NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
10227 | 1pet | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H GLY 325 1H GLY 25 14.155 1.435 1.435 2 2H GLY 325 3H GLY 25 14.223 2.999 2.999 3 3H GLY 325 2H GLY 25 13.727 1.697 1.697 4 1HA GLY 325 2HA GLY 25 11.669 2.400 2.400 5 2HA GLY 325 1HA GLY 25 12.227 3.249 3.249 6 H GLU 326 H GLU 26 10.891 0.301 0.301 7 HA GLU 326 HA GLU 26 10.780 -0.729 -0.729 8 1HB GLU 326 2HB GLU 26 11.428 -2.226 -2.226 9 2HB GLU 326 1HB GLU 26 10.839 -3.053 -3.053 10 1HG GLU 326 2HG GLU 26 13.329 -1.333 -1.333 11 2HG GLU 326 1HG GLU 26 13.278 -3.086 -3.086 12 H TYR 327 H TYR 27 9.007 -2.575 -2.575 13 HA TYR 327 HA TYR 27 6.644 -1.510 -1.510 14 1HB TYR 327 2HB TYR 27 7.019 -2.542 -2.542 15 2HB TYR 327 1HB TYR 27 5.483 -2.886 -2.886 16 HD1 TYR 327 HD1 TYR 27 7.817 -0.134 -0.134 17 HD2 TYR 327 HD2 TYR 27 3.839 -1.195 -1.195 18 HE1 TYR 327 HE1 TYR 27 7.059 2.184 2.184 19 HE2 TYR 327 HE2 TYR 27 3.081 1.123 1.123 20 HH TYR 327 HH TYR 27 4.511 3.196 3.196 21 H PHE 328 H PHE 28 5.652 -2.898 -2.898 22 HA PHE 328 HA PHE 28 6.331 -5.804 -5.804 23 1HB PHE 328 2HB PHE 28 5.907 -4.171 -4.171 24 2HB PHE 328 1HB PHE 28 6.207 -5.908 -5.908 25 HD1 PHE 328 HD1 PHE 28 8.396 -6.776 -6.776 26 HD2 PHE 328 HD2 PHE 28 7.683 -2.584 -2.584 27 HE1 PHE 328 HE1 PHE 28 10.838 -6.350 -6.350 28 HE2 PHE 328 HE2 PHE 28 10.125 -2.159 -2.159 29 HZ PHE 328 HZ PHE 28 11.703 -4.042 -4.042 30 H THR 329 H THR 29 4.630 -7.263 -7.263 31 HA THR 329 HA THR 29 1.902 -6.039 -6.039 32 HB THR 329 HB THR 29 2.092 -8.948 -8.948 33 HG1 THR 329 HG1 THR 29 3.833 -8.900 -8.900 34 1HG2 THR 329 2HG2 THR 29 0.223 -7.250 -7.250 35 2HG2 THR 329 1HG2 THR 29 1.172 -7.025 -7.025 36 3HG2 THR 329 3HG2 THR 29 0.535 -8.620 -8.620 37 H LEU 330 H LEU 30 0.505 -6.299 -6.299 38 HA LEU 330 HA LEU 30 1.424 -8.086 -8.086 39 1HB LEU 330 2HB LEU 30 0.563 -5.303 -5.303 40 2HB LEU 330 1HB LEU 30 -0.438 -6.267 -6.267 41 HG LEU 330 HG LEU 30 2.566 -6.503 -6.503 42 1HD1 LEU 330 1HD1 LEU 30 1.127 -4.132 -4.132 43 2HD1 LEU 330 3HD1 LEU 30 1.550 -4.854 -4.854 44 3HD1 LEU 330 2HD1 LEU 30 2.813 -4.482 -4.482 45 1HD2 LEU 330 2HD2 LEU 30 0.281 -7.518 -7.518 46 2HD2 LEU 330 1HD2 LEU 30 1.962 -8.050 -8.050 47 3HD2 LEU 330 3HD2 LEU 30 1.441 -6.711 -6.711 48 H GLN 331 H GLN 31 0.241 -9.916 -9.916 49 HA GLN 331 HA GLN 31 -2.623 -9.615 -9.615 50 1HB GLN 331 2HB GLN 31 -1.109 -11.165 -11.165 51 2HB GLN 331 1HB GLN 31 -0.960 -12.138 -12.138 52 1HG GLN 331 2HG GLN 31 -2.947 -13.116 -13.116 53 2HG GLN 331 1HG GLN 31 -3.736 -11.545 -11.545 54 1HE2 GLN 331 2HE2 GLN 31 -2.013 -12.845 -12.845 55 2HE2 GLN 331 1HE2 GLN 31 -1.114 -12.879 -12.879 56 H ILE 332 H ILE 32 -3.955 -9.453 -9.453 57 HA ILE 332 HA ILE 32 -3.265 -11.040 -11.040 58 HB ILE 332 HB ILE 32 -4.961 -8.540 -8.540 59 1HG1 ILE 332 2HG1 ILE 32 -2.677 -8.316 -8.316 60 2HG1 ILE 332 1HG1 ILE 32 -2.146 -8.902 -8.902 61 1HG2 ILE 332 3HG2 ILE 32 -4.530 -10.512 -10.512 62 2HG2 ILE 332 2HG2 ILE 32 -4.411 -8.819 -8.819 63 3HG2 ILE 332 1HG2 ILE 32 -5.887 -9.421 -9.421 64 1HD1 ILE 332 1HD1 ILE 32 -3.828 -6.991 -6.991 65 2HD1 ILE 332 3HD1 ILE 32 -3.405 -6.299 -6.299 66 3HD1 ILE 332 2HD1 ILE 32 -2.142 -6.644 -6.644 67 H ARG 333 H ARG 33 -4.950 -12.211 -12.211 68 HA ARG 333 HA ARG 33 -7.168 -12.951 -12.951 69 1HB ARG 333 2HB ARG 33 -5.821 -14.752 -14.752 70 2HB ARG 333 1HB ARG 33 -6.317 -14.163 -14.163 71 1HG ARG 333 2HG ARG 33 -8.704 -14.523 -14.523 72 2HG ARG 333 1HG ARG 33 -8.130 -15.254 -15.254 73 1HD ARG 333 2HD ARG 33 -7.965 -17.216 -17.216 74 2HD ARG 333 1HD ARG 33 -6.678 -16.509 -16.509 75 HE ARG 333 HE ARG 33 -8.355 -15.948 -15.948 76 1HH1 ARG 333 2HH1 ARG 33 -10.904 -15.581 -15.581 77 2HH1 ARG 333 1HH1 ARG 33 -11.686 -17.127 -17.127 78 1HH2 ARG 333 1HH2 ARG 33 -8.718 -18.922 -18.922 79 2HH2 ARG 333 2HH2 ARG 33 -10.447 -19.019 -19.019 80 H GLY 334 H GLY 34 -9.367 -12.787 -12.787 81 1HA GLY 334 2HA GLY 34 -10.951 -12.274 -12.274 82 2HA GLY 334 1HA GLY 34 -9.788 -11.071 -11.071 83 H ARG 335 H ARG 35 -11.236 -9.311 -9.311 84 HA ARG 335 HA ARG 35 -11.429 -8.252 -8.252 85 1HB ARG 335 2HB ARG 35 -13.463 -9.777 -9.777 86 2HB ARG 335 1HB ARG 35 -14.010 -8.604 -8.604 87 1HG ARG 335 2HG ARG 35 -14.275 -6.904 -6.904 88 2HG ARG 335 1HG ARG 35 -13.195 -7.686 -7.686 89 1HD ARG 335 2HD ARG 35 -14.863 -9.505 -9.505 90 2HD ARG 335 1HD ARG 35 -15.950 -8.664 -8.664 91 HE ARG 335 HE ARG 35 -15.052 -7.440 -7.440 92 1HH1 ARG 335 1HH2 ARG 35 -16.588 -5.711 -5.711 93 2HH1 ARG 335 2HH2 ARG 35 -18.220 -5.938 -5.938 94 1HH2 ARG 335 2HH1 ARG 35 -17.515 -8.820 -8.820 95 2HH2 ARG 335 1HH1 ARG 35 -18.746 -7.699 -7.699 96 H GLU 336 H GLU 36 -12.647 -7.880 -7.880 97 HA GLU 336 HA GLU 36 -12.772 -4.994 -4.994 98 1HB GLU 336 2HB GLU 36 -14.107 -6.274 -6.274 99 2HB GLU 336 1HB GLU 36 -12.619 -6.776 -6.776 100 1HG GLU 336 2HG GLU 36 -12.064 -4.443 -4.443 101 2HG GLU 336 1HG GLU 36 -13.507 -3.900 -3.900 102 H ARG 337 H ARG 37 -10.439 -7.246 -7.246 103 HA ARG 337 HA ARG 37 -8.638 -5.326 -5.326 104 1HB ARG 337 2HB ARG 37 -8.351 -8.149 -8.149 105 2HB ARG 337 1HB ARG 37 -6.887 -7.217 -7.217 106 1HG ARG 337 2HG ARG 37 -8.036 -6.609 -6.609 107 2HG ARG 337 1HG ARG 37 -9.087 -7.983 -7.983 108 1HD ARG 337 2HD ARG 37 -6.150 -8.421 -8.421 109 2HD ARG 337 1HD ARG 37 -6.781 -8.261 -8.261 110 HE ARG 337 HE ARG 37 -7.560 -10.388 -10.388 111 1HH1 ARG 337 2HH1 ARG 37 -9.758 -9.594 -9.594 112 2HH1 ARG 337 1HH1 ARG 37 -9.493 -10.685 -10.685 113 1HH2 ARG 337 1HH2 ARG 37 -6.279 -11.525 -11.525 114 2HH2 ARG 337 2HH2 ARG 37 -7.523 -11.776 -11.776 115 H PHE 338 H PHE 38 -8.820 -6.742 -6.742 116 HA PHE 338 HA PHE 38 -6.526 -5.487 -5.487 117 1HB PHE 338 2HB PHE 38 -7.840 -7.219 -7.219 118 2HB PHE 338 1HB PHE 38 -9.161 -6.067 -6.067 119 HD1 PHE 338 HD2 PHE 38 -5.646 -6.818 -6.818 120 HD2 PHE 338 HD1 PHE 38 -9.059 -4.310 -4.310 121 HE1 PHE 338 HE2 PHE 38 -4.551 -5.911 -5.911 122 HE2 PHE 338 HE1 PHE 38 -7.963 -3.404 -3.404 123 HZ PHE 338 HZ PHE 38 -5.709 -4.204 -4.204 124 H GLU 339 H GLU 39 -9.804 -4.253 -4.253 125 HA GLU 339 HA GLU 39 -9.454 -1.813 -1.813 126 1HB GLU 339 2HB GLU 39 -11.226 -2.248 -2.248 127 2HB GLU 339 1HB GLU 39 -11.425 -1.024 -1.024 128 1HG GLU 339 2HG GLU 39 -11.444 -3.115 -3.115 129 2HG GLU 339 1HG GLU 39 -11.902 -3.974 -3.974 130 H MET 340 H MET 40 -8.832 -2.729 -2.729 131 HA MET 340 HA MET 40 -8.203 -0.199 -0.199 132 1HB MET 340 2HB MET 40 -6.807 -2.801 -2.801 133 2HB MET 340 1HB MET 40 -6.855 -1.372 -1.372 134 1HG MET 340 2HG MET 40 -9.427 -1.610 -1.610 135 2HG MET 340 1HG MET 40 -9.111 -3.238 -3.238 136 1HE MET 340 1HE MET 40 -6.740 -4.171 -4.171 137 2HE MET 340 3HE MET 40 -6.057 -2.865 -2.865 138 3HE MET 340 2HE MET 40 -6.550 -4.375 -4.375 139 H PHE 341 H PHE 41 -5.941 -2.555 -2.555 140 HA PHE 341 HA PHE 41 -3.663 -0.901 -0.901 141 1HB PHE 341 2HB PHE 41 -4.544 -3.287 -3.287 142 2HB PHE 341 1HB PHE 41 -3.031 -2.481 -2.481 143 HD1 PHE 341 HD1 PHE 41 -2.040 -1.659 -1.659 144 HD2 PHE 341 HD2 PHE 41 -4.013 -5.280 -5.280 145 HE1 PHE 341 HE1 PHE 41 -0.998 -2.867 -2.867 146 HE2 PHE 341 HE2 PHE 41 -2.978 -6.483 -6.483 147 HZ PHE 341 HZ PHE 41 -1.483 -5.280 -5.280 148 H ARG 342 H ARG 42 -6.251 -1.300 -1.300 149 HA ARG 342 HA ARG 42 -5.140 0.166 0.166 150 1HB ARG 342 2HB ARG 42 -7.690 -0.961 -0.961 151 2HB ARG 342 1HB ARG 42 -7.938 0.683 0.683 152 1HG ARG 342 2HG ARG 42 -6.253 -0.023 -0.023 153 2HG ARG 342 1HG ARG 42 -6.699 -1.664 -1.664 154 1HD ARG 342 2HD ARG 42 -8.480 -1.424 -1.424 155 2HD ARG 342 1HD ARG 42 -9.142 -0.347 -0.347 156 HE ARG 342 HE ARG 42 -7.599 1.376 1.376 157 1HH1 ARG 342 1HH2 ARG 42 -10.668 0.435 0.435 158 2HH1 ARG 342 2HH2 ARG 42 -10.769 0.545 0.545 159 1HH2 ARG 342 2HH1 ARG 42 -7.345 0.862 0.862 160 2HH2 ARG 342 1HH1 ARG 42 -8.889 0.787 0.787 161 H GLU 343 H GLU 43 -6.851 1.226 1.226 162 HA GLU 343 HA GLU 43 -7.118 3.982 3.982 163 1HB GLU 343 2HB GLU 43 -8.334 2.765 2.765 164 2HB GLU 343 1HB GLU 43 -6.869 3.063 3.063 165 1HG GLU 343 2HG GLU 43 -7.793 5.076 5.076 166 2HG GLU 343 1HG GLU 43 -7.346 5.523 5.523 167 H LEU 344 H LEU 44 -4.743 2.276 2.276 168 HA LEU 344 HA LEU 44 -3.101 4.522 4.522 169 1HB LEU 344 2HB LEU 44 -2.412 1.584 1.584 170 2HB LEU 344 1HB LEU 44 -1.265 2.788 2.788 171 HG LEU 344 HG LEU 44 -2.108 1.944 1.944 