N/A LEU 517.A N PHE 514.A O no hydrogen 2.917 N/A ASP 518.A N GLU 515.A O no hydrogen 3.035 N/A THR 519.A N SER 516.A O no hydrogen 3.203 N/A THR 519.A OG1 SER 516.A O no hydrogen 3.216 N/A THR 519.A OG1 ASP 520.A OD1 no hydrogen 3.021 N/A ASP 520.A N SER 516.A O no hydrogen 2.895 N/A ARG 523.A NE TYR 610.A O no hydrogen 3.075 N/A ARG 523.A NH1 ASP 312.A OD1 no hydrogen 2.969 N/A ARG 523.A NH1 GLY 498.A O no hydrogen 3.186 N/A ARG 523.A NH2 ASP 312.A OD1 no hydrogen 3.458 N/A ARG 523.A NH2 ASP 312.A OD2 no hydrogen 2.720 N/A MET 525.A N GLY 613.A O no hydrogen 2.899 N/A SER 526.A N SER 502.A O no hydrogen 2.923 N/A SER 526.A OG SER 485.A OG no hydrogen 3.246 N/A SER 526.A OG ASP 501.A OD2 no hydrogen 2.706 N/A SER 526.A OG SER 502.A O no hydrogen 3.325 N/A GLU 527.A N SER 502.A O no hydrogen 3.277 N/A GLN 531.A NE2 GLN 559.A OE1.A no hydrogen 2.968 N/A GLN 531.A NE2 GLN 559.A OE1.B no hydrogen 3.681 N/A SER 532.A N SER 627.A O no hydrogen 2.855 N/A SER 532.A OG GLN 593.A OE1 no hydrogen 2.744 N/A LYS 537.A NZ THR 789.A O no hydrogen 2.904 N/A LYS 537.A NZ LEU 791.A O no hydrogen 2.800 N/A THR 538.A N GLU 535.A O no hydrogen 3.079 N/A THR 538.A OG1 ASP 632.A OD2 no hydrogen 2.561 N/A ILE 539.A N GLU 535.A O no hydrogen 3.124 N/A ALA 540.A N MET 536.A O no hydrogen 2.758 N/A ALA 541.A N THR 538.A O no hydrogen 2.766 N/A PHE 542.A N.A ILE 539.A O no hydrogen 2.793 N/A PHE 542.A N.B ILE 539.A O no hydrogen 2.978 N/A ALA 543.A N.A ILE 539.A O no hydrogen 2.747 N/A ALA 544.A N.A ASP 547.A OD1.A no hydrogen 2.688 N/A ALA 544.A N.B TYR 47.A OH.B no hydrogen 2.498 N/A GLU 546.A N.B GLU 546.A OE2.B no hydrogen 2.958 N/A ASP 547.A N.A ALA 544.A O.A no hydrogen 2.817 N/A TYR 548.A N.A PRO 545.A O.A no hydrogen 3.181 N/A TYR 548.A N.B PRO 545.A O.B no hydrogen 2.942 N/A TYR 548.A OH.B ALA 543.A O.A no hydrogen 3.014 N/A TYR 548.A OH.B ALA 543.A O.B no hydrogen 2.725 N/A GLN 549.A N.A ASP 547.A O.A no hydrogen 2.798 N/A GLN 549.A N.B ASP 547.A O.B no hydrogen 3.175 N/A GLU 551.A N.A GLN 549.A OE1.A no hydrogen 2.771 N/A SER 552.A N.A GLN 549.A O.A no hydrogen 3.447 N/A SER 552.A OG.A ASP 547.A O.A no hydrogen 2.759 N/A SER 552.A OG.A GLN 549.A O.A no hydrogen 3.266 N/A SER 552.A OG.A GLN 549.A O.B no hydrogen 2.784 N/A SER 552.A OG.B ASP 547.A O.B no hydrogen 2.668 N/A SER 552.A OG.B ASP 547.A OD1.B no