Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5xgi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N HIS 7.A O no hydrogen 3.218 N/A LEU 3.A N ILE 6.A O no hydrogen 3.481 N/A TRP 4.A N PHE 88.A O no hydrogen 3.232 N/A ILE 6.A N LEU 3.A O no hydrogen 2.669 N/A ILE 13.A N CYS 29.A O no hydrogen 3.194 N/A VAL 15.A N LEU 27.A O no hydrogen 3.181 N/A GLU 16.A N PRO 90.A O no hydrogen 3.164 N/A CYS 17.A N VAL 25.A O no hydrogen 3.014 N/A CYS 17.A SG VAL 15.A O no hydrogen 3.579 N/A LEU 18.A N LEU 92.A O no hydrogen 2.881 N/A LEU 19.A N MET 23.A O no hydrogen 2.884 N/A ASN 21.A ND2 LEU 51.A O no hydrogen 2.769 N/A GLY 22.A N LEU 19.A O no hydrogen 3.192 N/A MET 23.A N ASN 21.A OD1 no hydrogen 3.176 N/A VAL 25.A N CYS 17.A O no hydrogen 2.897 N/A THR 26.A OG1 GLU 16.A OE1 no hydrogen 3.307 N/A LEU 27.A N VAL 15.A O no hydrogen 3.112 N/A CYS 29.A N ILE 13.A O no hydrogen 3.227 N/A CYS 29.A SG LEU 27.A O no hydrogen 3.990 N/A ARG 31.A NE MET 9.A O no hydrogen 2.847 N/A THR 34.A OG1 THR 37.A OG1 no hydrogen 2.744 N/A LEU 35.A N GLU 78.A O no hydrogen 2.873 N/A THR 37.A OG1 THR 34.A OG1 no hydrogen 2.744 N/A ILE 38.A N THR 34.A O no hydrogen 3.335 N/A LYS 39.A N LEU 35.A O no hydrogen 2.854 N/A LYS 39.A NZ GLU 58.A O no hydrogen 2.750 N/A LYS 39.A NZ TYR 61.A O no hydrogen 3.044 N/A LYS 39.A NZ GLU 78.A OE1 no hydrogen 3.060 N/A LYS 39.A NZ GLU 78.A OE2 no hydrogen 3.147 N/A HIS 40.A N ILE 36.A O no hydrogen 2.718 N/A GLU 41.A N THR 37.A O no hydrogen 3.164 N/A LEU 42.A N ILE 38.A O no hydrogen 2.730 N/A PHE 43.A N LYS 39.A O no hydrogen 3.254 N/A LYS 44.A N HIS 40.A O no hydrogen 3.059 N/A GLU 45.A N GLU 41.A O no hydrogen 3.205 N/A ALA 46.A N LEU 42.A O no hydrogen 2.700 N/A LYS 48.A N GLU 45.A O no hydrogen 3.263 N/A LEU 54.A N LEU 51.A O no hydrogen 3.344 N/A GLN 56.A N TYR 61.A OH no hydrogen 3.225 N/A GLN 56.A NE2 GLU 96.A OE1 no hydrogen 3.565 N/A SER 60.A N ASP 57.A O no hydrogen 3.131 N/A SER 60.A OG GLN 56.A OE1 no hydrogen 3.199 N/A ILE 62.A N ILE 95.A O no hydrogen 2.855 N/A VAL 64.A N LYS 93.A O no hydrogen 2.695 N/A SER 65.A N GLU 73.A O no hydrogen 3.250 N/A SER 65.A OG PHE 91.A O no hydrogen 2.736 N/A THR 67.A N GLU 71.A O no hydrogen 3.051 N/A THR 67.A OG1 GLU 71.A O no hydrogen 3.469 N/A GLN 68.A N ARG 86.A O no hydrogen 3.110 N/A GLN 68.A NE2 GLY 1.A O no hydrogen 2.742 N/A ALA 70.A N THR 67.A O no hydrogen 3.022 N/A GLU 71.A N THR 67.A OG1 no hydrogen 3.291 N/A GLU 73.A N SER 65.A O no hydrogen 2.952 N/A PHE 75.A N PHE 63.A O no hydrogen 3.254 N/A THR 79.A N ASP 77.A OD1 no hydrogen 3.395 N/A THR 79.A OG1 ASP 77.A OD1 no hydrogen 2.585 N/A THR 79.A OG1 ASP 77.A OD2 no hydrogen 3.438 N/A ARG 80.A N ASP 77.A O no hydrogen 3.367 N/A ARG 80.A NH1 GLU 73.A OE2 no hydrogen 3.097 N/A ARG 80.A NH2 ASP 84.A O no hydrogen 2.898 N/A LEU 82.A N ARG 31.A O no hydrogen 3.344 N/A CYS 83.A SG ASP 84.A OD1 no hydrogen 3.580 N/A ASP 84.A N ARG 81.A O no hydrogen 3.246 N/A LEU 85.A N LEU 82.A O no hydrogen 3.162 N/A PHE 88.A N VAL 66.A O no hydrogen 3.009 N/A PHE 91.A N GLN 89.A O no hydrogen 2.752 N/A LEU 92.A N GLU 16.A O no hydrogen 2.978 N/A LYS 93.A N VAL 64.A O no hydrogen 2.775 N/A VAL 94.A N LEU 18.A O no hydrogen 3.281 N/A ILE 95.A N ILE 62.A O no hydrogen 2.863 N/A GLU 102.A N ASN 100.A OD1 no hydrogen 3.114 N/A LYS 104.A N ASN 100.A O no hydrogen 3.410 N/A LYS 104.A NZ VAL 98.A O no hydrogen 2.678 N/A ILE 105.A N ARG 101.A O no hydrogen 3.161 N/A LEU 106.A N GLU 102.A O no hydrogen 3.309 N/A ASN 107.A N GLU 103.A O no hydrogen 2.813 N/A ARG 108.A N LYS 104.A O no hydrogen 3.251 N/A GLU 109.A N ILE 105.A O no hydrogen 3.045 N/A ILE 110.A N LEU 106.A O no hydrogen 2.794 N/A GLY 111.A N ASN 107.A O no hydrogen 2.930 N/A PHE 112.A N ARG 108.A O no hydrogen 2.972 N/A ALA 113.A N GLU 109.A O no hydrogen 3.273 N/A ILE 114.A N ILE 110.A O no hydrogen 2.983 N/A GLY 115.A N GLY 111.A O no hydrogen 2.961 N/A GLU 120.A N PRO 117.A O no hydrogen 3.107 N/A PHE 121.A N VAL 118.A O no hydrogen 3.042 N/A VAL 124.A N PHE 121.A O no hydrogen 3.295 N/A GLU 128.A N ASP 126.A OD1 no hydrogen 3.270 N/A VAL 129.A N ASP 126.A O no hydrogen 3.181 N/A GLN 130.A N ASP 126.A O no hydrogen 3.458 N/A GLN 130.A NE2 PHE 121.A O no hydrogen 2.876 N/A GLN 130.A NE2 VAL 124.A O no hydrogen 2.683 N/A ASP 131.A N PRO 127.A O no hydrogen 2.791 N/A PHE 132.A N GLU 128.A O no hydrogen 2.958 N/A ARG 133.A N VAL 129.A O no hydrogen 3.130 N/A ARG 133.A NH1 ASP 122.A OD1 no hydrogen 2.472 N/A ARG 133.A NH2 GLU 653.A OE1 no hydrogen 3.361 N/A ARG 133.A NH2 GLU 653.A OE2 no hydrogen 2.911 N/A ARG 134.A N GLN 130.A O no hydrogen 3.192 N/A ASN 135.A N ASP 131.A O no hydrogen 2.810 N/A ILE 136.A N PHE 132.A O no hydrogen 2.971 N/A LEU 137.A N ARG 134.A O no hydrogen 3.328 N/A ASN 138.A N ASN 135.A O no hydrogen 3.337 N/A VAL 139.A N ILE 136.A O no hydrogen 3.014 N/A CYS 140.A SG ILE 136.A O no hydrogen 3.932 N/A CYS 140.A SG SER 654.A O no hydrogen 3.448 N/A LYS 141.A N LEU 137.A O no hydrogen 3.001 N/A GLU 142.A N ASN 138.A O no hydrogen 2.995 N/A ALA 143.A N VAL 139.A O no hydrogen 2.831 N/A VAL 144.A N CYS 140.A O no hydrogen 3.086 N/A ASP 145.A N LYS 141.A O