Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jps_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLU 75.A O no hydrogen 3.129 N/A PRO 1.A N GLU 126.A OE2 no hydrogen 2.695 N/A ARG 3.A NH1 GLN 74.A OE1 no hydrogen 2.968 N/A SER 6.A OG GLU 656.A OE1 no hydrogen 2.662 N/A GLY 7.A N SER 5.A OG no hydrogen 3.086 N/A GLU 8.A N HIS 13.A O no hydrogen 2.991 N/A LEU 9.A N ILE 12.A O no hydrogen 3.156 N/A TRP 10.A N PHE 94.A O no hydrogen 3.067 N/A ILE 12.A N LEU 9.A O no hydrogen 3.196 N/A HIS 13.A ND1 GLU 668.A OE1 no hydrogen 2.898 N/A MET 15.A N GLU 8.A OE1 no hydrogen 2.806 N/A ILE 19.A N CYS 35.A O no hydrogen 2.857 N/A VAL 21.A N LEU 33.A O no hydrogen 2.777 N/A GLU 22.A N PRO 96.A O no hydrogen 2.911 N/A CYS 23.A N VAL 31.A O no hydrogen 2.789 N/A CYS 23.A SG VAL 21.A O no hydrogen 3.746 N/A LEU 24.A N LEU 98.A O no hydrogen 2.818 N/A LEU 25.A N MET 29.A O no hydrogen 2.838 N/A ASN 27.A ND2 LEU 57.A O no hydrogen 2.985 N/A GLY 28.A N LEU 25.A O no hydrogen 3.129 N/A MET 29.A N ASN 27.A OD1 no hydrogen 3.153 N/A VAL 31.A N CYS 23.A O no hydrogen 2.937 N/A THR 32.A OG1 GLU 22.A OE1 no hydrogen 2.686 N/A LEU 33.A N VAL 21.A O no hydrogen 2.883 N/A CYS 35.A N ILE 19.A O no hydrogen 2.774 N/A CYS 35.A SG LEU 33.A O no hydrogen 3.637 N/A ARG 37.A N PRO 17.A O no hydrogen 2.822 N/A ARG 37.A NE GLU 8.A OE1 no hydrogen 3.022 N/A ARG 37.A NH1 GLU 38.A OE2 no hydrogen 2.800 N/A ARG 37.A NH1 ASP 689.A OD1 no hydrogen 2.807 N/A ARG 37.A NH2 GLU 8.A OE1 no hydrogen 3.526 N/A ARG 37.A NH2 GLU 8.A OE2 no hydrogen 2.693 N/A ARG 37.A NH2 ASP 689.A OD2 no hydrogen 3.065 N/A ALA 39.A N LEU 36.A O no hydrogen 3.076 N/A LEU 41.A N ARG 86.A O no hydrogen 3.059 N/A ILE 42.A N GLU 84.A O no hydrogen 2.963 N/A ILE 44.A N THR 40.A O no hydrogen 3.083 N/A LYS 45.A N LEU 41.A O no hydrogen 2.810 N/A LYS 45.A NZ GLU 64.A O no hydrogen 3.380 N/A LYS 45.A NZ TYR 67.A O no hydrogen 2.730 N/A LYS 45.A NZ GLU 84.A OE1 no hydrogen 2.801 N/A LYS 45.A NZ GLU 84.A OE2 no hydrogen 3.056 N/A HIS 46.A N ILE 42.A O no hydrogen 3.050 N/A HIS 46.A ND1 GLU 64.A OE1 no hydrogen 3.049 N/A HIS 46.A ND1 GLU 64.A OE2 no hydrogen 2.905 N/A GLU 47.A N THR 43.A O no hydrogen 2.872 N/A LEU 48.A N ILE 44.A O no hydrogen 2.831 N/A PHE 49.A N LYS 45.A O no hydrogen 3.036 N/A LYS 50.A N HIS 46.A O no hydrogen 3.286 N/A LYS 50.A NZ GLU 47.A OE2 no hydrogen 3.245 N/A GLU 51.A N GLU 47.A O no hydrogen 3.183 N/A ALA 52.A N LEU 48.A O no hydrogen 2.775 N/A ARG 53.A N LYS 50.A O no hydrogen 3.419 N/A ARG 53.A NE LYS 50.A O no hydrogen 2.921 N/A ARG 53.A NH2 LYS 50.A O no hydrogen 3.505 N/A LYS 54.A N GLU 51.A O no hydrogen 3.089 N/A LYS 54.A NZ GLU 51.A OE1 no hydrogen 3.305 N/A TYR 55.A N ALA 52.A O no hydrogen 3.259 N/A HIS 58.A ND1 TYR 55.A O no hydrogen 3.032 N/A GLN 59.A N GLN 59.A OE1 no hydrogen 2.902 N/A LEU 60.A N LEU 57.A O no hydrogen 3.023 N/A LEU 61.A N HIS 58.A O no hydrogen 2.963 N/A GLN 62.A N TYR 67.A OH no hydrogen 2.871 N/A GLN 62.A NE2 GLU 102.A OE1 no hydrogen 2.807 N/A SER 66.A N ASP 63.A O no hydrogen 2.905 N/A SER 66.A OG ASP 63.A O no hydrogen 3.309 N/A TYR 67.A N GLU 64.A O no hydrogen 3.259 N/A ILE 68.A N ILE 101.A O no hydrogen 2.923 N/A VAL 70.A N LYS 99.A O no hydrogen 2.855 N/A SER 71.A N GLU 79.A O no hydrogen 3.143 N/A SER 71.A OG PHE 97.A O no hydrogen 2.671 N/A THR 73.A N GLU 77.A O no hydrogen 2.811 N/A THR 73.A OG1 GLU 77.A O no hydrogen 3.253 N/A GLN 74.A N ARG 92.A O no hydrogen 2.789 N/A GLN 74.A NE2 GLY 7.A O no hydrogen 2.952 N/A GLN 74.A NE2 LEU 93.A O no hydrogen 2.792 N/A ALA 76.A N THR 73.A O no hydrogen 2.882 N/A GLU 79.A N SER 71.A O no hydrogen 2.808 N/A PHE 81.A N PHE 69.A O no hydrogen 2.833 N/A PHE 82.A N GLU 80.A O no hydrogen 3.271 N/A THR 85.A N ASP 83.A OD1 no hydrogen 3.133 N/A THR 85.A OG1 ASP 83.A OD1 no hydrogen 2.666 N/A ARG 86.A N ASP 83.A O no hydrogen 3.495 N/A ARG 86.A NH1 GLU 79.A OE2 no hydrogen 2.849 N/A ARG 86.A NH2 ASP 90.A O no hydrogen 3.129 N/A ARG 87.A NH1 GLU 38.A O no hydrogen 3.129 N/A ARG 87.A NH2 ASP 692.A OD2 no hydrogen 2.907 N/A LEU 88.A N ALA 39.A O no hydrogen 2.859 N/A CYS 89.A SG ASP 90.A OD1 no hydrogen 3.780 N/A ASP 90.A N ARG 87.A O no hydrogen 2.955 N/A LEU 91.A N LEU 88.A O no hydrogen 3.430 N/A PHE 94.A N VAL 72.A O no hydrogen 3.039 N/A PHE 97.A N GLN 95.A O no hydrogen 2.814 N/A LEU 98.A N GLU 22.A O no hydrogen 2.835 N/A LYS 99.A N VAL 70.A O no hydrogen 2.769 N/A VAL 100.A N LEU 24.A O no hydrogen 2.869 N/A ILE 101.A N ILE 68.A O no hydrogen 3.050 N/A GLU 109.A N ASN 106.A OD1 no hydrogen 3.299 N/A LYS 110.A N ASN 106.A O no hydrogen 2.990 N/A LYS 110.A NZ GLU 80.A OE1 no hydrogen 2.847 N/A LYS 110.A NZ GLU 80.A OE2 no hydrogen 2.922 N/A LYS 110.A NZ VAL 104.A O no hydrogen 2.770 N/A ILE 111.A N ARG 107.A O no hydrogen 2.996 N/A LEU 112.A N GLU 108.A O no hydrogen 3.109 N/A ASN 113.A N GLU 109.A O no hydrogen 2.869 N/A ARG 114.A N LYS 110.A O no hydrogen 3.007 N/A GLU 115.A N ILE 111.A O no hydrogen 3.123 N/A ILE 116.A N LEU 112.A O no hydrogen 2.905 N/A GLY 117.A N ASN 113.A O no hydrogen 2.860 N/A PHE 118.A N ARG 114.A O no hydrogen 2.899 N/A ALA 119.A N GLU 115.A O no hydrogen 3.278 N/A ILE 120.A N ILE 116.A O no hydrogen 3.103 N/A GLY 121.A N GLY 117.A O no hydrogen 2.981 N/A MET 122.A N GLY 117.A O no hydrogen 3.195 N/A CYS 125.A SG GLU 77.A OE2 no hydrogen 3.825 N/A GLU 126.A N PRO 123.A O no hydrogen 3.166 N/A PHE 127.A N VAL 124.A O no hydrogen 2.975 N/A GLU 134.A N ASP 132.A OD1 no hydrogen 3.066 N/A VAL 135.A N ASP 132.A O no hydrogen 3.185 N/A GLN 136.A N ASP 132.A O no hydrogen 3.401 N/A GLN 136.A NE2 PHE 127.A O no hydrogen 2.774 N/A GLN 136.A NE2 VAL 130.A O no hydrogen 3.016 N/A ASP 137.A N PRO 133.A O no hydrogen 2.906 N/A PHE 138.A N GLU 134.A O no hydrogen 2.892 