hydrogen 2.841 N/A SER 552.A OG.B GLN 549.A O.B no hydrogen 3.562 N/A MET 555.A N.B SER 552.A OG.B no hydrogen 3.064 N/A ASN 556.A N.A SER 552.A O.A no hydrogen 3.277 N/A ASN 556.A N.A GLU 553.A O.A no hydrogen 3.248 N/A ASN 556.A N.B GLU 553.A O.A no hydrogen 2.662 N/A ASN 556.A N.B GLU 553.A O.B no hydrogen 3.175 N/A ASN 556.A ND2.B SER 552.A O.B no hydrogen 3.466 N/A ALA 557.A N.A GLN 559.A O.B no hydrogen 2.910 N/A HIS 558.A N.A VAL 554.A O.A no hydrogen 2.918 N/A HIS 558.A N.A MET 555.A O.A no hydrogen 2.792 N/A HIS 558.A N.A MET 555.A O.B no hydrogen 2.830 N/A HIS 558.A N.B VAL 554.A O.A no hydrogen 2.619 N/A HIS 558.A N.B MET 555.A O.B no hydrogen 2.728 N/A HIS 558.A ND1.A PRO 624.A O no hydrogen 3.190 N/A HIS 558.A ND1.B VAL 554.A O.B no hydrogen 2.881 N/A HIS 558.A NE2.A GLY 48.A O no hydrogen 3.014 N/A HIS 558.A NE2.B PHE 46.A O no hydrogen 2.471 N/A GLN 559.A NE2.A GLN 531.A OE1 no hydrogen 2.566 N/A GLN 559.A NE2.A ASN 565.A OD1 no hydrogen 3.095 N/A GLN 559.A NE2.B GLN 531.A OE1 no hydrogen 2.918 N/A GLN 559.A NE2.B ASN 565.A OD1 no hydrogen 2.326 N/A LYS 560.A NZ GLU 51.A OE1 no hydrogen 2.826 N/A SER 561.A N GLN 559.A OE1.A no hydrogen 2.641 N/A SER 561.A OG TYR 509.A OH no hydrogen 2.804 N/A SER 561.A OG ILE 563.A O no hydrogen 3.248 N/A ASN 565.A ND2 ILE 550.A O.A no hydrogen 2.455 N/A ILE 568.A N ASN 565.A O no hydrogen 2.991 N/A ARG 569.A N ASN 565.A O no hydrogen 3.326 N/A THR 570.A N SER 566.A O no hydrogen 2.940 N/A THR 570.A OG1 SER 566.A O no hydrogen 3.229 N/A TYR 571.A N LEU 567.A O no hydrogen 3.002 N/A TYR 571.A OH LYS 512.A O no hydrogen 2.500 N/A MET 572.A N ILE 568.A O no hydrogen 2.841 N/A GLU 573.A N ARG 569.A O no hydrogen 3.002 N/A ARG 574.A N TYR 571.A O no hydrogen 3.064 N/A ARG 574.A NH1 LYS 511.A O no hydrogen 3.100 N/A ARG 574.A NH2 LYS 511.A O no hydrogen 2.763 N/A ASP 575.A N MET 572.A O no hydrogen 2.973 N/A TYR 576.A N MET 572.A O no hydrogen 2.723 N/A GLU 583.A N.A GLU 583.A OE1.A no hydrogen 2.713 N/A ASP 584.A N SER 581.A OG no hydrogen 3.237 N/A PHE 585.A N SER 581.A O no hydrogen 2.842 N/A VAL 586.A N PHE 582.A O no hydrogen 2.746 N/A TYR 587.A N GLU 583.A O.A no hydrogen 3.047 N/A TYR 587.A N GLU 583.A O.B no hydrogen 3.128 N/A TYR 587.A N GLU 583.A O.C no hydrogen 3.002 N/A TYR 587.A OH ASP 784.A O no hydrogen 2.471 N/A VAL 588.A N ASP 584.A