no hydrogen 3.188 N/A LEU 146.A N GLU 142.A O no hydrogen 3.147 N/A ARG 147.A N ALA 143.A O no hydrogen 3.406 N/A ARG 147.A NH1 LEU 622.A O no hydrogen 2.625 N/A ARG 147.A NH1 ALA 658.A O no hydrogen 3.440 N/A ARG 147.A NH2 ASP 288.A OD1 no hydrogen 3.293 N/A ARG 147.A NH2 ALA 658.A O no hydrogen 2.769 N/A HIS 153.A NE2 LEU 250.A O no hydrogen 2.996 N/A SER 154.A N ASN 150.A O no hydrogen 3.166 N/A SER 154.A OG ARG 147.A O no hydrogen 2.757 N/A ALA 156.A N PRO 152.A O no hydrogen 3.356 N/A MET 157.A N HIS 153.A O no hydrogen 2.766 N/A TYR 158.A N SER 154.A O no hydrogen 3.021 N/A TYR 158.A OH CYS 659.A O no hydrogen 2.706 N/A VAL 159.A N ARG 155.A O no hydrogen 3.432 N/A TYR 160.A N ALA 156.A O no hydrogen 2.843 N/A ASN 163.A ND2 GLU 247.A OE2 no hydrogen 3.490 N/A GLU 165.A N GLN 257.A O no hydrogen 2.895 N/A SER 166.A OG THR 588.A OG1 no hydrogen 2.989 N/A SER 166.A OG ASP 590.A OD2 no hydrogen 2.721 N/A SER 167.A OG GLU 169.A OE2 no hydrogen 3.376 N/A HIS 173.A NE2 GLN 789.A OE1 no hydrogen 2.707 N/A ILE 174.A N PRO 171.A O no hydrogen 3.056 N/A TYR 175.A N PRO 171.A O no hydrogen 3.161 N/A ASN 176.A N LYS 172.A O no hydrogen 3.075 N/A LYS 177.A N ILE 174.A O no hydrogen 3.299 N/A LEU 178.A N TYR 175.A O no hydrogen 3.201 N/A GLN 182.A N ASP 179.A O no hydrogen 2.828 N/A GLN 182.A NE2 ASN 205.A OD1 no hydrogen 3.034 N/A ILE 183.A N ILE 204.A O no hydrogen 3.136 N/A VAL 185.A N LEU 202.A O no hydrogen 3.099 N/A VAL 186.A N PRO 271.A O no hydrogen 3.128 N/A ILE 187.A N TYR 200.A O no hydrogen 3.138 N/A TRP 188.A N LEU 273.A O no hydrogen 3.347 N/A TRP 188.A NE1 ASN 272.A OD1 no hydrogen 2.765 N/A VAL 189.A N GLN 198.A O no hydrogen 3.022 N/A ASN 195.A N SER 192.A O no hydrogen 3.361 N/A LYS 197.A NZ ILE 752.A O no hydrogen 2.993 N/A LYS 197.A NZ GLU 755.A OE2 no hydrogen 2.866 N/A GLN 198.A N VAL 189.A O no hydrogen 3.257 N/A TYR 200.A N ILE 187.A O no hydrogen 2.845 N/A LEU 202.A N VAL 185.A O no hydrogen 2.847 N/A ILE 204.A N ILE 183.A O no hydrogen 3.380 N/A HIS 206.A ND1 SER 256.A OG no hydrogen 3.221 N/A CYS 208.A N ASN 205.A O no hydrogen 3.155 N/A CYS 208.A SG ASN 205.A O no hydrogen 3.266 N/A CYS 208.A SG GLN 212.A OE1 no hydrogen 3.955 N/A VAL 213.A N VAL 209.A O no hydrogen 3.230 N/A ILE 214.A N PRO 210.A O no hydrogen 2.928 N/A ALA 215.A N GLU 211.A O no hydrogen 2.946 N/A GLU 216.A N GLN 212.A O no hydrogen 3.236 N/A ALA 217.A N VAL 213.A O no hydrogen 3.283 N/A ILE 218.A N ILE 214.A O no hydrogen 3.460 N/A LYS 220.A N GLU 216.A O no hydrogen 3.299 N/A LEU 227.A N SER 224.A O no hydrogen 3.301 N/A LEU 229.A N GLN 226.A O no hydrogen 3.002 N/A CYS 230.A SG LEU 227.A O no hydrogen 3.188 N/A VAL 231.A N LEU 227.A O no hydrogen 3.279 N/A GLU 233.A N LEU 229.A O no hydrogen 3.119 N/A TYR 234.A N CYS 230.A O no hydrogen 2.768 N/A ILE 239.A N MET 276.A O no hydrogen 2.755 N/A LYS 241.A N MET 274.A O no hydrogen 2.971 N/A LYS 241.A NZ VAL 242.A O no hydrogen 3.407 N/A LYS 241.A NZ CYS 245.A O no hydrogen 2.911 N/A LYS 241.A NZ ASP 751.A OD1 no hydrogen 2.964 N/A VAL 242.A N GLU 247.A O no hydrogen 2.962 N/A CYS 243.A N ASN 272.A O no hydrogen 3.149 N/A CYS 243.A SG ASN 272.A O no hydrogen 3.243 N/A GLY 244.A N ASP 751.A OD2 no hydrogen 2.842 N/A CYS 245.A N VAL 242.A O no hydrogen 3.376 N/A ASP 246.A N ALA 722.A O no hydrogen 3.164 N/A PHE 249.A N LEU 240.A O no hydrogen 3.272 N/A LYS 252.A N GLU 251.A OE1 no hydrogen 3.284 N/A SER 256.A N HIS 206.A O no hydrogen 3.015 N/A SER 256.A OG HIS 206.A ND1 no hydrogen 3.221 N/A SER 256.A OG HIS 206.A O no hydrogen 3.496 N/A GLN 257.A N PRO 254.A O no hydrogen 3.103 N/A GLN 257.A NE2 GLU 165.A O no hydrogen 3.217 N/A TYR 258.A N LEU 255.A O no hydrogen 3.282 N/A TYR 258.A OH GLU 251.A O no hydrogen 2.746 N/A LYS 259.A N ASN 163.A O no hydrogen 2.941 N/A LYS 259.A NZ VAL 164.A O no hydrogen 3.343 N/A LYS 259.A NZ ASP 590.A OD1 no hydrogen 2.746 N/A ARG 262.A N TYR 258.A O no hydrogen 2.972 N/A ARG 262.A NE SER 256.A O no hydrogen 3.047 N/A SER 263.A N LYS 259.A O no hydrogen 2.805 N/A CYS 264.A N TYR 260.A O no hydrogen 2.824 N/A CYS 264.A SG TYR 260.A O no hydrogen 3.488 N/A ILE 265.A N ILE 261.A O no hydrogen 3.185 N/A MET 266.A N ARG 262.A O no hydrogen 3.467 N/A LEU 267.A N SER 263.A O no hydrogen 3.216 N/A GLY 268.A N CYS 264.A O no hydrogen 3.147 N/A ARG 269.A N CYS 264.A O no hydrogen 2.984 N/A ASN 272.A N TYR 260.A OH no hydrogen 3.226 N/A LEU 273.A N VAL 186.A O no hydrogen 3.022 N/A LEU 275.A N TRP 188.A O no hydrogen 2.760 N/A MET 276.A N ILE 239.A O no hydrogen 3.165 N/A LYS 278.A N LYS 237.A O no hydrogen 2.711 N/A LYS 278.A NZ GLY 236.A O no hydrogen 3.282 N/A TYR 282.A N LYS 278.A O no hydrogen 2.878 N/A SER 283.A N GLU 279.A O no hydrogen 3.183 N/A SER 283.A OG GLU 279.A O no hydrogen 2.722 N/A LEU 285.A N TYR 282.A O no hydrogen 3.419 N/A SER 294.A N GLU 103.A OE2 no hydrogen 2.740 N/A SER 294.A OG GLU 103.A OE1 no hydrogen 3.484 N/A SER 294.A OG GLU 103.A OE2 no hydrogen 2.741 N/A SER 296.A N PRO 293.A O no hydrogen 3.239 N/A SER 296.A OG PRO 293.A O no hydrogen 2.676 N/A SER 300.A OG SER 456.A OG no hydrogen 2.750 N/A THR 301.A OG1 THR 299.A O no hydrogen 