N/A ARG 139.A N VAL 135.A O no hydrogen 3.065 N/A ARG 139.A NE GLU 635.A OE1 no hydrogen 2.871 N/A ARG 139.A NH1 ASP 128.A OD1 no hydrogen 2.851 N/A ARG 139.A NH2 GLU 635.A OE1 no hydrogen 3.424 N/A ARG 139.A NH2 GLU 635.A OE2 no hydrogen 2.796 N/A ARG 140.A N GLN 136.A O no hydrogen 3.215 N/A ASN 141.A N ASP 137.A O no hydrogen 2.836 N/A ILE 142.A N PHE 138.A O no hydrogen 2.967 N/A LEU 143.A N ARG 140.A O no hydrogen 3.396 N/A ASN 144.A N ASN 141.A O no hydrogen 3.462 N/A VAL 145.A N ILE 142.A O no hydrogen 2.887 N/A CYS 146.A N ILE 142.A O no hydrogen 3.461 N/A CYS 146.A SG ILE 142.A O no hydrogen 3.954 N/A CYS 146.A SG SER 636.A O no hydrogen 3.407 N/A LYS 147.A N LEU 143.A O no hydrogen 2.943 N/A LYS 147.A NZ ASP 151.A OD1 no hydrogen 2.974 N/A GLU 148.A N ASN 144.A O no hydrogen 2.926 N/A ALA 149.A N VAL 145.A O no hydrogen 2.998 N/A VAL 150.A N CYS 146.A O no hydrogen 3.148 N/A ASP 151.A N LYS 147.A O no hydrogen 3.090 N/A LEU 152.A N GLU 148.A O no hydrogen 3.263 N/A ARG 153.A N VAL 150.A O no hydrogen 3.269 N/A ARG 153.A NH1 ASP 283.A OD2 no hydrogen 3.548 N/A ARG 153.A NH1 ALA 640.A O no hydrogen 3.098 N/A ARG 153.A NH2 LEU 604.A O no hydrogen 2.811 N/A ARG 153.A NH2 ALA 640.A O no hydrogen 2.955 N/A ASP 154.A N VAL 150.A O no hydrogen 3.262 N/A ASP 154.A N ASP 151.A O no hydrogen 3.070 N/A ASN 156.A N SER 160.A OG no hydrogen 3.169 N/A SER 160.A N ASN 156.A O no hydrogen 2.912 N/A SER 160.A OG ARG 153.A O no hydrogen 2.676 N/A ARG 161.A N PRO 158.A O no hydrogen 2.998 N/A ARG 161.A NE SER 157.A OG no hydrogen 2.725 N/A ARG 161.A NH2 SER 157.A OG no hydrogen 2.912 N/A ALA 162.A N PRO 158.A O no hydrogen 2.920 N/A MET 163.A N HIS 159.A O no hydrogen 2.850 N/A TYR 164.A N SER 160.A O no hydrogen 3.322 N/A TYR 164.A OH CYS 641.A O no hydrogen 2.772 N/A VAL 165.A N ARG 161.A O no hydrogen 3.225 N/A TYR 166.A N ALA 162.A O no hydrogen 2.799 N/A ASN 169.A ND2 GLU 242.A OE1 no hydrogen 3.035 N/A GLU 171.A N GLN 252.A O no hydrogen 2.815 N/A SER 172.A OG THR 570.A OG1 no hydrogen 2.729 N/A SER 172.A OG ASP 572.A OD2 no hydrogen 2.691 N/A GLU 175.A N SER 173.A OG no hydrogen 3.257 N/A HIS 179.A NE2 GLN 771.A OE1 no hydrogen 2.812 N/A ILE 180.A N PRO 177.A O no hydrogen 2.943 N/A TYR 181.A N PRO 177.A O no hydrogen 2.994 N/A ASN 182.A N LYS 178.A O no hydrogen 3.032 N/A LYS 183.A N ILE 180.A O no hydrogen 3.078 N/A LEU 184.A N TYR 181.A O no hydrogen 3.174 N/A ASP 185.A N GLN 188.A O no hydrogen 3.215 N/A GLN 188.A N ASP 185.A O no hydrogen 3.229 N/A GLN 188.A NE2 ASN 211.A OD1 no hydrogen 3.246 N/A ILE 189.A N ILE 210.A O no hydrogen 2.749 N/A VAL 191.A N LEU 208.A O no hydrogen 2.786 N/A VAL 192.A N PRO 266.A O no hydrogen 2.927 N/A ILE 193.A N TYR 206.A O no hydrogen 2.790 N/A TRP 194.A N LEU 268.A O no hydrogen 2.789 N/A TRP 194.A NE1 ASN 267.A OD1 no hydrogen 2.922 N/A VAL 195.A N GLN 204.A O no hydrogen 3.262 N/A VAL 197.A N ASP 202.A O no hydrogen 2.936 N/A ASP 202.A N VAL 197.A O no hydrogen 3.028 N/A GLN 204.A N VAL 195.A O no hydrogen 3.291 N/A TYR 206.A N ILE 193.A O no hydrogen 3.030 N/A LEU 208.A N VAL 191.A O no hydrogen 2.772 N/A LYS 209.A NZ ASP 185.A OD2 no hydrogen 2.977 N/A LYS 209.A NZ GLN 188.A OE1 no hydrogen 3.372 N/A ILE 210.A N ILE 189.A O no hydrogen 3.134 N/A HIS 212.A N GLY 187.A O no hydrogen 2.981 N/A HIS 212.A ND1 SER 251.A OG no hydrogen 2.902 N/A CYS 214.A N ASN 211.A O no hydrogen 3.311 N/A VAL 215.A N GLN 218.A OE1 no hydrogen 3.120 N/A GLN 218.A N VAL 215.A O no hydrogen 2.981 N/A VAL 219.A N VAL 215.A O no hydrogen 3.360 N/A ILE 220.A N PRO 216.A O no hydrogen 3.153 N/A ALA 221.A N GLU 217.A O no hydrogen 2.974 N/A GLU 222.A N GLN 218.A O no hydrogen 3.218 N/A ALA 223.A N VAL 219.A O no hydrogen 3.250 N/A ILE 224.A N ILE 220.A O no hydrogen 3.099 N/A ARG 225.A N ALA 221.A O no hydrogen 3.398 N/A ARG 225.A NE GLU 222.A OE1 no hydrogen 3.431 N/A LYS 226.A N GLU 222.A O no hydrogen 3.119 N/A LYS 232.A N TYR 229.A O no hydrogen 2.896 N/A ILE 234.A N MET 271.A O no hydrogen 2.820 N/A LYS 236.A N MET 269.A O no hydrogen 2.892 N/A LYS 236.A NZ VAL 237.A O no hydrogen 3.104 N/A LYS 236.A NZ CYS 240.A O no hydrogen 2.837 N/A LYS 236.A NZ ASP 733.A OD1 no hydrogen 2.777 N/A VAL 237.A N GLU 242.A O no hydrogen 2.880 N/A CYS 238.A N ASN 267.A O no hydrogen 3.015 N/A CYS 238.A SG ASN 267.A O no hydrogen 3.253 N/A GLY 239.A N ASP 733.A OD2 no hydrogen 3.008 N/A ASP 241.A N ALA 704.A O no hydrogen 2.890 N/A PHE 244.A N LEU 235.A O no hydrogen 2.906 N/A LYS 247.A N GLU 246.A OE2 no hydrogen 2.961 N/A TYR 248.A N GLU 246.A O no hydrogen 2.934 N/A LEU 250.A N CYS 214.A O no hydrogen 2.897 N/A SER 251.A N HIS 212.A O no hydrogen 3.047 N/A SER 251.A OG HIS 212.A ND1 no hydrogen 2.902 N/A SER 251.A OG HIS 212.A O no hydrogen 3.456 N/A GLN 252.A N PRO 249.A O no hydrogen 2.914 N/A GLN 252.A NE2 GLU 171.A O no hydrogen 2.805 N/A TYR 253.A N LEU 250.A O no hydrogen 3.239 N/A TYR 253.A OH GLU 246.A O no hydrogen 2.918 N/A LYS 254.A N ASN 169.A O no hydrogen 3.003 N/A LYS 254.A NZ ASP 572.A OD1 no hydrogen 2.766 N/A ARG 257.A N TYR 253.A O no hydrogen 2.918 N/A ARG 257.A NE SER 251.A O no hydrogen 2.837 N/A ARG 257.A NH2 SER 173.A O no hydrogen 2.779 N/A SER 258.A N LYS 254.A O no hydrogen 2.806 N/A CYS 259.A N TYR 255.A O no hydrogen 2.963 N/A CYS 259.A SG TYR 255.A O no hydrogen 3.372 N/A ILE 260.A N ILE 256.A O no hydrogen 2.868 N/A MET 261.A N ARG 257.A O no hydrogen 3.106 N/A LEU 262.A N SER 258.A O no hydrogen 2.922 N/A GLY 263.A N ILE 260.A O no hydrogen 3.014 N/A ARG 264.A N CYS 259.A O no hydrogen 2.808 N/A ASN 267.A N TYR 255.A OH no hydrogen 2.819 N/A LEU 268.A N VAL 192.A O no hydrogen 2.820 N/A MET 269.A N LYS 236.A O no hydrogen 2.749 N/A LEU 270.A N TRP 194.A O no hydrogen 2.796 N/A MET 271.A N