O no hydrogen 3.040 N/A GLY 589.A N PHE 585.A O no hydrogen 2.977 N/A LEU 590.A N VAL 586.A O no hydrogen 3.110 N/A VAL 591.A N TYR 587.A O no hydrogen 3.136 N/A LEU 592.A N VAL 588.A O no hydrogen 2.645 N/A GLN 593.A N GLY 589.A O no hydrogen 3.023 N/A GLN 593.A NE2 PHE 530.A O no hydrogen 2.654 N/A GLN 593.A NE2 SER 629.A O no hydrogen 3.076 N/A GLY 594.A N LEU 590.A O no hydrogen 2.958 N/A GLN 595.A N VAL 591.A O no hydrogen 2.904 N/A GLN 595.A NE2 ASP 784.A OD1 no hydrogen 3.009 N/A GLY 596.A N LEU 592.A O no hydrogen 2.971 N/A MET 597.A N GLN 593.A O no hydrogen 3.067 N/A ARG 598.A N GLY 594.A O no hydrogen 3.095 N/A ARG 598.A NE GLN 595.A OE1 no hydrogen 2.934 N/A ARG 598.A NH1 GLU 602.A OE1 no hydrogen 3.494 N/A ARG 598.A NH1 GLU 602.A OE2 no hydrogen 2.723 N/A ARG 598.A NH2 GLN 595.A OE1 no hydrogen 2.914 N/A HIS 599.A N GLN 595.A O no hydrogen 3.088 N/A HIS 599.A NE2 ASP 518.A OD2 no hydrogen 2.648 N/A GLY 600.A N GLY 596.A O no hydrogen 3.402 N/A LEU 601.A N MET 597.A O no hydrogen 3.076 N/A GLU 602.A N ARG 598.A O no hydrogen 2.924 N/A ALA 603.A N HIS 599.A O no hydrogen 3.100 N/A HIS 604.A N GLY 600.A O no hydrogen 2.924 N/A HIS 604.A ND1 THR 614.A OG1 no hydrogen 3.002 N/A ARG 605.A N LEU 601.A O no hydrogen 3.043 N/A ARG 605.A NH1 ALA 647.A O no hydrogen 2.773 N/A ARG 605.A NH1 ALA 649.A O no hydrogen 2.767 N/A ARG 605.A NH2 ALA 649.A O no hydrogen 3.257 N/A ARG 605.A NH2 PRO 650.A O no hydrogen 3.447 N/A ARG 606.A N GLU 602.A O no hydrogen 2.772 N/A ARG 606.A NH1 ASN 654.A OD1 no hydrogen 3.115 N/A ARG 606.A NH2 ASP 518.A OD1 no hydrogen 2.955 N/A ASN 607.A N ALA 603.A O no hydrogen 3.134 N/A ASN 607.A N HIS 604.A O no hydrogen 3.260 N/A ASN 607.A ND2 ALA 603.A O no hydrogen 2.783 N/A ARG 608.A N ARG 605.A O no hydrogen 3.243 N/A ARG 608.A NH1 ASN 705.A OD1 no hydrogen 3.459 N/A ARG 608.A NH2 PRO 326.A O no hydrogen 3.018 N/A CYS 611.A N ASN 607.A O no hydrogen 2.957 N/A CYS 611.A SG HIS 604.A O no hydrogen 3.777 N/A CYS 611.A SG GLY 613.A O no hydrogen 3.497 N/A MET 612.A N ARG 523.A O no hydrogen 3.003 N/A THR 614.A N ALA 329.A O no hydrogen 2.999 N/A THR 614.A OG1 HIS 604.A ND1 no hydrogen 3.002 N/A LEU 615.A N MET 525.A O no hydrogen 2.735 N/A TYR 616.A N GLY 331.A O no hydrogen 3.275 N/A TYR 616.A OH SER 630.A OG no hydrogen 2.880 N/A ALA 617.A N PHE 528.A O no hydrogen 