3.560 N/A LYS 302.A N VAL 458.A O no hydrogen 2.898 N/A LEU 304.A N LYS 460.A O no hydrogen 2.754 N/A VAL 306.A N SER 303.A O no hydrogen 3.252 N/A ILE 307.A N LEU 304.A O no hydrogen 3.350 N/A SER 309.A OG ALA 310.A O no hydrogen 3.099 N/A LEU 311.A N ILE 368.A O no hydrogen 2.985 N/A ARG 312.A NE ASP 453.A OD2 no hydrogen 2.992 N/A ARG 312.A NH2 ASP 453.A OD1 no hydrogen 3.420 N/A ILE 313.A N LEU 364.A O no hydrogen 3.100 N/A LYS 314.A N GLU 451.A O no hydrogen 2.853 N/A ILE 315.A N GLU 362.A O no hydrogen 3.052 N/A LEU 316.A N GLU 449.A O no hydrogen 3.007 N/A CYS 317.A SG GLU 449.A OE1 no hydrogen 3.917 N/A ALA 318.A N PRO 358.A O no hydrogen 3.153 N/A THR 319.A N CYS 447.A O no hydrogen 3.148 N/A ARG 326.A NH2 ASN 324.A OD1 no hydrogen 3.145 N/A ILE 328.A N ASN 324.A O no hydrogen 3.146 N/A ASP 329.A N VAL 386.A O no hydrogen 2.837 N/A LYS 330.A N VAL 386.A O no hydrogen 3.390 N/A ILE 331.A N VAL 353.A O no hydrogen 2.909 N/A TYR 332.A N CYS 384.A O no hydrogen 3.004 N/A TYR 332.A OH HIS 394.A ND1 no hydrogen 2.565 N/A VAL 333.A N THR 350.A OG1 no hydrogen 2.825 N/A ARG 334.A N SER 382.A O no hydrogen 2.769 N/A ARG 334.A NH1 ASN 349.A OD1 no hydrogen 2.843 N/A THR 335.A OG1 ARG 334.A O no hydrogen 3.318 N/A GLY 336.A N CYS 380.A O no hydrogen 2.753 N/A TYR 338.A N ARG 378.A O no hydrogen 2.765 N/A HIS 339.A N GLU 342.A O no hydrogen 2.850 N/A GLU 342.A N HIS 339.A O no hydrogen 3.443 N/A LEU 344.A N ILE 337.A O no hydrogen 2.772 N/A CYS 345.A SG ASP 346.A O no hydrogen 3.809 N/A ASN 347.A ND2 TYR 338.A OH no hydrogen 3.025 N/A VAL 348.A N THR 335.A O no hydrogen 2.972 N/A THR 350.A N VAL 333.A O no hydrogen 2.983 N/A THR 350.A OG1 VAL 333.A O no hydrogen 3.529 N/A THR 350.A OG1 GLN 351.A O no hydrogen 3.275 N/A GLN 351.A N GLU 362.A OE1 no hydrogen 2.640 N/A ARG 352.A NH1 GLU 392.A OE1 no hydrogen 3.447 N/A ARG 352.A NH1 GLU 392.A OE2 no hydrogen 3.162 N/A ARG 352.A NH2 GLU 392.A OE1 no hydrogen 2.708 N/A VAL 353.A N ILE 331.A O no hydrogen 2.902 N/A CYS 355.A SG ILE 328.A O no hydrogen 3.425 N/A ASN 357.A N PRO 354.A O no hydrogen 3.239 N/A TRP 360.A N LEU 316.A O no hydrogen 2.759 N/A ASN 361.A N LEU 316.A O no hydrogen 2.967 N/A GLU 362.A N ILE 315.A O no hydrogen 3.116 N/A LEU 364.A N ILE 313.A O no hydrogen 2.728 N/A TYR 366.A N LEU 311.A O no hydrogen 3.156 N/A ILE 368.A N TYR 366.A O no hydrogen 2.935 N/A TYR 369.A OH ASN 308.A OD1 no hydrogen 2.855 N/A ILE 370.A N SER 309.A O no hydrogen 3.134 N/A ASP 372.A N TYR 369.A O no hydrogen 2.939 N/A LEU 373.A N ILE 370.A O no hydrogen 3.169 N/A ARG 375.A NE ASP 409.A OD1 no hydrogen 3.168 N/A ARG 375.A NH1 ARG 375.A O no hydrogen 2.768 N/A ARG 375.A NH1 TYR 608.A OH no hydrogen 2.738 N/A ARG 375.A NH2 ASP 409.A OD1 no hydrogen 2.744 N/A ARG 375.A NH2 TYR 608.A OH no hydrogen 3.400 N/A ALA 377.A N PRO 374.A O no hydrogen 3.069 N/A ARG 378.A N TYR 338.A O no hydrogen 2.820 N/A ARG 378.A NH1 PRO 433.A O no hydrogen 3.162 N/A ARG 378.A NH2 PRO 433.A O no hydrogen 2.631 N/A LEU 379.A N ILE 402.A O no hydrogen 2.766 N/A CYS 380.A N GLY 336.A O no hydrogen 2.764 N/A CYS 380.A SG ASN 401.A OD1 no hydrogen 3.324 N/A LEU 381.A N GLY 400.A O no hydrogen 2.962 N/A SER 382.A N ARG 334.A O no hydrogen 2.949 N/A SER 382.A OG LEU 430.A O no hydrogen 2.552 N/A ILE 383.A N ALA 398.A O no hydrogen 3.109 N/A CYS 384.A N TYR 332.A O no hydrogen 2.765 N/A CYS 384.A SG SER 382.A OG no hydrogen 3.219 N/A CYS 384.A SG LEU 430.A O no hydrogen 3.920 N/A SER 385.A N CYS 395.A O no hydrogen 2.770 N/A SER 385.A OG CYS 395.A O no hydrogen 3.232 N/A VAL 386.A N LYS 330.A O no hydrogen 2.833 N/A LYS 387.A N GLU 393.A O no hydrogen 3.090 N/A GLY 388.A N ASP 329.A OD2 no hydrogen 2.659 N/A GLU 393.A N LYS 387.A O no hydrogen 2.822 N/A HIS 394.A ND1 TYR 332.A OH no hydrogen 2.565 N/A HIS 394.A NE2 GLU 392.A OE1 no hydrogen 2.922 N/A CYS 395.A N SER 385.A O no hydrogen 3.212 N/A LEU 397.A N ILE 383.A O no hydrogen 2.848 N/A TRP 399.A N TRP 421.A O no hydrogen 2.971 N/A TRP 399.A NE1 PRO 422.A O no hydrogen 2.892 N/A GLY 400.A N LEU 381.A O no hydrogen 2.986 N/A ASN 401.A ND2 ASN 432.A O no hydrogen 2.817 N/A ASN 401.A ND2 GLY 435.A O no hydrogen 2.897 N/A ASN 401.A ND2 VAL 436.A O no hydrogen 3.657 N/A ILE 402.A N LEU 379.A O no hydrogen 2.784 N/A ASN 403.A ND2 THR 437.A OG1 no hydrogen 3.328 N/A ASN 403.A ND2 GLN 607.A O no hydrogen 3.184 N/A LEU 404.A N ALA 377.A O no hydrogen 3.133 N/A ASP 406.A N THR 410.A O no hydrogen 2.844 N/A TYR 407.A OH ASP 131.A OD2 no hydrogen 2.686 N/A THR 408.A N ASP 406.A OD1 no hydrogen 2.992 N/A THR 408.A OG1 ASP 406.A OD1 no hydrogen 2.775 N/A THR 408.A OG1 ASP 406.A OD2 no hydrogen 3.291 N/A THR 408.A OG1 THR 410.A OG1 no hydrogen 3.001 N/A ASP 409.A N ASP 406.A O no hydrogen 2.975 N/A THR 410.A N ASP 406.A OD1 no hydrogen 2.886 N/A THR 410.A OG1 THR 408.A OG1 no hydrogen 3.001 N/A LEU 411.A N VAL 459.A O no hydrogen 2.756 N/A VAL 412.A N LEU 404.A O no hydrogen 2.872 N/A GLY 414.A N PHE 452.A O no hydrogen 3.061 N/A MET 416.A N LEU 450.A O no hydrogen 2.837 N/A LEU 418.A N LEU 448.A O no hydrogen 2.926 N/A ASN 419.A N SER 439.A OG no hydrogen 2.850 N/A LEU 420.A N PRO 