Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dec_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE1 no hydrogen 2.831 N/A GLN 5.A N PRO 2.A O no hydrogen 2.969 N/A GLN 5.A NE2 VAL 111.A O no hydrogen 2.762 N/A SER 6.A N GLU 3.A O no hydrogen 3.019 N/A GLN 7.A N GLN 7.A OE1 no hydrogen 2.791 N/A GLN 7.A NE2 THR 409.A O no hydrogen 3.548 N/A GLN 7.A NE2 THR 409.A OG1 no hydrogen 2.900 N/A TYR 8.A N SER 6.A OG no hydrogen 3.278 N/A VAL 10.A N TYR 8.A O no hydrogen 2.755 N/A ASN 13.A ND2 LEU 156.A O no hydrogen 2.844 N/A LYS 14.A NZ ASN 159.A OD1 no hydrogen 2.891 N/A LEU 15.A N GLU 167.A O no hydrogen 2.789 N/A HIS 18.A ND1 THR 19.A O no hydrogen 2.320 N/A HIS 18.A NE2 GLU 167.A OE2 no hydrogen 2.739 N/A THR 19.A N ASP 220.A OD1 no hydrogen 3.006 N/A TYR 20.A OH GLU 141.A OE1 no hydrogen 2.600 N/A TRP 22.A NE1 TYR 209.A OH no hydrogen 2.798 N/A TYR 24.A N ILE 308.A O no hydrogen 2.867 N/A ALA 25.A N GLU 29.A OE2 no hydrogen 2.715 N/A SER 28.A N ASP 26.A OD1 no hydrogen 2.917 N/A VAL 30.A N ASP 26.A O no hydrogen 3.083 N/A GLU 31.A N ALA 27.A O no hydrogen 3.287 N/A GLY 33.A N VAL 30.A O no hydrogen 3.183 N/A THR 34.A N GLU 29.A O no hydrogen 3.462 N/A PHE 35.A N GLY 33.A O no hydrogen 3.003 N/A GLN 37.A N THR 34.A O no hydrogen 3.347 N/A SER 38.A N PHE 35.A O no hydrogen 3.230 N/A SER 38.A OG PRO 23.A O no hydrogen 2.743 N/A TYR 40.A N SER 38.A OG no hydrogen 2.975 N/A TYR 41.A N SER 38.A O no hydrogen 3.319 N/A LEU 43.A N VAL 208.A O no hydrogen 2.912 N/A ASN 44.A N SER 42.A OG no hydrogen 2.845 N/A ASN 44.A ND2 ASP 207.A OD1 no hydrogen 2.723 N/A GLY 45.A N VAL 77.A O no hydrogen 3.080 N/A TRP 47.A N ILE 75.A O no hydrogen 2.947 N/A TRP 47.A NE1 LEU 43.A O no hydrogen 2.880 N/A LYS 48.A N ARG 122.A O no hydrogen 2.733 N/A LYS 48.A NZ TRP 72.A O no hydrogen 2.696 N/A LYS 48.A NZ ALA 73.A O no hydrogen 3.564 N/A LYS 48.A NZ ASP 74.A OD1 no hydrogen 3.005 N/A PHE 49.A N ALA 73.A O no hydrogen 2.960 N/A HIS 50.A N SER 120.A O no hydrogen 2.951 N/A TRP 51.A NE1 GLU 117.A OE1 no hydrogen 3.113 N/A VAL 52.A N VAL 118.A O no hydrogen 2.896 N/A ASN 54.A N ASN 116.A O no hydrogen 2.767 N/A ASP 56.A N ASN 54.A OD1 no hydrogen 2.874 N/A THR 57.A N ASN 54.A O no hydrogen 2.761 N/A THR 57.A OG1 LYS 53.A O no hydrogen 3.434 N/A THR 57.A OG1 ASN 54.A O no hydrogen 2.784 N/A ARG 58.A NE GLU 184.A OE1 no hydrogen 3.232 N/A ARG 58.A NE GLU 184.A OE2 no hydrogen 2.798 N/A ARG 58.A NH1 PRO 55.A O no hydrogen 2.753 N/A PHE 62.A N PRO 59.A O no hydrogen 3.122 N/A LYS 64.A N ASP 61.A O no hydrogen 2.939 N/A TYR 67.A N LYS 64.A O no hydrogen 2.758 N/A TRP 72.A N THR 69.A O no hydrogen 3.322 N/A ILE 75.A N TRP 47.A O no hydrogen 2.845 N/A LYS 76.A N GLN 84.A OE1 no hydrogen 2.815 N/A VAL 77.A N GLY 45.A O no hydrogen 2.987 N/A GLY 79.A N ILE 204.A O no hydrogen 2.577 N/A ASN 80.A ND2 SER 202.A O no hydrogen 3.268 N/A ASN 80.A ND2 GLU 205.A OE2 no hydrogen 3.095 N/A TRP 81.A N SER 202.A O no hydrogen 2.950 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.991 N/A ARG 83.A N ASN 80.A O no hydrogen 3.129 N/A ARG 83.A NE GLN 344.A O no hydrogen 2.812 N/A ARG 83.A NH1 GLU 538.A OE2 no hydrogen 3.304 N/A ARG 83.A NH2 GLN 344.A O no hydrogen 3.383 N/A GLN 84.A N TRP 81.A O no hydrogen 2.895 N/A GLN 84.A NE2 LYS 76.A O no hydrogen 2.868 N/A GLN 84.A NE2 GLY 79.A O no hydrogen 3.518 N/A TYR 86.A N TRP 81.A O no hydrogen 3.226 N/A TYR 91.A OH ASP 198.A OD1 no hydrogen 2.623 N/A TYR 96.A OH TYR 193.A O no hydrogen 3.043 N/A GLU 97.A N GLU 97.A OE1 no hydrogen 2.651 N/A ASP 99.A N TYR 96.A O no hydrogen 2.934 N/A ASP 100.A N PHE 98.A O no hydrogen 2.783 N/A ASN 103.A N LYS 101.A O no hydrogen 3.249 N/A ASN 103.A ND2 GLU 115.A OE2 no hydrogen 2.849 N/A LYS 106.A N ASP 99.A OD1 no hydrogen 2.705 N/A ASN 107.A N TYR 193.A OH no hydrogen 3.086 N/A LEU 110.A N ASN 107.A O no hydrogen 2.868 N/A VAL 111.A N GLN 5.A OE1 no hydrogen 2.817 N/A TYR 113.A OH ASP 56.A OD1 no hydrogen 2.699 N/A ASN 116.A N TYR 113.A O no hydrogen 3.006 N/A ASN 116.A ND2 TRP 188.A O no hydrogen 2.821 N/A GLU 117.A N ASN 116.A OD1 no hydrogen 2.600 N/A VAL 118.A N VAL 52.A O no hydrogen 2.864 N/A GLY 119.A N VAL 185.A O no hydrogen 2.922 N/A SER 120.A N HIS 50.A O no hydrogen 2.639 N/A TYR 121.A N LEU 183.A O no hydrogen 2.945 N/A ARG 122.A N LYS 48.A O no hydrogen 2.961 N/A ARG 122.A NH1 PHE 62.A O no hydrogen 2.739 N/A ARG 122.A NH1 LYS 64.A O no hydrogen 2.806 N/A ARG 122.A NH1 TYR 67.A O no hydrogen 3.130 N/A ARG 122.A NH2 TYR 67.A O no hydrogen 2.958 N/A ARG 123.A N ILE 181.A O no hydrogen 3.295 N/A ARG 123.A NE THR 124.A O no hydrogen 2.917 N/A ARG 123.A NH1 LEU 43.A O no hydrogen 2.903 N/A ARG 123.A NH2 THR 124.A O no hydrogen 3.149 N/A PHE 125.A N ASN 179.A O no hydrogen 2.791 N/A TRP 131.A N PRO 128.A O no hydrogen 3.236 N/A TRP 131.A NE1 PRO 39.A O no hydrogen 2.778 N/A ARG 134.A N TRP 131.A O no hydrogen 3.088 N/A ARG 134.A NE SER 212.A OG no hydrogen 2.566 N/A ARG 134.A NH2 SER 212.A O no hydrogen 2.733 N/A ARG 135.A N THR 213.A O no hydrogen 2.702 N/A ARG 135.A NH1 THR 213.A OG1 no hydrogen 3.052 N/A VAL 136.A N THR 171.A OG1 no hydrogen 2.993 N/A VAL 137.A N TYR 211.A O no hydrogen 2.849 N/A LEU 138.A N TRP 168.A O no hydrogen 2.929 N/A CYS 139.A N TYR 209.A O no hydrogen 2.779 N/A CYS 139.A SG GLU 167.A OE1 no hydrogen 3.363 N/A CYS 140.A N ALA 166.A O no hydrogen 3.146 N/A GLU 141.A N ASP 207.A O no hydrogen 2.739 N/A ILE 144.A N GLY 203.A O no hydrogen 2.975 N/A SER 145.A N TYR 186.A O no hydrogen 2.830 N/A SER 145.A OG SER 189.A OG no hydrogen 3.158 N/A PHE 146.A N TYR 186.A O no hydrogen 3.392 N/A TYR 147.A N ASN 159.A O no hydrogen 3.366 N/A TYR 148.A N