172 1HD1 LEU 344 2HD1 LEU 44 -2.529 4.492 4.492 173 2HD1 LEU 344 1HD1 LEU 44 -4.232 4.025 4.025 174 3HD1 LEU 344 3HD1 LEU 44 -3.221 3.726 3.726 175 1HD2 LEU 344 3HD2 LEU 44 -4.037 0.790 0.790 176 2HD2 LEU 344 2HD2 LEU 44 -4.150 0.922 0.922 177 3HD2 LEU 344 1HD2 LEU 44 -4.990 2.085 2.085 178 H ASN 345 H ASN 45 -3.266 2.397 2.397 179 HA ASN 345 HA ASN 45 -0.922 3.579 3.579 180 1HB ASN 345 2HB ASN 45 -2.869 1.423 1.423 181 2HB ASN 345 1HB ASN 45 -2.239 2.254 2.254 182 1HD2 ASN 345 2HD2 ASN 45 0.049 -0.549 -0.549 183 2HD2 ASN 345 1HD2 ASN 45 -1.647 -0.496 -0.496 184 H GLU 346 H GLU 46 -4.292 4.255 4.255 185 HA GLU 346 HA GLU 46 -4.572 5.697 5.697 186 1HB GLU 346 2HB GLU 46 -6.455 4.772 4.772 187 2HB GLU 346 1HB GLU 46 -6.188 6.179 6.179 188 1HG GLU 346 2HG GLU 46 -6.867 7.688 7.688 189 2HG GLU 346 1HG GLU 46 -6.587 6.528 6.528 190 H ALA 347 H ALA 47 -3.729 6.600 6.600 191 HA ALA 347 HA ALA 47 -3.566 9.449 9.449 192 1HB ALA 347 1HB ALA 47 -3.877 8.245 8.245 193 2HB ALA 347 3HB ALA 47 -2.118 8.136 8.136 194 3HB ALA 347 2HB ALA 47 -2.904 9.714 9.714 195 H LEU 348 H LEU 48 -1.182 6.814 6.814 196 HA LEU 348 HA LEU 48 1.157 8.346 8.346 197 1HB LEU 348 2HB LEU 48 0.458 5.512 5.512 198 2HB LEU 348 1HB LEU 48 2.072 6.193 6.193 199 HG LEU 348 HG LEU 48 0.592 6.075 6.075 200 1HD1 LEU 348 3HD1 LEU 48 2.295 4.140 4.140 201 2HD1 LEU 348 2HD1 LEU 48 2.813 4.473 4.473 202 3HD1 LEU 348 1HD1 LEU 48 1.180 3.883 3.883 203 1HD2 LEU 348 3HD2 LEU 48 3.409 6.872 6.872 204 2HD2 LEU 348 2HD2 LEU 48 2.168 7.917 7.917 205 3HD2 LEU 348 1HD2 LEU 48 2.883 6.635 6.635 206 H GLU 349 H GLU 49 -0.961 6.761 6.761 207 HA GLU 349 HA GLU 49 0.405 7.663 7.663 208 1HB GLU 349 2HB GLU 49 -2.306 6.612 6.612 209 2HB GLU 349 1HB GLU 49 -2.162 7.537 7.537 210 1HG GLU 349 2HG GLU 49 0.065 5.939 5.939 211 2HG GLU 349 1HG GLU 49 -1.094 4.873 4.873 212 H LEU 350 H LEU 50 -1.948 9.200 9.200 213 HA LEU 350 HA LEU 50 -2.531 11.412 11.412 214 1HB LEU 350 2HB LEU 50 -3.956 11.937 11.937 215 2HB LEU 350 1HB LEU 50 -3.395 10.484 10.484 216 HG LEU 350 HG LEU 50 -1.490 11.952 11.952 217 1HD1 LEU 350 1HD1 LEU 50 -3.181 13.872 13.872 218 2HD1 LEU 350 3HD1 LEU 50 -2.667 14.387 14.387 219 3HD1 LEU 350 2HD1 LEU 50 -1.463 13.960 13.960 220 1HD2 LEU 350 1HD2 LEU 50 -3.967 11.303 11.303 221 2HD2 LEU 350 3HD2 LEU 50 -2.725 12.135 12.135 222 3HD2 LEU 350 2HD2 LEU 50 -3.989 13.061 13.061 223 H LYS 351 H LYS 51 0.054 10.651 10.651 224 HA LYS 351 HA LYS 51 1.225 13.242 13.242 225 1HB LYS 351 2HB LYS 51 1.899 11.194 11.194 226 2HB LYS 351 1HB LYS 51 2.726 10.619 10.619 227 1HG LYS 351 2HG LYS 51 4.312 12.336 12.336 228 2HG LYS 351 1HG LYS 51 3.286 13.384 13.384 229 1HD LYS 351 2HD LYS 51 3.521 11.465 11.465 230 2HD LYS 351 1HD LYS 51 4.957 11.041 11.041 231 1HE LYS 351 2HE LYS 51 4.514 13.899 13.899 232 2HE LYS 351 1HE LYS 51 5.164 12.755 12.755 233 1HZ LYS 351 3HZ LYS 51 6.303 13.076 13.076 234 2HZ LYS 351 2HZ LYS 51 6.839 13.989 13.989 235 3HZ LYS 351 1HZ LYS 51 6.997 12.298 12.298 236 H ASP 352 H ASP 52 1.711 10.620 10.620 237 HA ASP 352 HA ASP 52 3.648 12.004 12.004 238 1HB ASP 352 2HB ASP 52 2.142 9.511 9.511 239 2HB ASP 352 1HB ASP 52 2.262 10.266 10.266 240 H ALA 353 H ALA 53 0.210 12.192 12.192 241 HA ALA 353 HA ALA 53 -0.021 13.738 13.738 242 1HB ALA 353 2HB ALA 53 -1.653 11.825 11.825 243 2HB ALA 353 1HB ALA 53 -2.383 13.228 13.228 244 3HB ALA 353 3HB ALA 53 -2.246 13.168 13.168 245 H GLN 354 H GLN 54 1.283 14.779 14.779 246 HA GLN 354 HA GLN 54 -0.636 16.715 16.715 247 1HB GLN 354 2HB GLN 54 2.164 15.881 15.881 248 2HB GLN 354 1HB GLN 54 1.747 17.550 17.550 249 1HG GLN 354 2HG GLN 54 -0.441 16.217 16.217 250 2HG GLN 354 1HG GLN 54 0.833 15.029 15.029 251 1HE2 GLN 354 2HE2 GLN 54 0.535 17.984 17.984 252 2HE2 GLN 354 1HE2 GLN 54 -0.722 17.365 17.365 253 H ALA 355 HN ALA 55 -0.811 17.333 17.333 254 HA ALA 355 HA ALA 55 1.212 19.438 19.438 255 1HB ALA 355 1HB ALA 55 0.770 17.686 17.686 256 2HB ALA 355 3HB ALA 55 -0.899 18.248 18.248 257 3HB ALA 355 2HB ALA 55 0.418 19.321 19.321 258 1H GLY 325 1H GLY 25 -15.374 -13.854 -13.854 259 2H GLY 325 3H GLY 25 -15.561 -14.153 -14.153 260 3H GLY 325 2H GLY 25 -15.087 -12.612 -12.612 261 1HA GLY 325 2HA GLY 25 -13.030 -13.313 -13.313 262 2HA GLY 325 1HA GLY 25 -13.508 -15.009 -15.009 263 H GLU 326 H GLU 26 -12.142 -12.341 -12.341 264 HA GLU 326 HA GLU 26 -11.766 -14.141 -14.141 265 1HB GLU 326 2HB GLU 26 -12.544 -11.220 -11.220 266 2HB GLU 326 1HB GLU 26 -11.809 -11.967 -11.967 267 1HG GLU 326 2HG GLU 26 -14.379 -12.834 -12.834 268 2HG GLU 326 1HG GLU 26 -14.239 -12.051 -12.051 269 H TYR 327 H TYR 27 -9.914 -13.098 -13.098 270 HA TYR 327 HA TYR 27 -7.724 -12.315 -12.315 271 1HB TYR 327 2HB TYR 27 -7.838 -14.114 -14.114 272 2HB TYR 327 1HB TYR 27 -6.354 -13.194 -13.194 273 HD1 TYR 327 HD1 TYR 27 -8.722 -15.568 -15.568 274 HD2 TYR 327 HD2 TYR 27 -4.812 -13.790 -13.790 275 HE1 TYR 327 HE1 TYR 27 -8.032 -17.164 -17.164 276 HE2 TYR 327 HE2 TYR 27 -4.123 -15.387 -15.387 277 HH TYR 327 HH TYR 27 -5.487 -18.116 -18.116 278 H PHE 328 H PHE 28 -6.783 -10.345 -10.345 279 HA PHE 328 HA PHE 28 -7.322 -9.014 -9.014 280 1HB PHE 328 2HB PHE 28 -7.169 -7.733 -7.733 281 2HB PHE 328 1HB PHE 28 -7.395 -6.867 -6.867 282 HD1 PHE 328 HD1 PHE 28 -9.467 -7.215 -7.215 283 HD2 PHE 328 HD2 PHE 28 -8.976 -8.917 -8.917 284 HE1 PHE 328 HE1 PHE 28 -11.911 -7.614 -7.614 285 HE2 PHE 328 HE2 PHE 28 -11.420 -9.315 -9.315 286 HZ PHE 328 HZ PHE 28 -12.888 -8.663 -8.663 287 H THR 329 H THR 29 -5.622 -7.581 -7.581 288 HA THR 329 HA THR 29 -2.959 -8.272 -8.272 289 HB THR 329 HB THR 29 -2.873 -6.909 -6.909 290 HG1 THR 329 HG1 THR 29 -4.593 -7.868 -7.868 291 1HG2 THR 329 2HG2 THR 29 -1.164 -8.412 -8.412 292 2HG2 THR 329 1HG2 THR 29 -2.094 -9.759 -9.759 293 3HG2 THR 329 3HG2 THR 29 -1.326 -8.601 -8.601 294 H LEU 330 H LEU 30 -1.600 -6.618 -6.618 295 HA LEU 330 HA LEU 30 -2.676 -3.837 -3.837 296 1HB LEU 330 2HB LEU 30 -1.913 -5.385 -5.385 297 2HB LEU 330 1HB LEU 30 -0.960 -3.906 -3.906 298 HG LEU 330 HG LEU 30 -3.949 -3.859 -3.859 299 1HD1 LEU 330 1HD1 LEU 30 -2.617 -4.629 -4.629 300 2HD1 LEU 330 3HD1 LEU 30 -3.131 -2.959 -2.959 301 3HD1 LEU 330 2HD1 LEU 30 -4.317 -4.195 -4.195 302 1HD2 LEU 330 2HD2 LEU 30 -1.743 -1.947 -1.947 303 2HD2 LEU 330 1HD2 LEU 30 -3.394 -1.711 -1.711 304 3HD2 LEU 330 3HD2 LEU 30 -3.027 -1.553 -1.553 305 H GLN 331 H GLN 31 -1.363 -3.522 -3.522 306 HA GLN 331 HA GLN 31 1.532 -3.916 -3.916 307 1HB GLN 331 2HB GLN 31 0.142 -4.145 -4.145 308 2HB GLN 331 1HB GLN 31 0.032 -2.385 -2.385 309 1HG GLN 331 2HG GLN 31 2.096 -2.220 -2.220 310 2HG GLN 331 1HG GLN 31 2.767 -3.172 -3.172 311 1HE2 GLN 331 2HE2 GLN 31 1.338 -5.482 -5.482 312 2HE2 GLN 331 1HE2 GLN 31 0.354 -4.266 -4.266 313 H ILE 332 H ILE 32 2.711 -2.485 -2.485 314 HA ILE 332 HA ILE 32 1.877 0.388 0.388 315 HB ILE 332 HB ILE 32 3.472 -1.106 -1.106 316 1HG1 ILE 332 2HG1 ILE 32 1.024 0.102 0.102 317 2HG1 ILE 332 1HG1 ILE 32 0.674 -0.942 -0.942 318 1HG2 ILE 332 3HG2 ILE 32 2.910 1.757 1.757 319 2HG2 ILE 332 2HG2 ILE 32 2.675 1.229 1.229 320 3HG2 ILE 332 1HG2 ILE 32 4.242 1.015 1.015 321 1HD1 ILE 332 1HD1 ILE 32 2.345 -2.576 -2.576 322 2HD1 ILE 332 3HD1 ILE 32 1.756 -1.652 -1.652 323 3HD1 ILE 332 2HD1 ILE 32 0.619 -2.532 -2.532 324 H ARG 333 H ARG 33 3.524 1.958 1.958 325 HA ARG 333 HA ARG 33 5.913 0.910 0.910 326 1HB ARG 333 2HB ARG 33 4.569 2.716 2.716 327 2HB ARG 333 1HB ARG 33 4.921 3.761 3.761 328 1HG ARG 333 2HG ARG 33 7.365 3.481 3.481 329 2HG ARG 333 1HG ARG 33 6.934 2.582 2.582 330 1HD ARG 333 2HD ARG 33 6.778 4.545 4.545 331 2HD ARG 333 1HD ARG 33 5.389 4.939 4.939 332 HE ARG 333 HE ARG 33 6.904 6.137 6.137 333 1HH1 ARG 333 2HH1 ARG 33 9.493 5.348 5.348 334 2HH1 ARG 333 1HH1 ARG 33 10.338 6.190 6.190 335 1HH2 ARG 333 1HH2 ARG 33 7.458 7.049 7.049 336 2HH2 ARG 333 2HH2 ARG 33 9.186 7.153 7.153 337 H GLY 334 H GLY 34 8.049 1.504 1.504 338 1HA GLY 334 2HA GLY 34 9.485 2.842 2.842 339 2HA GLY 334 1HA GLY 34 8.230 2.632 2.632 340 H ARG 335 H ARG 35 9.607 1.555 1.555 341 HA ARG 335 HA ARG 35 9.944 -1.303 -1.303 342 1HB ARG 335 2HB ARG 35 12.015 -0.107 -0.107 343 2HB ARG 335 1HB ARG 35 12.417 0.269 0.269 344 1HG ARG 335 2HG ARG 35 12.701 -1.992 -1.992 345 2HG ARG 335 1HG ARG 35 11.770 -2.557 -2.557 346 1HD ARG 335 2HD ARG 35 13.557 -1.743 -1.743 347 2HD ARG 335 1HD ARG 35 14.495 -1.229 -1.229 348 HE ARG 335 HE ARG 35 13.761 -4.096 -4.096 349 1HH1 ARG 335 1HH2 ARG 35 15.065 -3.389 -3.389 350 2HH1 ARG 335 2HH2 ARG 35 16.743 -3.645 -3.645 351 1HH2 ARG 335 2HH1 ARG 35 16.310 -3.641 -3.641 352 2HH2 ARG 335 1HH1 ARG 35 17.448 -3.787 -3.787 353 H GLU 336 H GLU 36 10.872 1.363 1.363 354 HA GLU 336 HA GLU 36 10.892 -0.336 -0.336 355 1HB GLU 336 2HB GLU 36 12.135 1.803 1.803 356 2HB GLU 336 1HB GLU 36 10.606 2.677 2.677 357 1HG GLU 336 2HG GLU 36 9.929 1.813 1.813 358 2HG GLU 336 1HG GLU 36 11.410 0.860 0.860 359 H ARG 337 H ARG 37 8.534 2.035 2.035 360 HA ARG 337 HA ARG 37 6.580 1.774 1.774 361 1HB ARG 337 2HB ARG 37 6.486 2.440 2.440 362 2HB ARG 337 1HB ARG 37 4.969 2.176 2.176 363 1HG ARG 337 2HG ARG 37 5.951 3.803 3.803 364 2HG ARG 337 1HG ARG 37 7.072 4.276 4.276 365 1HD ARG 337 2HD ARG 37 4.194 4.140 4.140 366 2HD ARG 337 1HD ARG 37 4.672 5.458 5.458 367 HE ARG 337 HE ARG 37 5.701 5.034 5.034 368 1HH1 ARG 337 2HH1 ARG 37 7.696 6.303 6.303 369 2HH1 ARG 337 1HH1 ARG 37 7.365 7.989 7.989 370 1HH2 ARG 337 1HH2 ARG 37 4.287 7.458 7.458 371 2HH2 ARG 337 2HH2 ARG 37 5.437 8.642 8.642 372 H PHE 338 H PHE 38 7.073 -0.217 -0.217 373 HA PHE 338 HA PHE 38 4.821 -1.925 -1.925 374 1HB PHE 338 2HB PHE 38 6.305 -1.921 -1.921 375 2HB PHE 338 1HB PHE 38 7.586 -2.652 -2.652 376 HD1 PHE 338 HD2 PHE 38 4.192 -3.173 -3.173 377 HD2 PHE 338 HD1 PHE 38 7.545 -4.982 -4.982 378 HE1 PHE 338 HE2 PHE 38 3.226 -5.419 -5.419 379 HE2 PHE 338 HE1 PHE 38 6.580 -7.228 -7.228 380 HZ PHE 338 HZ PHE 38 4.420 -7.446 -7.446 381 H GLU 339 H GLU 39 7.988 -1.962 -1.962 382 HA GLU 339 HA GLU 39 7.671 -4.535 -4.535 383 1HB GLU 339 2HB GLU 39 9.252 -2.172 -2.172 384 2HB GLU 339 1HB GLU 39 9.512 -3.877 -3.877 385 1HG GLU 339 2HG GLU 39 9.735 -4.073 -4.073 386 2HG GLU 339 1HG GLU 39 10.152 -2.365 -2.365 387 H MET 340 H MET 40 6.834 -1.227 -1.227 388 HA MET 340 HA MET 40 6.016 -1.756 -1.756 389 1HB MET 340 2HB MET 40 4.670 0.134 0.134 390 2HB MET 340 1HB MET 40 4.618 0.233 0.233 391 1HG MET 340 2HG MET 40 7.201 0.358 0.358 392 2HG MET 340 1HG MET 40 6.955 0.732 0.732 393 1HE MET 340 1HE MET 40 4.620 2.081 2.081 394 2HE MET 340 3HE MET 40 3.771 2.181 2.181 395 3HE MET 340 2HE MET 40 4.327 3.649 3.649 396 H PHE 341 H PHE 41 3.946 -1.634 -1.634 397 HA PHE 341 HA PHE 41 1.605 -2.682 -2.682 398 1HB PHE 341 2HB PHE 41 2.661 -2.735 -2.735 399 2HB PHE 341 1HB PHE 41 1.125 -3.495 -3.495 400 HD1 PHE 341 HD1 PHE 41 -0.011 -1.724 -1.724 401 HD2 PHE 341 HD2 PHE 41 2.173 -0.756 -0.756 402 HE1 PHE 341 HE1 PHE 41 -1.130 0.488 0.488 403 HE2 PHE 341 HE2 PHE 41 1.056 1.455 1.455 404 HZ PHE 341 HZ PHE 41 -0.595 2.076 2.076 405 H ARG 342 H ARG 42 4.445 -4.290 -4.290 406 HA ARG 342 HA ARG 42 3.393 -6.934 -6.934 407 1HB ARG 342 2HB ARG 42 5.946 -5.677 -5.677 408 2HB ARG 342 1HB ARG 42 6.151 -7.050 -7.050 409 1HG ARG 342 2HG ARG 42 4.655 -8.319 -8.319 410 2HG ARG 342 1HG ARG 42 5.131 -7.023 -7.023 411 1HD ARG 342 2HD ARG 42 6.997 -8.235 -8.235 412 2HD ARG 342 1HD ARG 42 7.523 -7.743 -7.743 413 HE ARG 342 HE ARG 42 6.025 -9.934 -9.934 414 1HH1 ARG 342 1HH2 ARG 42 9.146 -9.571 -9.571 415 2HH1 ARG 342 2HH2 ARG 42 9.382 -11.081 -11.081 416 1HH2 ARG 342 2HH1 ARG 42 5.995 -11.783 -11.783 417 2HH2 ARG 342 1HH1 ARG 42 7.598 -12.334 -12.334 418 H GLU 343 H GLU 43 4.821 -5.002 -5.002 419 HA GLU 343 HA GLU 43 5.037 -7.156 -7.156 420 1HB GLU 343 2HB GLU 43 6.146 -4.820 -4.820 421 2HB GLU 343 1HB GLU 43 4.604 -4.258 -4.258 422 1HG GLU 343 2HG GLU 43 5.430 -4.877 -4.877 423 2HG GLU 343 1HG GLU 43 5.080 -6.525 -6.525 424 H LEU 344 H LEU 44 2.574 -4.607 -4.607 425 HA LEU 344 HA LEU 44 0.807 -5.436 -5.436 426 1HB LEU 344 2HB LEU 44 0.229 -4.135 -4.135 427 2HB LEU 344 1HB LEU 44 -0.980 -4.352 -4.352 428 HG LEU 344 HG LEU 44 -0.239 -2.178 -2.178 429 1HD1 LEU 344 2HD1 LEU 44 0.194 -3.940 -3.940 430 2HD1 LEU 344 1HD1 LEU 44 1.880 -3.504 -3.504 431 3HD1 LEU 344 3HD1 LEU 44 0.712 -2.264 -2.264 432 1HD2 LEU 344 3HD2 LEU 44 1.752 -2.695 -2.695 433 2HD2 LEU 344 2HD2 LEU 44 1.834 -1.332 -1.332 434 3HD2 LEU 344 1HD2 LEU 44 2.672 -2.836 -2.836 435 H ASN 345 H ASN 45 1.321 -6.629 -6.629 436 HA ASN 345 HA ASN 45 -0.986 -8.437 -8.437 437 1HB ASN 345 2HB ASN 45 1.092 -7.696 -7.696 438 2HB ASN 345 1HB ASN 45 0.507 -9.357 -9.357 439 1HD2 ASN 345 2HD2 ASN 45 -1.732 -6.673 -6.673 440 2HD2 ASN 345 1HD2 ASN 45 -0.043 -6.648 -6.648 441 H GLU 346 H GLU 46 2.339 -8.466 -8.466 442 HA GLU 346 HA GLU 46 2.742 -11.331 -11.331 443 1HB GLU 346 2HB GLU 46 4.545 -9.510 -9.510 444 2HB GLU 346 1HB GLU 46 4.136 -9.397 -9.397 445 1HG GLU 346 2HG GLU 46 4.864 -11.582 -11.582 446 2HG GLU 346 1HG GLU 46 4.740 -12.071 -12.071 447 H ALA 347 H ALA 47 1.613 -9.035 -9.035 448 HA ALA 347 HA ALA 47 1.391 -11.050 -11.050 449 1HB ALA 347 1HB ALA 47 1.532 -8.437 -8.437 450 2HB ALA 347 3HB ALA 47 -0.213 -8.504 -8.504 451 3HB ALA 347 2HB ALA 47 0.523 -9.333 -9.333 452 H LEU 348 H LEU 48 -0.944 -9.417 -9.417 453 HA LEU 348 HA LEU 48 -3.295 -10.703 -10.703 454 1HB LEU 348 2HB LEU 48 -2.424 -9.819 -9.819 455 2HB LEU 348 1HB LEU 48 -4.034 -10.461 -10.461 456 HG LEU 348 HG LEU 48 -2.815 -8.096 -8.096 457 1HD1 LEU 348 3HD1 LEU 48 -4.285 -8.337 -8.337 458 2HD1 LEU 348 2HD1 LEU 48 -4.954 -7.148 -7.148 459 3HD1 LEU 348 1HD1 LEU 48 -3.274 -7.020 -7.020 460 1HD2 LEU 348 3HD2 LEU 48 -5.581 -9.340 -9.340 461 2HD2 LEU 348 2HD2 LEU 48 -4.475 -9.252 -9.252 462 3HD2 LEU 348 1HD2 LEU 48 -5.213 -7.781 -7.781 463 H GLU 349 H GLU 49 -0.925 -11.776 -11.776 464 HA GLU 349 HA GLU 49 -2.172 -14.268 -14.268 465 1HB GLU 349 2HB GLU 49 0.535 -13.079 -13.079 466 2HB GLU 349 1HB GLU 49 0.455 -14.840 -14.840 467 1HG GLU 349 2HG GLU 49 -1.672 -14.181 -14.181 468 2HG GLU 349 1HG GLU 49 -0.538 -12.883 -12.883 469 H LEU 350 H LEU 50 -0.013 -13.232 -13.232 470 HA LEU 350 HA LEU 50 0.578 -15.837 -15.837 471 1HB LEU 350 2HB LEU 50 1.817 -14.658 -14.658 472 2HB LEU 350 1HB LEU 50 1.293 -13.210 -13.210 473 HG LEU 350 HG LEU 50 -0.791 -13.312 -13.312 474 1HD1 LEU 350 1HD1 LEU 50 0.953 -15.456 -15.456 475 2HD1 LEU 350 3HD1 LEU 50 0.292 -14.362 -14.362 476 3HD1 LEU 350 2HD1 LEU 50 -0.792 -15.253 -15.253 477 1HD2 LEU 350 1HD2 LEU 50 1.619 -11.989 -11.989 478 2HD2 LEU 350 3HD2 LEU 50 0.243 -11.678 -11.678 479 3HD2 LEU 350 2HD2 LEU 50 1.534 -12.758 -12.758 480 H LYS 351 H LYS 51 -2.164 -13.679 -13.679 481 HA LYS 351 HA LYS 51 -3.443 -14.935 -14.935 482 1HB LYS 351 2HB LYS 51 -4.134 -12.744 -12.744 483 2HB LYS 351 1HB LYS 51 -4.826 -13.692 -13.692 484 1HG LYS 351 2HG LYS 51 -6.475 -14.633 -14.633 485 2HG LYS 351 1HG LYS 51 -5.569 -14.315 -14.315 486 1HD LYS 351 2HD LYS 51 -5.872 -11.797 -11.797 487 2HD LYS 351 1HD LYS 51 -7.208 -12.422 -12.422 488 1HE LYS 351 2HE LYS 51 -6.956 -13.254 -13.254 489 2HE LYS 351 1HE LYS 51 -7.643 -11.677 -11.677 490 1HZ LYS 351 3HZ LYS 51 -8.584 -14.184 -14.184 491 2HZ LYS 351 2HZ LYS 51 -9.259 -13.575 -13.575 492 3HZ LYS 351 1HZ LYS 51 -9.343 -12.666 -12.666 493 H ASP 352 H ASP 52 -3.630 -15.514 -15.514 494 HA ASP 352 HA ASP 52 -5.499 -17.694 -17.694 495 1HB ASP 352 2HB ASP 52 -3.878 -16.397 -16.397 496 2HB ASP 352 1HB ASP 52 -3.949 -18.146 -18.146 497 H ALA 353 H ALA 53 -2.113 -17.387 -17.387 498 HA ALA 353 HA ALA 53 -1.764 -20.345 -20.345 499 1HB ALA 353 2HB ALA 53 -0.124 -18.473 -18.473 500 2HB ALA 353 1HB ALA 53 0.514 -18.528 -18.528 501 3HB ALA 353 3HB ALA 53 0.479 -19.993 -19.993 502 H GLN 354 H GLN 54 -3.281 -18.878 -18.878 503 HA GLN 354 HA GLN 54 -1.533 -18.906 -18.906 504 1HB GLN 354 2HB GLN 54 -4.314 -18.076 -18.076 505 2HB GLN 354 1HB GLN 54 -4.037 -18.669 -18.669 506 1HG GLN 354 2HG GLN 54 -1.858 -17.058 -17.058 507 2HG GLN 354 1HG GLN 54 -3.066 -16.197 -16.197 508 1HE2 GLN 354 2HE2 GLN 54 -3.183 -15.595 -15.595 509 2HE2 GLN 354 1HE2 GLN 54 -1.811 -15.966 -15.966 510 H ALA 355 HN ALA 55 -1.196 -21.353 -21.353 511 HA ALA 355 HA ALA 55 -3.255 -23.077 -23.077 512 1HB ALA 355 1HB ALA 55 -2.602 -23.586 -23.586 513 2HB ALA 355 3HB ALA 55 -0.957 -23.886 -23.886 514 3HB ALA 355 2HB ALA 55 -2.277 -24.918 -24.918 515 1H GLY 325 1H GLY 25 13.233 -0.479 -0.479 516 2H GLY 325 3H GLY 25 13.441 -2.034 -2.034 517 3H GLY 325 2H GLY 25 12.921 -0.764 -0.764 518 1HA GLY 325 2HA GLY 25 10.888 -1.602 -1.602 519 2HA GLY 325 1HA GLY 25 11.410 -2.413 -2.413 520 H GLU 326 H GLU 26 9.958 0.444 0.444 521 HA GLU 326 HA GLU 26 9.603 1.454 1.454 522 1HB GLU 326 2HB GLU 26 10.315 3.004 3.004 523 2HB GLU 326 1HB GLU 26 9.584 3.782 3.782 524 1HG GLU 326 2HG GLU 26 12.186 2.226 2.226 525 2HG GLU 326 1HG GLU 26 12.012 3.971 3.971 526 H TYR 327 H TYR 27 7.715 3.180 3.180 527 HA TYR 327 HA TYR 27 5.527 1.976 1.976 528 1HB TYR 327 2HB TYR 27 5.656 3.012 3.012 529 2HB TYR 327 1HB TYR 27 4.155 3.264 3.264 530 HD1 TYR 327 HD1 TYR 27 6.594 0.663 0.663 531 HD2 TYR 327 HD2 TYR 27 2.645 1.473 1.473 532 HE1 TYR 327 HE1 TYR 27 5.959 -1.701 -1.701 533 HE2 TYR 327 HE2 TYR 27 2.011 -0.891 -0.891 534 HH TYR 327 HH TYR 27 3.435 -2.874 -2.874 535 H PHE 328 H PHE 28 4.536 3.312 3.312 536 HA PHE 328 HA PHE 28 5.021 6.252 6.252 537 1HB PHE 328 2HB PHE 28 4.857 4.620 4.620 538 2HB PHE 328 1HB PHE 28 5.043 6.372 6.372 539 HD1 PHE 328 HD1 PHE 28 7.112 7.369 7.369 540 HD2 PHE 328 HD2 PHE 28 6.707 3.145 3.145 541 HE1 PHE 328 HE1 PHE 28 9.567 7.099 7.099 542 HE2 PHE 328 HE2 PHE 28 9.163 2.875 2.875 543 HZ PHE 328 HZ PHE 28 10.592 4.851 4.851 544 H THR 329 H THR 29 3.286 7.617 7.617 545 HA THR 329 HA THR 29 0.644 6.219 6.219 546 HB THR 329 HB THR 29 0.572 9.129 9.129 547 HG1 THR 329 HG1 THR 29 2.263 9.224 9.224 548 1HG2 THR 329 2HG2 THR 29 -1.149 7.239 7.239 549 2HG2 THR 329 1HG2 THR 29 -0.244 7.107 7.107 550 3HG2 THR 329 3HG2 THR 29 -1.022 8.630 8.630 551 H LEU 330 H LEU 30 -0.700 6.438 6.438 552 HA LEU 330 HA LEU 30 0.256 8.228 8.228 553 1HB LEU 330 2HB LEU 30 -0.444 5.402 5.402 554 2HB LEU 330 1HB LEU 30 -1.433 6.299 6.299 555 HG LEU 330 HG LEU 30 1.549 6.717 6.717 556 1HD1 LEU 330 1HD1 LEU 30 0.287 4.261 4.261 557 2HD1 LEU 330 3HD1 LEU 30 0.762 4.991 4.991 558 3HD1 LEU 330 2HD1 LEU 30 1.970 4.705 4.705 559 1HD2 LEU 330 2HD2 LEU 30 -0.705 7.592 7.592 560 2HD2 LEU 330 1HD2 LEU 30 0.935 8.236 8.236 561 3HD2 LEU 330 3HD2 LEU 30 0.572 6.872 6.872 562 H GLN 331 H GLN 31 -1.077 9.978 9.978 563 HA GLN 331 HA GLN 31 -3.966 9.542 9.542 564 1HB GLN 331 2HB GLN 31 -2.592 11.229 11.229 565 2HB GLN 331 1HB GLN 31 -2.514 12.192 12.192 566 1HG GLN 331 2HG GLN 31 -4.588 12.986 12.986 567 2HG GLN 331 1HG GLN 31 -5.231 11.347 11.347 568 1HE2 GLN 331 2HE2 GLN 31 -3.780 12.713 12.713 569 2HE2 GLN 331 1HE2 GLN 31 -2.817 12.837 12.837 570 H ILE 332 H ILE 32 -5.159 9.288 9.288 571 HA ILE 332 HA ILE 32 -4.398 10.904 10.904 572 HB ILE 332 HB ILE 32 -5.944 8.298 8.298 573 1HG1 ILE 332 2HG1 ILE 32 -3.511 8.222 8.222 574 2HG1 ILE 332 1HG1 ILE 32 -3.155 8.828 8.828 575 1HG2 ILE 332 3HG2 ILE 32 -5.440 10.291 10.291 576 2HG2 ILE 332 2HG2 ILE 32 -5.183 8.607 8.607 577 3HG2 ILE 332 1HG2 ILE 32 -6.752 9.124 9.124 578 1HD1 ILE 332 1HD1 ILE 32 -4.775 6.818 6.818 579 2HD1 ILE 332 3HD1 ILE 32 -4.201 6.162 6.162 580 3HD1 ILE 332 2HD1 ILE 32 -3.049 6.568 6.568 581 H ARG 333 H ARG 33 -6.088 11.969 11.969 582 HA ARG 333 HA ARG 33 -8.461 12.547 12.547 583 1HB ARG 333 2HB ARG 33 -7.172 14.439 14.439 584 2HB ARG 333 1HB ARG 33 -7.536 13.839 13.839 585 1HG ARG 333 2HG ARG 33 -9.978 14.039 14.039 586 2HG ARG 333 1HG ARG 33 -9.537 14.788 14.788 587 1HD ARG 333 2HD ARG 33 -9.444 16.769 16.769 588 2HD ARG 333 1HD ARG 33 -8.054 16.160 16.160 589 HE ARG 333 HE ARG 33 -9.582 15.502 15.502 590 1HH1 ARG 333 2HH1 ARG 33 -12.150 14.967 14.967 591 2HH1 ARG 333 1HH1 ARG 33 -13.029 16.460 16.460 592 1HH2 ARG 333 1HH2 ARG 33 -10.187 18.441 18.441 593 2HH2 ARG 333 2HH2 ARG 33 -11.917 18.427 18.427 594 H GLY 334 H GLY 34 -10.604 12.275 12.275 595 1HA GLY 334 2HA GLY 34 -12.064 11.673 11.673 596 2HA GLY 334 1HA GLY 34 -10.797 10.554 10.554 597 H ARG 335 H ARG 35 -12.122 8.689 8.689 598 HA ARG 335 HA ARG 35 -12.400 7.597 7.597 599 1HB ARG 335 2HB ARG 35 -14.509 8.990 8.990 600 2HB ARG 335 1HB ARG 35 -14.907 7.776 7.776 601 1HG ARG 335 2HG ARG 35 -15.127 6.064 6.064 602 2HG ARG 335 1HG ARG 35 -14.200 6.948 6.948 603 1HD ARG 335 2HD ARG 35 -16.024 8.617 8.617 604 2HD ARG 335 1HD ARG 35 -16.957 7.696 7.696 605 HE ARG 335 HE ARG 35 -16.156 6.528 6.528 606 1HH1 ARG 335 1HH2 ARG 35 -17.452 4.718 4.718 607 2HH1 ARG 335 2HH2 ARG 35 -19.127 4.834 4.834 608 1HH2 ARG 335 2HH1 ARG 35 -18.729 7.743 7.743 609 2HH2 ARG 335 1HH1 ARG 35 -19.851 6.549 6.549 610 H GLU 336 H GLU 36 -13.375 7.164 7.164 611 HA GLU 336 HA GLU 36 -13.337 4.275 4.275 612 1HB GLU 336 2HB GLU 36 -14.628 5.482 5.482 613 2HB GLU 336 1HB GLU 36 -13.122 6.077 6.077 614 1HG GLU 336 2HG GLU 36 -12.397 3.784 3.784 615 2HG GLU 336 1HG GLU 36 -13.855 3.149 3.149 616 H ARG 337 H ARG 37 -11.053 6.674 6.674 617 HA ARG 337 HA ARG 37 -9.069 4.884 4.884 618 1HB ARG 337 2HB ARG 37 -9.027 7.708 7.708 619 2HB ARG 337 1HB ARG 37 -7.493 6.875 6.875 620 1HG ARG 337 2HG ARG 37 -8.484 6.228 6.228 621 2HG ARG 337 1HG ARG 37 -9.629 7.536 7.536 622 1HD ARG 337 2HD ARG 37 -6.756 8.143 8.143 623 2HD ARG 337 1HD ARG 37 -7.252 7.945 7.945 624 HE ARG 337 HE ARG 37 -8.293 10.024 10.024 625 1HH1 ARG 337 1HH1 ARG 37 -10.013 10.196 10.196 626 2HH1 ARG 337 2HH1 ARG 37 -10.300 9.090 9.090 627 1HH2 ARG 337 1HH2 ARG 37 -6.937 11.240 11.240 628 2HH2 ARG 337 2HH2 ARG 37 -8.108 11.414 11.414 629 H PHE 338 H PHE 38 -9.558 6.255 6.255 630 HA PHE 338 HA PHE 38 -7.255 5.148 5.148 631 1HB PHE 338 2HB PHE 38 -8.750 6.784 6.784 632 2HB PHE 338 1HB PHE 38 -10.004 5.548 5.548 633 HD1 PHE 338 HD2 PHE 38 -6.607 6.514 6.514 634 HD2 PHE 338 HD1 PHE 38 -9.896 3.796 3.796 635 HE1 PHE 338 HE2 PHE 38 -5.588 5.668 5.668 636 HE2 PHE 338 HE1 PHE 38 -8.876 2.950 2.950 637 HZ PHE 338 HZ PHE 38 -6.722 3.886 3.886 638 H GLU 339 H GLU 39 -10.401 3.713 3.713 639 HA GLU 339 HA GLU 39 -10.000 1.283 1.283 640 1HB GLU 339 2HB GLU 39 -11.628 1.625 1.625 641 2HB GLU 339 1HB GLU 39 -11.841 0.391 0.391 642 1HG GLU 339 2HG GLU 39 -12.093 2.502 2.502 643 2HG GLU 339 1HG GLU 39 -12.545 3.300 3.300 644 H MET 340 H MET 40 -9.227 2.257 2.257 645 HA MET 340 HA MET 40 -8.370 -0.250 -0.250 646 1HB MET 340 2HB MET 40 -7.083 2.440 2.440 647 2HB MET 340 1HB MET 40 -7.022 1.010 1.010 648 1HG MET 340 2HG MET 40 -9.605 1.141 1.141 649 2HG MET 340 1HG MET 40 -9.386 2.782 2.782 650 1HE MET 340 1HE MET 40 -7.079 3.891 3.891 651 2HE MET 340 3HE MET 40 -6.227 2.658 2.658 652 3HE MET 340 2HE MET 40 -6.819 4.118 4.118 653 H PHE 341 H PHE 41 -6.344 2.312 2.312 654 HA PHE 341 HA PHE 41 -3.968 0.780 0.780 655 1HB PHE 341 2HB PHE 41 -5.045 3.114 3.114 656 2HB PHE 341 1HB PHE 41 -3.489 2.383 2.383 657 HD1 PHE 341 HD1 PHE 41 -2.387 1.647 1.647 658 HD2 PHE 341 HD2 PHE 41 -4.606 5.150 5.150 659 HE1 PHE 341 HE1 PHE 41 -1.325 2.907 2.907 660 HE2 PHE 341 HE2 PHE 41 -3.544 6.413 6.413 661 HZ PHE 341 HZ PHE 41 -1.902 5.295 5.295 662 H ARG 342 H ARG 42 -6.786 0.957 0.957 663 HA ARG 342 HA ARG 42 -5.674 -0.420 -0.420 664 1HB ARG 342 2HB ARG 42 -8.255 0.525 0.525 665 2HB ARG 342 1HB ARG 42 -8.415 -1.131 -1.131 666 1HG ARG 342 2HG ARG 42 -6.900 -0.303 -0.303 667 2HG ARG 342 1HG ARG 42 -7.426 1.304 1.304 668 1HD ARG 342 2HD ARG 42 -9.259 0.945 0.945 669 2HD ARG 342 1HD ARG 42 -9.782 -0.159 -0.159 670 HE ARG 342 HE ARG 42 -8.221 -1.796 -1.796 671 1HH1 ARG 342 1HH2 ARG 42 -11.358 -1.063 -1.063 672 2HH1 ARG 342 2HH2 ARG 42 -11.565 -1.191 -1.191 673 1HH2 ARG 342 2HH1 ARG 42 -8.164 -1.286 -1.286 674 2HH2 ARG 342 1HH1 ARG 42 -9.756 -1.320 -1.320 675 H GLU 343 H GLU 43 -7.105 -1.560 -1.560 676 HA GLU 343 HA GLU 43 -7.248 -4.335 -4.335 677 1HB GLU 343 2HB GLU 43 -8.411 -3.165 -3.165 678 2HB GLU 343 1HB GLU 43 -6.876 -3.379 -3.379 679 1HG GLU 343 2HG GLU 43 -7.673 -5.427 -5.427 680 2HG GLU 343 1HG GLU 43 -7.284 -5.870 -5.870 681 H LEU 344 H LEU 44 -4.866 -2.456 -2.456 682 HA LEU 344 HA LEU 44 -3.041 -4.590 -4.590 683 1HB LEU 344 2HB LEU 44 -2.564 -1.615 -1.615 684 2HB LEU 344 1HB LEU 44 -1.310 -2.744 -2.744 685 HG LEU 344 HG LEU 44 -2.093 -1.962 -1.962 686 1HD1 LEU 344 2HD1 LEU 44 -2.437 -4.543 -4.543 687 2HD1 LEU 344 1HD1 LEU 44 -4.142 -4.133 -4.133 688 3HD1 LEU 344 3HD1 LEU 44 -3.008 -3.816 -3.816 689 1HD2 LEU 344 3HD2 LEU 44 -4.163 -0.922 -0.922 690 2HD2 LEU 344 2HD2 LEU 44 -4.165 -1.043 -1.043 691 3HD2 LEU 344 1HD2 LEU 44 -5.000 -2.259 -2.259 692 H ASN 345 H ASN 45 -3.573 -2.510 -2.510 693 HA ASN 345 