2.812 N/A GLN 618.A N TRP 628.A O no hydrogen 3.202 N/A GLN 618.A NE2 ASN 620.A O no hydrogen 2.891 N/A LEU 619.A N ASN 333.A O no hydrogen 2.762 N/A ASN 620.A ND2 ILE 335.A O no hydrogen 2.766 N/A TRP 623.A NE1 TRP 173.A O no hydrogen 2.727 N/A VAL 626.A N HIS 558.A O.A no hydrogen 3.110 N/A VAL 626.A N HIS 558.A O.B no hydrogen 3.004 N/A SER 627.A N SER 532.A O no hydrogen 3.296 N/A SER 627.A OG ASP 621.A OD1 no hydrogen 2.506 N/A SER 627.A OG ASP 621.A OD2 no hydrogen 3.242 N/A SER 629.A N SER 627.A OG no hydrogen 3.174 N/A SER 629.A OG ASP 621.A OD2 no hydrogen 2.794 N/A SER 629.A OG SER 627.A OG no hydrogen 3.098 N/A SER 630.A N GLN 618.A O no hydrogen 3.033 N/A SER 630.A N LEU 619.A O no hydrogen 3.244 N/A SER 630.A OG TYR 616.A OH no hydrogen 2.880 N/A SER 630.A OG LEU 619.A O no hydrogen 3.221 N/A SER 630.A OG HIS 641.A ND1 no hydrogen 2.826 N/A ILE 631.A N LEU 619.A O no hydrogen 2.961 N/A ASP 632.A N ASN 636.A O no hydrogen 3.079 N/A TYR 633.A OH ASP 338.A OD2 no hydrogen 2.563 N/A GLY 635.A N ASP 632.A O no hydrogen 2.999 N/A ASN 636.A N ASP 632.A OD1 no hydrogen 3.020 N/A ASN 636.A ND2 THR 538.A OG1 no hydrogen 3.358 N/A ASN 636.A ND2 ASP 632.A OD2 no hydrogen 3.119 N/A ASN 636.A ND2 GLN 792.A OE1 no hydrogen 2.778 N/A TRP 637.A NE1 ASP 355.A OD1 no hydrogen 2.941 N/A LYS 638.A N SER 630.A O no hydrogen 2.973 N/A LYS 638.A NZ SER 532.A O no hydrogen 3.392 N/A LYS 638.A NZ SER 532.A OG no hydrogen 3.065 N/A LYS 638.A NZ SER 629.A O no hydrogen 2.889 N/A LYS 638.A NZ SER 629.A OG no hydrogen 2.785 N/A HIS 641.A N LYS 638.A O no hydrogen 3.014 N/A HIS 641.A ND1 SER 630.A OG no hydrogen 2.826 N/A HIS 641.A NE2 ASP 355.A O no hydrogen 2.952 N/A GLN 643.A N ALA 639.A O no hydrogen 2.853 N/A ALA 644.A N LEU 640.A O no hydrogen 2.764 N/A LYS 645.A N HIS 641.A O no hydrogen 2.988 N/A LYS 645.A NZ GLU 358.A O no hydrogen 2.696 N/A ARG 646.A N TYR 642.A O no hydrogen 3.087 N/A ARG 646.A NH1 PHE 800.A O no hydrogen 2.803 N/A ARG 646.A NH2 ASP 798.A OD1 no hydrogen 2.674 N/A ARG 646.A NH2 ASN 799.A O no hydrogen 2.769 N/A ARG 646.A NH2 PHE 800.A O no hydrogen 3.371 N/A ALA 647.A N GLN 643.A O no hydrogen 2.763 N/A PHE 648.A N ALA 644.A O no hydrogen 2.880 N/A PHE 648.A N LYS 645.A O no hydrogen 3.295 N/A ALA 649.A N ARG 646.A O no hydrogen 3.322 N/A LEU 652.A N ILE 667.A O no hydrogen 2.833 