GLU 184.A O no hydrogen 3.176 N/A TYR 148.A OH GLU 3.A OE1 no hydrogen 2.556 N/A VAL 149.A N GLY 157.A O no hydrogen 3.121 N/A TRP 150.A N ALA 182.A O no hydrogen 2.700 N/A VAL 151.A N GLU 154.A O no hydrogen 2.971 N/A ASN 152.A N THR 180.A O no hydrogen 2.993 N/A ASN 152.A ND2 LYS 173.A O no hydrogen 2.560 N/A ASN 152.A ND2 ASN 179.A OD1 no hydrogen 2.598 N/A GLU 154.A N VAL 151.A O no hydrogen 2.953 N/A LEU 156.A N VAL 149.A O no hydrogen 2.932 N/A ASN 159.A N TYR 147.A O no hydrogen 3.145 N/A ASN 159.A ND2 GLY 161.A O no hydrogen 3.322 N/A GLN 160.A N VAL 10.A O no hydrogen 3.066 N/A GLN 160.A NE2 SER 6.A O no hydrogen 2.916 N/A GLN 160.A NE2 ALA 9.A O no hydrogen 2.842 N/A SER 162.A N GLU 195.A OE2 no hydrogen 2.919 N/A SER 162.A OG GLU 195.A OE1 no hydrogen 2.340 N/A LYS 163.A NZ SER 162.A OG no hydrogen 2.743 N/A LYS 163.A NZ GLU 205.A OE1 no hydrogen 3.346 N/A ALA 166.A N CYS 140.A O no hydrogen 2.980 N/A TRP 168.A N LEU 138.A O no hydrogen 3.048 N/A TRP 168.A NE1 LEU 12.A O no hydrogen 3.069 N/A ILE 170.A N VAL 136.A O no hydrogen 3.062 N/A THR 171.A N ASP 169.A OD1 no hydrogen 2.935 N/A THR 171.A OG1 VAL 136.A O no hydrogen 3.457 N/A THR 171.A OG1 ASP 169.A OD1 no hydrogen 2.510 N/A LYS 173.A N ILE 170.A O no hydrogen 2.801 N/A LYS 173.A NZ ASP 172.A OD2 no hydrogen 3.151 N/A LEU 174.A N THR 171.A O no hydrogen 3.488 N/A THR 175.A N ASN 179.A OD1 no hydrogen 3.002 N/A THR 175.A OG1 ASP 176.A O no hydrogen 2.720 N/A ASN 179.A N PHE 125.A O no hydrogen 2.741 N/A ASN 179.A ND2 THR 175.A O no hydrogen 3.311 N/A ASN 179.A ND2 GLY 177.A O no hydrogen 3.246 N/A THR 180.A N ASN 152.A OD1 no hydrogen 2.944 N/A ILE 181.A N ARG 123.A O no hydrogen 2.982 N/A ALA 182.A N TRP 150.A O no hydrogen 2.911 N/A LEU 183.A N TYR 121.A O no hydrogen 3.100 N/A GLU 184.A N TYR 148.A O no hydrogen 2.905 N/A VAL 185.A N GLY 119.A O no hydrogen 3.016 N/A TYR 186.A N PHE 146.A O no hydrogen 2.748 N/A TYR 186.A OH GLU 184.A OE1 no hydrogen 2.694 N/A ARG 187.A N GLU 117.A O no hydrogen 2.999 N/A ARG 187.A NH1 THR 88.A O no hydrogen 3.074 N/A ARG 187.A NH1 GLU 117.A OE2 no hydrogen 2.950 N/A ARG 187.A NH2 THR 88.A O no hydrogen 2.782 N/A ARG 187.A NH2 ARG 200.A O no hydrogen 3.023 N/A TRP 188.A N ASN 116.A OD1 no hydrogen 3.184 N/A TRP 188.A NE1 GLU 97.A OE2 no hydrogen 2.803 N/A SER 189.A OG SER 145.A OG no hydrogen 3.158 N/A SER 190.A N TRP 4.A O no hydrogen 2.878 N/A SER 190.A OG TRP 4.A O no hydrogen 3.348 N/A SER 190.A OG PRO 109.A O no hydrogen 2.772 N/A GLY 191.A N SER 189.A OG no hydrogen 3.254 N/A ALA 192.A N SER 189.A O no hydrogen 2.867 N/A TYR 193.A N SER 190.A O no hydrogen 3.214 N/A TYR 193.A OH LEU 110.A O no hydrogen 2.355 N/A LEU 194.A N GLY 191.A O no hydrogen 2.924 N/A GLU 195.A N ALA 192.A O no hydrogen 2.816 N/A CYS 196.A N GLU 396.A O no hydrogen 2.961 N/A CYS 196.A SG THR 95.A O no hydrogen 3.282 N/A GLN 197.A N GLN 197.A OE1 no hydrogen 2.895 N/A GLN 197.A NE2 HIS 371.A O no hydrogen 2.949 N/A GLN 197.A NE2 ASN 394.A OD1 no hydrogen 2.772 N/A TRP 199.A NE1 GLN 534.A O no hydrogen 2.989 N/A ARG 200.A N ILE 90.A O no hydrogen 2.670 N/A ARG 200.A NH1 THR 95.A O no hydrogen 3.069 N/A ARG 200.A NH1 GLU 97.A OE1 no hydrogen 3.049 N/A ARG 200.A NH2 ASN 93.A O no hydrogen 3.369 N/A ARG 200.A NH2 GLN 197.A O no hydrogen 2.898 N/A SER 202.A N GLU 82.A OE1 no hydrogen 2.654 N/A SER 202.A OG GLU 82.A OE2 no hydrogen 2.667 N/A GLY 203.A N ILE 144.A O no hydrogen 2.811 N/A ILE 204.A N TYR 121.A OH no hydrogen 3.342 N/A GLU 205.A N GLY 142.A O no hydrogen 2.981 N/A ARG 206.A N GLY 142.A O no hydrogen 3.167 N/A ARG 206.A NH2 PRO 373.A O no hydrogen 3.130 N/A VAL 208.A N ASN 44.A OD1 no hydrogen 2.999 N/A TYR 209.A N CYS 139.A O no hydrogen 2.725 N/A TYR 209.A OH GLU 141.A OE2 no hydrogen 2.950 N/A TYR 211.A N VAL 137.A O no hydrogen 2.984 N/A TYR 211.A OH GLU 167.A OE1 no hydrogen 3.145 N/A TYR 211.A OH GLU 167.A OE2 no hydrogen 3.018 N/A SER 212.A N TYR 40.A O no hydrogen 2.767 N/A SER 212.A OG ARG 135.A O no hydrogen 3.482 N/A THR 213.A N ARG 135.A O no hydrogen 2.946 N/A THR 213.A OG1 PRO 214.A O no hydrogen 3.164 N/A GLN 216.A NE2 SER 248.A OG no hydrogen 3.252 N/A TYR 217.A N GLY 244.A O no hydrogen 2.888 N/A ILE 218.A N GLU 307.A OE1 no hydrogen 3.043 N/A ALA 219.A N ALA 242.A O no hydrogen 2.739 N/A ASP 220.A N ALA 242.A O no hydrogen 3.301 N/A TYR 221.A N ASP 220.A OD1 no hydrogen 2.787 N/A LYS 222.A N GLU 240.A O no hydrogen 2.814 N/A LYS 222.A NZ TYR 421.A OH no hydrogen 3.230 N/A LYS 222.A NZ VAL 455.A O no hydrogen 3.117 N/A VAL 223.A N ASN 426.A OD1 no hydrogen 2.964 N/A THR 224.A N GLU 238.A O no hydrogen 2.806 N/A SER 225.A OG GLY 314.A O no hydrogen 2.999 N/A LEU 226.A N ILE 236.A O no hydrogen 2.791 N/A GLU 228.A N GLU 234.A O no hydrogen 3.018 N/A TYR 232.A N GLU 228.A O no hydrogen 2.918 N/A TYR 232.A OH GLU 319.A OE2 no hydrogen 2.521 N/A LYS 233.A N GLU 228.A OE2 no hydrogen 2.447 N/A GLU 234.A N GLU 228.A OE1 no hydrogen 2.790 N/A GLU 234.A N GLU 228.A OE2 no hydrogen 3.330 N/A GLY 235.A N LEU 278.A O no hydrogen 2.474 N/A ILE 236.A N LEU 226.A O no hydrogen 2.967 N/A PHE 237.A N GLN 276.A O no hydrogen 2.790 N/A GLU 238.A N THR 224.A O no hydrogen 2.856 N/A GLU 240.A N LYS 222.A O no hydrogen 3.102 N/A VAL 241.A N ILE 271.A O no hydrogen 2.885 N/A ALA 242.A N ASP 220.A O no hydrogen 2.818 N/A GLY 244.A N TYR 217.A O no hydrogen 2.697 N/A SER 248.A OG GLN 216.A OE1 no hydrogen 3.149 N/A SER 249.A N LYS 299.A O no hydrogen 3.291 N/A ILE 250.A N ARG 267.A O no hydrogen 3.178 N/A ALA 251.A N GLU 297.A O no hydrogen 2.904 N/A TYR 252.A N GLY 265.A O no hydrogen 3.239 N/A THR 253.A N LEU 295.A O no hydrogen 2.904 N/A