HA ASN 45 -1.213 -3.521 -3.521 694 1HB ASN 345 2HB ASN 45 -3.327 -1.500 -1.500 695 2HB ASN 345 1HB ASN 45 -2.724 -2.308 -2.308 696 1HD2 ASN 345 2HD2 ASN 45 -0.539 0.649 0.649 697 2HD2 ASN 345 1HD2 ASN 45 -2.224 0.485 0.485 698 H GLU 346 H GLU 46 -4.522 -4.402 -4.402 699 HA GLU 346 HA GLU 46 -4.843 -5.889 -5.889 700 1HB GLU 346 2HB GLU 46 -6.697 -5.068 -5.068 701 2HB GLU 346 1HB GLU 46 -6.276 -6.434 -6.434 702 1HG GLU 346 2HG GLU 46 -6.940 -8.016 -8.016 703 2HG GLU 346 1HG GLU 46 -6.831 -6.857 -6.857 704 H ALA 347 H ALA 47 -3.755 -6.675 -6.675 705 HA ALA 347 HA ALA 47 -3.468 -9.513 -9.513 706 1HB ALA 347 1HB ALA 47 -3.715 -8.285 -8.285 707 2HB ALA 347 3HB ALA 47 -1.968 -8.079 -8.079 708 3HB ALA 347 2HB ALA 47 -2.666 -9.698 -9.698 709 H LEU 348 H LEU 48 -1.214 -6.745 -6.745 710 HA LEU 348 HA LEU 48 1.185 -8.143 -8.143 711 1HB LEU 348 2HB LEU 48 0.274 -5.356 -5.356 712 2HB LEU 348 1HB LEU 48 1.900 -5.947 -5.947 713 HG LEU 348 HG LEU 48 0.644 -5.917 -5.917 714 1HD1 LEU 348 3HD1 LEU 48 2.100 -3.878 -3.878 715 2HD1 LEU 348 2HD1 LEU 48 2.751 -4.163 -4.163 716 3HD1 LEU 348 1HD1 LEU 48 1.065 -3.685 -3.685 717 1HD2 LEU 348 3HD2 LEU 48 3.430 -6.522 -6.522 718 2HD2 LEU 348 2HD2 LEU 48 2.336 -7.638 -7.638 719 3HD2 LEU 348 1HD2 LEU 48 3.048 -6.294 -6.294 720 H GLU 349 H GLU 49 -1.181 -6.724 -6.724 721 HA GLU 349 HA GLU 49 0.123 -7.526 -7.526 722 1HB GLU 349 2HB GLU 49 -2.618 -6.672 -6.672 723 2HB GLU 349 1HB GLU 49 -2.494 -7.603 -7.603 724 1HG GLU 349 2HG GLU 49 -0.400 -5.860 -5.860 725 2HG GLU 349 1HG GLU 49 -1.568 -4.864 -4.864 726 H LEU 350 H LEU 50 -2.050 -9.200 -9.200 727 HA LEU 350 HA LEU 50 -2.552 -11.486 -11.486 728 1HB LEU 350 2HB LEU 50 -3.804 -12.126 -12.126 729 2HB LEU 350 1HB LEU 50 -3.317 -10.624 -10.624 730 HG LEU 350 HG LEU 50 -1.216 -11.951 -11.951 731 1HD1 LEU 350 1HD1 LEU 50 -2.913 -14.027 -14.027 732 2HD1 LEU 350 3HD1 LEU 50 -2.269 -14.445 -14.445 733 3HD1 LEU 350 2HD1 LEU 50 -1.171 -14.013 -14.013 734 1HD2 LEU 350 1HD2 LEU 50 -3.646 -11.397 -11.397 735 2HD2 LEU 350 3HD2 LEU 50 -2.266 -12.099 -12.099 736 3HD2 LEU 350 2HD2 LEU 50 -3.534 -13.145 -13.145 737 H LYS 351 H LYS 51 0.141 -10.535 -10.535 738 HA LYS 351 HA LYS 51 1.474 -13.058 -13.058 739 1HB LYS 351 2HB LYS 51 2.099 -10.954 -10.954 740 2HB LYS 351 1HB LYS 51 2.802 -10.340 -10.340 741 1HG LYS 351 2HG LYS 51 4.489 -11.962 -11.962 742 2HG LYS 351 1HG LYS 51 3.590 -13.056 -13.056 743 1HD LYS 351 2HD LYS 51 3.821 -11.113 -11.113 744 2HD LYS 351 1HD LYS 51 5.163 -10.605 -10.605 745 1HE LYS 351 2HE LYS 51 4.961 -13.479 -13.479 746 2HE LYS 351 1HE LYS 51 5.605 -12.288 -12.288 747 1HZ LYS 351 3HZ LYS 51 6.594 -12.548 -12.548 748 2HZ LYS 351 2HZ LYS 51 7.269 -13.418 -13.418 749 3HZ LYS 351 1HZ LYS 51 7.316 -11.719 -11.719 750 H ASP 352 H ASP 52 1.633 -10.417 -10.417 751 HA ASP 352 HA ASP 52 3.554 -11.707 -11.707 752 1HB ASP 352 2HB ASP 52 1.883 -9.311 -9.311 753 2HB ASP 352 1HB ASP 52 1.999 -10.067 -10.067 754 H ALA 353 H ALA 53 0.176 -12.131 -12.131 755 HA ALA 353 HA ALA 53 -0.104 -13.695 -13.695 756 1HB ALA 353 2HB ALA 53 -1.800 -11.853 -11.853 757 2HB ALA 353 1HB ALA 53 -2.423 -13.281 -13.281 758 3HB ALA 353 3HB ALA 53 -2.358 -13.241 -13.241 759 H GLN 354 H GLN 54 1.397 -14.618 -14.618 760 HA GLN 354 HA GLN 54 -0.327 -16.657 -16.657 761 1HB GLN 354 2HB GLN 54 2.424 -15.621 -15.621 762 2HB GLN 354 1HB GLN 54 2.187 -17.327 -17.327 763 1HG GLN 354 2HG GLN 54 -0.039 -16.221 -16.221 764 2HG GLN 354 1HG GLN 54 1.140 -14.929 -14.929 765 1HE2 GLN 354 2HE2 GLN 54 1.275 -17.905 -17.905 766 2HE2 GLN 354 1HE2 GLN 54 -0.094 -17.377 -17.377 767 H ALA 355 HN ALA 55 -0.610 -17.307 -17.307 768 HA ALA 355 HA ALA 55 1.500 -19.288 -19.288 769 1HB ALA 355 1HB ALA 55 0.843 -17.579 -17.579 770 2HB ALA 355 3HB ALA 55 -0.790 -18.244 -18.244 771 3HB ALA 355 2HB ALA 55 0.558 -19.237 -19.237 772 1H GLY 325 1H GLY 25 -16.758 12.846 12.846 773 2H GLY 325 3H GLY 25 -16.853 13.135 13.135 774 3H GLY 325 2H GLY 25 -16.305 11.631 11.631 775 1HA GLY 325 2HA GLY 25 -14.276 12.482 12.482 776 2HA GLY 325 1HA GLY 25 -14.880 14.138 14.138 777 H GLU 326 H GLU 26 -13.449 11.566 11.566 778 HA GLU 326 HA GLU 26 -13.354 13.383 13.383 779 1HB GLU 326 2HB GLU 26 -13.934 10.418 10.418 780 2HB GLU 326 1HB GLU 26 -13.349 11.212 11.212 781 1HG GLU 326 2HG GLU 26 -15.871 11.906 11.906 782 2HG GLU 326 1HG GLU 26 -15.788 11.132 11.132 783 H TYR 327 H TYR 27 -11.543 12.460 12.460 784 HA TYR 327 HA TYR 27 -9.185 11.818 11.818 785 1HB TYR 327 2HB TYR 27 -9.573 13.606 13.606 786 2HB TYR 327 1HB TYR 27 -8.019 12.785 12.785 787 HD1 TYR 327 HD1 TYR 27 -10.428 14.994 14.994 788 HD2 TYR 327 HD2 TYR 27 -6.412 13.480 13.480 789 HE1 TYR 327 HE1 TYR 27 -9.729 16.630 16.630 790 HE2 TYR 327 HE2 TYR 27 -5.714 15.117 15.117 791 HH TYR 327 HH TYR 27 -7.200 17.748 17.748 792 H PHE 328 H PHE 28 -8.147 9.914 9.914 793 HA PHE 328 HA PHE 28 -8.774 8.548 8.548 794 1HB PHE 328 2HB PHE 28 -8.346 7.294 7.294 795 2HB PHE 328 1HB PHE 28 -8.608 6.404 6.404 796 HD1 PHE 328 HD1 PHE 28 -10.786 6.608 6.608 797 HD2 PHE 328 HD2 PHE 28 -10.159 8.348 8.348 798 HE1 PHE 328 HE1 PHE 28 -13.237 6.845 6.845 799 HE2 PHE 328 HE2 PHE 28 -12.610 8.584 8.584 800 HZ PHE 328 HZ PHE 28 -14.150 7.833 7.833 801 H THR 329 H THR 29 -7.038 7.224 7.224 802 HA THR 329 HA THR 29 -4.352 8.112 8.112 803 HB THR 329 HB THR 29 -4.427 6.777 6.777 804 HG1 THR 329 HG1 THR 29 -6.212 7.700 7.700 805 1HG2 THR 329 2HG2 THR 29 -2.673 8.335 8.335 806 2HG2 THR 329 1HG2 THR 29 -3.686 9.640 9.640 807 3HG2 THR 329 3HG2 THR 29 -2.947 8.492 8.492 808 H LEU 330 H LEU 30 -2.885 6.569 6.569 809 HA LEU 330 HA LEU 30 -3.740 3.713 3.713 810 1HB LEU 330 2HB LEU 30 -2.925 5.281 5.281 811 2HB LEU 330 1HB LEU 30 -1.890 3.869 3.869 812 HG LEU 330 HG LEU 30 -4.888 3.622 3.622 813 1HD1 LEU 330 1HD1 LEU 30 -3.475 4.462 4.462 814 2HD1 LEU 330 3HD1 LEU 30 -3.864 2.759 2.759 815 3HD1 LEU 330 2HD1 LEU 30 -5.150 3.918 3.918 816 1HD2 LEU 330 2HD2 LEU 30 -2.552 1.870 1.870 817 2HD2 LEU 330 1HD2 LEU 30 -4.216 1.519 1.519 818 3HD2 LEU 330 3HD2 LEU 30 -3.725 1.380 1.380 819 H GLN 331 H GLN 31 -2.543 3.440 3.440 820 HA GLN 331 HA GLN 31 0.329 4.054 4.054 821 1HB GLN 331 2HB GLN 31 -1.214 4.205 4.205 822 2HB GLN 331 1HB GLN 31 -1.218 2.441 2.441 823 1HG GLN 331 2HG GLN 31 0.787 2.402 2.402 824 2HG GLN 331 1HG GLN 31 1.489 3.393 3.393 825 1HE2 GLN 331 2HE2 GLN 31 -0.289 5.612 5.612 826 2HE2 GLN 331 1HE2 GLN 31 -1.147 4.335 4.335 827 H ILE 332 H ILE 32 1.671 2.706 2.706 828 HA ILE 332 HA ILE 32 1.024 -0.215 -0.215 829 HB ILE 332 HB ILE 32 2.663 1.377 1.377 830 1HG1 ILE 332 2HG1 ILE 32 0.362 0.020 0.020 831 2HG1 ILE 332 1HG1 ILE 32 -0.144 1.037 1.037 832 1HG2 ILE 332 3HG2 ILE 32 2.247 -1.514 -1.514 833 2HG2 ILE 332 2HG2 ILE 32 2.089 -1.007 -1.007 834 3HG2 ILE 332 1HG2 ILE 32 3.585 -0.692 -0.692 835 1HD1 ILE 332 1HD1 ILE 32 1.502 2.775 2.775 836 2HD1 ILE 332 3HD1 ILE 32 1.071 1.817 1.817 837 3HD1 ILE 332 2HD1 ILE 32 -0.188 2.620 2.620 838 H ARG 333 H ARG 33 2.752 -1.678 -1.678 839 HA ARG 333 HA ARG 33 4.959 -0.474 -0.474 840 1HB ARG 333 2HB ARG 33 3.670 -2.362 -2.362 841 2HB ARG 333 1HB ARG 33 4.186 -3.387 -3.387 842 1HG ARG 333 2HG ARG 33 6.567 -2.937 -2.937 843 2HG ARG 333 1HG ARG 33 5.976 -2.066 -2.066 844 1HD ARG 333 2HD ARG 33 5.881 -4.032 -4.032 845 2HD ARG 333 1HD ARG 33 4.594 -4.522 -4.522 846 HE ARG 333 HE ARG 33 6.284 -5.621 -5.621 847 1HH1 ARG 333 2HH1 ARG 33 8.812 -4.654 -4.654 848 2HH1 ARG 333 1HH1 ARG 33 9.626 -5.432 -5.432 849 1HH2 ARG 333 1HH2 ARG 33 6.700 -6.485 -6.485 850 2HH2 ARG 333 2HH2 ARG 33 8.430 -6.470 -6.470 851 H GLY 334 H GLY 34 7.166 -0.920 -0.920 852 1HA GLY 334 2HA GLY 34 8.801 -2.161 -2.161 853 2HA GLY 334 1HA GLY 34 7.630 -2.040 -2.040 854 H ARG 335 H ARG 35 9.015 -0.870 -0.870 855 HA ARG 335 HA ARG 35 9.134 2.004 2.004 856 1HB ARG 335 2HB ARG 35 11.213 0.947 0.947 857 2HB ARG 335 1HB ARG 35 11.750 0.597 0.597 858 1HG ARG 335 2HG ARG 35 11.924 2.871 2.871 859 2HG ARG 335 1HG ARG 35 10.863 3.374 3.374 860 1HD ARG 335 2HD ARG 35 12.591 2.695 2.695 861 2HD ARG 335 1HD ARG 35 13.656 2.233 2.233 862 HE ARG 335 HE ARG 35 12.705 5.048 5.048 863 1HH1 ARG 335 1HH2 ARG 35 14.220 4.426 4.426 864 2HH1 ARG 335 2HH2 ARG 35 15.851 4.793 4.793 865 1HH2 ARG 335 2HH1 ARG 35 15.193 