ILE 234.A O no hydrogen 3.066 N/A LYS 273.A N LYS 232.A O no hydrogen 2.925 N/A LYS 273.A NZ TYR 277.A OH no hydrogen 3.010 N/A SER 275.A N ALA 272.A O no hydrogen 3.073 N/A LEU 276.A N LYS 273.A O no hydrogen 3.155 N/A TYR 277.A N LYS 273.A O no hydrogen 2.845 N/A TYR 277.A OH HIS 159.A ND1 no hydrogen 3.345 N/A SER 278.A N GLU 274.A O no hydrogen 2.886 N/A SER 278.A OG GLU 274.A O no hydrogen 2.736 N/A CYS 284.A SG MET 282.A O no hydrogen 3.709 N/A SER 289.A N GLU 109.A OE2 no hydrogen 2.838 N/A SER 289.A OG GLU 109.A OE2 no hydrogen 3.442 N/A SER 291.A N PRO 288.A O no hydrogen 2.977 N/A SER 291.A OG PRO 288.A O no hydrogen 2.711 N/A ARG 292.A N SER 289.A O no hydrogen 2.898 N/A ARG 293.A NH1 ASP 128.A OD1 no hydrogen 2.814 N/A ARG 293.A NH2 ASP 128.A OD1 no hydrogen 2.927 N/A THR 296.A OG1 SER 295.A O no hydrogen 2.721 N/A LYS 298.A N VAL 456.A O no hydrogen 2.878 N/A LEU 300.A N LYS 458.A O no hydrogen 3.085 N/A TRP 301.A N SER 299.A OG no hydrogen 3.350 N/A ILE 303.A N LEU 300.A O no hydrogen 3.179 N/A SER 305.A N ILE 303.A O no hydrogen 3.247 N/A LEU 307.A N ILE 364.A O no hydrogen 2.835 N/A ARG 308.A NE ASP 451.A OD2 no hydrogen 2.842 N/A ARG 308.A NH2 ASP 451.A OD1 no hydrogen 3.403 N/A ILE 309.A N LEU 360.A O no hydrogen 3.006 N/A LYS 310.A N GLU 449.A O no hydrogen 2.815 N/A ILE 311.A N GLU 358.A O no hydrogen 2.925 N/A LEU 312.A N GLU 447.A O no hydrogen 2.976 N/A ALA 314.A N PRO 354.A O no hydrogen 3.004 N/A THR 315.A N CYS 445.A O no hydrogen 2.959 N/A ARG 322.A N ASN 320.A OD1 no hydrogen 3.364 N/A ASP 323.A N ASN 320.A O no hydrogen 2.975 N/A ILE 324.A N ASN 320.A O no hydrogen 3.245 N/A ASP 325.A N VAL 382.A O no hydrogen 3.049 N/A LYS 326.A N VAL 382.A O no hydrogen 3.374 N/A ILE 327.A N VAL 349.A O no hydrogen 2.949 N/A TYR 328.A N CYS 380.A O no hydrogen 3.087 N/A TYR 328.A OH HIS 392.A ND1 no hydrogen 2.752 N/A VAL 329.A N THR 346.A OG1 no hydrogen 2.819 N/A ARG 330.A N SER 378.A O no hydrogen 2.832 N/A ARG 330.A NH1 ASN 345.A OD1 no hydrogen 2.792 N/A THR 331.A N VAL 344.A O no hydrogen 3.003 N/A THR 331.A OG1 VAL 344.A O no hydrogen 2.726 N/A THR 331.A OG1 TYR 362.A OH no hydrogen 2.704 N/A GLY 332.A N CYS 376.A O no hydrogen 2.805 N/A TYR 334.A N ARG 374.A O no hydrogen 2.815 N/A HIS 335.A N GLU 338.A O no hydrogen 2.937 N/A GLU 338.A N HIS 335.A O no hydrogen 3.313 N/A LEU 340.A N ILE 333.A O no hydrogen 2.721 N/A CYS 341.A SG ASP 342.A O no hydrogen 3.881 N/A VAL 344.A N THR 331.A O no hydrogen 3.086 N/A THR 346.A N VAL 329.A O no hydrogen 3.000 N/A THR 346.A OG1 GLN 347.A O no hydrogen 3.284 N/A GLN 347.A N GLU 358.A OE1 no hydrogen 2.842 N/A ARG 348.A NH1 GLU 390.A OE1 no hydrogen 2.778 N/A ARG 348.A NH2 GLU 390.A OE1 no hydrogen 3.561 N/A ARG 348.A NH2 GLU 390.A OE2 no hydrogen 2.912 N/A VAL 349.A N ILE 327.A O no hydrogen 2.874 N/A CYS 351.A SG ILE 324.A O no hydrogen 3.784 N/A ASN 353.A N PRO 350.A O no hydrogen 2.980 N/A ARG 355.A N ASN 353.A O no hydrogen 2.885 N/A TRP 356.A N LEU 312.A O no hydrogen 2.816 N/A ASN 357.A N LEU 312.A O no hydrogen 3.001 N/A GLU 358.A N ILE 311.A O no hydrogen 3.094 N/A LEU 360.A N ILE 309.A O no hydrogen 2.796 N/A TYR 362.A N LEU 307.A O no hydrogen 2.864 N/A TYR 362.A OH THR 331.A OG1 no hydrogen 2.704 N/A ILE 364.A N TYR 362.A O no hydrogen 2.771 N/A TYR 365.A OH ASN 304.A OD1 no hydrogen 2.700 N/A ILE 366.A N SER 305.A O no hydrogen 3.118 N/A ASP 368.A N TYR 365.A O no hydrogen 2.814 N/A LEU 369.A N ILE 366.A O no hydrogen 3.052 N/A ARG 371.A NE ASP 407.A OD1 no hydrogen 3.088 N/A ARG 371.A NH1 ARG 371.A O no hydrogen 2.783 N/A ARG 371.A NH1 TYR 590.A OH no hydrogen 2.769 N/A ARG 371.A NH2 ASP 407.A OD1 no hydrogen 2.863 N/A ARG 371.A NH2 TYR 590.A OH no hydrogen 3.230 N/A ALA 373.A N PRO 370.A O no hydrogen 3.241 N/A ARG 374.A N TYR 334.A O no hydrogen 2.835 N/A ARG 374.A NH1 PRO 431.A O no hydrogen 2.910 N/A ARG 374.A NH2 GLY 336.A O no hydrogen 2.782 N/A ARG 374.A NH2 PRO 431.A O no hydrogen 2.813 N/A LEU 375.A N ILE 400.A O no hydrogen 2.896 N/A CYS 376.A N GLY 332.A O no hydrogen 2.891 N/A LEU 377.A N GLY 398.A O no hydrogen 2.910 N/A SER 378.A N ARG 330.A O no hydrogen 2.932 N/A SER 378.A OG LEU 428.A O no hydrogen 2.760 N/A ILE 379.A N ALA 396.A O no hydrogen 2.976 N/A CYS 380.A N TYR 328.A O no hydrogen 2.860 N/A CYS 380.A SG SER 378.A OG no hydrogen 3.173 N/A CYS 380.A SG LEU 428.A O no hydrogen 4.006 N/A SER 381.A N CYS 393.A O no hydrogen 2.846 N/A SER 381.A OG CYS 393.A O no hydrogen 3.490 N/A VAL 382.A N LYS 326.A O no hydrogen 2.913 N/A LYS 383.A N GLU 391.A O no hydrogen 2.989 N/A GLY 384.A N ASP 325.A OD2 no hydrogen 2.781 N/A ARG 385.A NE ASP 325.A OD1 no hydrogen 3.098 N/A ARG 385.A NH1 ARG 322.A O no hydrogen 2.845 N/A ARG 385.A NH2 ASP 325.A OD1 no hydrogen 2.800 N/A LYS 389.A N LYS 386.A O no hydrogen 2.852 N/A GLU 391.A N LYS 383.A O no hydrogen 2.825 N/A HIS 392.A ND1 TYR 328.A OH no hydrogen 2.752 N/A HIS 392.A NE2 GLU 390.A OE2 no hydrogen 3.038 N/A CYS 393.A N SER 381.A O no hydrogen 3.140 N/A CYS 393.A SG.B PRO 394.A O no hydrogen 3.473 N/A LEU 395.A N ILE 379.A O no hydrogen 2.799 N/A TRP 397.A N TRP 419.A O no hydrogen 3.116 N/A TRP 397.A NE1 PRO 420.A O no hydrogen 2.868 N/A GLY 398.A N LEU 377.A O no hydrogen 2.995 N/A ASN 399.A ND2 ASN 430.A O no hydrogen 2.816 N/A ASN 399.A ND2 GLY 433.A O no hydrogen 3.016 N/A ASN 399.A ND2 VAL 434.A O no hydrogen 3.678 N/A ILE 400.A N LEU 375.A O no hydrogen 2.883 N/A ASN 401.A ND2 GLN 589.A O no hydrogen 3.004 N/A LEU 402.A N ALA 373.A O no hydrogen 3.124 N/A ASP 404.A N THR 408.A O no hydrogen 2.810 N/A TYR 405.A OH ASP 137.A OD2 no hydrogen 2.758 N/A THR 406.A N ASP 404.A OD1 no hydrogen 3.047 N/A THR 406.A OG1 ASP 404.A OD1 no hydrogen 2.733 N/A THR 406.A OG1 ASP 404.A OD2 no hydrogen 