LEU 254.A N LEU 263.A O no hydrogen 3.007 N/A LYS 255.A N THR 293.A O no hydrogen 2.867 N/A LYS 255.A NZ ASP 259.A O no hydrogen 2.720 N/A LYS 255.A NZ THR 261.A OG1 no hydrogen 2.706 N/A ASP 256.A N LYS 260.A O no hydrogen 2.967 N/A SER 258.A N ASP 256.A OD1 no hydrogen 2.522 N/A LYS 260.A N ASP 256.A OD1 no hydrogen 3.340 N/A VAL 262.A N LEU 254.A O no hydrogen 2.914 N/A LEU 263.A N LEU 254.A O no hydrogen 3.502 N/A GLY 265.A N TYR 252.A O no hydrogen 3.135 N/A ARG 267.A N ILE 250.A O no hydrogen 3.067 N/A ILE 271.A N VAL 241.A O no hydrogen 2.977 N/A PHE 273.A N LEU 239.A O no hydrogen 3.038 N/A GLN 276.A N PHE 237.A O no hydrogen 3.013 N/A ARG 277.A NE GLU 275.A OE2 no hydrogen 3.468 N/A ARG 277.A NH1 GLU 234.A OE1 no hydrogen 3.463 N/A LEU 278.A N GLY 235.A O no hydrogen 2.748 N/A ARG 282.A N TYR 292.A OH no hydrogen 3.085 N/A ARG 282.A NE GLU 290.A OE1 no hydrogen 2.623 N/A ARG 282.A NH1 LEU 291.A O no hydrogen 2.798 N/A ARG 282.A NH2 GLU 290.A OE1 no hydrogen 2.879 N/A ARG 282.A NH2 LEU 291.A O no hydrogen 2.925 N/A TRP 284.A N PHE 315.A O no hydrogen 2.680 N/A TRP 284.A NE1 ASP 383.A O no hydrogen 3.098 N/A ASN 285.A N HIS 288.A O no hydrogen 3.451 N/A ALA 286.A N TYR 388.A OH no hydrogen 3.368 N/A GLU 287.A N ASN 285.A OD1 no hydrogen 2.816 N/A HIS 288.A N ASN 285.A OD1 no hydrogen 2.836 N/A HIS 288.A NE2 GLU 615.A OE1 no hydrogen 2.995 N/A GLU 290.A N HIS 288.A O no hydrogen 2.576 N/A TYR 292.A N VAL 313.A O no hydrogen 2.730 N/A THR 293.A N LYS 255.A O no hydrogen 2.914 N/A LEU 294.A N THR 311.A O no hydrogen 2.880 N/A LEU 295.A N THR 253.A O no hydrogen 2.873 N/A LEU 296.A N THR 309.A O no hydrogen 2.718 N/A GLU 297.A N ALA 251.A O no hydrogen 2.814 N/A LEU 298.A N GLU 307.A O no hydrogen 3.103 N/A LYS 299.A N SER 249.A O no hydrogen 2.797 N/A ASP 300.A N LYS 304.A O no hydrogen 2.614 N/A GLY 303.A N ASP 300.A O no hydrogen 2.797 N/A THR 306.A N LEU 298.A O no hydrogen 2.965 N/A THR 309.A N LEU 296.A O no hydrogen 2.922 N/A THR 309.A OG1 TRP 22.A O no hydrogen 2.660 N/A THR 311.A N LEU 294.A O no hydrogen 3.191 N/A THR 311.A OG1 LYS 312.A O no hydrogen 3.414 N/A LYS 312.A NZ GLU 31.A O no hydrogen 3.449 N/A LYS 312.A NZ THR 293.A OG1 no hydrogen 2.752 N/A VAL 313.A N TYR 292.A O no hydrogen 2.645 N/A ARG 316.A N SER 225.A O no hydrogen 3.262 N/A ARG 316.A NE PRO 428.A O no hydrogen 3.068 N/A ARG 316.A NH2 PRO 428.A O no hydrogen 3.302 N/A THR 317.A N ASN 328.A OD1 no hydrogen 2.802 N/A SER 318.A OG VAL 431.A O no hydrogen 2.976 N/A GLU 319.A N CYS 326.A O no hydrogen 3.035 N/A LYS 321.A N ARG 324.A O no hydrogen 2.782 N/A ARG 324.A N LYS 321.A O no hydrogen 2.811 N/A ARG 324.A NE PRO 522.A O no hydrogen 2.667 N/A PHE 325.A N GLN 524.A OE1 no hydrogen 2.934 N/A CYS 326.A N GLU 319.A O no hydrogen 2.777 N/A CYS 326.A SG ARG 324.A O no hydrogen 3.224 N/A ILE 327.A N VAL 330.A O no hydrogen 2.889 N/A ASN 328.A N THR 317.A O no hydrogen 3.092 N/A ASN 328.A ND2 TRP 284.A O no hydrogen 2.986 N/A VAL 330.A N ILE 327.A O no hydrogen 2.968 N/A VAL 332.A N PHE 325.A O no hydrogen 3.269 N/A VAL 334.A N GLN 524.A O no hydrogen 2.701 N/A LYS 335.A N ASN 365.A OD1 no hydrogen 2.845 N/A LYS 335.A NZ TYR 587.A O no hydrogen 3.183 N/A LYS 335.A NZ GLN 588.A O no hydrogen 3.331 N/A LYS 335.A NZ ASN 589.A OD1 no hydrogen 2.862 N/A GLY 336.A N GLY 526.A O no hydrogen 3.044 N/A VAL 337.A N THR 366.A O no hydrogen 3.033 N/A ASN 338.A N ILE 528.A O no hydrogen 2.797 N/A ASN 338.A ND2 CYS 500.A O no hydrogen 3.306 N/A ASN 338.A ND2 ILE 528.A O no hydrogen 3.254 N/A ARG 339.A N ARG 368.A O no hydrogen 2.815 N/A ARG 339.A NE ASP 356.A OD2 no hydrogen 2.783 N/A ARG 339.A NH2 ASP 356.A OD2 no hydrogen 3.380 N/A HIS 340.A ND1 TYR 372.A OH no hydrogen 2.985 N/A GLU 341.A N TYR 372.A OH no hydrogen 2.955 N/A HIS 342.A NE2 SER 535.A O no hydrogen 2.805 N/A SER 343.A N GLY 346.A O no hydrogen 2.843 N/A SER 343.A OG THR 348.A O no hydrogen 2.578 N/A GLN 344.A NE2 SER 535.A O no hydrogen 3.220 N/A LEU 345.A N SER 343.A OG no hydrogen 3.312 N/A GLY 346.A N SER 343.A O no hydrogen 2.950 N/A ARG 347.A N ASN 80.A OD1 no hydrogen 3.005 N/A ARG 347.A NE GLU 341.A O no hydrogen 3.064 N/A ARG 347.A NH1 TRP 199.A O no hydrogen 3.547 N/A ARG 347.A NH2 GLU 341.A O no hydrogen 2.998 N/A THR 348.A OG1 GLU 205.A O no hydrogen 2.736 N/A LYS 351.A NZ GLU 36.A OE1 no hydrogen 2.918 N/A LEU 353.A N SER 350.A OG no hydrogen 3.297 N/A GLN 355.A N GLU 352.A O no hydrogen 2.829 N/A ASP 356.A N LEU 353.A O no hydrogen 2.976 N/A ARG 358.A N GLU 354.A O no hydrogen 2.856 N/A LEU 359.A N GLN 355.A O no hydrogen 3.011 N/A LYS 360.A NZ ALA 286.A O no hydrogen 2.923 N/A LYS 360.A NZ TYR 385.A O no hydrogen 3.264 N/A LYS 360.A NZ GLY 386.A O no hydrogen 2.903 N/A GLN 361.A N ARG 358.A O no hydrogen 3.050 N/A GLN 361.A NE2 LEU 675.A O no hydrogen 2.899 N/A HIS 362.A ND1 LEU 359.A O no hydrogen 2.720 N/A ASN 363.A N LYS 360.A O no hydrogen 3.171 N/A ASN 363.A ND2 LYS 584.A O no hydrogen 3.152 N/A ASN 363.A ND2 ILE 682.A O no hydrogen 3.127 N/A ASN 365.A N LYS 335.A O no hydrogen 2.664 N/A ASN 365.A ND2 LEU 333.A O no hydrogen 3.272 N/A THR 366.A N LYS 335.A O no hydrogen 3.159 N/A VAL 367.A N TYR 388.A O no hydrogen 2.781 N/A ARG 368.A N VAL 337.A O no hydrogen 2.784 N/A ARG 368.A NH1 ASN 338.A OD1 no hydrogen 2.643 N/A ARG 368.A NH1 GLU 501.A OE2 no hydrogen 2.878 N/A ARG 368.A NH2 GLU 392.A OE2 no hydrogen 2.711 N/A ARG 368.A NH2 ASN 437.A OD1 no hydrogen 3.058 N/A ASN 369.A N ILE 390.A O no hydrogen 2.876 N/A ASN 369.A ND2 ASP 391.A OD1 no hydrogen 3.162 N/A SER 370.A N ARG 339.A O no hydrogen 3.041 N/A HIS 371.A ND1 GLU 392.A OE1 no hydrogen 2.954 N/A TYR 372.A OH HIS 340.A