4.767 4.767 866 2HH2 ARG 335 1HH1 ARG 35 16.402 4.985 4.985 867 H GLU 336 H GLU 36 10.389 -0.597 -0.597 868 HA GLU 336 HA GLU 36 10.455 1.095 1.095 869 1HB GLU 336 2HB GLU 36 11.825 -0.959 -0.959 870 2HB GLU 336 1HB GLU 36 10.353 -1.932 -1.932 871 1HG GLU 336 2HG GLU 36 9.762 -1.119 -1.119 872 2HG GLU 336 1HG GLU 36 11.183 -0.073 -0.073 873 H ARG 337 H ARG 37 8.183 -1.432 -1.432 874 HA ARG 337 HA ARG 37 6.350 -1.298 -1.298 875 1HB ARG 337 2HB ARG 37 6.110 -1.969 -1.969 876 2HB ARG 337 1HB ARG 37 4.638 -1.802 -1.802 877 1HG ARG 337 2HG ARG 37 5.837 -3.363 -3.363 878 2HG ARG 337 1HG ARG 37 6.896 -3.764 -3.764 879 1HD ARG 337 2HD ARG 37 3.972 -3.807 -3.807 880 2HD ARG 337 1HD ARG 37 4.603 -5.094 -5.094 881 HE ARG 337 HE ARG 37 5.408 -4.606 -4.606 882 1HH1 ARG 337 2HH1 ARG 37 7.605 -5.739 -5.739 883 2HH1 ARG 337 1HH1 ARG 37 7.375 -7.443 -7.443 884 1HH2 ARG 337 1HH2 ARG 37 4.175 -7.119 -7.119 885 2HH2 ARG 337 2HH2 ARG 37 5.433 -8.224 -8.224 886 H PHE 338 H PHE 38 6.529 0.725 0.725 887 HA PHE 338 HA PHE 38 4.186 2.256 2.256 888 1HB PHE 338 2HB PHE 38 5.517 2.376 2.376 889 2HB PHE 338 1HB PHE 38 6.810 3.189 3.189 890 HD1 PHE 338 HD2 PHE 38 3.296 3.482 3.482 891 HD2 PHE 338 HD1 PHE 38 6.651 5.509 5.509 892 HE1 PHE 338 HE2 PHE 38 2.154 5.658 5.658 893 HE2 PHE 338 HE1 PHE 38 5.508 7.685 7.685 894 HZ PHE 338 HZ PHE 38 3.260 7.760 7.760 895 H GLU 339 H GLU 39 7.440 2.534 2.534 896 HA GLU 339 HA GLU 39 7.030 5.072 5.072 897 1HB GLU 339 2HB GLU 39 8.829 2.821 2.821 898 2HB GLU 339 1HB GLU 39 8.999 4.541 4.541 899 1HG GLU 339 2HG GLU 39 9.036 4.745 4.745 900 2HG GLU 339 1HG GLU 39 9.570 3.067 3.067 901 H MET 340 H MET 40 6.484 1.711 1.711 902 HA MET 340 HA MET 40 5.805 2.186 2.186 903 1HB MET 340 2HB MET 40 4.458 0.209 0.209 904 2HB MET 340 1HB MET 40 4.532 0.109 0.109 905 1HG MET 340 2HG MET 40 7.101 0.149 0.149 906 2HG MET 340 1HG MET 40 6.770 -0.232 -0.232 907 1HE MET 340 1HE MET 40 4.493 -1.724 -1.724 908 2HE MET 340 3HE MET 40 3.771 -1.897 -1.897 909 3HE MET 340 2HE MET 40 4.362 -3.315 -3.315 910 H PHE 341 H PHE 41 3.563 1.952 1.952 911 HA PHE 341 HA PHE 41 1.247 2.838 2.838 912 1HB PHE 341 2HB PHE 41 2.097 2.955 2.955 913 2HB PHE 341 1HB PHE 41 0.548 3.616 3.616 914 HD1 PHE 341 HD1 PHE 41 -0.315 1.796 1.796 915 HD2 PHE 341 HD2 PHE 41 1.650 0.933 0.933 916 HE1 PHE 341 HE1 PHE 41 -1.284 -0.484 -0.484 917 HE2 PHE 341 HE2 PHE 41 0.679 -1.348 -1.348 918 HZ PHE 341 HZ PHE 41 -0.788 -2.057 -2.057 919 H ARG 342 H ARG 42 3.885 4.633 4.633 920 HA ARG 342 HA ARG 42 2.663 7.216 7.216 921 1HB ARG 342 2HB ARG 42 5.260 6.113 6.113 922 2HB ARG 342 1HB ARG 42 5.443 7.507 7.507 923 1HG ARG 342 2HG ARG 42 3.744 8.650 8.650 924 2HG ARG 342 1HG ARG 42 4.239 7.381 7.381 925 1HD ARG 342 2HD ARG 42 5.976 8.729 8.729 926 2HD ARG 342 1HD ARG 42 6.648 8.275 8.275 927 HE ARG 342 HE ARG 42 5.042 10.356 10.356 928 1HH1 ARG 342 1HH2 ARG 42 8.123 10.203 10.203 929 2HH1 ARG 342 2HH2 ARG 42 8.203 11.726 11.726 930 1HH2 ARG 342 2HH1 ARG 42 4.767 12.199 12.199 931 2HH2 ARG 342 1HH1 ARG 42 6.302 12.858 12.858 932 H GLU 343 H GLU 43 4.374 5.342 5.342 933 HA GLU 343 HA GLU 43 4.577 7.498 7.498 934 1HB GLU 343 2HB GLU 43 5.831 5.233 5.233 935 2HB GLU 343 1HB GLU 43 4.371 4.578 4.578 936 1HG GLU 343 2HG GLU 43 5.300 5.243 5.243 937 2HG GLU 343 1HG GLU 43 4.798 6.863 6.863 938 H LEU 344 H LEU 44 2.262 4.802 4.802 939 HA LEU 344 HA LEU 44 0.569 5.496 5.496 940 1HB LEU 344 2HB LEU 44 -0.040 4.160 4.160 941 2HB LEU 344 1HB LEU 44 -1.220 4.309 4.309 942 HG LEU 344 HG LEU 44 -0.338 2.189 2.189 943 1HD1 LEU 344 2HD1 LEU 44 0.049 3.971 3.971 944 2HD1 LEU 344 1HD1 LEU 44 1.754 3.672 3.672 945 3HD1 LEU 344 3HD1 LEU 44 0.711 2.344 2.344 946 1HD2 LEU 344 3HD2 LEU 44 1.583 2.819 2.819 947 2HD2 LEU 344 2HD2 LEU 44 1.736 1.443 1.443 948 3HD2 LEU 344 1HD2 LEU 44 2.527 2.971 2.971 949 H ASN 345 H ASN 45 0.800 6.743 6.743 950 HA ASN 345 HA ASN 45 -1.616 8.384 8.384 951 1HB ASN 345 2HB ASN 45 0.366 7.791 7.791 952 2HB ASN 345 1HB ASN 45 -0.320 9.415 9.415 953 1HD2 ASN 345 2HD2 ASN 45 -2.511 6.591 6.591 954 2HD2 ASN 345 1HD2 ASN 45 -0.816 6.647 6.647 955 H GLU 346 H GLU 46 1.745 8.637 8.637 956 HA GLU 346 HA GLU 46 1.944 11.523 11.523 957 1HB GLU 346 2HB GLU 46 3.871 9.825 9.825 958 2HB GLU 346 1HB GLU 46 3.587 9.684 9.684 959 1HG GLU 346 2HG GLU 46 4.196 11.912 11.912 960 2HG GLU 346 1HG GLU 46 3.930 12.393 12.393 961 H ALA 347 H ALA 47 1.138 9.145 9.145 962 HA ALA 347 HA ALA 47 0.925 11.130 11.130 963 1HB ALA 347 1HB ALA 47 1.257 8.530 8.530 964 2HB ALA 347 3HB ALA 47 -0.502 8.483 8.483 965 3HB ALA 347 2HB ALA 47 0.276 9.353 9.353 966 H LEU 348 H LEU 48 -1.429 9.356 9.356 967 HA LEU 348 HA LEU 48 -3.799 10.476 10.476 968 1HB LEU 348 2HB LEU 48 -3.054 9.654 9.654 969 2HB LEU 348 1HB LEU 48 -4.679 10.189 10.189 970 HG LEU 348 HG LEU 48 -3.215 7.907 7.907 971 1HD1 LEU 348 3HD1 LEU 48 -4.874 8.057 8.057 972 2HD1 LEU 348 2HD1 LEU 48 -5.387 6.828 6.828 973 3HD1 LEU 348 1HD1 LEU 48 -3.743 6.806 6.806 974 1HD2 LEU 348 3HD2 LEU 48 -6.042 8.989 8.989 975 2HD2 LEU 348 2HD2 LEU 48 -4.840 8.945 8.945 976 3HD2 LEU 348 1HD2 LEU 48 -5.542 7.443 7.443 977 H GLU 349 H GLU 49 -1.664 11.712 11.712 978 HA GLU 349 HA GLU 49 -3.119 14.113 14.113 979 1HB GLU 349 2HB GLU 49 -0.365 13.113 13.113 980 2HB GLU 349 1HB GLU 49 -0.566 14.865 14.865 981 1HG GLU 349 2HG GLU 49 -2.748 14.067 14.067 982 2HG GLU 349 1HG GLU 49 -1.556 12.851 12.851 983 H LEU 350 H LEU 50 -0.716 13.235 13.235 984 HA LEU 350 HA LEU 50 -0.237 15.869 15.869 985 1HB LEU 350 2HB LEU 50 1.151 14.768 14.768 986 2HB LEU 350 1HB LEU 50 0.681 13.296 13.296 987 HG LEU 350 HG LEU 50 -1.323 13.234 13.234 988 1HD1 LEU 350 1HD1 LEU 50 0.323 15.487 15.487 989 2HD1 LEU 350 3HD1 LEU 50 -0.212 14.334 14.334 990 3HD1 LEU 350 2HD1 LEU 50 -1.397 15.166 15.166 991 1HD2 LEU 350 1HD2 LEU 50 1.167 12.072 12.072 992 2HD2 LEU 350 3HD2 LEU 50 -0.124 11.679 11.679 993 3HD2 LEU 350 2HD2 LEU 50 1.124 12.839 12.839 994 H LYS 351 H LYS 51 -2.806 13.529 13.529 995 HA LYS 351 HA LYS 51 -4.022 14.713 14.713 996 1HB LYS 351 2HB LYS 51 -4.629 12.475 12.475 997 2HB LYS 351 1HB LYS 51 -5.470 13.370 13.370 998 1HG LYS 351 2HG LYS 51 -7.090 14.196 14.196 999 2HG LYS 351 1HG LYS 51 -6.068 13.941 13.941 1000 1HD LYS 351 2HD LYS 51 -6.240 11.407 11.407 1001 2HD LYS 351 1HD LYS 51 -7.679 11.939 11.939 1002 1HE LYS 351 2HE LYS 51 -7.290 12.779 12.779 1003 2HE LYS 351 1HE LYS 51 -7.897 11.161 11.161 1004 1HZ LYS 351 3HZ LYS 51 -9.082 13.604 13.604 1005 2HZ LYS 351 2HZ LYS 51 -9.617 12.951 12.951 1006 3HZ LYS 351 1HZ LYS 51 -9.739 12.041 12.041 1007 H ASP 352 H ASP 52 -4.483 15.265 15.265 1008 HA ASP 352 HA ASP 52 -6.469 17.325 17.325 1009 1HB ASP 352 2HB ASP 52 -4.906 16.137 16.137 1010 2HB ASP 352 1HB ASP 52 -5.109 17.877 17.877 1011 H ALA 353 H ALA 53 -3.041 17.239 17.239 1012 HA ALA 353 HA ALA 53 -2.893 20.216 20.216 1013 1HB ALA 353 2HB ALA 53 -1.202 18.460 18.460 1014 2HB ALA 353 1HB ALA 53 -0.460 18.558 18.558 1015 3HB ALA 353 3HB ALA 53 -0.661 20.017 20.017 1016 H GLN 354 H GLN 54 -4.161 18.634 18.634 1017 HA GLN 354 HA GLN 54 -2.261 18.776 18.776 1018 1HB GLN 354 2HB GLN 54 -5.002 17.736 17.736 1019 2HB GLN 354 1HB GLN 54 -4.676 18.338 18.338 1020 1HG GLN 354 2HG GLN 54 -2.402 16.925 16.925 1021 2HG GLN 354 1HG GLN 54 -3.573 15.973 15.973 1022 1HE2 GLN 354 2HE2 GLN 54 -3.433 15.329 15.329 1023 2HE2 GLN 354 1HE2 GLN 54 -2.159 15.887 15.887 1024 H ALA 355 HN ALA 55 -2.155 21.244 21.244 1025 HA ALA 355 HA ALA 55 -4.230 22.821 22.821 1026 1HB ALA 355 1HB ALA 55 -3.779 23.377 23.377 1027 2HB ALA 355 3HB ALA 55 -2.123 23.785 23.785 1028 3HB ALA 355 2HB ALA 55 -3.467 24.727 24.727 Start of MODEL 2 1 1H GLY 325 1H GLY 25 13.658 1.300 1.300 2 2H GLY 325 3H GLY 25 13.880 2.786 2.786 3 3H GLY 325 2H GLY 25 12.664 1.724 1.724 4 1HA GLY 325 2HA GLY 25 11.316 3.005 3.005 5 2HA GLY 325 1HA GLY 25 12.659 3.604 3.604 6 H GLU 326 H GLU 26 10.544 0.800 0.800 7 HA GLU 326 HA GLU 26 10.649 0.276 0.276 8 1HB GLU 326 2HB GLU 26 12.239 -1.210 -1.210 9 2HB GLU 326 1HB GLU 26 10.869 -2.245 -2.245 10 1HG GLU 326 2HG GLU 26 11.687 -0.984 -0.984 11 2HG GLU 326 1HG GLU 26 13.147 -1.582 -1.582 12 H TYR 327 H TYR 27 9.288 -2.143 -2.143 13 HA TYR 327 HA TYR 27 6.703 -1.318 -1.318 14 1HB