3.489 N/A THR 406.A OG1 THR 408.A OG1 no hydrogen 3.244 N/A ASP 407.A N ASP 404.A O no hydrogen 3.029 N/A THR 408.A N ASP 404.A OD1 no hydrogen 3.026 N/A THR 408.A OG1 THR 406.A OG1 no hydrogen 3.244 N/A LEU 409.A N VAL 457.A O no hydrogen 2.912 N/A VAL 410.A N LEU 402.A O no hydrogen 2.805 N/A MET 414.A N LEU 448.A O no hydrogen 2.963 N/A LEU 416.A N LEU 446.A O no hydrogen 2.867 N/A ASN 417.A N SER 437.A OG no hydrogen 2.966 N/A ASN 417.A ND2 LYS 441.A O no hydrogen 3.501 N/A ASN 417.A ND2 THR 443.A O no hydrogen 3.374 N/A ASN 417.A ND2 THR 443.A OG1 no hydrogen 2.942 N/A LEU 418.A N PRO 444.A O no hydrogen 2.928 N/A TRP 419.A N TRP 397.A O no hydrogen 2.808 N/A TRP 419.A NE1 GLY 436.A O no hydrogen 3.261 N/A LEU 425.A N PRO 422.A O no hydrogen 3.075 N/A GLY 433.A N ASN 430.A O no hydrogen 3.136 N/A GLY 436.A N ASN 399.A O no hydrogen 2.807 N/A ASN 438.A N ASN 417.A O no hydrogen 2.906 N/A ASN 438.A ND2 LEU 418.A O no hydrogen 3.083 N/A ASN 440.A N ASN 438.A OD1 no hydrogen 3.004 N/A LYS 441.A NZ ASN 438.A O no hydrogen 3.059 N/A GLU 442.A N ASN 440.A OD1 no hydrogen 3.232 N/A THR 443.A OG1 ASN 440.A O no hydrogen 2.773 N/A CYS 445.A N THR 315.A OG1 no hydrogen 2.859 N/A CYS 445.A SG ASN 417.A OD1 no hydrogen 3.750 N/A LEU 446.A N LEU 416.A O no hydrogen 2.786 N/A GLU 447.A N CYS 313.A O no hydrogen 2.772 N/A LEU 448.A N MET 414.A O no hydrogen 2.742 N/A GLU 449.A N LYS 310.A O no hydrogen 2.918 N/A PHE 450.A N GLY 412.A O no hydrogen 2.789 N/A TRP 452.A N ASP 451.A OD1 no hydrogen 3.226 N/A LYS 458.A N LYS 298.A O no hydrogen 2.906 N/A LYS 458.A NZ THR 406.A O no hydrogen 2.815 N/A LYS 458.A NZ THR 408.A OG1 no hydrogen 2.983 N/A PHE 459.A N ASP 407.A O no hydrogen 2.918 N/A ILE 465.A N ASP 461.A O no hydrogen 3.086 N/A GLU 466.A N MET 462.A O no hydrogen 2.909 N/A GLU 467.A N ILE 465.A O no hydrogen 2.733 N/A ASN 470.A ND2 GLN 528.A OE1 no hydrogen 3.658 N/A LYS 474.A N GLU 471.A O no hydrogen 3.347 N/A GLN 476.A N ASN 472.A O no hydrogen 3.198 N/A LEU 477.A N ASP 473.A O no hydrogen 3.143 N/A LYS 478.A N LYS 474.A O no hydrogen 3.188 N/A ALA 479.A N GLU 475.A O no hydrogen 3.091 N/A ILE 480.A N GLN 476.A O no hydrogen 3.045 N/A SER 481.A N LEU 477.A O no hydrogen 3.092 N/A SER 481.A OG LEU 477.A O no hydrogen 3.550 N/A SER 481.A OG LYS 478.A O no hydrogen 2.901 N/A THR 482.A OG1 LYS 478.A O no hydrogen 3.403 N/A THR 482.A OG1 ALA 479.A O no hydrogen 2.754 N/A ARG 483.A N ILE 480.A O no hydrogen 3.255 N/A ARG 483.A NH2 GLU 493.A OE2 no hydrogen 2.773 N/A LEU 486.A N ASP 484.A OD1 no hydrogen 2.933 N/A SER 487.A N ASP 484.A O no hydrogen 3.081 N/A SER 487.A OG ASP 484.A O no hydrogen 3.186 N/A THR 490.A N GLU 493.A OE1 no hydrogen 3.082 N/A GLN 492.A N GLN 492.A OE1 no hydrogen 3.034 N/A GLU 493.A N THR 490.A OG1 no hydrogen 3.228 N/A LYS 494.A N THR 490.A O no hydrogen 2.887 N/A LYS 494.A NZ GLU 491.A OE2 no hydrogen 3.013 N/A ASP 495.A N GLU 491.A O no hydrogen 2.927 N/A PHE 496.A N GLN 492.A O no hydrogen 2.888 N/A LEU 497.A N GLU 493.A O no hydrogen 2.770 N/A TRP 498.A N LYS 494.A O no hydrogen 2.906 N/A SER 499.A N ASP 495.A O no hydrogen 2.992 N/A SER 499.A OG ASP 495.A O no hydrogen 2.733 N/A HIS 500.A N PHE 496.A O no hydrogen 3.241 N/A HIS 500.A ND1 PHE 496.A O no hydrogen 2.755 N/A ARG 501.A N TRP 498.A O no hydrogen 3.453 N/A ARG 501.A NE GLN 528.A OE1 no hydrogen 3.314 N/A ARG 501.A NH1 TRP 498.A O no hydrogen 2.750 N/A ARG 501.A NH2 GLN 528.A OE1 no hydrogen 2.766 N/A TYR 503.A N HIS 500.A O no hydrogen 3.015 N/A CYS 504.A N HIS 500.A O no hydrogen 2.929 N/A CYS 504.A SG LEU 497.A O no hydrogen 4.024 N/A CYS 504.A SG HIS 500.A O no hydrogen 3.325 N/A THR 506.A N TYR 503.A O no hydrogen 3.008 N/A THR 506.A OG1 TYR 503.A O no hydrogen 2.720 N/A ILE 507.A N CYS 504.A O no hydrogen 2.972 N/A GLU 509.A N GLU 509.A OE1 no hydrogen 2.782 N/A ILE 510.A N ILE 507.A O no hydrogen 3.277 N/A LEU 511.A N PRO 508.A O no hydrogen 3.237 N/A LYS 513.A NZ ARG 483.A O no hydrogen 2.895 N/A LEU 514.A N ILE 510.A O no hydrogen 3.086 N/A LEU 515.A N LEU 511.A O no hydrogen 2.845 N/A LEU 516.A N PRO 512.A O no hydrogen 3.254 N/A SER 517.A N LEU 514.A O no hydrogen 3.034 N/A SER 517.A OG LYS 513.A O no hydrogen 3.038 N/A VAL 518.A N LEU 514.A O no hydrogen 3.301 N/A LYS 519.A N GLU 525.A OE1 no hydrogen 3.071 N/A LYS 519.A NZ ASN 521.A OD1 no hydrogen 3.397 N/A TRP 520.A NE1 LEU 515.A O no hydrogen 2.838 N/A ASN 521.A ND2 LEU 340.A O no hydrogen 2.801 N/A SER 522.A N LYS 519.A O no hydrogen 3.202 N/A ARG 523.A N ASP 368.A OD1 no hydrogen 3.021 N/A VAL 526.A N SER 522.A O no hydrogen 3.245 N/A ALA 527.A N ARG 523.A O no hydrogen 3.134 N/A GLN 528.A NE2 ASP 524.A O no hydrogen 3.437 N/A MET 529.A N GLU 525.A O no hydrogen 2.953 N/A TYR 530.A N VAL 526.A O no hydrogen 2.820 N/A TYR 530.A OH ASP 554.A OD1 no hydrogen 2.612 N/A CYS 531.A N ALA 527.A O no hydrogen 3.271 N/A CYS 531.A SG ALA 527.A O no hydrogen 3.411 N/A LEU 532.A N GLN 528.A O no hydrogen 3.279 N/A VAL 533.A N MET 529.A O no hydrogen 2.932 N/A LYS 534.A N TYR 530.A O no hydrogen 3.136 N/A TRP 536.A N VAL 533.A O no hydrogen 3.234 N/A TRP 536.A NE1 PRO 508.A O no hydrogen 2.974 N/A GLN 543.A N LYS 540.A O no hydrogen 2.938 N/A ALA 544.A N LYS 540.A O no hydrogen 2.909 N/A MET 545.A N PRO 541.A O no hydrogen 2.935 N/A GLU 546.A N GLN 543.A O no hydrogen 3.363 N/A LEU 547.A N ALA 544.A O no hydrogen 2.948 N/A LEU 548.A N MET 545.A O no hydrogen 3.046 N/A ASP 549.A N GLU 546.A O no hydrogen 3.140 N/A ASN 551.A N ASP 549.A OD1 no hydrogen 2.899 N/A TYR 552.A N ASP 549.A O no hydrogen 3.217 N/A TYR 552.A OH PRO 512.A O no hydrogen 2.992 N/A TYR 552.A OH GLU 546.A OE2 no hydrogen 3.254 N/A MET 556.A N ASP 554.A OD2 no hydrogen 2.880 N/A VAL 557.A N ASP 554.A OD2 no hydrogen 