446.A O no hydrogen 2.758 N/A TRP 421.A N TRP 399.A O no hydrogen 2.714 N/A TRP 421.A NE1 GLY 438.A O no hydrogen 3.241 N/A LEU 427.A N PRO 424.A O no hydrogen 3.186 N/A GLY 435.A N ASN 432.A O no hydrogen 3.282 N/A GLY 438.A N ASN 401.A O no hydrogen 3.127 N/A ASN 440.A N ASN 419.A O no hydrogen 2.839 N/A ASN 440.A ND2 LEU 420.A O no hydrogen 3.086 N/A ASN 442.A N ASN 440.A OD1 no hydrogen 3.059 N/A THR 445.A OG1 ASN 442.A O no hydrogen 3.367 N/A THR 445.A OG1 GLU 444.A O no hydrogen 2.848 N/A LEU 448.A N LEU 418.A O no hydrogen 2.943 N/A GLU 449.A N CYS 317.A O no hydrogen 2.750 N/A LEU 450.A N MET 416.A O no hydrogen 2.982 N/A GLU 451.A N LYS 314.A O no hydrogen 2.845 N/A PHE 452.A N GLY 414.A O no hydrogen 3.071 N/A SER 456.A OG SER 300.A O no hydrogen 2.602 N/A SER 456.A OG SER 300.A OG no hydrogen 2.750 N/A SER 457.A N SER 300.A OG no hydrogen 3.274 N/A VAL 458.A N SER 300.A O no hydrogen 3.389 N/A LYS 460.A N LYS 302.A O no hydrogen 2.730 N/A LYS 460.A NZ THR 408.A O no hydrogen 2.704 N/A LYS 460.A NZ THR 408.A OG1 no hydrogen 3.386 N/A LYS 460.A NZ THR 410.A OG1 no hydrogen 2.917 N/A PHE 461.A N ASP 409.A O no hydrogen 2.934 N/A ILE 467.A N ASP 463.A O no hydrogen 3.082 N/A GLU 468.A N MET 464.A O no hydrogen 2.974 N/A GLU 469.A N SER 465.A O no hydrogen 3.338 N/A HIS 470.A N VAL 466.A O no hydrogen 3.307 N/A HIS 470.A NE2 ASP 542.A OD1 no hydrogen 2.698 N/A ALA 471.A N ILE 467.A O no hydrogen 2.904 N/A ASN 472.A N GLU 468.A O no hydrogen 3.050 N/A TRP 473.A N GLU 469.A O no hydrogen 3.165 N/A SER 474.A N HIS 470.A O no hydrogen 2.808 N/A SER 474.A OG HIS 470.A O no hydrogen 2.996 N/A SER 474.A OG ASP 542.A OD1 no hydrogen 3.356 N/A VAL 475.A N ALA 471.A O no hydrogen 3.142 N/A SER 476.A OG ASN 472.A O no hydrogen 2.960 N/A GLU 478.A N SER 474.A O no hydrogen 3.295 N/A ARG 483.A N ARG 480.A O no hydrogen 3.287 N/A LYS 492.A N ARG 488.A O no hydrogen 2.843 N/A GLU 493.A N GLU 489.A O no hydrogen 3.086 N/A GLN 494.A N ASN 490.A O no hydrogen 3.359 N/A LEU 495.A N ASP 491.A O no hydrogen 3.164 N/A LYS 496.A N LYS 492.A O no hydrogen 3.270 N/A ALA 497.A N GLU 493.A O no hydrogen 3.053 N/A ILE 498.A N GLN 494.A O no hydrogen 2.915 N/A SER 499.A N LEU 495.A O no hydrogen 3.234 N/A SER 499.A OG LEU 495.A O no hydrogen 3.526 N/A SER 499.A OG LYS 496.A O no hydrogen 2.608 N/A THR 500.A OG1 ALA 497.A O no hydrogen 2.611 N/A ARG 501.A N ILE 498.A O no hydrogen 3.272 N/A ARG 501.A NH1 SER 505.A O no hydrogen 3.209 N/A ARG 501.A NH1 GLU 506.A O no hydrogen 2.793 N/A LEU 504.A N ASP 502.A OD1 no hydrogen 3.105 N/A SER 505.A N ASP 502.A O no hydrogen 3.116 N/A THR 508.A N GLU 511.A OE1 no hydrogen 2.985 N/A GLN 510.A N GLN 510.A OE1 no hydrogen 3.063 N/A GLU 511.A N THR 508.A OG1 no hydrogen 3.154 N/A LYS 512.A N THR 508.A O no hydrogen 2.811 N/A LYS 512.A NZ GLU 509.A OE2 no hydrogen 2.767 N/A ASP 513.A N GLU 509.A O no hydrogen 3.170 N/A PHE 514.A N GLN 510.A O no hydrogen 2.892 N/A LEU 515.A N GLU 511.A O no hydrogen 2.908 N/A TRP 516.A N LYS 512.A O no hydrogen 2.968 N/A SER 517.A N ASP 513.A O no hydrogen 2.984 N/A SER 517.A OG ASP 513.A O no hydrogen 2.829 N/A HIS 518.A N PHE 514.A O no hydrogen 3.134 N/A HIS 518.A ND1 PHE 514.A O no hydrogen 3.010 N/A ARG 519.A N TRP 516.A O no hydrogen 3.238 N/A ARG 519.A NE GLN 546.A OE1 no hydrogen 3.042 N/A ARG 519.A NH1 TRP 516.A O no hydrogen 2.679 N/A ARG 519.A NH2 GLU 478.A OE1 no hydrogen 2.679 N/A ARG 519.A NH2 GLN 546.A OE1 no hydrogen 2.749 N/A TYR 521.A N HIS 518.A O no hydrogen 3.158 N/A TYR 521.A OH ASN 485.A O no hydrogen 2.636 N/A CYS 522.A N HIS 518.A O no hydrogen 3.051 N/A CYS 522.A SG LEU 515.A O no hydrogen 4.045 N/A CYS 522.A SG HIS 518.A O no hydrogen 3.296 N/A THR 524.A N TYR 521.A O no hydrogen 3.259 N/A THR 524.A OG1 TYR 521.A O no hydrogen 2.650 N/A ILE 525.A N CYS 522.A O no hydrogen 3.028 N/A GLU 527.A N GLU 527.A OE1 no hydrogen 2.949 N/A ILE 528.A N ILE 525.A O no hydrogen 3.108 N/A LEU 529.A N PRO 526.A O no hydrogen 3.246 N/A LYS 531.A NZ ARG 501.A O no hydrogen 2.609 N/A LEU 532.A N ILE 528.A O no hydrogen 3.055 N/A LEU 533.A N LEU 529.A O no hydrogen 2.872 N/A LEU 534.A N PRO 530.A O no hydrogen 3.274 N/A SER 535.A N LYS 531.A O no hydrogen 3.137 N/A SER 535.A N LEU 532.A O no hydrogen 3.117 N/A SER 535.A OG LYS 531.A O no hydrogen 2.803 N/A VAL 536.A N LEU 533.A O no hydrogen 3.430 N/A LYS 537.A N GLU 543.A OE1 no hydrogen 2.968 N/A LYS 537.A NZ GLU 543.A OE2 no hydrogen 3.077 N/A TRP 538.A NE1 LEU 533.A O no hydrogen 2.813 N/A ASN 539.A ND2 LEU 344.A O no hydrogen 2.703 N/A SER 540.A N LYS 537.A O no hydrogen 3.199 N/A ARG 541.A N ASP 372.A OD1 no hydrogen 3.006 N/A VAL 544.A N SER 540.A O no hydrogen 3.019 N/A ALA 545.A N ARG 541.A O no hydrogen 2.938 N/A GLN 546.A N ASP 542.A O no hydrogen 3.367 N/A MET 547.A N GLU 543.A O no hydrogen 3.109 N/A TYR 548.A N VAL 544.A O no hydrogen 3.080 N/A TYR 548.A OH ASP 572.A OD2 no hydrogen 2.653 N/A CYS 549.A SG ALA 545.A O no hydrogen 3.807 N/A LEU 550.A N GLN 546.A O no hydrogen 3.307 N/A VAL 551.A N MET 547.A O no hydrogen 2.765 N/A LYS 552.A N TYR 548.A O no hydrogen 2.911 N/A LYS 552.A NZ GLU 468.A OE2 no