TYR 327 2HB TYR 27 7.423 -2.376 -2.376 15 2HB TYR 327 1HB TYR 27 6.194 -3.375 -3.375 16 HD1 TYR 327 HD2 TYR 27 4.291 -1.971 -1.971 17 HD2 TYR 327 HD1 TYR 27 6.698 -0.529 -0.529 18 HE1 TYR 327 HE2 TYR 27 2.567 -0.267 -0.267 19 HE2 TYR 327 HE1 TYR 27 4.973 1.176 1.176 20 HH TYR 327 HH TYR 27 1.987 1.078 1.078 21 H PHE 328 H PHE 28 5.604 -2.781 -2.781 22 HA PHE 328 HA PHE 28 6.779 -5.494 -5.494 23 1HB PHE 328 2HB PHE 28 6.504 -3.352 -3.352 24 2HB PHE 328 1HB PHE 28 6.300 -5.039 -5.039 25 HD1 PHE 328 HD2 PHE 28 8.620 -2.843 -2.843 26 HD2 PHE 328 HD1 PHE 28 8.187 -6.307 -6.307 27 HE1 PHE 328 HE2 PHE 28 11.082 -3.142 -3.142 28 HE2 PHE 328 HE1 PHE 28 10.648 -6.605 -6.605 29 HZ PHE 328 HZ PHE 28 12.096 -5.023 -5.023 30 H THR 329 H THR 29 5.242 -7.047 -7.047 31 HA THR 329 HA THR 29 2.394 -6.116 -6.116 32 HB THR 329 HB THR 29 2.944 -9.000 -9.000 33 HG1 THR 329 HG1 THR 29 4.687 -8.524 -8.524 34 1HG2 THR 329 3HG2 THR 29 0.832 -7.513 -7.513 35 2HG2 THR 329 2HG2 THR 29 1.626 -7.340 -7.340 36 3HG2 THR 329 1HG2 THR 29 1.196 -8.943 -8.943 37 H LEU 330 H LEU 30 1.040 -6.530 -6.530 38 HA LEU 330 HA LEU 30 2.164 -8.141 -8.141 39 1HB LEU 330 2HB LEU 30 1.209 -5.436 -5.436 40 2HB LEU 330 1HB LEU 30 0.092 -6.403 -6.403 41 HG LEU 330 HG LEU 30 3.092 -6.541 -6.541 42 1HD1 LEU 330 1HD1 LEU 30 1.216 -4.453 -4.453 43 2HD1 LEU 330 3HD1 LEU 30 2.017 -5.194 -5.194 44 3HD1 LEU 330 2HD1 LEU 30 2.977 -4.472 -4.472 45 1HD2 LEU 330 3HD2 LEU 30 1.694 -8.407 -8.407 46 2HD2 LEU 330 2HD2 LEU 30 2.471 -7.503 -7.503 47 3HD2 LEU 330 1HD2 LEU 30 0.762 -7.246 -7.246 48 H GLN 331 H GLN 31 1.149 -10.087 -10.087 49 HA GLN 331 HA GLN 31 -1.729 -10.060 -10.060 50 1HB GLN 331 2HB GLN 31 0.227 -12.365 -12.365 51 2HB GLN 331 1HB GLN 31 -1.432 -12.494 -12.494 52 1HG GLN 331 2HG GLN 31 -0.952 -11.064 -11.064 53 2HG GLN 331 1HG GLN 31 0.679 -10.756 -10.756 54 1HE2 GLN 331 2HE2 GLN 31 0.007 -14.033 -14.033 55 2HE2 GLN 331 1HE2 GLN 31 -1.141 -12.797 -12.797 56 H ILE 332 H ILE 32 -3.145 -10.001 -10.001 57 HA ILE 332 HA ILE 32 -2.406 -11.430 -11.430 58 HB ILE 332 HB ILE 32 -4.063 -8.923 -8.923 59 1HG1 ILE 332 2HG1 ILE 32 -1.931 -8.856 -8.856 60 2HG1 ILE 332 1HG1 ILE 32 -1.307 -9.328 -9.328 61 1HG2 ILE 332 3HG2 ILE 32 -3.732 -10.778 -10.778 62 2HG2 ILE 332 2HG2 ILE 32 -4.027 -9.060 -9.060 63 3HG2 ILE 332 1HG2 ILE 32 -5.203 -10.033 -10.033 64 1HD1 ILE 332 2HD1 ILE 32 -2.987 -7.296 -7.296 65 2HD1 ILE 332 1HD1 ILE 32 -2.445 -6.745 -6.745 66 3HD1 ILE 332 3HD1 ILE 32 -1.266 -7.082 -7.082 67 H ARG 333 H ARG 33 -4.103 -12.585 -12.585 68 HA ARG 333 HA ARG 33 -6.260 -13.436 -13.436 69 1HB ARG 333 2HB ARG 33 -5.810 -14.632 -14.632 70 2HB ARG 333 1HB ARG 33 -6.378 -15.409 -15.409 71 1HG ARG 333 2HG ARG 33 -4.037 -14.904 -14.904 72 2HG ARG 333 1HG ARG 33 -3.563 -14.590 -14.590 73 1HD ARG 333 2HD ARG 33 -4.903 -16.964 -16.964 74 2HD ARG 333 1HD ARG 33 -4.169 -17.151 -17.151 75 HE ARG 333 HE ARG 33 -2.191 -16.160 -16.160 76 1HH1 ARG 333 1HH1 ARG 33 -2.709 -19.706 -19.706 77 2HH1 ARG 333 2HH1 ARG 33 -3.668 -18.310 -18.310 78 1HH2 ARG 333 1HH2 ARG 33 -1.125 -18.236 -18.236 79 2HH2 ARG 333 2HH2 ARG 33 -1.269 -19.664 -19.664 80 H GLY 334 H GLY 34 -8.486 -13.589 -13.589 81 1HA GLY 334 2HA GLY 34 -10.108 -13.007 -13.007 82 2HA GLY 334 1HA GLY 34 -9.007 -11.735 -11.735 83 H ARG 335 H ARG 35 -9.899 -9.795 -9.795 84 HA ARG 335 HA ARG 35 -10.345 -8.885 -8.885 85 1HB ARG 335 2HB ARG 35 -12.327 -10.534 -10.534 86 2HB ARG 335 1HB ARG 35 -12.978 -9.264 -9.264 87 1HG ARG 335 2HG ARG 35 -13.327 -7.812 -7.812 88 2HG ARG 335 1HG ARG 35 -11.988 -8.466 -8.466 89 1HD ARG 335 2HD ARG 35 -13.354 -10.568 -10.568 90 2HD ARG 335 1HD ARG 35 -14.712 -9.722 -9.722 91 HE ARG 335 HE ARG 35 -13.529 -8.266 -8.266 92 1HH1 ARG 335 1HH2 ARG 35 -14.640 -11.248 -11.248 93 2HH1 ARG 335 2HH2 ARG 35 -16.149 -10.851 -10.851 94 1HH2 ARG 335 1HH1 ARG 35 -16.903 -8.719 -8.719 95 2HH2 ARG 335 2HH1 ARG 35 -15.970 -7.485 -7.485 96 H GLU 336 H GLU 36 -11.699 -8.569 -8.569 97 HA GLU 336 HA GLU 36 -11.993 -5.702 -5.702 98 1HB GLU 336 2HB GLU 36 -12.433 -7.775 -7.775 99 2HB GLU 336 1HB GLU 36 -11.716 -6.332 -6.332 100 1HG GLU 336 2HG GLU 36 -14.044 -5.918 -5.918 101 2HG GLU 336 1HG GLU 36 -13.494 -5.015 -5.015 102 H ARG 337 H ARG 37 -9.612 -7.710 -7.710 103 HA ARG 337 HA ARG 37 -7.950 -5.617 -5.617 104 1HB ARG 337 2HB ARG 37 -6.929 -8.290 -8.290 105 2HB ARG 337 1HB ARG 37 -6.179 -7.245 -7.245 106 1HG ARG 337 2HG ARG 37 -8.678 -7.602 -7.602 107 2HG ARG 337 1HG ARG 37 -8.401 -9.162 -9.162 108 1HD ARG 337 2HD ARG 37 -6.159 -9.256 -9.256 109 2HD ARG 337 1HD ARG 37 -6.628 -7.809 -7.809 110 HE ARG 337 HE ARG 37 -7.716 -9.338 -9.338 111 1HH1 ARG 337 2HH1 ARG 37 -6.982 -11.379 -11.379 112 2HH1 ARG 337 1HH1 ARG 37 -8.503 -12.204 -12.204 113 1HH2 ARG 337 1HH2 ARG 37 -10.153 -9.907 -9.907 114 2HH2 ARG 337 2HH2 ARG 37 -10.298 -11.370 -11.370 115 H PHE 338 H PHE 38 -8.085 -7.212 -7.212 116 HA PHE 338 HA PHE 38 -5.756 -6.030 -6.030 117 1HB PHE 338 2HB PHE 38 -6.900 -7.827 -7.827 118 2HB PHE 338 1HB PHE 38 -8.368 -6.858 -6.858 119 HD1 PHE 338 HD2 PHE 38 -4.909 -7.296 -7.296 120 HD2 PHE 338 HD1 PHE 38 -8.533 -5.022 -5.022 121 HE1 PHE 338 HE2 PHE 38 -4.062 -6.305 -6.305 122 HE2 PHE 338 HE1 PHE 38 -7.685 -4.030 -4.030 123 HZ PHE 338 HZ PHE 38 -5.450 -4.671 -4.671 124 H GLU 339 H GLU 39 -9.154 -4.895 -4.895 125 HA GLU 339 HA GLU 39 -8.646 -2.494 -2.494 126 1HB GLU 339 2HB GLU 39 -10.763 -3.015 -3.015 127 2HB GLU 339 1HB GLU 39 -10.790 -1.714 -1.714 128 1HG GLU 339 2HG GLU 39 -10.463 -3.726 -3.726 129 2HG GLU 339 1HG GLU 39 -11.189 -4.651 -4.651 130 H MET 340 H MET 40 -8.343 -3.308 -3.308 131 HA MET 340 HA MET 40 -8.094 -0.726 -0.726 132 1HB MET 340 2HB MET 40 -7.350 -3.452 -3.452 133 2HB MET 340 1HB MET 40 -6.268 -2.226 -2.226 134 1HG MET 340 2HG MET 40 -8.136 -1.029 -1.029 135 2HG MET 340 1HG MET 40 -9.290 -2.109 -2.109 136 1HE MET 340 2HE MET 40 -5.971 -2.272 -2.272 137 2HE MET 340 1HE MET 40 -6.087 -3.720 -3.720 138 3HE MET 340 3HE MET 40 -6.025 -3.857 -3.857 139 H PHE 341 H PHE 41 -5.499 -2.851 -2.851 140 HA PHE 341 HA PHE 41 -3.397 -0.984 -0.984 141 1HB PHE 341 2HB PHE 41 -3.845 -3.399 -3.399 142 2HB PHE 341 1HB PHE 41 -2.377 -2.453 -2.453 143 HD1 PHE 341 HD2 PHE 41 -1.732 -1.684 -1.684 144 HD2 PHE 341 HD1 PHE 41 -3.423 -5.359 -5.359 145 HE1 PHE 341 HE2 PHE 41 -0.859 -2.876 -2.876 146 HE2 PHE 341 HE1 PHE 41 -2.567 -6.546 -6.546 147 HZ PHE 341 HZ PHE 41 -1.297 -5.308 -5.308 148 H ARG 342 H ARG 42 -5.657 -1.633 -1.633 149 HA ARG 342 HA ARG 42 -4.584 -0.130 -0.130 150 1HB ARG 342 2HB ARG 42 -6.978 -1.407 -1.407 151 2HB ARG 342 1HB ARG 42 -7.480 0.283 0.283 152 1HG ARG 342 2HG ARG 42 -6.396 0.611 0.611 153 2HG ARG 342 1HG ARG 42 -5.773 -1.040 -1.040 154 1HD ARG 342 2HD ARG 42 -7.922 -1.983 -1.983 155 2HD ARG 342 1HD ARG 42 -8.732 -0.491 -0.491 156 HE ARG 342 HE ARG 42 -7.178 -0.624 -0.624 157 1HH1 ARG 342 1HH2 ARG 42 -8.149 1.815 1.815 158 2HH1 ARG 342 2HH2 ARG 42 -9.834 1.720 1.720 159 1HH2 ARG 342 2HH1 ARG 42 -10.175 -1.551 -1.551 160 2HH2 ARG 342 1HH1 ARG 42 -10.981 -0.184 -0.184 161 H GLU 343 H GLU 43 -6.337 0.943 0.943 162 HA GLU 343 HA GLU 43 -6.473 3.724 3.724 163 1HB GLU 343 2HB GLU 43 -7.973 2.655 2.655 164 2HB GLU 343 1HB GLU 43 -6.593 2.639 2.639 165 1HG GLU 343 2HG GLU 43 -7.474 4.683 4.683 166 2HG GLU 343 1HG GLU 43 -6.466 5.208 5.208 167 H LEU 344 H LEU 44 -4.422 2.051 2.051 168 HA LEU 344 HA LEU 44 -2.820 4.256 4.256 169 1HB LEU 344 2HB LEU 44 -2.081 1.330 1.330 170 2HB LEU 344 1HB LEU 44 -0.964 2.537 2.537 171 HG LEU 344 HG LEU 44 -1.944 1.724 1.724 172 1HD1 LEU 344 1HD1 LEU 44 -2.293 4.260 4.260 173 2HD1 LEU 344 3HD1 LEU 44 -3.990 3.845 3.845 174 3HD1 LEU 344 2HD1 LEU 44 -3.208 3.498 3.498 175 1HD2 LEU 344 2HD2 LEU 44 -3.723 0.493 0.493 176 2HD2 LEU 344 1HD2 LEU 44 -4.070 0.802 0.802 177 3HD2 LEU 344 3HD2 LEU 44 -4.748 1.853 1.853 178 H ASN 345 H ASN 45 -1.953 1.824 1.824 179 HA ASN 345 HA ASN 45 0.211 3.313 3.313 180 1HB ASN 345 2HB ASN 45 0.317 1.705 1.705 181 2HB ASN 345 1HB ASN 45 -0.647 0.840 0.840 182 1HD2 ASN 345 2HD2 ASN 45 -3.264 0.407 0.407 183 2HD2 ASN 345 1HD2 ASN 45 -2.390 -0.192 -0.192 184 H GLU 346 H GLU 46 -3.220 3.721 3.721 185 HA GLU 346 HA GLU 46 -3.195 5.189 5.189 186 1HB GLU 346 2HB GLU 46 -5.098 