3.177 N/A ARG 558.A N ASP 554.A O no hydrogen 2.823 N/A ARG 558.A NE GLU 588.A OE2 no hydrogen 2.779 N/A ARG 558.A NH1 LEU 548.A O no hydrogen 2.893 N/A ARG 558.A NH1 ASP 549.A O no hydrogen 3.203 N/A ARG 558.A NH1 TYR 552.A O no hydrogen 3.005 N/A ARG 558.A NH2 LEU 548.A O no hydrogen 2.802 N/A ARG 558.A NH2 GLU 588.A OE2 no hydrogen 2.929 N/A GLY 559.A N PRO 555.A O no hydrogen 2.810 N/A PHE 560.A N MET 556.A O no hydrogen 2.889 N/A ALA 561.A N VAL 557.A O no hydrogen 3.115 N/A VAL 562.A N ARG 558.A O no hydrogen 3.043 N/A ARG 563.A N GLY 559.A O no hydrogen 3.202 N/A CYS 564.A N PHE 560.A O no hydrogen 3.160 N/A CYS 564.A SG PHE 560.A O no hydrogen 3.339 N/A LEU 565.A N ALA 561.A O no hydrogen 3.176 N/A GLU 566.A N VAL 562.A O no hydrogen 2.802 N/A LYS 567.A N ARG 563.A O no hydrogen 3.174 N/A TYR 568.A N CYS 564.A O no hydrogen 2.868 N/A LEU 569.A N LEU 565.A O no hydrogen 2.871 N/A THR 570.A OG1 SER 172.A OG no hydrogen 2.729 N/A LYS 573.A N THR 570.A OG1 no hydrogen 3.272 N/A LEU 574.A N THR 570.A O no hydrogen 2.880 N/A SER 575.A N ASP 571.A O no hydrogen 2.914 N/A SER 575.A OG ASP 571.A O no hydrogen 3.295 N/A GLN 576.A N ASP 572.A O no hydrogen 2.993 N/A TYR 577.A N LYS 573.A O no hydrogen 2.912 N/A TYR 577.A OH GLU 542.A OE2 no hydrogen 2.804 N/A GLN 580.A NE2 GLN 761.A OE1 no hydrogen 2.784 N/A LEU 581.A N TYR 577.A O no hydrogen 3.037 N/A VAL 582.A N LEU 578.A O no hydrogen 2.908 N/A GLN 583.A N ILE 579.A O no hydrogen 3.208 N/A GLN 583.A NE2 GLU 620.A OE1 no hydrogen 2.737 N/A VAL 584.A N GLN 580.A O no hydrogen 2.979 N/A LEU 585.A N VAL 582.A O no hydrogen 3.229 N/A LYS 586.A N GLN 583.A O no hydrogen 3.171 N/A LYS 586.A NZ GLN 583.A OE1 no hydrogen 2.963 N/A LYS 586.A NZ GLU 620.A OE1 no hydrogen 3.219 N/A LYS 586.A NZ GLU 620.A OE2 no hydrogen 2.750 N/A TYR 587.A N VAL 584.A O no hydrogen 2.950 N/A TYR 587.A OH SER 941.A O no hydrogen 3.330 N/A GLU 588.A N LEU 585.A O no hydrogen 3.213 N/A GLN 589.A NE2 ASN 401.A OD1 no hydrogen 3.067 N/A TYR 590.A OH PHE 403.A O no hydrogen 2.620 N/A LEU 591.A N GLU 134.A OE2 no hydrogen 2.943 N/A ASN 593.A ND2 TYR 590.A O no hydrogen 2.804 N/A VAL 596.A N ASN 593.A OD1 no hydrogen 2.808 N/A ARG 597.A N ASN 593.A O no hydrogen 3.402 N/A ARG 597.A NE ASP 592.A OD1 no hydrogen 2.766 N/A ARG 597.A NH2 ASN 141.A O no hydrogen 3.392 N/A ARG 597.A NH2 ASP 592.A OD1 no hydrogen 3.200 N/A ARG 597.A NH2 ASP 592.A OD2 no hydrogen 2.794 N/A PHE 598.A N LEU 594.A O no hydrogen 3.013 N/A LEU 599.A N LEU 595.A O no hydrogen 2.945 N/A LEU 600.A N VAL 596.A O no hydrogen 2.984 N/A LYS 601.A N ARG 597.A O no hydrogen 3.054 N/A LYS 601.A NZ GLU 148.A OE1 no hydrogen 2.827 N/A LYS 602.A N PHE 598.A O no hydrogen 3.062 N/A LYS 602.A NZ ASP 571.A OD1 no hydrogen 3.328 N/A ALA 603.A N LEU 599.A O no hydrogen 2.857 N/A LEU 604.A N LEU 600.A O no hydrogen 2.875 N/A THR 605.A N LYS 602.A O no hydrogen 3.196 N/A THR 605.A OG1 LYS 601.A O no hydrogen 2.718 N/A THR 605.A OG1 LYS 602.A O no hydrogen 3.352 N/A ASN 606.A ND2 ASP 571.A OD2 no hydrogen 3.164 N/A GLN 607.A N TYR 164.A O no hydrogen 2.891 N/A ARG 608.A N ASN 606.A OD1 no hydrogen 2.997 N/A ARG 608.A NE SER 575.A OG no hydrogen 3.133 N/A ARG 608.A NH2 ASP 571.A O no hydrogen 3.139 N/A ARG 608.A NH2 SER 575.A OG no hydrogen 3.091 N/A ILE 609.A N ASN 606.A OD1 no hydrogen 3.258 N/A GLY 610.A N ASN 606.A O no hydrogen 2.908 N/A HIS 611.A N GLN 607.A O no hydrogen 2.882 N/A HIS 611.A ND1 TYR 644.A OH no hydrogen 2.714 N/A HIS 611.A NE2 PRO 700.A O no hydrogen 2.771 N/A PHE 613.A N ILE 609.A O no hydrogen 2.846 N/A PHE 614.A N GLY 610.A O no hydrogen 2.866 N/A TRP 615.A N HIS 611.A O no hydrogen 3.116 N/A TRP 615.A NE1 GLN 651.A OE1 no hydrogen 2.934 N/A HIS 616.A N PHE 612.A O no hydrogen 2.836 N/A LEU 617.A N PHE 613.A O no hydrogen 3.185 N/A LYS 618.A N PHE 614.A O no hydrogen 2.834 N/A LYS 618.A NZ ALA 119.A O no hydrogen 2.880 N/A SER 619.A N TRP 615.A O no hydrogen 2.861 N/A SER 619.A OG HIS 616.A O no hydrogen 2.977 N/A GLU 620.A N LEU 617.A O no hydrogen 3.209 N/A MET 621.A N LYS 618.A O no hydrogen 3.076 N/A ASN 623.A N GLU 620.A O no hydrogen 2.957 N/A THR 625.A N ASN 623.A OD1 no hydrogen 3.204 N/A THR 625.A OG1 ASN 623.A OD1 no hydrogen 2.687 N/A VAL 626.A N ASN 623.A O no hydrogen 3.118 N/A SER 627.A N ASN 623.A O no hydrogen 2.817 N/A SER 627.A OG MET 621.A O no hydrogen 3.107 N/A ARG 629.A NH1 TYR 590.A O no hydrogen 3.020 N/A PHE 630.A N VAL 626.A O no hydrogen 2.768 N/A GLY 631.A N SER 627.A O no hydrogen 2.857 N/A LEU 632.A N GLN 628.A O no hydrogen 2.940 N/A LEU 633.A N ARG 629.A O no hydrogen 3.093 N/A LEU 634.A N PHE 630.A O no hydrogen 2.813 N/A GLU 635.A N GLY 631.A O no hydrogen 2.917 N/A SER 636.A N LEU 632.A O no hydrogen 3.278 N/A SER 636.A OG LEU 633.A O no hydrogen 2.730 N/A TYR 637.A N LEU 633.A O no hydrogen 3.003 N/A CYS 638.A N LEU 634.A O no hydrogen 2.812 N/A CYS 638.A SG LEU 634.A O no hydrogen 3.428 N/A ARG 639.A N GLU 635.A O no hydrogen 2.976 N/A ARG 639.A NH1 ASN 113.A OD1 no hydrogen 3.306 N/A ARG 639.A NH2 ASN 113.A OD1 no hydrogen 3.054 N/A ARG 639.A NH2 GLU 635.A OE2 no hydrogen 2.738 N/A ALA 640.A N TYR 637.A O no hydrogen 3.177 N/A CYS 641.A SG CYS 638.A O no hydrogen 3.631 N/A MET 643.A N ASP 283.A OD1 no hydrogen 2.856 N/A TYR 644.A OH HIS 611.A ND1 no hydrogen 2.714 N/A LEU 645.A N GLY 642.A O no hydrogen 3.377 N/A LYS 646.A N MET 643.A O no hydrogen 3.075 N/A LEU 648.A N TYR 644.A O no hydrogen 2.876 N/A ASN 649.A N LEU 645.A O no hydrogen 2.897 N/A ASN 649.A ND2 GLU 115.A O no hydrogen 2.834 N/A ARG 650.A N.A LYS 646.A O no hydrogen 3.300 N/A ARG 650.A N.B LYS 646.A O no hydrogen 3.305 N/A ARG 650.A NE.A GLY 696.A O no hydrogen 3.123 N/A ARG 650.A NH2.A ASP 692.A O no hydrogen 2.954 N/A ARG 