hydrogen 2.708 N/A TRP 554.A N VAL 551.A O no hydrogen 3.170 N/A TRP 554.A NE1 PRO 526.A O no hydrogen 3.062 N/A ALA 562.A N LYS 558.A O no hydrogen 2.907 N/A MET 563.A N PRO 559.A O no hydrogen 2.959 N/A GLU 564.A N GLN 561.A O no hydrogen 3.344 N/A LEU 565.A N ALA 562.A O no hydrogen 3.070 N/A LEU 566.A N MET 563.A O no hydrogen 3.398 N/A ASP 567.A N GLU 564.A O no hydrogen 3.386 N/A ASN 569.A N ASP 567.A OD1 no hydrogen 2.846 N/A TYR 570.A N ASP 567.A O no hydrogen 3.311 N/A TYR 570.A OH PRO 530.A O no hydrogen 3.173 N/A MET 574.A N ASP 572.A OD1 no hydrogen 2.985 N/A ARG 576.A N ASP 572.A O no hydrogen 2.995 N/A ARG 576.A NE GLU 606.A OE2 no hydrogen 2.852 N/A ARG 576.A NH1 LEU 566.A O no hydrogen 2.747 N/A ARG 576.A NH1 GLU 606.A OE2 no hydrogen 3.291 N/A ARG 576.A NH2 LEU 566.A O no hydrogen 3.301 N/A ARG 576.A NH2 ASP 567.A O no hydrogen 3.178 N/A ARG 576.A NH2 TYR 570.A O no hydrogen 2.717 N/A GLY 577.A N PRO 573.A O no hydrogen 2.832 N/A PHE 578.A N MET 574.A O no hydrogen 3.121 N/A ALA 579.A N VAL 575.A O no hydrogen 3.004 N/A VAL 580.A N ARG 576.A O no hydrogen 2.953 N/A ARG 581.A N GLY 577.A O no hydrogen 2.913 N/A CYS 582.A N PHE 578.A O no hydrogen 3.060 N/A CYS 582.A SG ILE 557.A O no hydrogen 3.534 N/A CYS 582.A SG PHE 578.A O no hydrogen 3.412 N/A LEU 583.A N ALA 579.A O no hydrogen 3.305 N/A GLU 584.A N VAL 580.A O no hydrogen 2.910 N/A LYS 585.A N ARG 581.A O no hydrogen 3.295 N/A TYR 586.A N CYS 582.A O no hydrogen 2.923 N/A LEU 587.A N LEU 583.A O no hydrogen 2.954 N/A THR 588.A OG1 SER 166.A OG no hydrogen 2.989 N/A LYS 591.A N THR 588.A OG1 no hydrogen 3.342 N/A LYS 591.A NZ GLU 560.A OE2 no hydrogen 2.727 N/A LYS 591.A NZ TYR 595.A OH no hydrogen 3.517 N/A LEU 592.A N THR 588.A O no hydrogen 2.921 N/A SER 593.A N ASP 589.A O no hydrogen 3.119 N/A SER 593.A OG ASP 589.A O no hydrogen 3.341 N/A GLN 594.A N ASP 590.A O no hydrogen 3.025 N/A TYR 595.A N LYS 591.A O no hydrogen 3.013 N/A TYR 595.A OH GLU 560.A OE2 no hydrogen 2.987 N/A GLN 598.A NE2 GLN 779.A OE1 no hydrogen 2.760 N/A LEU 599.A N TYR 595.A O no hydrogen 3.156 N/A VAL 600.A N LEU 596.A O no hydrogen 3.042 N/A GLN 601.A N ILE 597.A O no hydrogen 3.307 N/A GLN 601.A NE2 GLU 638.A OE2 no hydrogen 2.740 N/A VAL 602.A N GLN 598.A O no hydrogen 2.895 N/A LEU 603.A N VAL 600.A O no hydrogen 3.245 N/A LYS 604.A N GLN 601.A O no hydrogen 3.155 N/A LYS 604.A NZ GLN 601.A OE1 no hydrogen 3.229 N/A LYS 604.A NZ GLU 638.A OE1 no hydrogen 2.746 N/A LYS 604.A NZ GLU 638.A OE2 no hydrogen 3.306 N/A LYS 604.A NZ GLY 961.A O no hydrogen 3.504 N/A TYR 605.A N VAL 602.A O no hydrogen 2.971 N/A TYR 605.A OH SER 957.A O no hydrogen 2.864 N/A GLU 606.A N LEU 603.A O no hydrogen 3.307 N/A GLN 607.A NE2 ASN 403.A OD1 no hydrogen 2.695 N/A TYR 608.A OH PHE 405.A O no hydrogen 2.670 N/A LEU 609.A N GLU 128.A OE2 no hydrogen 2.818 N/A ASN 611.A ND2 TYR 608.A O no hydrogen 2.944 N/A VAL 614.A N ASN 611.A OD1 no hydrogen 2.931 N/A ARG 615.A N ASN 611.A O no hydrogen 3.422 N/A ARG 615.A NE ASP 610.A OD1 no hydrogen 2.670 N/A ARG 615.A NH2 ASP 610.A OD1 no hydrogen 3.372 N/A ARG 615.A NH2 ASP 610.A OD2 no hydrogen 2.935 N/A PHE 616.A N LEU 612.A O no hydrogen 3.098 N/A LEU 617.A N LEU 613.A O no hydrogen 2.946 N/A LEU 618.A N VAL 614.A O no hydrogen 2.993 N/A LYS 619.A N ARG 615.A O no hydrogen 3.101 N/A LYS 619.A NZ GLU 142.A OE1 no hydrogen 3.198 N/A LYS 620.A N PHE 616.A O no hydrogen 3.014 N/A ALA 621.A N LEU 617.A O no hydrogen 2.786 N/A LEU 622.A N LEU 618.A O no hydrogen 2.850 N/A THR 623.A OG1 LYS 619.A O no hydrogen 2.961 N/A THR 623.A OG1 LYS 620.A O no hydrogen 3.434 N/A ASN 624.A N LYS 620.A O no hydrogen 2.966 N/A ASN 624.A ND2 ASP 589.A OD2 no hydrogen 3.220 N/A GLN 625.A N TYR 158.A O no hydrogen 3.124 N/A ARG 626.A NH1 SER 593.A OG no hydrogen 2.891 N/A ILE 627.A N ASN 624.A OD1 no hydrogen 3.067 N/A GLY 628.A N ASN 624.A O no hydrogen 2.808 N/A HIS 629.A N GLN 625.A O no hydrogen 2.887 N/A HIS 629.A ND1 TYR 662.A OH no hydrogen 2.583 N/A HIS 629.A NE2 PRO 718.A O no hydrogen 2.848 N/A PHE 631.A N ILE 627.A O no hydrogen 2.895 N/A PHE 632.A N GLY 628.A O no hydrogen 3.030 N/A TRP 633.A N HIS 629.A O no hydrogen 3.213 N/A TRP 633.A NE1 GLN 669.A OE1 no hydrogen 2.907 N/A HIS 634.A N PHE 630.A O no hydrogen 2.888 N/A LEU 635.A N PHE 631.A O no hydrogen 3.327 N/A LYS 636.A N PHE 632.A O no hydrogen 2.840 N/A LYS 636.A NZ ALA 113.A O no hydrogen 2.833 N/A SER 637.A N TRP 633.A O no hydrogen 2.961 N/A SER 637.A OG TRP 633.A O no hydrogen 3.264 N/A SER 637.A OG HIS 634.A O no hydrogen 2.773 N/A GLU 638.A N LEU 635.A O no hydrogen 3.295 N/A MET 639.A N LYS 636.A O no hydrogen 3.139 N/A ASN 641.A N GLU 638.A O no hydrogen 2.998 N/A THR 643.A N ASN 641.A OD1 no hydrogen 3.261 N/A THR 643.A OG1 ASN 641.A OD1 no hydrogen 2.679 N/A VAL 644.A N ASN 641.A O no hydrogen 3.270 N/A SER 645.A OG MET 639.A O no hydrogen 2.881 N/A SER 645.A OG ASN 641.A O no hydrogen 2.806 N/A ARG 647.A NH1 TYR 608.A O no hydrogen 3.002 N/A PHE 648.A N VAL 644.A O no hydrogen 2.934 N/A GLY 649.A N SER 645.A O no hydrogen 2.817 N/A LEU 650.A N GLN 646.A O no hydrogen 2.848 N/A LEU 651.A N ARG 647.A