ND1 no hydrogen 2.985 N/A ALA 374.A N TYR 379.A OH no hydrogen 2.924 N/A HIS 375.A N GLU 341.A OE2 no hydrogen 2.762 N/A HIS 375.A NE2 ASP 207.A OD2 no hydrogen 3.037 N/A TYR 377.A N HIS 375.A ND1 no hydrogen 2.943 N/A TYR 377.A OH GLU 354.A OE2 no hydrogen 2.493 N/A TRP 378.A N HIS 375.A O no hydrogen 2.833 N/A TYR 379.A N PRO 376.A O no hydrogen 3.208 N/A TYR 379.A OH ASP 391.A OD1 no hydrogen 2.742 N/A TYR 379.A OH ASP 391.A OD2 no hydrogen 3.259 N/A LEU 381.A N TYR 377.A O no hydrogen 3.011 N/A CYS 382.A N TRP 378.A O no hydrogen 3.082 N/A CYS 382.A SG TRP 378.A O no hydrogen 3.315 N/A ASP 383.A N TYR 379.A O no hydrogen 3.025 N/A ARG 384.A N GLN 380.A O no hydrogen 3.162 N/A TYR 385.A N LEU 381.A O no hydrogen 2.918 N/A GLY 386.A N CYS 382.A O no hydrogen 2.903 N/A LEU 387.A N CYS 382.A O no hydrogen 3.276 N/A TYR 388.A N ASN 365.A O no hydrogen 2.877 N/A VAL 389.A N SER 429.A O no hydrogen 2.677 N/A ILE 390.A N VAL 367.A O no hydrogen 2.872 N/A ASP 391.A N ILE 432.A O no hydrogen 3.119 N/A GLU 392.A N ASP 391.A OD1 no hydrogen 3.014 N/A ALA 393.A N SER 434.A O no hydrogen 3.201 N/A ILE 395.A N ALA 393.A O no hydrogen 2.872 N/A GLU 396.A N LEU 194.A O no hydrogen 2.813 N/A ALA 405.A N SER 403.A OG no hydrogen 3.220 N/A LYS 406.A N SER 403.A O no hydrogen 3.115 N/A LYS 406.A NZ GLY 400.A O no hydrogen 2.451 N/A THR 409.A N ASP 407.A OD1 no hydrogen 3.091 N/A THR 409.A OG1 ASP 407.A OD1 no hydrogen 2.672 N/A TRP 410.A N ASP 407.A O no hydrogen 2.957 N/A LEU 411.A N SER 408.A O no hydrogen 3.267 N/A HIS 414.A N TRP 410.A O no hydrogen 3.093 N/A HIS 414.A ND1 TRP 410.A O no hydrogen 2.783 N/A ILE 415.A N LEU 411.A O no hydrogen 2.845 N/A ASP 416.A N PRO 412.A O no hydrogen 2.942 N/A ARG 417.A N ALA 413.A O no hydrogen 2.797 N/A ARG 417.A NH1 GLU 195.A OE2 no hydrogen 3.087 N/A ARG 417.A NH1 ASN 394.A O no hydrogen 2.715 N/A ARG 417.A NH2 GLU 195.A OE2 no hydrogen 3.146 N/A THR 418.A N HIS 414.A O no hydrogen 3.059 N/A THR 418.A OG1 HIS 414.A O no hydrogen 2.844 N/A ARG 419.A N ILE 415.A O no hydrogen 2.896 N/A ARG 420.A N ASP 416.A O no hydrogen 3.221 N/A ARG 420.A NH1 GLN 160.A O no hydrogen 2.850 N/A ARG 420.A NH1 ASP 416.A OD2 no hydrogen 2.949 N/A ARG 420.A NH2 THR 164.A O no hydrogen 3.420 N/A GLU 422.A N ARG 419.A O no hydrogen 2.798 N/A ARG 423.A N ARG 420.A O no hydrogen 3.371 N/A ARG 423.A NH1 ALA 374.A O no hydrogen 3.117 N/A ARG 423.A NH2 ALA 374.A O no hydrogen 2.814 N/A SER 424.A N TYR 421.A O no hydrogen 3.226 N/A LYS 425.A N TYR 421.A O no hydrogen 2.879 N/A LYS 425.A NZ ASP 220.A OD1 no hydrogen 2.824 N/A LYS 425.A NZ ASP 220.A OD2 no hydrogen 3.367 N/A LYS 425.A NZ TYR 221.A O no hydrogen 3.350 N/A ASN 426.A ND2 TYR 221.A O no hydrogen 2.957 N/A HIS 427.A N SER 424.A O no hydrogen 3.023 N/A HIS 427.A ND1 ASP 383.A OD2 no hydrogen 2.849 N/A SER 429.A N ASP 383.A OD1 no hydrogen 2.747 N/A SER 429.A OG TYR 379.A O no hydrogen 3.567 N/A SER 429.A OG ASP 383.A OD1 no hydrogen 3.007 N/A VAL 430.A N HIS 427.A O no hydrogen 3.430 N/A VAL 431.A N VAL 389.A O no hydrogen 2.928 N/A TRP 433.A N PRO 460.A O no hydrogen 3.072 N/A TRP 433.A NE1 GLU 456.A OE1 no hydrogen 2.693 N/A SER 434.A N ASP 391.A O no hydrogen 2.815 N/A SER 434.A OG GLU 392.A OE2 no hydrogen 2.568 N/A LEU 435.A N GLN 462.A O no hydrogen 3.005 N/A ASN 437.A N ILE 395.A O no hydrogen 2.938 N/A ASN 437.A ND2 GLU 396.A OE2 no hydrogen 3.048 N/A ASN 441.A ND2 ASN 469.A OD1 no hydrogen 3.586 N/A ASN 441.A ND2 ASN 471.A OD1 no hydrogen 3.424 N/A ASN 444.A N ALA 405.A O no hydrogen 3.002 N/A ASN 444.A ND2 LEU 404.A O no hydrogen 2.785 N/A ASN 444.A ND2 ASP 407.A O no hydrogen 2.945 N/A GLU 446.A N GLY 442.A O no hydrogen 3.018 N/A ARG 447.A N ILE 443.A O no hydrogen 2.854 N/A THR 448.A N ASN 444.A O no hydrogen 2.868 N/A THR 448.A OG1 ASN 444.A O no hydrogen 3.101 N/A TYR 449.A N PHE 445.A O no hydrogen 2.833 N/A TYR 449.A OH ASP 473.A OD1 no hydrogen 2.600 N/A ASP 450.A N GLU 446.A O no hydrogen 2.797 N/A TRP 451.A N ARG 447.A O no hydrogen 2.819 N/A LEU 452.A N THR 448.A O no hydrogen 2.902 N/A LYS 453.A N TYR 449.A O no hydrogen 2.941 N/A LYS 453.A NZ ASP 473.A OD2 no hydrogen 2.525 N/A SER 454.A N ASP 450.A O no hydrogen 3.067 N/A SER 454.A N TRP 451.A O no hydrogen 2.953 N/A SER 454.A OG TRP 451.A O no hydrogen 2.662 N/A VAL 455.A N TRP 451.A O no hydrogen 3.338 N/A VAL 455.A N LEU 452.A O no hydrogen 3.244 N/A GLU 456.A N LEU 452.A O no hydrogen 2.818 N/A LYS 457.A NZ LYS 453.A O no hydrogen 2.801 N/A ASN 458.A N GLU 456.A OE2 no hydrogen 3.013 N/A ARG 459.A NE VAL 430.A O no hydrogen 2.627 N/A ARG 459.A NH1 LYS 425.A O no hydrogen 3.330 N/A ARG 459.A NH1 GLU 456.A OE1 no hydrogen 2.887 N/A ARG 459.A NH2 LYS 425.A O no hydrogen 3.232 N/A ARG 459.A NH2 HIS 427.A O no hydrogen 2.608 N/A VAL 461.A N ASP 473.A OD2 no hydrogen 3.265 N/A GLN 462.A N TRP 433.A O no hydrogen 2.736 N/A TYR 463.A N THR 472.A OG1 no hydrogen 2.802 N/A TYR 463.A OH GLY 440.A O no hydrogen 2.523 N/A ARG 465.A NE GLU 464.A OE1 no hydrogen 2.920 N/A ARG 465.A NH2 GLU 464.A OE2 no hydrogen 3.285 N/A ARG 465.A NH2 GLU 467.A OE2 no hydrogen 3.511 N/A ALA 466.A N TYR 463.A O no hydrogen 3.113 N/A ASN 469.A N ALA 466.A O no hydrogen 3.196 N/A TYR 470.A OH ASP 450.A OD1 no hydrogen 2.570 N/A TYR 470.A OH ASP 450.A OD2 no hydrogen 3.202 N/A ASN 471.A ND2 ASN 441.A OD1 no hydrogen 3.087 N/A THR 472.A N TYR 470.A O no hydrogen 2.655 N/A THR 472.A OG1 TYR 463.A O no hydrogen 3.360 N/A THR 472.A OG1 ILE 474.A O no hydrogen 2.861 N/A ASP 473.A N VAL 461.A O no hydrogen 2.791 N/A TYR 475.A N PRO 496.A O no hydrogen 2.945 N/A CYS 476.A SG ILE 498.A O no hydrogen 3.457 N/A ARG 477.A NH1 GLU 