650.A NH2.A GLY 696.A O no hydrogen 3.516 N/A GLN 651.A N HIS 647.A O no hydrogen 3.210 N/A GLN 651.A NE2 TYR 644.A OH no hydrogen 3.324 N/A GLN 651.A NE2 HIS 647.A O no hydrogen 3.440 N/A VAL 652.A N LEU 648.A O no hydrogen 2.961 N/A GLU 653.A N ASN 649.A O no hydrogen 2.992 N/A ALA 654.A N ARG 650.A O.A no hydrogen 3.086 N/A ALA 654.A N ARG 650.A O.B no hydrogen 3.089 N/A MET 655.A N GLN 651.A O no hydrogen 2.971 N/A GLU 656.A N VAL 652.A O no hydrogen 2.980 N/A LYS 657.A N GLU 653.A O no hydrogen 3.177 N/A LYS 657.A NZ ASP 90.A OD1 no hydrogen 2.761 N/A LYS 657.A NZ ASP 689.A OD2 no hydrogen 2.784 N/A LEU 658.A N ALA 654.A O no hydrogen 3.309 N/A ILE 659.A N MET 655.A O no hydrogen 2.904 N/A ASN 660.A N GLU 656.A O no hydrogen 2.974 N/A ASN 660.A ND2 HIS 13.A O no hydrogen 2.873 N/A LEU 661.A N LYS 657.A O no hydrogen 2.972 N/A THR 662.A N LEU 658.A O no hydrogen 3.012 N/A THR 662.A OG1 LEU 658.A O no hydrogen 2.928 N/A THR 662.A OG1 ILE 659.A O no hydrogen 3.001 N/A ASP 663.A N ILE 659.A O no hydrogen 2.898 N/A ILE 664.A N ASN 660.A O no hydrogen 3.073 N/A LEU 665.A N LEU 661.A O no hydrogen 3.267 N/A LYS 666.A N THR 662.A O no hydrogen 2.888 N/A LYS 666.A NZ ASN 749.A O no hydrogen 3.018 N/A GLU 668.A N GLU 668.A OE2 no hydrogen 3.047 N/A LYS 669.A N ILE 664.A O no hydrogen 2.979 N/A LYS 670.A NZ GLN 667.A O no hydrogen 3.068 N/A GLU 672.A N LYS 669.A O no hydrogen 3.253 N/A GLN 674.A NE2 ILE 717.A O no hydrogen 2.962 N/A VAL 676.A N THR 673.A OG1 no hydrogen 3.344 N/A GLN 677.A N THR 673.A O no hydrogen 3.001 N/A GLN 677.A NE2 GLU 672.A O no hydrogen 3.133 N/A GLN 677.A NE2 THR 673.A O no hydrogen 3.438 N/A MET 678.A N GLN 674.A O no hydrogen 2.822 N/A LYS 679.A N LYS 675.A O no hydrogen 3.069 N/A PHE 680.A N VAL 676.A O no hydrogen 3.181 N/A LEU 681.A N GLN 677.A O no hydrogen 2.888 N/A VAL 682.A N MET 678.A O no hydrogen 3.073 N/A GLU 683.A N LYS 679.A O no hydrogen 3.234 N/A GLN 684.A N PHE 680.A O no hydrogen 2.956 N/A MET 685.A N LEU 681.A O no hydrogen 2.978 N/A ARG 686.A N VAL 682.A O no hydrogen 3.193 N/A ARG 687.A N GLN 684.A O no hydrogen 3.261 N/A MET 691.A N ARG 687.A O no hydrogen 3.006 N/A ASP 692.A N PRO 688.A O no hydrogen 2.976 N/A ALA 693.A N ASP 689.A O no hydrogen 3.297 N/A LEU 694.A N PHE 690.A O no hydrogen 2.835 N/A GLN 695.A NE2 MET 691.A O no hydrogen 3.258 N/A GLY 696.A N GLY 708.A O no hydrogen 3.246 N/A PHE 697.A N LEU 707.A O no hydrogen 3.075 N/A SER 699.A N HIS 705.A O no hydrogen 2.842 N/A LEU 701.A N SER 699.A OG no hydrogen 3.172 N/A ASN 702.A N SER 699.A O no hydrogen 3.147 N/A ALA 704.A N ASN 702.A OD1 no hydrogen 3.130 N/A HIS 705.A N ASN 702.A O no hydrogen 2.856 N/A GLN 706.A NE2 ASP 241.A OD2 no hydrogen 2.777 N/A LEU 707.A N PHE 697.A O no hydrogen 2.748 N/A GLY 708.A N GLU 730.A O no hydrogen 2.983 N/A LEU 710.A N GLN 695.A OE1 no hydrogen 2.883 N/A ARG 711.A N ASN 728.A O no hydrogen 2.862 N/A ARG 711.A NH1 ASN 728.A OD1 no hydrogen 3.118 N/A ARG 711.A NH1 GLN 741.A O no hydrogen 3.291 N/A ARG 711.A NH2 GLN 741.A O no hydrogen 3.321 N/A GLU 713.A N GLU 713.A OE1 no hydrogen 2.989 N/A GLU 714.A N ARG 711.A O no hydrogen 2.974 N/A CYS 715.A N LEU 712.A O no hydrogen 3.064 N/A CYS 715.A SG ARG 711.A O no hydrogen 3.395 N/A CYS 715.A SG ASN 728.A O no hydrogen 3.953 N/A ARG 716.A N TRP 726.A O no hydrogen 3.011 N/A MET 718.A N PRO 724.A O no hydrogen 2.796 N/A ARG 723.A N SER 720.A O no hydrogen 3.372 N/A ARG 723.A NE GLN 677.A OE1 no hydrogen 3.152 N/A ARG 723.A NH1 SER 720.A O no hydrogen 3.004 N/A ARG 723.A NH2 GLN 674.A OE1 no hydrogen 2.775 N/A ARG 723.A NH2 GLN 677.A OE1 no hydrogen 3.516 N/A LEU 725.A N PHE 747.A O no hydrogen 2.821 N/A TRP 726.A N ARG 716.A O no hydrogen 2.754 N/A TRP 726.A NE1 GLU 744.A OE2 no hydrogen 2.804 N/A LEU 727.A N ILE 745.A O no hydrogen 2.812 N/A ASN 728.A ND2 GLU 744.A OE2 no hydrogen 3.019 N/A TRP 729.A N ASN 743.A O no hydrogen 3.055 N/A TRP 729.A NE1 LEU 694.A O no hydrogen 2.748 N/A GLU 730.A N ASN 709.A O no hydrogen 2.743 N/A ASN 731.A N GLN 741.A O no hydrogen 2.997 N/A ASN 731.A ND2 GLY 239.A O no hydrogen 2.775 N/A ASN 731.A ND2 PHE 740.A O no hydrogen 2.949 N/A ASP 733.A N ASN 731.A OD1 no hydrogen 3.170 N/A MET 735.A N ASP 733.A OD2 no hydrogen 2.932 N/A SER 736.A N ASP 733.A O no hydrogen 3.160 N/A SER 736.A OG ASN 731.A O no hydrogen 3.543 N/A SER 736.A OG ASP 733.A O no hydrogen 3.476 N/A GLU 737.A N GLU 737.A OE1 no hydrogen 2.809 N/A LEU 738.A N MET 735.A O no hydrogen 3.222 N/A LEU 739.A N SER 736.A O no hydrogen 3.012 N/A PHE 740.A N SER 736.A O no hydrogen 2.932 N/A ASN 743.A N TRP 729.A O no hydrogen 2.930 N/A ILE 745.A N LEU 727.A O no hydrogen 2.991 N/A ILE 746.A N ILE 794.A O no hydrogen 2.781 N/A PHE 747.A N LEU 725.A O no hydrogen 2.767 N/A LYS 748.A N GLY 792.A O no hydrogen 2.934 N/A LYS 748.A NZ ASP 751.A OD2 no hydrogen 2.796 N/A ASN 749.A ND2 ILE 659.A O no hydrogen 3.490 N/A ASN 749.A ND2 THR 662.A OG1 no hydrogen 2.772 N/A ASN 749.A ND2 ASP 663.A OD1 no hydrogen 2.920 N/A GLY 750.A N CYS 790.A O no hydrogen 2.745 N/A ARG 754.A N ASP 752.A OD1 no hydrogen 3.358 N/A ARG 754.A NE ASP 752.A OD1 no hydrogen 2.872 N/A ARG 754.A NE ASP 752.A OD2 no hydrogen 3.453 N/A ARG 754.A NH2 ASP 752.A OD2 no hydrogen 2.783 N/A GLN 755.A N.B GLN 755.A OE1.B no hydrogen 2.794 N/A GLN 755.A NE2.B ASP 752.A OD2 no hydrogen 3.046 N/A MET 757.A N LEU 753.A O no hydrogen 2.906 N/A LEU 758.A N ARG 754.A O no hydrogen 3.051 N/A THR 759.A N GLN 755.A O.A no hydrogen 2.945 N/A THR 759.A N GLN 755.A O.B no hydrogen 3.034 N/A THR 759.A OG1 GLN 755.A O.A no hydrogen 2.986 N/A THR 759.A OG1 GLN 755.A O.B no hydrogen 2.969 N/A LEU 760.A N ASP 756.A O no hydrogen 2.913 N/A GLN 761.A N MET 757.A O no hydrogen 3.115 N/A GLN 761.A NE2 GLN 576.A