O no hydrogen 2.955 N/A LEU 652.A N PHE 648.A O no hydrogen 2.817 N/A GLU 653.A N GLY 649.A O no hydrogen 3.031 N/A SER 654.A N LEU 650.A O no hydrogen 3.201 N/A SER 654.A OG LEU 650.A O no hydrogen 3.038 N/A TYR 655.A N LEU 651.A O no hydrogen 3.043 N/A CYS 656.A N LEU 652.A O no hydrogen 2.826 N/A CYS 656.A SG LEU 652.A O no hydrogen 3.220 N/A ARG 657.A N GLU 653.A O no hydrogen 2.823 N/A ARG 657.A NH1 ASN 107.A OD1 no hydrogen 2.783 N/A ARG 657.A NH2 TYR 295.A OH no hydrogen 3.110 N/A ALA 658.A N SER 654.A O no hydrogen 3.363 N/A ALA 658.A N TYR 655.A O no hydrogen 3.136 N/A CYS 659.A N TYR 655.A O no hydrogen 2.808 N/A CYS 659.A SG CYS 656.A O no hydrogen 3.814 N/A TYR 662.A OH HIS 629.A ND1 no hydrogen 2.583 N/A LEU 663.A N GLY 660.A O no hydrogen 3.354 N/A LYS 664.A N MET 661.A O no hydrogen 3.037 N/A LYS 664.A NZ GLU 109.A OE1 no hydrogen 2.670 N/A LEU 666.A N TYR 662.A O no hydrogen 2.753 N/A ASN 667.A N LEU 663.A O no hydrogen 2.937 N/A ASN 667.A ND2 GLU 109.A O no hydrogen 3.260 N/A ARG 668.A N LYS 664.A O no hydrogen 3.288 N/A GLN 669.A N HIS 665.A O no hydrogen 3.267 N/A GLN 669.A NE2 TYR 662.A OH no hydrogen 3.501 N/A VAL 670.A N LEU 666.A O no hydrogen 2.847 N/A GLU 671.A N ASN 667.A O no hydrogen 2.844 N/A ALA 672.A N ARG 668.A O no hydrogen 2.916 N/A MET 673.A N GLN 669.A O no hydrogen 3.030 N/A GLU 674.A N VAL 670.A O no hydrogen 2.886 N/A LYS 675.A N GLU 671.A O no hydrogen 3.236 N/A LEU 676.A N ALA 672.A O no hydrogen 3.231 N/A ILE 677.A N MET 673.A O no hydrogen 2.761 N/A ASN 678.A N GLU 674.A O no hydrogen 2.849 N/A LEU 679.A N LYS 675.A O no hydrogen 3.205 N/A THR 680.A N LEU 676.A O no hydrogen 3.114 N/A THR 680.A OG1 LEU 676.A O no hydrogen 2.657 N/A THR 680.A OG1 ILE 677.A O no hydrogen 3.049 N/A ASP 681.A N ILE 677.A O no hydrogen 2.983 N/A ILE 682.A N ASN 678.A O no hydrogen 3.197 N/A LEU 683.A N LEU 679.A O no hydrogen 2.992 N/A LYS 684.A N THR 680.A O no hydrogen 3.092 N/A GLN 685.A N ASP 681.A O no hydrogen 2.869 N/A GLU 686.A N ILE 682.A O no hydrogen 2.843 N/A LYS 687.A N ILE 682.A O no hydrogen 3.189 N/A GLN 695.A N THR 691.A O no hydrogen 2.841 N/A GLN 695.A NE2 LYS 687.A O no hydrogen 2.644 N/A MET 696.A N GLN 692.A O no hydrogen 3.013 N/A LYS 697.A N LYS 693.A O no hydrogen 3.215 N/A PHE 698.A N VAL 694.A O no hydrogen 2.882 N/A LEU 699.A N GLN 695.A O no hydrogen 2.930 N/A VAL 700.A N MET 696.A O no hydrogen 2.795 N/A GLU 701.A N LYS 697.A O no hydrogen 3.057 N/A GLN 702.A N PHE 698.A O no hydrogen 3.094 N/A MET 703.A N LEU 699.A O no hydrogen 2.761 N/A ARG 704.A N VAL 700.A O no hydrogen 2.808 N/A ARG 705.A N GLN 702.A O no hydrogen 3.363 N/A ARG 705.A NE ASP 707.A OD1 no hydrogen 3.397 N/A MET 709.A N ARG 705.A O no hydrogen 2.881 N/A ASP 710.A N PRO 706.A O no hydrogen 2.911 N/A ALA 711.A N ASP 707.A O no hydrogen 3.461 N/A LEU 712.A N PHE 708.A O no hydrogen 2.747 N/A GLN 713.A NE2 MET 709.A O no hydrogen 2.893 N/A GLY 714.A N GLY 726.A O no hydrogen 3.195 N/A PHE 715.A N LEU 725.A O no hydrogen 3.063 N/A SER 717.A N HIS 723.A O no hydrogen 2.948 N/A ASN 720.A N SER 717.A O no hydrogen 3.211 N/A ALA 722.A N ASN 720.A OD1 no hydrogen 3.211 N/A HIS 723.A N ASN 720.A O no hydrogen 2.955 N/A LEU 725.A N PHE 715.A O no hydrogen 2.742 N/A GLY 726.A N GLU 748.A O no hydrogen 2.842 N/A LEU 728.A N GLN 713.A OE1 no hydrogen 2.835 N/A ARG 729.A N ASN 746.A O no hydrogen 2.962 N/A ARG 729.A NE GLU 748.A OE2 no hydrogen 2.608 N/A ARG 729.A NH2 GLU 748.A OE2 no hydrogen 3.225 N/A GLU 732.A N ARG 729.A O no hydrogen 2.941 N/A CYS 733.A SG ARG 729.A O no hydrogen 3.397 N/A CYS 733.A SG ASN 746.A O no hydrogen 3.925 N/A ARG 734.A N TRP 744.A O no hydrogen 2.918 N/A ARG 734.A NH1 GLU 731.A O no hydrogen 2.597 N/A ARG 734.A NH1 CYS 733.A O no hydrogen 3.189 N/A MET 736.A N PRO 742.A O no hydrogen 2.724 N/A ARG 741.A N SER 738.A O no hydrogen 3.139 N/A ARG 741.A NE GLN 695.A OE1 no hydrogen 2.917 N/A ARG 741.A NH1 SER 738.A O no hydrogen 3.498 N/A LEU 743.A N PHE 765.A O no hydrogen 2.866 N/A TRP 744.A N ARG 734.A O no hydrogen 2.671 N/A TRP 744.A NE1 GLU 762.A OE1 no hydrogen 2.720 N/A LEU 745.A N ILE 763.A O no hydrogen 2.902 N/A TRP 747.A N ASN 761.A O no hydrogen 3.046 N/A TRP 747.A NE1 LEU 712.A O no hydrogen 2.744 N/A GLU 748.A N ASN 727.A O no hydrogen 2.694 N/A ASN 749.A N GLN 759.A O no hydrogen 2.843 N/A ASN 749.A ND2 GLY 244.A O no hydrogen 3.334 N/A ASN 749.A ND2 PHE 758.A O no hydrogen 2.980 N/A MET 753.A N ASP 751.A OD2 no hydrogen 3.142 N/A SER 754.A N ASP 751.A O no hydrogen 3.293 N/A GLU 755.A N GLU 755.A OE1 no hydrogen 2.749 N/A LEU 757.A N SER 754.A O no hydrogen 3.006 N/A ASN 760.A ND2 ASN 746.A OD1 no hydrogen 3.473 N/A ASN 760.A ND2 GLU 762.A OE2 no hydrogen 3.108 N/A ASN 761.A N TRP 747.A O no hydrogen 2.867 N/A ILE 763.A N LEU 745.A O no hydrogen 3.157 N/A ILE 764.A N ILE 812.A O no hydrogen 2.878 N/A PHE 765.A N LEU 743.A O no hydrogen 2.865 N/A LYS 766.A N GLY 810.A O no hydrogen 3.031 N/A LYS 766.A NZ ASP 769.A OD2 no hydrogen 2.735 N/A ASN 767.A ND2 THR 680.A OG1 no hydrogen 2.661 N/A ASN 767.A ND2 ASP 681.A OD1 no hydrogen 3.277 N/A ARG 772.A N ASP 770.A OD1 no hydrogen 