464.A OE2 no hydrogen 3.059 N/A TYR 478.A N GLU 501.A O no hydrogen 2.768 N/A TYR 478.A OH GLU 501.A OE1 no hydrogen 3.052 N/A VAL 483.A N SER 480.A OG no hydrogen 3.273 N/A ILE 484.A N SER 480.A O no hydrogen 3.019 N/A ARG 485.A N VAL 481.A O no hydrogen 3.031 N/A ASN 486.A N ASP 482.A O no hydrogen 2.756 N/A TYR 487.A N VAL 483.A O no hydrogen 3.177 N/A TYR 487.A N ILE 484.A O no hydrogen 3.135 N/A TYR 487.A OH ARG 495.A O no hydrogen 2.559 N/A VAL 488.A N ILE 484.A O no hydrogen 3.173 N/A ARG 490.A N TYR 487.A O no hydrogen 3.189 N/A ARG 490.A NE ASP 492.A OD1 no hydrogen 3.184 N/A ARG 490.A NH1 GLU 468.A OE1 no hydrogen 3.444 N/A ARG 490.A NH1 ASP 492.A OD1 no hydrogen 3.230 N/A ARG 490.A NH1 ASP 492.A OD2 no hydrogen 2.874 N/A ARG 490.A NH2 GLU 468.A OE1 no hydrogen 3.196 N/A ARG 490.A NH2 GLU 468.A OE2 no hydrogen 2.680 N/A ARG 495.A NH1 ASN 469.A O no hydrogen 2.872 N/A ARG 495.A NH1 THR 472.A O no hydrogen 2.932 N/A ARG 495.A NH2 GLU 468.A O no hydrogen 2.697 N/A ILE 498.A N TYR 475.A O no hydrogen 2.855 N/A LEU 499.A N GLY 525.A O no hydrogen 2.757 N/A CYS 500.A N CYS 476.A O no hydrogen 3.202 N/A TYR 502.A N CYS 527.A O no hydrogen 3.025 N/A TYR 502.A OH TYR 587.A OH no hydrogen 2.914 N/A HIS 504.A ND1 THR 943.A OG1 no hydrogen 2.811 N/A ALA 505.A N TRP 529.A O no hydrogen 2.647 N/A ASN 507.A N GLN 872.A OE1 no hydrogen 2.928 N/A ASN 507.A ND2 TYR 846.A OH no hydrogen 3.079 N/A ASN 507.A ND2 SER 873.A O no hydrogen 2.940 N/A SER 508.A OG HIS 504.A O no hydrogen 2.789 N/A SER 508.A OG GLY 940.A O no hydrogen 3.454 N/A GLY 510.A N GLY 940.A O no hydrogen 2.992 N/A GLY 511.A N ASP 848.A O no hydrogen 2.873 N/A GLU 513.A N GLY 511.A O no hydrogen 3.238 N/A TYR 514.A OH ARG 479.A O no hydrogen 2.547 N/A TRP 515.A NE1 TYR 502.A OH no hydrogen 2.810 N/A GLU 516.A N LYS 512.A O no hydrogen 2.869 N/A VAL 517.A N GLU 513.A O no hydrogen 3.379 N/A VAL 517.A N TYR 514.A O no hydrogen 3.067 N/A PHE 518.A N TYR 514.A O no hydrogen 3.048 N/A GLU 519.A N TRP 515.A O no hydrogen 2.815 N/A ASN 520.A N VAL 517.A O no hydrogen 3.173 N/A ASN 520.A ND2 GLU 516.A O no hydrogen 2.775 N/A GLU 521.A N VAL 517.A O no hydrogen 2.750 N/A GLN 524.A N PHE 497.A O no hydrogen 3.042 N/A GLN 524.A NE2 PHE 325.A O no hydrogen 3.022 N/A GLN 524.A NE2 VAL 332.A O no hydrogen 3.322 N/A GLY 526.A N VAL 334.A O no hydrogen 3.014 N/A CYS 527.A N LEU 499.A O no hydrogen 2.856 N/A ILE 528.A N GLY 336.A O no hydrogen 2.819 N/A TRP 529.A N TYR 502.A O no hydrogen 3.095 N/A TRP 529.A NE1 ASN 567.A OD1 no hydrogen 2.970 N/A ASP 530.A N ASN 567.A O no hydrogen 2.735 N/A TRP 531.A N ASN 338.A O no hydrogen 2.816 N/A TRP 531.A NE1 ASP 356.A OD1 no hydrogen 2.823 N/A ASP 533.A N VAL 570.A O no hydrogen 3.023 N/A GLN 534.A NE2 ASP 198.A O no hydrogen 3.541 N/A SER 535.A OG THR 548.A O no hydrogen 2.516 N/A ARG 537.A N GLN 344.A OE1 no hydrogen 2.791 N/A GLU 538.A N TYR 546.A O no hydrogen 2.985 N/A ASP 540.A N LYS 544.A O no hydrogen 2.897 N/A ASP 542.A N ASP 540.A OD1 no hydrogen 2.777 N/A GLY 543.A N ASP 540.A O no hydrogen 3.106 N/A LYS 544.A N ASP 540.A OD1 no hydrogen 2.971 N/A LYS 544.A NZ ASN 920.A O no hydrogen 3.327 N/A LYS 544.A NZ LEU 922.A O no hydrogen 3.171 N/A TYR 546.A N GLU 538.A O no hydrogen 3.078 N/A THR 548.A N PHE 536.A O no hydrogen 2.887 N/A THR 548.A OG1 PHE 536.A O no hydrogen 3.061 N/A THR 548.A OG1 TYR 553.A OH no hydrogen 2.949 N/A TYR 549.A N ASP 552.A OD2 no hydrogen 3.009 N/A TYR 549.A OH LEU 917.A O no hydrogen 2.596 N/A GLY 550.A N GLY 562.A O no hydrogen 2.984 N/A ASP 552.A N TYR 549.A O no hydrogen 3.203 N/A TYR 553.A OH GLU 538.A OE2 no hydrogen 2.513 N/A TYR 553.A OH THR 548.A OG1 no hydrogen 2.949 N/A VAL 558.A N PRO 555.A O no hydrogen 3.407 N/A PHE 561.A N TYR 91.A O no hydrogen 3.019 N/A GLY 562.A N SER 560.A OG no hydrogen 3.204 N/A ASN 563.A ND2 ASP 742.A OD1 no hydrogen 2.930 N/A PHE 564.A N PHE 561.A O no hydrogen 3.394 N/A CYS 565.A SG GLN 534.A O no hydrogen 3.743 N/A CYS 565.A SG GLY 562.A O no hydrogen 3.978 N/A CYS 566.A N ASN 563.A O no hydrogen 3.027 N/A CYS 566.A SG GLN 534.A O no hydrogen 4.020 N/A ASN 567.A ND2 PHE 564.A O no hydrogen 3.151 N/A GLY 568.A N ASP 533.A OD1 no hydrogen 2.662 N/A LEU 569.A N ASP 530.A O no hydrogen 2.955 N/A VAL 570.A N TRP 531.A O no hydrogen 2.902 N/A ASN 571.A N GLU 575.A O no hydrogen 2.693 N/A ASN 571.A ND2 GLU 575.A OE1 no hydrogen 2.593 N/A VAL 573.A N ASN 571.A OD1 no hydrogen 3.152 N/A ARG 574.A N ASN 571.A O no hydrogen 2.908 N/A ARG 574.A NE ASP 356.A OD1 no hydrogen 2.771 N/A ARG 574.A NH1 HIS 342.A O no hydrogen 3.137 N/A ARG 574.A NH1 ALA 572.A O no hydrogen 2.899 N/A ARG 574.A NH2 HIS 342.A O no hydrogen 3.192 N/A ARG 574.A NH2 ASP 356.A OD1 no hydrogen 3.560 N/A ARG 574.A NH2 ASP 356.A OD2 no hydrogen 3.091 N/A GLU 575.A N ASN 571.A OD1 no hydrogen 2.724 N/A HIS 577.A N LEU 569.A O no hydrogen 3.016 N/A HIS 577.A ND1 HIS 866.A NE2 no hydrogen 2.668 N/A HIS 577.A NE2 ASP 533.A OD2 no hydrogen 2.842 N/A HIS 579.A NE2 GLY 506.A O no hydrogen 3.058 N/A LEU 580.A N HIS 577.A O no hydrogen 2.880 N/A LEU 581.A N PRO 578.A O no hydrogen 2.690 N/A VAL 583.A N HIS 579.A O no hydrogen 3.282 N/A LYS 584.A N LEU 580.A O no hydrogen 3.059 N/A LYS 584.A NZ GLU 681.A O no hydrogen 2.418 N/A LYS 585.A N LEU 581.A O no hydrogen 3.168 N/A LYS 585.A NZ TYR 684.A O no hydrogen 2.948 N/A LYS 585.A NZ ASP 685.A OD1 no hydrogen 3.026 N/A LYS 585.A NZ GLN 851.A O no hydrogen 3.425 N/A ILE 586.A N GLU 582.A O no hydrogen 2.992 N/A TYR 587.A N VAL 583.A O no hydrogen 2.850 N/A TYR 587.A OH GLY 336.A O no hydrogen 3.110 N/A TYR 587.A OH TYR 502.A OH no hydrogen 2.914 N/A GLN 588.A N LYS 585.A