O no hydrogen 2.739 N/A GLN 761.A NE2 GLN 580.A OE1 no hydrogen 2.794 N/A ILE 762.A N LEU 758.A O no hydrogen 2.925 N/A ILE 763.A N THR 759.A O no hydrogen 2.929 N/A ARG 764.A N.A LEU 760.A O no hydrogen 3.196 N/A ARG 764.A N.B LEU 760.A O no hydrogen 3.196 N/A ARG 764.A NH2.A PRO 781.A O no hydrogen 2.864 N/A ARG 764.A NH2.B GLN 576.A OE1 no hydrogen 3.409 N/A ILE 765.A N GLN 761.A O no hydrogen 3.042 N/A MET 766.A N ILE 762.A O no hydrogen 2.880 N/A GLU 767.A N ILE 763.A O no hydrogen 2.995 N/A ASN 768.A N ARG 764.A O.A no hydrogen 3.055 N/A ASN 768.A N ARG 764.A O.B no hydrogen 3.157 N/A ILE 769.A N ILE 765.A O no hydrogen 3.068 N/A TRP 770.A N MET 766.A O no hydrogen 2.964 N/A TRP 770.A NE1 ALA 925.A O no hydrogen 2.984 N/A GLN 771.A N GLU 767.A O no hydrogen 3.014 N/A GLN 771.A NE2 ASP 776.A OD1 no hydrogen 2.999 N/A ASN 772.A N ASN 768.A O no hydrogen 2.989 N/A GLN 773.A N TRP 770.A O no hydrogen 3.162 N/A GLY 774.A N GLN 771.A O no hydrogen 3.099 N/A LEU 775.A N TRP 770.A O no hydrogen 2.789 N/A LEU 777.A N LEU 775.A O no hydrogen 2.909 N/A MET 779.A N GLU 767.A OE2 no hydrogen 2.795 N/A LEU 780.A N TYR 842.A OH no hydrogen 2.824 N/A TYR 782.A N LEU 780.A O no hydrogen 2.908 N/A GLY 783.A N GLU 795.A OE1 no hydrogen 2.788 N/A LEU 785.A N LEU 793.A O no hydrogen 2.944 N/A SER 786.A OG GLY 788.A O no hydrogen 3.253 N/A ILE 787.A N VAL 791.A O no hydrogen 2.899 N/A CYS 790.A SG ASP 789.A OD1 no hydrogen 3.843 N/A GLY 792.A N LYS 748.A O no hydrogen 3.025 N/A LEU 793.A N LEU 785.A O no hydrogen 2.880 N/A ILE 794.A N ILE 746.A O no hydrogen 2.879 N/A GLU 795.A N GLY 783.A O no hydrogen 2.819 N/A VAL 796.A N GLU 744.A O no hydrogen 3.079 N/A ARG 798.A NH1 GLU 744.A OE1 no hydrogen 2.787 N/A SER 800.A OG VAL 797.A O no hydrogen 2.735 N/A HIS 801.A N VAL 861.A O no hydrogen 3.002 N/A THR 802.A N GLN 805.A OE1 no hydrogen 2.998 N/A ILE 803.A N ILE 859.A O no hydrogen 3.121 N/A MET 804.A N ASN 856.A O no hydrogen 2.985 N/A GLN 805.A N THR 802.A OG1 no hydrogen 3.234 N/A ILE 806.A N THR 802.A O no hydrogen 3.194 N/A GLN 807.A N ILE 803.A O no hydrogen 2.873 N/A GLN 807.A NE2 ASP 897.A OD2 no hydrogen 3.469 N/A CYS 808.A N MET 804.A O no hydrogen 2.860 N/A CYS 808.A SG MET 804.A O no hydrogen 3.282 N/A LYS 809.A N ILE 806.A O no hydrogen 3.320 N/A ASN 811.A N THR 814.A OG1 no hydrogen 2.866 N/A HIS 813.A N ASN 811.A OD1 no hydrogen 3.028 N/A THR 814.A N ASN 811.A O no hydrogen 3.280 N/A THR 814.A OG1 ASN 811.A O no hydrogen 2.782 N/A THR 814.A OG1 ASN 811.A OD1 no hydrogen 3.483 N/A HIS 816.A NE2 TYR 828.A OH no hydrogen 2.743 N/A GLN 817.A N HIS 813.A O no hydrogen 2.948 N/A GLN 817.A NE2 GLN 817.A O no hydrogen 3.093 N/A GLN 817.A NE2 ASP 821.A OD1 no hydrogen 2.799 N/A TRP 818.A N THR 814.A O no hydrogen 2.862 N/A LEU 819.A N LEU 815.A O no hydrogen 3.103 N/A LYS 820.A N HIS 816.A O no hydrogen 2.996 N/A LYS 820.A NZ GLN 817.A OE1 no hydrogen 3.413 N/A ASP 821.A N GLN 817.A O no hydrogen 2.978 N/A LYS 822.A N TRP 818.A O no hydrogen 3.127 N/A LYS 822.A NZ ASP 863.A OD1 no hydrogen 3.478 N/A ASN 823.A N LEU 819.A O no hydrogen 2.875 N/A ASN 823.A N LYS 820.A O no hydrogen 3.282 N/A ASN 823.A ND2 LEU 819.A O no hydrogen 3.035 N/A ASN 823.A ND2 ASP 863.A O no hydrogen 2.776 N/A TYR 828.A N GLY 825.A O no hydrogen 3.325 N/A TYR 828.A OH HIS 816.A NE2 no hydrogen 2.743 N/A ALA 831.A N ILE 827.A O no hydrogen 3.407 N/A ILE 832.A N TYR 828.A O no hydrogen 3.223 N/A ASP 833.A N ASP 829.A O no hydrogen 3.043 N/A LEU 834.A N ALA 830.A O no hydrogen 3.012 N/A PHE 835.A N ALA 831.A O no hydrogen 2.988 N/A THR 836.A N ILE 832.A O no hydrogen 2.928 N/A THR 836.A OG1 ILE 832.A O no hydrogen 2.675 N/A ARG 837.A N ASP 833.A O no hydrogen 2.922 N/A ARG 837.A NE.A ASP 833.A OD1 no hydrogen 3.173 N/A ARG 837.A NE.B ASP 833.A O no hydrogen 3.349 N/A ARG 837.A NH1.A ASP 776.A O no hydrogen 3.278 N/A SER 838.A N LEU 834.A O no hydrogen 2.957 N/A SER 838.A OG LEU 834.A O no hydrogen 2.725 N/A SER 838.A OG PHE 835.A O no hydrogen 3.053 N/A CYS 839.A N PHE 835.A O no hydrogen 2.877 N/A ALA 840.A N THR 836.A O no hydrogen 3.053 N/A GLY 841.A N ARG 837.A O no hydrogen 3.203 N/A TYR 842.A N SER 838.A O no hydrogen 3.037 N/A CYS 843.A N.A CYS 839.A O no hydrogen 2.792 N/A CYS 843.A N.B CYS 839.A O no hydrogen 2.813 N/A CYS 843.A SG.B CYS 839.A O no hydrogen 3.280 N/A VAL 844.A N ALA 840.A O no hydrogen 3.173 N/A ALA 845.A N GLY 841.A O no hydrogen 2.994 N/A THR 846.A N TYR 842.A O no hydrogen 3.091 N/A THR 846.A OG1 TYR 842.A O no hydrogen 2.766 N/A THR 846.A OG1 CYS 843.A O.A no hydrogen 3.382 N/A THR 846.A OG1 CYS 843.A O.B no hydrogen 3.370 N/A PHE 847.A N CYS 843.A O.A no hydrogen 3.250 N/A PHE 847.A N CYS 843.A O.B no hydrogen 3.188 N/A ILE 848.A N VAL 844.A O no hydrogen 2.937 N/A LEU 849.A N ALA 845.A O no hydrogen 3.005 N/A GLY 850.A N THR 846.A O no hydrogen 2.898 N/A GLY 852.A N HIS 874.A O no hydrogen 3.235 N/A ARG 854.A N PRO 891.A O no hydrogen 2.953 N/A ARG 854.A NE GLY 852.A O no hydrogen 3.099 N/A ARG 854.A NH1 ASN 858.A O no hydrogen 2.982 N/A ARG 854.A NH1 ILE 870.A O no hydrogen 2.722 N/A ARG 854.A NH2 GLY 852.A O no hydrogen 3.005 N/A ARG 854.A NH2 ASP 871.A O no hydrogen 3.208 N/A HIS 855.A N ASN 858.A OD1 no hydrogen 2.825 N/A ASN 856.A ND2 GLN 807.A OE1 no hydrogen 3.610 N/A SER 857.A N HIS 855.A ND1 no hydrogen 3.116 N/A ASN 858.A N HIS 855.A O no hydrogen 3.373 N/A ASN 858.A ND2 ASP 853.A O no hydrogen 2.962 N/A MET 860.A N PHE 868.A O no hydrogen 2.839 N/A VAL 861.A N HIS 801.A O no hydrogen 2.835 N/A LYS 862.A N GLN 866.A O no hydrogen 2.794 N/A ASP 863.A N ASN 799.A O no hydrogen 2.935 N/A GLY 865.A N LYS 862.A O no hydrogen 2.981 N/A GLN 866.A N ASP 864.A OD1 no hydrogen 3.147 N/A LEU 867.A N SER 838.A OG no hydrogen 2.890 