3.376 N/A ARG 772.A NE ASP 770.A OD1 no hydrogen 3.125 N/A ARG 772.A NE ASP 770.A OD2 no hydrogen 3.439 N/A ARG 772.A NH2 ASP 770.A OD2 no hydrogen 3.196 N/A GLN 773.A NE2 ASP 770.A OD2 no hydrogen 2.879 N/A GLN 773.A NE2 GLU 966.A OE1 no hydrogen 2.865 N/A MET 775.A N LEU 771.A O no hydrogen 2.860 N/A LEU 776.A N ARG 772.A O no hydrogen 2.947 N/A THR 777.A N GLN 773.A O no hydrogen 2.929 N/A THR 777.A OG1 GLN 773.A O no hydrogen 2.797 N/A LEU 778.A N ASP 774.A O no hydrogen 2.850 N/A GLN 779.A N MET 775.A O no hydrogen 3.187 N/A GLN 779.A NE2 GLN 594.A O no hydrogen 2.646 N/A GLN 779.A NE2 GLN 598.A OE1 no hydrogen 2.769 N/A ILE 780.A N LEU 776.A O no hydrogen 3.002 N/A ILE 781.A N THR 777.A O no hydrogen 3.017 N/A ARG 782.A N LEU 778.A O no hydrogen 3.168 N/A ARG 782.A NH2 PRO 799.A O no hydrogen 3.228 N/A ILE 783.A N GLN 779.A O no hydrogen 3.042 N/A MET 784.A N ILE 780.A O no hydrogen 2.750 N/A GLU 785.A N ILE 781.A O no hydrogen 2.830 N/A ASN 786.A N ARG 782.A O no hydrogen 3.084 N/A ILE 787.A N ILE 783.A O no hydrogen 3.109 N/A TRP 788.A N MET 784.A O no hydrogen 3.295 N/A TRP 788.A NE1 ALA 941.A O no hydrogen 2.921 N/A GLN 789.A N GLU 785.A O no hydrogen 3.027 N/A GLN 789.A NE2 ASP 794.A OD1 no hydrogen 3.268 N/A ASN 790.A N ASN 786.A O no hydrogen 3.312 N/A ASN 790.A ND2 ASN 786.A OD1 no hydrogen 3.090 N/A GLN 791.A N ILE 787.A O no hydrogen 3.288 N/A GLY 792.A N GLN 789.A O no hydrogen 3.077 N/A ARG 796.A NH1 GLN 882.A OE1 no hydrogen 3.536 N/A MET 797.A N GLU 785.A OE2 no hydrogen 2.754 N/A LEU 798.A N TYR 858.A OH no hydrogen 3.188 N/A TYR 800.A N LEU 798.A O no hydrogen 2.943 N/A GLY 801.A N GLU 813.A OE1 no hydrogen 2.809 N/A CYS 802.A SG LEU 771.A O no hydrogen 3.930 N/A CYS 802.A SG LEU 811.A O no hydrogen 3.877 N/A LEU 803.A N LEU 811.A O no hydrogen 3.120 N/A SER 804.A OG GLY 806.A O no hydrogen 3.419 N/A SER 804.A OG VAL 809.A O no hydrogen 3.506 N/A ILE 805.A N VAL 809.A O no hydrogen 2.789 N/A GLY 806.A N VAL 809.A O no hydrogen 3.183 N/A VAL 809.A N GLY 806.A O no hydrogen 3.412 N/A GLY 810.A N LYS 766.A O no hydrogen 2.981 N/A LEU 811.A N LEU 803.A O no hydrogen 2.949 N/A ILE 812.A N ILE 764.A O no hydrogen 2.987 N/A GLU 813.A N GLY 801.A O no hydrogen 2.889 N/A VAL 814.A N GLU 762.A O no hydrogen 3.175 N/A SER 818.A OG VAL 815.A O no hydrogen 2.771 N/A HIS 819.A N VAL 877.A O no hydrogen 3.105 N/A ILE 821.A N ASN 872.A O no hydrogen 2.947 N/A ILE 821.A N ILE 875.A O no hydrogen 3.132 N/A MET 822.A N ASN 872.A O no hydrogen 3.423 N/A GLN 825.A N ILE 821.A O no hydrogen 2.977 N/A CYS 826.A N MET 822.A O no hydrogen 3.039 N/A CYS 826.A SG GLN 825.A O no hydrogen 3.099 N/A THR 830.A OG1 ASN 827.A O no hydrogen 3.132 N/A HIS 832.A NE2 TYR 844.A OH no hydrogen 2.670 N/A GLN 833.A N HIS 829.A O no hydrogen 3.042 N/A TRP 834.A N THR 830.A O no hydrogen 3.024 N/A LEU 835.A N LEU 831.A O no hydrogen 3.043 N/A LYS 836.A N HIS 832.A O no hydrogen 2.956 N/A ASP 837.A N GLN 833.A O no hydrogen 2.861 N/A LYS 838.A N TRP 834.A O no hydrogen 2.899 N/A LYS 838.A NZ ASP 879.A OD2 no hydrogen 3.163 N/A ASN 839.A N LEU 835.A O no hydrogen 3.184 N/A ASN 839.A N LYS 836.A O no hydrogen 3.239 N/A ASN 839.A ND2 LEU 835.A O no hydrogen 3.170 N/A ASN 839.A ND2 ASP 879.A O no hydrogen 2.690 N/A TYR 844.A OH HIS 832.A NE2 no hydrogen 2.670 N/A ILE 848.A N TYR 844.A O no hydrogen 3.027 N/A ASP 849.A N ASP 845.A O no hydrogen 3.037 N/A LEU 850.A N ALA 846.A O no hydrogen 3.163 N/A PHE 851.A N ALA 847.A O no hydrogen 2.971 N/A THR 852.A N ILE 848.A O no hydrogen 2.981 N/A THR 852.A OG1 ILE 848.A O no hydrogen 2.622 N/A ARG 853.A N ASP 849.A O no hydrogen 2.845 N/A ARG 853.A NE ASP 849.A OD1 no hydrogen 3.279 N/A ARG 853.A NE ASP 849.A OD2 no hydrogen 3.018 N/A ARG 853.A NH1 ASP 794.A O no hydrogen 2.737 N/A SER 854.A N LEU 850.A O no hydrogen 2.945 N/A SER 854.A OG ARG 796.A O no hydrogen 3.246 N/A SER 854.A OG LEU 850.A O no hydrogen 2.777 N/A CYS 855.A N PHE 851.A O no hydrogen 2.749 N/A ALA 856.A N THR 852.A O no hydrogen 3.082 N/A GLY 857.A N ARG 853.A O no hydrogen 3.318 N/A TYR 858.A N SER 854.A O no hydrogen 3.266 N/A CYS 859.A N CYS 855.A O no hydrogen 2.811 N/A VAL 860.A N ALA 856.A O no hydrogen 3.041 N/A ALA 861.A N GLY 857.A O no hydrogen 2.761 N/A THR 862.A N TYR 858.A O no hydrogen 3.159 N/A THR 862.A OG1 TYR 858.A O no hydrogen 2.540 N/A THR 862.A OG1 CYS 859.A O no hydrogen 3.455 N/A PHE 863.A N CYS 859.A O no hydrogen 3.360 N/A ILE 864.A N VAL 860.A O no hydrogen 3.053 N/A LEU 865.A N ALA 861.A O no hydrogen 3.105 N/A GLY 866.A N THR 862.A O no hydrogen 2.915 N/A ARG 870.A N PRO 907.A O no hydrogen 3.060 N/A ARG 870.A NE GLY 868.A O no hydrogen 2.954 N/A ARG 870.A NH1 GLY 868.A O no hydrogen 2.922 N/A ARG 870.A NH1 ASP 887.A O no hydrogen 2.881 N/A ARG 870.A NH2 ILE 886.A O no hydrogen 2.674 N/A ASN 874.A N HIS 871.A O no hydrogen 3.129 N/A ASN 874.A ND2 ASP 869.A O no hydrogen 3.064 N/A ILE 875.A N HIS 871.A O no hydrogen 3.263 N/A MET 876.A N PHE 884.A O no hydrogen 2.824 N/A VAL 877.A N HIS 819.A O no hydrogen 2.731 N/A LYS 878.A N GLN 882.A O no hydrogen 2.934 N/A LYS 878.A NZ ASP 880.A OD1 no hydrogen 2.995 N/A