O no hydrogen 3.337 N/A GLN 588.A NE2 TYR 684.A O no hydrogen 2.931 N/A LYS 591.A N LYS 605.A O no hydrogen 3.201 N/A LYS 591.A NZ GLU 519.A OE2 no hydrogen 2.635 N/A LYS 591.A NZ ILE 586.A O no hydrogen 2.819 N/A SER 592.A N ASP 685.A OD2 no hydrogen 2.849 N/A THR 593.A N ARG 603.A O no hydrogen 3.091 N/A ILE 595.A N THR 601.A O no hydrogen 2.742 N/A ASP 596.A N THR 601.A O no hydrogen 3.182 N/A LYS 597.A NZ VAL 688.A O no hydrogen 3.204 N/A LYS 598.A N ASP 596.A OD2 no hydrogen 2.833 N/A LYS 598.A NZ ASP 596.A OD1 no hydrogen 3.102 N/A ASN 599.A N ASP 596.A OD2 no hydrogen 3.249 N/A THR 601.A N ASP 596.A O no hydrogen 3.027 N/A THR 601.A OG1 THR 648.A OG1 no hydrogen 2.574 N/A VAL 602.A N LEU 647.A O no hydrogen 2.747 N/A ARG 603.A N THR 593.A O no hydrogen 2.962 N/A ARG 603.A NH2 GLU 646.A OE2 no hydrogen 2.750 N/A VAL 604.A N VAL 645.A O no hydrogen 2.701 N/A LYS 605.A N LYS 591.A O no hydrogen 2.821 N/A ASN 606.A N ALA 643.A O no hydrogen 3.178 N/A ASN 606.A ND2 SER 611.A O no hydrogen 2.972 N/A ASN 606.A ND2 CYS 639.A O no hydrogen 3.238 N/A TRP 607.A N ASN 589.A O no hydrogen 2.642 N/A PHE 608.A N ASN 606.A OD1 no hydrogen 3.010 N/A ASP 609.A N GLU 287.A OE2 no hydrogen 2.926 N/A PHE 610.A N GLU 287.A OE1 no hydrogen 2.996 N/A SER 611.A OG GLU 287.A OE1 no hydrogen 2.705 N/A ASP 612.A N GLU 615.A OE2 no hydrogen 3.359 N/A LEU 613.A N CYS 639.A O no hydrogen 2.786 N/A ASN 614.A N ASP 612.A OD1 no hydrogen 2.801 N/A GLU 615.A N ASP 612.A O no hydrogen 3.122 N/A TYR 616.A N LEU 613.A O no hydrogen 2.841 N/A ILE 617.A N THR 668.A O no hydrogen 2.772 N/A LEU 618.A N LYS 635.A O no hydrogen 2.996 N/A HIS 619.A N GLY 666.A O no hydrogen 2.686 N/A HIS 619.A NE2 THR 668.A OG1 no hydrogen 3.212 N/A TRP 620.A N GLY 633.A O no hydrogen 2.881 N/A LYS 621.A N ASP 664.A O no hydrogen 2.855 N/A VAL 622.A N ALA 631.A O no hydrogen 2.622 N/A THR 623.A N TYR 662.A O no hydrogen 2.876 N/A GLY 624.A N THR 628.A O no hydrogen 3.343 N/A ASP 625.A N GLU 660.A O no hydrogen 2.852 N/A GLY 627.A N GLY 624.A O no hydrogen 2.577 N/A THR 628.A OG1 ASP 626.A OD1 no hydrogen 2.781 N/A LEU 630.A N VAL 622.A O no hydrogen 2.896 N/A GLY 633.A N TRP 620.A O no hydrogen 3.112 N/A LYS 635.A N LEU 618.A O no hydrogen 2.776 N/A CYS 639.A N ASP 612.A OD1 no hydrogen 2.867 N/A CYS 639.A SG GLU 640.A O no hydrogen 3.678 N/A CYS 639.A SG ALA 643.A O no hydrogen 3.207 N/A HIS 642.A N ASN 606.A O no hydrogen 2.511 N/A HIS 642.A NE2 ASP 609.A OD1 no hydrogen 2.545 N/A ALA 643.A N GLU 640.A O no hydrogen 2.933 N/A VAL 645.A N VAL 604.A O no hydrogen 2.809 N/A LEU 647.A N VAL 602.A O no hydrogen 3.039 N/A THR 648.A OG1 THR 601.A OG1 no hydrogen 2.574 N/A LEU 649.A N LEU 600.A O no hydrogen 2.653 N/A GLY 650.A N ASN 599.A O no hydrogen 2.618 N/A THR 657.A OG1 ASN 697.A OD1 no hydrogen 3.340 N/A ARG 659.A N ASP 625.A OD1 no hydrogen 2.921 N/A GLU 660.A N ASP 625.A OD1 no hydrogen 3.450 N/A ALA 661.A N LEU 689.A O no hydrogen 2.791 N/A TYR 662.A N THR 623.A O no hydrogen 2.715 N/A TYR 662.A OH GLU 660.A OE2 no hydrogen 2.420 N/A LEU 663.A N PHE 687.A O no hydrogen 2.880 N/A ASP 664.A N LYS 621.A O no hydrogen 2.750 N/A LEU 665.A N ASP 685.A O no hydrogen 2.785 N/A GLY 666.A N HIS 619.A O no hydrogen 2.735 N/A TRP 667.A N ALA 683.A O no hydrogen 2.934 N/A THR 668.A N ILE 617.A O no hydrogen 3.073 N/A THR 668.A OG1 HIS 619.A NE2 no hydrogen 3.212 N/A ARG 669.A NE LYS 671.A O no hydrogen 2.998 N/A LYS 670.A N GLU 615.A O no hydrogen 2.985 N/A LYS 670.A NZ ASN 614.A O no hydrogen 2.458 N/A THR 673.A N VAL 676.A O no hydrogen 3.159 N/A LEU 675.A N THR 673.A OG1 no hydrogen 2.980 N/A VAL 676.A N THR 673.A OG1 no hydrogen 3.184 N/A ALA 679.A N ASP 677.A OD1 no hydrogen 3.000 N/A TRP 680.A N ASP 677.A O no hydrogen 3.475 N/A TRP 680.A NE1 GLN 361.A O no hydrogen 3.155 N/A ILE 682.A N TRP 667.A O no hydrogen 2.821 N/A TYR 684.A N GLN 588.A OE1 no hydrogen 2.809 N/A ASP 685.A N LEU 665.A O no hydrogen 2.975 N/A GLN 686.A NE2 ASP 664.A OD1 no hydrogen 3.169 N/A GLN 686.A NE2 ILE 855.A O no hydrogen 2.965 N/A PHE 687.A N LEU 663.A O no hydrogen 2.872 N/A LEU 689.A N ALA 661.A O no hydrogen 2.544 N/A ALA 691.A N ARG 659.A O no hydrogen 3.326 N/A GLY 693.A N ILE 658.A O no hydrogen 3.070 N/A ASN 697.A N ASP 625.A OD2 no hydrogen 2.899 N/A ASN 697.A ND2 ASP 625.A OD2 no hydrogen 2.878 N/A ASN 697.A ND2 THR 657.A O no hydrogen 3.229 N/A LYS 699.A N TRP 696.A O no hydrogen 2.556 N/A LYS 699.A NZ GLU 896.A OE2 no hydrogen 3.344 N/A LYS 705.A N ASP 723.A OD1 no hydrogen 2.767 N/A THR 706.A OG1 GLY 802.A O no hydrogen 2.545 N/A THR 707.A N CYS 721.A O no hydrogen 3.350 N/A GLU 709.A N SER 719.A O no hydrogen 3.151 N/A ASP 711.A N ALA 716.A O no hydrogen 2.942 N/A ASN 713.A N ASP 711.A OD2 no hydrogen 2.748 N/A THR 714.A N ASP 711.A OD2 no hydrogen 3.065 N/A GLY 715.A N ASP 711.A O no hydrogen 3.041 N/A ALA 716.A N THR 714.A OG1 no hydrogen 3.143 N/A LYS 718.A N GLU 709.A O no hydrogen 2.859 N/A SER 719.A N GLU 709.A O no hydrogen 3.323 N/A SER 719.A OG GLU 726.A OE1 no hydrogen 2.544 N/A SER 719.A OG GLU 726.A OE2 no hydrogen 3.473 N/A LEU 720.A N GLU 726.A OE2 no hydrogen 2.785 N/A CYS 721.A N THR 707.A O no hydrogen 3.008 N/A CYS 721.A SG SER 719.A OG no hydrogen 3.605 N/A CYS 721.A SG GLY 724.A O no hydrogen 3.520 N/A CYS 721.A SG GLU 726.A OE1 no hydrogen 3.867 N/A LEU 722.A N GLU 725.A O no hydrogen 3.002 N/A ASP 723.A N LYS 705.A O no hydrogen 3.063 N/A GLU 725.A N LEU 722.A O no hydrogen 3.442 N/A LEU 727.A N GLU 726.A OE2 no hydrogen 2.816 N/A LEU 728.A N GLU 726.A OE2 no hydrogen 3.302 N/A ALA 729.A N GLU 828.A O no hydrogen 2.572 N/A SER 730.A N GLU 828.A O no hydrogen 