N/A PHE 868.A N MET 860.A O no hydrogen 2.929 N/A ILE 870.A N ASN 858.A O no hydrogen 3.110 N/A ASP 871.A N TYR 782.A OH no hydrogen 3.320 N/A PHE 872.A N ASP 756.A OD2 no hydrogen 2.806 N/A GLY 873.A N ASP 756.A OD1 no hydrogen 3.394 N/A HIS 874.A N PHE 872.A O no hydrogen 2.746 N/A HIS 874.A ND1 GLU 950.A OE2 no hydrogen 2.784 N/A PHE 875.A N GLU 950.A OE1 no hydrogen 2.906 N/A LEU 876.A N LEU 849.A O no hydrogen 2.786 N/A LYS 879.A NZ ASP 853.A OD2 no hydrogen 2.783 N/A LYS 880.A N ASP 877.A O no hydrogen 3.368 N/A LYS 880.A NZ GLY 884.A O no hydrogen 3.386 N/A LYS 881.A NZ GLU 426.A OE2 no hydrogen 3.054 N/A PHE 883.A N LYS 879.A O no hydrogen 3.045 N/A GLY 884.A N LYS 880.A O no hydrogen 2.852 N/A ARG 889.A NH1 ILE 851.A O no hydrogen 3.558 N/A ARG 889.A NH2 ILE 851.A O no hydrogen 2.761 N/A LEU 894.A N HIS 985.A NE2 no hydrogen 2.899 N/A PHE 898.A N THR 895.A O no hydrogen 2.819 N/A LEU 899.A N THR 895.A O no hydrogen 3.132 N/A ILE 900.A N GLN 896.A O no hydrogen 2.805 N/A ILE 902.A N PHE 898.A O no hydrogen 3.170 N/A SER 903.A N LEU 899.A O no hydrogen 2.937 N/A SER 903.A OG CYS 909.A O no hydrogen 2.686 N/A SER 903.A OG THR 912.A OG1 no hydrogen 2.740 N/A LYS 904.A N VAL 901.A O no hydrogen 3.038 N/A LYS 904.A NZ ASP 829.A OD1 no hydrogen 3.299 N/A GLY 905.A N ILE 900.A O no hydrogen 2.789 N/A ALA 906.A N SER 903.A O no hydrogen 3.339 N/A CYS 909.A SG ALA 906.A O no hydrogen 3.321 N/A THR 912.A N CYS 909.A O no hydrogen 3.448 N/A THR 912.A OG1 SER 903.A OG no hydrogen 2.740 N/A THR 912.A OG1 CYS 909.A O no hydrogen 2.708 N/A GLU 914.A N GLU 914.A OE1 no hydrogen 3.047 N/A PHE 915.A N THR 912.A OG1 no hydrogen 3.156 N/A GLU 916.A N THR 912.A O no hydrogen 3.255 N/A ARG 917.A N ARG 913.A O no hydrogen 3.146 N/A ARG 917.A NH1 ASP 833.A OD1 no hydrogen 3.490 N/A ARG 917.A NH2 ASP 833.A OD1 no hydrogen 2.765 N/A PHE 918.A N GLU 914.A O no hydrogen 2.913 N/A GLN 919.A N PHE 915.A O no hydrogen 2.851 N/A GLN 919.A NE2 PHE 915.A O no hydrogen 3.524 N/A GLU 920.A N GLU 916.A O no hydrogen 3.139 N/A MET 921.A N ARG 917.A O no hydrogen 3.076 N/A CYS 922.A N PHE 918.A O no hydrogen 3.106 N/A CYS 922.A SG PHE 918.A O no hydrogen 3.529 N/A TYR 923.A N GLN 919.A O no hydrogen 2.921 N/A TYR 923.A OH THR 990.A O no hydrogen 2.751 N/A LYS 924.A N GLU 920.A O no hydrogen 3.015 N/A ALA 925.A N MET 921.A O no hydrogen 2.858 N/A TYR 926.A N CYS 922.A O no hydrogen 2.824 N/A TYR 926.A OH THR 963.A O no hydrogen 2.713 N/A LEU 927.A N TYR 923.A O no hydrogen 3.093 N/A ALA 928.A N LYS 924.A O no hydrogen 2.994 N/A ILE 929.A N ALA 925.A O no hydrogen 3.204 N/A ARG 930.A N TYR 926.A O no hydrogen 3.041 N/A ARG 930.A NE LEU 964.A O no hydrogen 2.823 N/A ARG 930.A NH2 ALA 965.A O no hydrogen 2.960 N/A GLN 931.A N LEU 927.A O no hydrogen 2.955 N/A HIS 932.A N ILE 929.A O no hydrogen 2.888 N/A HIS 932.A ND1 ALA 928.A O no hydrogen 2.974 N/A ALA 933.A N ARG 930.A O no hydrogen 3.153 N/A LEU 935.A N HIS 932.A O no hydrogen 3.136 N/A ILE 937.A N ALA 933.A O no hydrogen 2.922 N/A ASN 938.A N ASN 934.A O no hydrogen 2.895 N/A LEU 939.A N LEU 935.A O no hydrogen 2.815 N/A PHE 940.A N PHE 936.A O no hydrogen 3.091 N/A SER 941.A N ILE 937.A O no hydrogen 2.863 N/A SER 941.A OG ILE 937.A O no hydrogen 2.798 N/A MET 942.A N ASN 938.A O no hydrogen 3.001 N/A MET 943.A N PHE 940.A O no hydrogen 3.007 N/A LEU 944.A N SER 941.A O no hydrogen 3.431 N/A GLY 945.A N TYR 587.A OH no hydrogen 3.052 N/A SER 946.A N MET 943.A O no hydrogen 3.114 N/A LEU 951.A N MET 948.A O no hydrogen 3.243 N/A GLN 952.A N ASP 956.A OD2 no hydrogen 2.808 N/A GLN 952.A NE2 HIS 423.A O no hydrogen 2.994 N/A SER 953.A N ASP 956.A OD2 no hydrogen 3.289 N/A ASP 956.A N SER 953.A O no hydrogen 3.115 N/A ALA 958.A N PHE 954.A O no hydrogen 3.152 N/A ALA 958.A N ASP 955.A O no hydrogen 3.288 N/A TYR 959.A N ASP 956.A O no hydrogen 3.433 N/A ILE 960.A N ILE 957.A O no hydrogen 3.020 N/A ARG 961.A NE ASP 484.A OD1 no hydrogen 2.820 N/A ARG 961.A NE ASP 484.A OD2 no hydrogen 3.151 N/A ARG 961.A NH1 ASP 967.A OD2 no hydrogen 3.422 N/A ARG 961.A NH2 ASP 484.A OD2 no hydrogen 2.766 N/A ARG 961.A NH2 ASP 967.A OD1 no hydrogen 2.855 N/A LYS 962.A N ALA 958.A O no hydrogen 3.228 N/A LYS 962.A N TYR 959.A O no hydrogen 3.016 N/A THR 963.A N TYR 959.A O no hydrogen 3.034 N/A THR 963.A OG1 ILE 848.A O no hydrogen 2.705 N/A THR 963.A OG1 ILE 960.A O no hydrogen 3.420 N/A LEU 964.A N ILE 960.A O no hydrogen 3.011 N/A ALA 965.A N LYS 962.A O no hydrogen 2.931 N/A LEU 966.A N ARG 961.A O no hydrogen 2.988 N/A LYS 968.A N ALA 965.A O no hydrogen 3.168 N/A THR 969.A N GLU 972.A OE2 no hydrogen 2.853 N/A GLN 971.A NE2 ASP 994.A O no hydrogen 3.342 N/A GLN 971.A NE2 TRP 995.A O no hydrogen 3.354 N/A GLU 972.A N THR 969.A OG1 no hydrogen 3.271 N/A ALA 973.A N THR 969.A O no hydrogen 2.827 N/A LEU 974.A N GLU 970.A O no hydrogen 3.072 N/A GLU 975.A N GLN 971.A O no hydrogen 3.085 N/A TYR 976.A N GLU 972.A O no hydrogen 2.769 N/A TYR 976.A OH GLU 888.A OE1 no hydrogen 2.737 N/A PHE 977.A N ALA 973.A O no hydrogen 2.933 N/A MET 978.A N LEU 974.A O no hydrogen 3.072 N/A LYS 979.A N GLU 975.A O no hydrogen 2.924 N/A LYS 979.A NZ ASP 983.A OD2 no hydrogen 3.143 N/A GLN 980.A N TYR 976.A O no hydrogen 2.937 N/A GLN 980.A NE2 TYR 976.A O no hydrogen 3.651 N/A MET 981.A N PHE 977.A O no hydrogen 2.995 N/A ASN 982.A N MET 978.A O no hydrogen 2.782 N/A ASN 982.A ND2 TRP 989.A O no hydrogen 2.817 N/A ASP 983.A N LYS 979.A O no hydrogen 2.805 N/A ALA 984.A N GLN 980.A O no hydrogen 3.079 N/A HIS 985.A N MET 981.A O no hydrogen 2.897 N/A HIS 985.A ND1 MET 981.A O no hydrogen 2.754 N/A GLY 987.A N ASN 982.A O no hydrogen 2.903 N/A TRP 989.A N ASN 982.A OD1 no hydrogen 2.885 N/A THR 990.A N GLN 919.A OE1 no hydrogen 2.778 N/A