LYS 878.A NZ GLN 882.A OE1 no hydrogen 3.041 N/A GLY 881.A N LYS 878.A O no hydrogen 3.253 N/A GLN 882.A N ASP 880.A OD1 no hydrogen 3.086 N/A PHE 884.A N MET 876.A O no hydrogen 2.920 N/A ILE 886.A N ASN 874.A O no hydrogen 2.927 N/A PHE 888.A N ASP 774.A OD2 no hydrogen 3.248 N/A GLY 889.A N ASP 774.A OD1 no hydrogen 2.805 N/A HIS 890.A N PHE 888.A O no hydrogen 2.794 N/A LEU 892.A N LEU 865.A O no hydrogen 2.649 N/A ASP 893.A N GLY 866.A O no hydrogen 3.139 N/A LYS 896.A N ASP 893.A O no hydrogen 3.097 N/A ARG 905.A NH2 ILE 867.A O no hydrogen 2.681 N/A PHE 914.A N THR 911.A O no hydrogen 3.070 N/A LEU 915.A N THR 911.A O no hydrogen 3.285 N/A ILE 916.A N GLN 912.A O no hydrogen 3.044 N/A ILE 918.A N PHE 914.A O no hydrogen 3.301 N/A SER 919.A N LEU 915.A O no hydrogen 3.077 N/A SER 919.A OG LEU 915.A O no hydrogen 3.145 N/A SER 919.A OG CYS 925.A O no hydrogen 2.751 N/A SER 919.A OG THR 928.A OG1 no hydrogen 2.870 N/A LYS 920.A N VAL 917.A O no hydrogen 3.389 N/A LYS 920.A NZ ASP 845.A OD1 no hydrogen 2.823 N/A GLY 921.A N ILE 916.A O no hydrogen 2.915 N/A CYS 925.A N GLN 923.A O no hydrogen 2.987 N/A LYS 927.A N GLU 924.A O no hydrogen 3.404 N/A THR 928.A OG1 SER 919.A OG no hydrogen 2.870 N/A THR 928.A OG1 CYS 925.A O no hydrogen 3.481 N/A GLU 932.A N THR 928.A O no hydrogen 3.277 N/A ARG 933.A N ARG 929.A O no hydrogen 3.135 N/A ARG 933.A NH1 ASP 849.A OD1 no hydrogen 3.529 N/A PHE 934.A N GLU 930.A O no hydrogen 2.928 N/A GLN 935.A N PHE 931.A O no hydrogen 2.858 N/A GLN 935.A NE2 THR 1006.A O no hydrogen 2.798 N/A GLU 936.A N GLU 932.A O no hydrogen 3.249 N/A MET 937.A N ARG 933.A O no hydrogen 3.181 N/A CYS 938.A N PHE 934.A O no hydrogen 3.107 N/A CYS 938.A SG PHE 934.A O no hydrogen 3.413 N/A TYR 939.A N GLN 935.A O no hydrogen 2.960 N/A LYS 940.A N GLU 936.A O no hydrogen 2.928 N/A ALA 941.A N MET 937.A O no hydrogen 3.096 N/A TYR 942.A N CYS 938.A O no hydrogen 2.933 N/A TYR 942.A OH THR 979.A O no hydrogen 2.653 N/A LEU 943.A N TYR 939.A O no hydrogen 3.134 N/A ALA 944.A N LYS 940.A O no hydrogen 3.107 N/A ILE 945.A N ALA 941.A O no hydrogen 3.361 N/A ARG 946.A N TYR 942.A O no hydrogen 3.214 N/A ARG 946.A NH1 LYS 984.A O no hydrogen 3.334 N/A GLN 947.A N LEU 943.A O no hydrogen 3.074 N/A HIS 948.A ND1 ALA 944.A O no hydrogen 3.026 N/A ALA 949.A N ARG 946.A O no hydrogen 3.083 N/A ILE 953.A N ALA 949.A O no hydrogen 3.025 N/A ASN 954.A N ASN 950.A O no hydrogen 2.892 N/A ASN 954.A ND2 GLU 560.A O no hydrogen 3.274 N/A LEU 955.A N LEU 951.A O no hydrogen 2.908 N/A PHE 956.A N PHE 952.A O no hydrogen 3.165 N/A SER 957.A N ILE 953.A O no hydrogen 2.881 N/A SER 957.A OG ILE 953.A O no hydrogen 2.830 N/A MET 958.A N ASN 954.A O no hydrogen 3.151 N/A MET 959.A N PHE 956.A O no hydrogen 3.119 N/A GLY 961.A N TYR 605.A OH no hydrogen 3.114 N/A SER 962.A N MET 959.A O no hydrogen 2.935 N/A SER 962.A OG MET 959.A O no hydrogen 2.724 N/A MET 964.A N SER 962.A OG no hydrogen 3.283 N/A LEU 967.A N MET 964.A O no hydrogen 3.157 N/A GLN 968.A N ASP 972.A OD2 no hydrogen 3.341 N/A SER 969.A N ASP 972.A OD2 no hydrogen 3.375 N/A SER 969.A OG ASP 972.A OD2 no hydrogen 3.345 N/A ASP 972.A N SER 969.A O no hydrogen 3.220 N/A ALA 974.A N PHE 970.A O no hydrogen 3.061 N/A TYR 975.A N ASP 972.A O no hydrogen 3.467 N/A ILE 976.A N ILE 973.A O no hydrogen 3.280 N/A ARG 977.A NH1 ASP 502.A OD1 no hydrogen 3.349 N/A ARG 977.A NH1 ASP 502.A OD2 no hydrogen 3.017 N/A ARG 977.A NH1 ASP 983.A OD1 no hydrogen 3.427 N/A ARG 977.A NH2 ASP 983.A OD1 no hydrogen 3.492 N/A ARG 977.A NH2 ASP 983.A OD2 no hydrogen 2.786 N/A LYS 978.A N ALA 974.A O no hydrogen 3.402 N/A LYS 978.A N TYR 975.A O no hydrogen 3.177 N/A LYS 978.A NZ LYS 902.A O no hydrogen 3.046 N/A LYS 978.A NZ GLU 904.A OE2 no hydrogen 3.138 N/A THR 979.A N TYR 975.A O no hydrogen 3.037 N/A THR 979.A OG1 ILE 864.A O no hydrogen 2.781 N/A THR 979.A OG1 TYR 975.A O no hydrogen 3.379 N/A THR 979.A OG1 ILE 976.A O no hydrogen 3.224 N/A LEU 980.A N ILE 976.A O no hydrogen 2.820 N/A LEU 982.A N ARG 977.A O no hydrogen 2.960 N/A LYS 984.A N ALA 981.A O no hydrogen 3.214 N/A THR 985.A N GLU 988.A OE1 no hydrogen 3.430 N/A ALA 989.A N THR 985.A O no hydrogen 2.688 N/A LEU 990.A N GLU 986.A O no hydrogen 3.158 N/A GLU 991.A N GLN 987.A O no hydrogen 3.203 N/A TYR 992.A N GLU 988.A O no hydrogen 2.875 N/A TYR 992.A OH GLU 904.A OE1 no hydrogen 2.643 N/A PHE 993.A N ALA 989.A O no hydrogen 2.979 N/A MET 994.A N LEU 990.A O no hydrogen 3.025 N/A LYS 995.A N GLU 991.A O no hydrogen 3.029 N/A LYS 995.A NZ ASP 999.A OD2 no hydrogen 3.298 N/A GLN 996.A N TYR 992.A O no hydrogen 2.957 N/A MET 997.A N PHE 993.A O no hydrogen 3.078 N/A ASN 998.A N MET 994.A O no hydrogen 2.961 N/A ASP 999.A N LYS 995.A O no hydrogen 3.058 N/A ALA 1000.A N GLN 996.A O no hydrogen 3.210 N/A HIS 1001.A N MET 997.A O no hydrogen 2.913 N/A HIS 1001.A ND1 MET 997.A O no hydrogen 2.615 N/A GLY 1003.A N ASN 998.A O no hydrogen 3.216 N/A GLY 1004.A N HIS 1001.A O no hydrogen 3.209 N/A TRP 1005.A NE1 TYR 939.A OH no hydrogen 2.979 N/A THR 1006.A OG1 THR 926.A O no hydrogen 2.708 N/A ASP 1010.A N LYS 1008.A O no hydrogen 2.797 N/A