3.187 N/A SER 730.A OG PRO 731.A O no hydrogen 3.448 N/A VAL 732.A N LEU 717.A O no hydrogen 2.926 N/A THR 733.A N THR 826.A O no hydrogen 3.206 N/A ILE 734.A N GLN 763.A OE1 no hydrogen 2.964 N/A SER 735.A N GLY 824.A O no hydrogen 2.897 N/A SER 735.A OG HIS 931.A ND1 no hydrogen 3.411 N/A ARG 738.A NE ASP 744.A OD2 no hydrogen 2.805 N/A ARG 738.A NH1 GLN 936.A OE1 no hydrogen 3.094 N/A ARG 738.A NH1 ALA 937.A O no hydrogen 3.033 N/A ARG 738.A NH2 ASP 744.A OD1 no hydrogen 2.954 N/A ARG 738.A NH2 GLY 938.A O no hydrogen 2.767 N/A ALA 740.A N GLU 914.A OE1 no hydrogen 2.894 N/A THR 741.A N ASP 744.A OD2 no hydrogen 3.117 N/A ASP 742.A N GLN 872.A OE1 no hydrogen 3.073 N/A ASN 743.A ND2 ASN 507.A O no hydrogen 3.650 N/A ASN 743.A ND2 SER 508.A OG no hydrogen 2.813 N/A ASN 743.A ND2 VAL 939.A O no hydrogen 3.116 N/A ASP 744.A N THR 741.A OG1 no hydrogen 2.747 N/A ASN 745.A N ASP 742.A O no hydrogen 3.111 N/A ARG 746.A N ASN 743.A O no hydrogen 2.813 N/A ARG 746.A NE ASP 742.A O no hydrogen 3.244 N/A ARG 746.A NH2 ASP 742.A O no hydrogen 2.826 N/A ASP 747.A N ASN 743.A O no hydrogen 2.784 N/A ALA 750.A N ASP 744.A O no hydrogen 2.646 N/A LYS 751.A NZ ARG 746.A O no hydrogen 3.254 N/A TRP 753.A N GLY 749.A O no hydrogen 3.285 N/A TRP 753.A NE1 SER 819.A OG no hydrogen 2.985 N/A ARG 754.A N ALA 750.A O no hydrogen 2.894 N/A ARG 754.A NH1 ASN 745.A OD1 no hydrogen 3.270 N/A ARG 754.A NH1 GLU 914.A OE2 no hydrogen 2.689 N/A ARG 754.A NH2 ASN 745.A OD1 no hydrogen 2.430 N/A LYS 755.A N LYS 751.A O no hydrogen 3.244 N/A ALA 756.A N LEU 752.A O no hydrogen 2.954 N/A ALA 756.A N TRP 753.A O no hydrogen 3.196 N/A GLY 757.A N ARG 754.A O no hydrogen 3.183 N/A LEU 758.A N TRP 753.A O no hydrogen 3.039 N/A HIS 759.A N HIS 759.A ND1 no hydrogen 2.628 N/A THR 760.A N GLY 757.A O no hydrogen 2.973 N/A THR 760.A OG1 GLY 757.A O no hydrogen 2.640 N/A THR 762.A N LEU 782.A O no hydrogen 2.770 N/A GLN 763.A NE2 THR 714.A O no hydrogen 3.019 N/A LYS 764.A N ASN 780.A O no hydrogen 2.788 N/A VAL 765.A N ASN 713.A O no hydrogen 2.805 N/A VAL 766.A N GLN 778.A O no hydrogen 2.551 N/A SER 767.A N GLN 778.A O no hydrogen 3.310 N/A SER 767.A OG GLN 778.A OE1 no hydrogen 3.230 N/A LYS 769.A N THR 776.A O no hydrogen 2.852 N/A SER 771.A N SER 774.A O no hydrogen 2.849 N/A SER 771.A OG SER 774.A OG no hydrogen 3.043 N/A SER 774.A N SER 771.A O no hydrogen 3.457 N/A SER 774.A OG SER 771.A OG no hydrogen 3.043 N/A ALA 775.A N TYR 796.A O no hydrogen 2.903 N/A THR 776.A N LYS 769.A O no hydrogen 2.759 N/A ALA 777.A N LEU 794.A O no hydrogen 2.961 N/A GLN 778.A N SER 767.A O no hydrogen 2.877 N/A VAL 779.A N ALA 792.A O no hydrogen 2.797 N/A ASN 780.A N LYS 764.A O no hydrogen 2.683 N/A ILE 781.A N GLY 790.A O no hydrogen 3.031 N/A LEU 782.A N THR 762.A O no hydrogen 2.741 N/A ASN 783.A N LYS 787.A O no hydrogen 3.045 N/A ASN 783.A ND2 ALA 756.A O no hydrogen 2.751 N/A VAL 784.A N THR 760.A OG1 no hydrogen 3.285 N/A GLY 786.A N ASN 783.A O no hydrogen 2.897 N/A LYS 787.A N ASN 783.A OD1 no hydrogen 3.098 N/A LYS 788.A NZ ASN 780.A OD1 no hydrogen 2.579 N/A LYS 788.A NZ ASP 791.A OD1 no hydrogen 2.540 N/A VAL 789.A N ILE 781.A O no hydrogen 2.499 N/A ASP 791.A N GLN 811.A O no hydrogen 2.864 N/A ALA 792.A N VAL 779.A O no hydrogen 3.086 N/A THR 793.A N THR 809.A O no hydrogen 2.780 N/A LEU 794.A N ALA 777.A O no hydrogen 2.788 N/A GLU 795.A N GLN 807.A O no hydrogen 2.749 N/A TYR 796.A N ALA 775.A O no hydrogen 2.994 N/A TYR 796.A OH GLY 715.A O no hydrogen 2.543 N/A THR 797.A N LYS 805.A O no hydrogen 2.980 N/A LEU 798.A N THR 773.A O no hydrogen 2.843 N/A ASN 799.A N SER 803.A O no hydrogen 2.769 N/A ASN 799.A ND2 SER 803.A OG no hydrogen 2.771 N/A GLY 802.A N ASN 799.A O no hydrogen 2.721 N/A LEU 804.A N ILE 965.A O no hydrogen 2.871 N/A LYS 805.A N THR 797.A O no hydrogen 2.776 N/A VAL 806.A N PHE 963.A O no hydrogen 2.837 N/A GLN 807.A N GLU 795.A O no hydrogen 2.960 N/A THR 808.A N PHE 961.A O no hydrogen 2.912 N/A THR 809.A N THR 793.A O no hydrogen 2.901 N/A THR 809.A OG1 THR 960.A OG1 no hydrogen 2.328 N/A PHE 810.A N GLN 959.A O no hydrogen 2.907 N/A GLN 811.A N ASP 791.A O no hydrogen 2.971 N/A ASP 813.A N VAL 789.A O no hydrogen 2.895 N/A THR 815.A N ASP 813.A O no hydrogen 2.617 N/A THR 815.A N ASP 813.A OD1 no hydrogen 3.178 N/A THR 815.A OG1 ASP 813.A OD1 no hydrogen 2.676 N/A TRP 816.A N ASP 813.A O no hydrogen 3.259 N/A TRP 816.A NE1 LYS 788.A O no hydrogen 3.101 N/A VAL 817.A N ASP 813.A O no hydrogen 3.151 N/A ALA 821.A N LEU 736.A O no hydrogen 2.796 N/A ARG 822.A N LEU 736.A O no hydrogen 3.335 N/A ARG 822.A NE PHE 737.A O no hydrogen 3.349 N/A ARG 822.A NH1 ASP 933.A OD1 no hydrogen 3.362 N/A ARG 822.A NH1 ASP 933.A OD2 no hydrogen 2.350 N/A LEU 823.A N LYS 935.A O no hydrogen 2.597 N/A LEU 825.A N LEU 932.A O no hydrogen 2.749 N/A THR 826.A N THR 733.A O no hydrogen 2.828 N/A THR 826.A OG1 VAL 930.A O no hydrogen 3.141 N/A PHE 827.A N VAL 930.A O no hydrogen 3.162 N/A GLU 828.A N SER 730.A OG no hydrogen 2.871 N/A ASP 830.A N GLY 926.A O no hydrogen 2.801 N/A TYR 832.A N ASN 829.A O no hydrogen 3.192 N/A ASN 834.A N ALA 886.A O no hydrogen 2.982 N/A VAL 835.A N THR 860.A O no hydrogen 3.051 N/A THR 836.A N LYS 884.A O no hydrogen 2.907 N/A TYR 837.A N TYR 858.A O no hydrogen 3.146 N/A LEU 838.A N TRP 882.A O no hydrogen 2.930 N/A GLY 839.A N GLY 856.A O no hydrogen 3.111 N/A ARG 840.A N THR 878.A O no hydrogen 2.967 N/A ARG 840.A NE ASP 879.A OD2 no hydrogen 2.891 N/A ARG 840.A NH1 SER 852.A O no hydrogen 2.999 N/A ARG 840.A NH2 ASP 879.A OD2 no hydrogen 3.227 N/A GLY 841.A N LYS 854.A O no hydrogen 3.075 N/A HIS 843.A NE2 SER 852.A OG