N/A ASN 654.A N TYR 665.A O no hydrogen 2.820 N/A ILE 656.A N SER 663.A O no hydrogen 2.801 N/A GLN 657.A NE2 PHE 748.A O no hydrogen 2.937 N/A GLN 658.A N SER 661.A O no hydrogen 3.033 N/A SER 661.A N GLN 658.A O no hydrogen 3.065 N/A SER 661.A OG ALA 713.A O no hydrogen 3.172 N/A LEU 662.A N ALA 713.A O no hydrogen 2.836 N/A SER 663.A N ILE 656.A O no hydrogen 2.942 N/A VAL 664.A N TYR 711.A O no hydrogen 2.790 N/A TYR 665.A N ASN 654.A O no hydrogen 2.790 N/A LEU 666.A N LYS 708.A O no hydrogen 2.824 N/A ILE 667.A N LEU 652.A O no hydrogen 2.981 N/A SER 668.A N THR 706.A O no hydrogen 2.874 N/A ASP 669.A N PRO 650.A O no hydrogen 2.807 N/A ARG 670.A N SER 668.A OG no hydrogen 3.143 N/A ARG 670.A NE ASP 672.A OD1 no hydrogen 2.991 N/A ARG 670.A NH2 ASP 672.A OD1 no hydrogen 3.107 N/A ARG 670.A NH2 ASP 672.A OD2 no hydrogen 2.667 N/A MET 674.A N VAL 702.A O no hydrogen 2.821 N/A MET 677.A N LEU 700.A O no hydrogen 2.705 N/A THR 678.A N LYS 734.A O no hydrogen 2.812 N/A THR 678.A OG1 HIS 698.A ND1 no hydrogen 3.160 N/A LEU 679.A N VAL 697.A O no hydrogen 2.845 N/A GLU 680.A N ILE 732.A O no hydrogen 2.921 N/A MET 681.A N ILE 695.A O no hydrogen 2.920 N/A LYS 682.A N LYS 730.A O no hydrogen 3.033 N/A VAL 684.A N PHE 728.A O no hydrogen 2.974 N/A ASP 685.A N LYS 689.A O no hydrogen 2.717 N/A PHE 686.A N ARG 726.A O no hydrogen 3.201 N/A ASP 687.A N ASP 685.A OD1 no hydrogen 2.860 N/A GLY 688.A N ASP 685.A O no hydrogen 2.976 N/A LYS 689.A N ASP 685.A OD1 no hydrogen 2.892 N/A LEU 691.A N VAL 683.A O no hydrogen 2.782 N/A ILE 695.A N MET 681.A O no hydrogen 2.766 N/A VAL 697.A N LEU 679.A O no hydrogen 2.761 N/A HIS 698.A ND1 THR 678.A OG1 no hydrogen 3.160 N/A LEU 700.A N MET 677.A O no hydrogen 2.706 N/A VAL 702.A N MET 674.A O no hydrogen 2.843 N/A ASN 705.A N ARG 670.A O no hydrogen 3.216 N/A THR 706.A OG1 PRO 703.A O no hydrogen 2.627 N/A SER 707.A OG ARG 606.A O no hydrogen 2.654 N/A LYS 708.A N LEU 666.A O no hydrogen 2.983 N/A CYS 709.A SG VAL 664.A O no hydrogen 3.732 N/A CYS 709.A SG TYR 711.A O no hydrogen 3.648 N/A VAL 710.A N VAL 664.A O no hydrogen 2.949 N/A ALA 713.A N LEU 662.A O no hydrogen 2.888 N/A LEU 715.A N ASP 660.A O no hydrogen 2.960 N/A TRP 718.A N LEU 715.A O no hydrogen 2.861 N/A LEU 719.A N LEU 715.A O no hydrogen 2.991 N/A ASP 723.A N THR 720.A OG1 no hydrogen 3.144 