no hydrogen 2.634 N/A THR 845.A N ASN 876.A O no hydrogen 3.146 N/A THR 845.A OG1 THR 878.A OG1 no hydrogen 2.794 N/A TYR 846.A N ARG 849.A O no hydrogen 3.038 N/A ARG 849.A N TYR 846.A O no hydrogen 2.659 N/A ARG 849.A NE SER 508.A O no hydrogen 2.973 N/A ARG 849.A NH1 SER 508.A O no hydrogen 3.418 N/A ASN 850.A ND2 THR 878.A OG1 no hydrogen 3.276 N/A GLN 851.A N GLU 582.A OE2 no hydrogen 3.005 N/A SER 852.A N GLU 582.A OE1 no hydrogen 3.086 N/A SER 852.A OG GLU 582.A OE1 no hydrogen 2.705 N/A SER 852.A OG HIS 843.A NE2 no hydrogen 2.634 N/A GLY 853.A N TYR 684.A OH no hydrogen 2.916 N/A LYS 854.A N GLY 841.A O no hydrogen 3.010 N/A LYS 854.A NZ GLU 681.A OE1 no hydrogen 3.117 N/A LYS 854.A NZ GLU 681.A OE2 no hydrogen 2.744 N/A ILE 855.A N GLN 686.A OE1 no hydrogen 2.685 N/A GLY 856.A N GLY 839.A O no hydrogen 2.916 N/A TYR 858.A N TYR 837.A O no hydrogen 2.921 N/A TYR 858.A OH LYS 854.A O no hydrogen 2.813 N/A THR 860.A N VAL 835.A O no hydrogen 3.003 N/A THR 861.A N THR 860.A OG1 no hydrogen 2.821 N/A LYS 864.A N THR 861.A OG1 no hydrogen 3.039 N/A HIS 866.A N THR 874.A OG1 no hydrogen 3.080 N/A HIS 866.A NE2 HIS 577.A ND1 no hydrogen 2.668 N/A TYR 868.A N HIS 866.A O no hydrogen 2.994 N/A TYR 868.A OH GLU 844.A OE1 no hydrogen 2.461 N/A GLN 872.A NE2 ASP 742.A OD2 no hydrogen 2.923 N/A GLN 872.A NE2 ILE 870.A O no hydrogen 2.896 N/A SER 873.A N PRO 739.A O no hydrogen 3.297 N/A SER 873.A OG PRO 739.A O no hydrogen 2.703 N/A THR 874.A OG1 GLU 844.A OE2 no hydrogen 2.372 N/A GLY 875.A N GLU 844.A OE2 no hydrogen 2.655 N/A ASN 876.A ND2 THR 845.A O no hydrogen 3.124 N/A ASN 876.A ND2 GLN 902.A OE1 no hydrogen 2.780 N/A ARG 877.A N PHE 903.A O no hydrogen 2.895 N/A ARG 877.A NE TYR 837.A OH no hydrogen 3.030 N/A ARG 877.A NH1 ASN 876.A O no hydrogen 3.225 N/A ARG 877.A NH2 GLU 842.A O no hydrogen 2.742 N/A THR 878.A OG1 THR 845.A OG1 no hydrogen 2.794 N/A VAL 880.A N PHE 901.A O no hydrogen 2.810 N/A ARG 881.A N LEU 838.A O no hydrogen 2.749 N/A ARG 881.A NE GLU 660.A OE2 no hydrogen 2.544 N/A ARG 881.A NH2 GLU 660.A OE1 no hydrogen 3.287 N/A ARG 881.A NH2 GLU 660.A OE2 no hydrogen 2.958 N/A VAL 883.A N ILE 895.A O no hydrogen 3.000 N/A LYS 884.A N THR 836.A O no hydrogen 2.568 N/A LEU 885.A N CYS 893.A O no hydrogen 3.042 N/A ALA 886.A N ASN 834.A O no hydrogen 2.899 N/A ASP 887.A N LYS 891.A O no hydrogen 2.720 N/A SER 889.A OG ASP 887.A OD1 no hydrogen 2.548 N/A SER 889.A OG ASP 887.A OD2 no hydrogen 3.190 N/A GLY 890.A N ASP 887.A O no hydrogen 3.102 N/A LYS 891.A NZ GLU 725.A OE2 no hydrogen 3.167 N/A GLY 892.A N VAL 968.A O no hydrogen 3.256 N/A CYS 893.A N LEU 885.A O no hydrogen 3.052 N/A TRP 894.A N TYR 966.A O no hydrogen 2.984 N/A ILE 895.A N VAL 883.A O no hydrogen 2.773 N/A GLU 896.A N THR 964.A O no hydrogen 3.209 N/A SER 897.A OG THR 962.A O no hydrogen 2.648 N/A SER 899.A OG ASP 898.A OD1 no hydrogen 3.142 N/A PHE 901.A N VAL 880.A O no hydrogen 2.952 N/A GLN 902.A N ASP 933.A O no hydrogen 2.877 N/A PHE 903.A N ARG 877.A O no hydrogen 3.262 N/A SER 904.A N HIS 931.A O no hydrogen 3.173 N/A LEU 906.A N THR 929.A O no hydrogen 2.965 N/A LEU 912.A N SER 909.A OG no hydrogen 3.264 N/A LEU 913.A N SER 909.A O no hydrogen 3.191 N/A GLU 914.A N ASP 910.A O no hydrogen 2.816 N/A LYS 915.A N LEU 911.A O no hydrogen 3.016 N/A ALA 916.A N LEU 912.A O no hydrogen 2.875 N/A LEU 917.A N ASP 921.A OD2 no hydrogen 2.915 N/A HIS 918.A N ASP 921.A OD2 no hydrogen 2.883 N/A HIS 918.A NE2 ASP 552.A OD2 no hydrogen 2.671 N/A ASN 920.A ND2 ASP 540.A OD2 no hydrogen 2.770 N/A ASP 921.A N HIS 918.A O no hydrogen 2.946 N/A LEU 922.A N ILE 919.A O no hydrogen 3.116 N/A ARG 924.A NE GLU 863.A OE2 no hydrogen 2.968 N/A ARG 924.A NH2 GLU 863.A OE1 no hydrogen 2.792 N/A ARG 924.A NH2 GLU 863.A OE2 no hydrogen 3.464 N/A ASN 925.A ND2 GLU 828.A OE2 no hydrogen 3.505 N/A ARG 927.A N ASN 925.A OD1 no hydrogen 2.714 N/A ARG 927.A NH1 GLU 828.A OE1 no hydrogen 3.232 N/A THR 929.A N LEU 906.A O no hydrogen 2.873 N/A VAL 930.A N PHE 827.A O no hydrogen 2.862 N/A HIS 931.A N SER 904.A O no hydrogen 2.799 N/A HIS 931.A NE2 ASP 910.A OD2 no hydrogen 2.715 N/A LEU 932.A N LEU 825.A O no hydrogen 2.816 N/A ASP 933.A N GLN 902.A O no hydrogen 2.637 N/A ALA 934.A N LEU 823.A O no hydrogen 2.794 N/A LYS 935.A N LEU 823.A O no hydrogen 3.153 N/A GLN 936.A NE2 ASN 876.A OD1 no hydrogen 2.906 N/A GLN 936.A NE2 GLN 902.A OE1 no hydrogen 3.627 N/A ALA 937.A N ALA 821.A O no hydrogen 2.893 N/A GLY 938.A N TYR 952.A O no hydrogen 3.320 N/A VAL 939.A N ASP 848.A OD1 no hydrogen 2.797 N/A VAL 939.A N ASP 848.A OD2 no hydrogen 3.204 N/A GLY 940.A N ASP 848.A OD2 no hydrogen 2.786 N/A THR 941.A N PRO 946.A O no hydrogen 2.969 N/A THR 941.A OG1 PRO 946.A O no hydrogen 2.658 N/A THR 943.A N ASN 743.A OD1 no hydrogen 2.761 N/A THR 943.A OG1 HIS 504.A ND1 no hydrogen 2.811 N/A THR 943.A OG1 ASN 743.A OD1 no hydrogen 2.814 N/A CYS 944.A N THR 941.A O no hydrogen 3.265 N/A VAL 948.A N ASP 747.A OD2 no hydrogen 2.760 N/A TYR 952.A N LEU 949.A O no hydrogen 2.899 N/A TYR 952.A OH GLU 513.A OE2 no hydrogen 2.423 N/A LEU 953.A N PRO 950.A O no hydrogen 3.399 N/A GLN 959.A N PHE 810.A O no hydrogen 2.888 N/A GLN 959.A NE2 PRO 955.A O no hydrogen 2.891 N/A GLN 959.A NE2 GLY 957.A O no hydrogen 3.040 N/A THR 960.A OG1 THR 809.A OG1 no hydrogen 2.328 N/A PHE 961.A N THR 808.A O no hydrogen 2.911 N/A PHE 963.A N VAL 806.A O no hydrogen 2.798 N/A THR 964.A N GLU 896.A O no hydrogen 2.866 N/A ILE 965.A N LEU 804.A O no hydrogen 2.948 N/A TYR 966.A N TRP 894.A O no hydrogen 2.899 N/A TYR 966.A OH GLU 896.A OE2 no hydrogen 3.146 N/A VAL 968.A N GLY 892.A O no hydrogen 2.939 N/A