N/A CYS 724.A N THR 720.A O no hydrogen 3.107 N/A CYS 724.A SG THR 720.A O no hydrogen 3.391 N/A ARG 725.A N GLU 722.A O no hydrogen 3.311 N/A ARG 726.A N ASP 723.A O no hydrogen 2.948 N/A ARG 726.A NE GLU 722.A O no hydrogen 3.222 N/A SER 727.A OG ASP 723.A O no hydrogen 2.833 N/A PHE 728.A N VAL 684.A O no hydrogen 2.943 N/A LEU 729.A N HIS 746.A O no hydrogen 2.759 N/A LYS 730.A N LYS 682.A O no hydrogen 2.870 N/A LYS 730.A NZ GLU 807.A OE1 no hydrogen 2.591 N/A LYS 730.A NZ GLU 807.A OE2 no hydrogen 2.791 N/A LEU 731.A N SER 744.A O no hydrogen 2.976 N/A ILE 732.A N GLU 680.A O no hydrogen 2.945 N/A LEU 733.A N ALA 742.A O no hydrogen 2.750 N/A LYS 734.A N THR 678.A O no hydrogen 2.978 N/A ASP 735.A N HIS 739.A O no hydrogen 2.987 N/A SER 737.A OG ASP 735.A OD1 no hydrogen 3.046 N/A SER 737.A OG HIS 739.A ND1 no hydrogen 2.717 N/A GLY 738.A N ASP 735.A O no hydrogen 2.934 N/A HIS 739.A N ASP 735.A OD1 no hydrogen 2.757 N/A HIS 739.A ND1 SER 737.A OG no hydrogen 2.717 N/A VAL 741.A N LEU 733.A O no hydrogen 2.776 N/A ALA 742.A N LEU 733.A O no hydrogen 3.372 N/A SER 744.A N LEU 731.A O no hydrogen 2.844 N/A SER 744.A OG.A ILE 653.A O no hydrogen 2.821 N/A SER 744.A OG.B VAL 745.A O no hydrogen 3.431 N/A HIS 746.A N LEU 729.A O no hydrogen 2.679 N/A HIS 746.A NE2 GLN 657.A OE1 no hydrogen 2.745 N/A ARG 749.A NH1 PHE 748.A O no hydrogen 2.981 N/A LYS 750.A NZ ARG 574.A O no hydrogen 3.139 N/A LYS 752.A N ASP 575.A O no hydrogen 2.901 N/A LYS 752.A NZ GLU 573.A O no hydrogen 2.832 N/A ASP 753.A N LYS 750.A O no hydrogen 2.858 N/A LEU 754.A N THR 751.A O no hydrogen 3.118 N/A GLN 755.A N ARG 725.A O no hydrogen 2.867 N/A THR 759.A OG1 SER 778.A OG no hydrogen 2.786 N/A SER 762.A N PHE 777.A O no hydrogen 3.031 N/A GLN 764.A N THR 775.A O no hydrogen 2.943 N/A LYS 766.A N GLU 773.A O no hydrogen 2.763 N/A GLN 767.A NE2 LYS 819.A O no hydrogen 2.897 N/A GLN 767.A NE2 GLU 822.A O no hydrogen 2.789 N/A THR 768.A N LYS 771.A O no hydrogen 2.885 N/A GLY 770.A N ILE 818.A O no hydrogen 2.725 N/A LYS 771.A N THR 768.A O no hydrogen 3.300 N/A LYS 771.A NZ GLU 773.A OE2 no hydrogen 3.486 N/A CYS 772.A N ILE 813.A O no hydrogen 2.753 N/A CYS 772.A SG GLN 767.A OE1 no hydrogen 3.656 N/A GLU 773.A N LYS 766.A O no hydrogen 3.248 N/A LEU 774.A N VAL 811.A O no hydrogen 2.952 N/A THR 775.A N GLN 764.A O no hydrogen 2.956 N/A LEU 776.A N LYS 809.A O no hydrogen 2.823 N/A PHE 777.A N SER 762.A O no hydrogen 2.853 N/A SER 778.A OG SER 760.A O no hydrogen 3.420 N/A SER 778.A OG MET 780.A O no hydrogen 2.986 N/A LEU 781.A N PHE 686.A O no hydrogen 2.914 N/A ALA 782.A N LEU 803.A O no hydrogen 3.112 N/A LYS 783.A NZ ASP 784.A OD2 no hydrogen 2.963 N/A LYS 783.A NZ ASP 802.A OD1 no hydrogen 2.926 N/A ASP 784.A N ASP 802.A OD1 no hydrogen 3.004 N/A ILE 785.A N PHE 801.A O no hydrogen 2.853 N/A PHE 786.A N LYS 829.A O no hydrogen 2.924 N/A ILE 787.A N ASN 799.A OD1 no hydrogen 2.918 N/A GLU 788.A N ASN 827.A O no hydrogen 2.848 N/A THR 789.A OG1 TYR 796.A OH no hydrogen 2.923 N/A GLY 793.A N ASN 636.A OD1 no hydrogen 2.914 N/A ALA 794.A N LEU 791.A O no hydrogen 3.167 N/A ARG 795.A N THR 814.A O no hydrogen 2.860 N/A ARG 795.A NH1 ASP 355.A OD1 no hydrogen 2.777 N/A ARG 795.A NH2 ASP 355.A OD1 no hydrogen 2.711 N/A ARG 795.A NH2 GLU 358.A OE1 no hydrogen 3.044 N/A TYR 796.A OH ILE 787.A O no hydrogen 2.747 N/A SER 797.A N ILE 812.A O no hydrogen 2.958 N/A ASN 799.A N ASP 798.A OD1 no hydrogen 3.006 N/A ASN 799.A ND2 ILE 787.A O no hydrogen 3.055 N/A PHE 800.A N ASN 799.A OD1 no hydrogen 2.952 N/A LEU 803.A N ALA 782.A O no hydrogen 3.032 N/A GLY 806.A N SER 778.A O no hydrogen 2.765 N/A GLU 807.A N LEU 804.A O no hydrogen 3.189 N/A LYS 809.A N LEU 776.A O no hydrogen 3.191 N/A LYS 809.A NZ ASP 798.A OD2 no hydrogen 3.246 N/A VAL 811.A N LEU 774.A O no hydrogen 2.951 N/A ILE 812.A N SER 797.A OG no hydrogen 2.784 N/A ILE 813.A N CYS 772.A O no hydrogen 2.704 N/A THR 814.A N ARG 795.A O no hydrogen 2.760 N/A SER 815.A N GLY 770.A O no hydrogen 3.045 N/A ILE 818.A N SER 815.A O no hydrogen 3.086 N/A LYS 820.A N ASP 769.A OD1 no hydrogen 2.838 N/A LEU 824.A N GLN 767.A OE1 no hydrogen 2.501 N/A ASN 827.A N GLU 788.A O no hydrogen 2.779 N/A ASN 827.A ND2 GLU 788.A OE1 no hydrogen 3.001 N/A LYS 829.A N PHE 786.A O no hydrogen 2.900 N/A LYS 829.A NZ ASP 584.A OD1 no hydrogen 2.644 N/A HIS 830.A N GLU 833.A OE1 no hydrogen 3.165 N/A ILE 831.A N LYS 783.A O no hydrogen 3.159 N/A ARG 832.A NE LEU 756.A O no hydrogen 3.265 N/A ARG 832.A NH2 ARG 832.A O no hydrogen 2.785 N/A GLU 833.A N HIS 830.A O no hydrogen 3.130 N/A THR 834.A N ILE 831.A O no hydrogen 2.876 N/A THR 834.A OG1 ILE 831.A O no hydrogen 2.585 N/A