4.614 4.614 187 2HB GLU 346 1HB GLU 46 -5.293 6.243 6.243 188 1HG GLU 346 2HG GLU 46 -5.315 5.263 5.263 189 2HG GLU 346 1HG GLU 46 -5.285 3.656 3.656 190 H ALA 347 H ALA 47 -2.956 6.247 6.247 191 HA ALA 347 HA ALA 47 -2.765 9.061 9.061 192 1HB ALA 347 2HB ALA 47 -3.468 8.119 8.119 193 2HB ALA 347 1HB ALA 47 -1.763 7.763 7.763 194 3HB ALA 347 3HB ALA 47 -2.290 9.431 9.431 195 H LEU 348 H LEU 48 -0.357 6.590 6.590 196 HA LEU 348 HA LEU 48 1.946 8.197 8.197 197 1HB LEU 348 2HB LEU 48 1.628 5.353 5.353 198 2HB LEU 348 1HB LEU 48 3.169 6.130 6.130 199 HG LEU 348 HG LEU 48 0.933 5.821 5.821 200 1HD1 LEU 348 1HD1 LEU 48 2.513 3.775 3.775 201 2HD1 LEU 348 3HD1 LEU 48 3.316 4.205 4.205 202 3HD1 LEU 348 2HD1 LEU 48 1.621 3.718 3.718 203 1HD2 LEU 348 3HD2 LEU 48 2.824 7.610 7.610 204 2HD2 LEU 348 2HD2 LEU 48 2.496 6.597 6.597 205 3HD2 LEU 348 1HD2 LEU 48 3.870 6.237 6.237 206 H GLU 349 H GLU 49 0.303 6.563 6.563 207 HA GLU 349 HA GLU 49 2.079 7.480 7.480 208 1HB GLU 349 2HB GLU 49 0.219 5.683 5.683 209 2HB GLU 349 1HB GLU 49 -0.876 7.039 7.039 210 1HG GLU 349 2HG GLU 49 0.777 7.777 7.777 211 2HG GLU 349 1HG GLU 49 1.477 6.168 6.168 212 H LEU 350 H LEU 50 -0.749 8.922 8.922 213 HA LEU 350 HA LEU 50 -0.973 11.132 11.132 214 1HB LEU 350 2HB LEU 50 -2.829 11.504 11.504 215 2HB LEU 350 1HB LEU 50 -2.378 10.136 10.136 216 HG LEU 350 HG LEU 50 -0.888 11.797 11.797 217 1HD1 LEU 350 1HD1 LEU 50 -1.839 13.446 13.446 218 2HD1 LEU 350 3HD1 LEU 50 -2.551 14.041 14.041 219 3HD1 LEU 350 2HD1 LEU 50 -0.803 13.884 13.884 220 1HD2 LEU 350 1HD2 LEU 50 -3.109 10.878 10.878 221 2HD2 LEU 350 3HD2 LEU 50 -2.726 12.476 12.476 222 3HD2 LEU 350 2HD2 LEU 50 -3.871 12.309 12.309 223 H LYS 351 H LYS 51 1.139 10.338 10.338 224 HA LYS 351 HA LYS 51 2.037 12.996 12.996 225 1HB LYS 351 2HB LYS 51 2.455 11.026 11.026 226 2HB LYS 351 1HB LYS 51 3.539 10.378 10.378 227 1HG LYS 351 2HG LYS 51 5.217 11.789 11.789 228 2HG LYS 351 1HG LYS 51 4.124 13.165 13.165 229 1HD LYS 351 2HD LYS 51 5.166 12.559 12.559 230 2HD LYS 351 1HD LYS 51 3.411 12.392 12.392 231 1HE LYS 351 2HE LYS 51 3.879 10.325 10.325 232 2HE LYS 351 1HE LYS 51 4.125 9.910 9.910 233 1HZ LYS 351 3HZ LYS 51 6.449 11.112 11.112 234 2HZ LYS 351 2HZ LYS 51 5.983 9.772 9.772 235 3HZ LYS 351 1HZ LYS 51 6.272 9.591 9.591 236 H ASP 352 H ASP 52 3.139 10.499 10.499 237 HA ASP 352 HA ASP 52 5.434 11.912 11.912 238 1HB ASP 352 2HB ASP 52 4.196 9.435 9.435 239 2HB ASP 352 1HB ASP 52 4.196 10.289 10.289 240 H ALA 353 H ALA 53 2.028 11.885 11.885 241 HA ALA 353 HA ALA 53 2.521 13.634 13.634 242 1HB ALA 353 1HB ALA 53 0.593 12.058 12.058 243 2HB ALA 353 3HB ALA 53 -0.087 13.012 13.012 244 3HB ALA 353 2HB ALA 53 0.085 13.723 13.723 245 H GLN 354 H GLN 54 2.522 14.165 14.165 246 HA GLN 354 HA GLN 54 1.222 16.791 16.791 247 1HB GLN 354 2HB GLN 54 2.435 14.955 14.955 248 2HB GLN 354 1HB GLN 54 2.786 16.654 16.654 249 1HG GLN 354 2HG GLN 54 0.087 16.620 16.620 250 2HG GLN 354 1HG GLN 54 0.285 15.215 15.215 251 1HE2 GLN 354 2HE2 GLN 54 1.770 17.507 17.507 252 2HE2 GLN 354 1HE2 GLN 54 2.401 16.240 16.240 253 H ALA 355 HN ALA 55 4.460 16.234 16.234 254 HA ALA 355 HA ALA 55 6.502 17.302 17.302 255 1HB ALA 355 2HB ALA 55 5.558 16.749 16.749 256 2HB ALA 355 1HB ALA 55 5.502 18.510 18.510 257 3HB ALA 355 3HB ALA 55 7.028 17.688 17.688 258 1H GLY 325 1H GLY 25 -13.857 -13.726 -13.726 259 2H GLY 325 3H GLY 25 -14.284 -13.884 -13.884 260 3H GLY 325 2H GLY 25 -13.069 -12.788 -12.788 261 1HA GLY 325 2HA GLY 25 -11.675 -14.420 -14.420 262 2HA GLY 325 1HA GLY 25 -12.923 -15.652 -15.652 263 H GLU 326 H GLU 26 -10.702 -13.576 -13.576 264 HA GLU 326 HA GLU 26 -10.416 -15.757 -15.757 265 1HB GLU 326 2HB GLU 26 -12.093 -13.546 -13.546 266 2HB GLU 326 1HB GLU 26 -10.611 -13.234 -13.234 267 1HG GLU 326 2HG GLU 26 -11.207 -15.989 -15.989 268 2HG GLU 326 1HG GLU 26 -12.711 -15.105 -15.105 269 H TYR 327 H TYR 27 -8.906 -14.277 -14.277 270 HA TYR 327 HA TYR 27 -6.546 -13.544 -13.544 271 1HB TYR 327 2HB TYR 27 -6.869 -15.224 -15.224 272 2HB TYR 327 1HB TYR 27 -5.682 -13.951 -13.951 273 HD1 TYR 327 HD2 TYR 27 -4.046 -13.515 -13.515 274 HD2 TYR 327 HD1 TYR 27 -6.113 -17.191 -17.191 275 HE1 TYR 327 HE2 TYR 27 -2.386 -14.751 -14.751 276 HE2 TYR 327 HE1 TYR 27 -4.454 -18.427 -18.427 277 HH TYR 327 HH TYR 27 -1.598 -17.474 -17.474 278 H PHE 328 H PHE 28 -5.517 -11.577 -11.577 279 HA PHE 328 HA PHE 28 -6.537 -9.908 -9.908 280 1HB PHE 328 2HB PHE 28 -6.673 -9.303 -9.303 281 2HB PHE 328 1HB PHE 28 -6.414 -7.979 -7.979 282 HD1 PHE 328 HD2 PHE 28 -8.612 -10.975 -10.975 283 HD2 PHE 328 HD1 PHE 28 -8.260 -6.973 -6.973 284 HE1 PHE 328 HE2 PHE 28 -11.031 -10.969 -10.969 285 HE2 PHE 328 HE1 PHE 28 -10.678 -6.968 -6.968 286 HZ PHE 328 HZ PHE 28 -12.064 -8.966 -8.966 287 H THR 329 H THR 29 -4.993 -8.376 -8.376 288 HA THR 329 HA THR 29 -2.245 -8.806 -8.806 289 HB THR 329 HB THR 29 -2.389 -7.373 -7.373 290 HG1 THR 329 HG1 THR 29 -4.172 -8.597 -8.597 291 1HG2 THR 329 3HG2 THR 29 -0.493 -8.703 -8.703 292 2HG2 THR 329 2HG2 THR 29 -1.209 -10.095 -10.095 293 3HG2 THR 329 1HG2 THR 29 -0.598 -8.738 -8.738 294 H LEU 330 H LEU 30 -0.987 -7.013 -7.013 295 HA LEU 330 HA LEU 30 -2.352 -4.354 -4.354 296 1HB LEU 330 2HB LEU 30 -1.592 -5.865 -5.865 297 2HB LEU 330 1HB LEU 30 -0.513 -4.475 -4.475 298 HG LEU 330 HG LEU 30 -3.519 -4.245 -4.245 299 1HD1 LEU 330 1HD1 LEU 30 -1.838 -4.649 -4.649 300 2HD1 LEU 330 3HD1 LEU 30 -2.760 -3.147 -3.147 301 3HD1 LEU 330 2HD1 LEU 30 -3.596 -4.684 -4.684 302 1HD2 LEU 330 3HD2 LEU 30 -2.086 -2.416 -2.416 303 2HD2 LEU 330 2HD2 LEU 30 -3.083 -1.878 -1.878 304 3HD2 LEU 330 1HD2 LEU 30 -1.367 -2.208 -2.208 305 H GLN 331 H GLN 31 -1.100 -3.909 -3.909 306 HA GLN 331 HA GLN 31 1.806 -4.078 -4.078 307 1HB GLN 331 2HB GLN 31 -0.030 -2.752 -2.752 308 2HB GLN 331 1HB GLN 31 1.706 -2.985 -2.985 309 1HG GLN 331 2HG GLN 31 1.454 -5.396 -5.396 310 2HG GLN 331 1HG GLN 31 -0.256 -5.241 -5.241 311 1HE2 GLN 331 2HE2 GLN 31 0.826 -5.260 -5.260 312 2HE2 GLN 331 1HE2 GLN 31 1.866 -5.709 -5.709 313 H ILE 332 H ILE 32 2.992 -2.618 -2.618 314 HA ILE 332 HA ILE 32 2.012 0.209 0.209 315 HB ILE 332 HB ILE 32 3.545 -1.372 -1.372 316 1HG1 ILE 332 2HG1 ILE 32 1.170 0.078 0.078 317 2HG1 ILE 332 1HG1 ILE 32 0.796 -1.040 -1.040 318 1HG2 ILE 332 3HG2 ILE 32 3.028 1.575 1.575 319 2HG2 ILE 332 2HG2 ILE 32 3.168 0.878 0.878 320 3HG2 ILE 332 1HG2 ILE 32 4.515 0.758 0.758 321 1HD1 ILE 332 2HD1 ILE 32 2.422 -2.598 -2.598 322 2HD1 ILE 332 1HD1 ILE 32 1.649 -1.610 -1.610 323 3HD1 ILE 332 3HD1 ILE 32 0.664 -2.577 -2.577 324 H ARG 333 H ARG 33 3.666 1.841 1.841 325 HA ARG 333 HA ARG 33 6.076 0.879 0.879 326 1HB ARG 333 2HB ARG 33 5.383 3.781 3.781 327 2HB ARG 333 1HB ARG 33 6.184 2.994 2.994 328 1HG ARG 333 2HG ARG 33 3.951 1.765 1.765 329 2HG ARG 333 1HG ARG 33 3.249 2.964 2.964 330 1HD ARG 333 2HD ARG 33 4.709 4.556 4.556 331 2HD ARG 333 1HD ARG 33 4.195 3.270 3.270 332 HE ARG 333 HE ARG 33 1.943 4.111 4.111 333 1HH1 ARG 333 2HH1 ARG 33 3.352 6.725 6.725 334 2HH1 ARG 333 1HH1 ARG 33 2.545 7.110 7.110 335 1HH2 ARG 333 1HH2 ARG 33 1.215 3.934 3.934 336 2HH2 ARG 333 2HH2 ARG 33 1.335 5.530 5.530 337 H GLY 334 H GLY 34 8.189 1.826 1.826 338 1HA GLY 334 2HA GLY 34 9.554 3.090 3.090 339 2HA GLY 334 1HA GLY 34 8.310 2.790 2.790 340 H ARG 335 H ARG 35 9.106 1.408 1.408 341 HA ARG 335 HA ARG 35 9.805 -1.280 -1.280 342 1HB ARG 335 2HB ARG 35 11.837 0.065 0.065 343 2HB ARG 335 1HB ARG 35 12.267 0.280 0.280 344 1HG ARG 335 2HG ARG 35 12.722 -1.959 -1.959 345 2HG ARG 335 1HG ARG 35 11.561 -2.476 -2.476 346 1HD ARG 335 2HD ARG 35 13.105 -1.514 -1.514 347 2HD ARG 335 1HD ARG 35 14.293 -1.256 -1.256 348 HE ARG 335 HE ARG 35 13.306 -4.002 -4.002 349 1HH1 ARG 335 1HH2 ARG 35 14.663 -2.658 -2.658 350 2HH1 ARG 335 2HH2 ARG 35 16.223 -3.401 -3.401 351 1HH2 ARG 335 2HH1 ARG 35 15.711 -4.553 -4.553 352 2HH2 ARG 335 1HH1 ARG 35 16.817 -4.472 -4.472 353 H GLU 336 H GLU 36 10.716 1.401 1.401 354 HA GLU 336 HA GLU 36 10.845 -0.279 -0.279 355 1HB GLU 336 2HB GLU 36 11.154 2.542 2.542 356 2HB GLU 336 1HB GLU 36 10.256 2.320 2.320 357 1HG GLU 336 2HG GLU 36 12.526 2.332 2.332 358 2HG GLU 336 1HG GLU 36 12.095 0.622 0.622 359 H ARG 337 H ARG 37 8.380 2.113 2.113 360 HA ARG 337 HA ARG 37 6.482 1.601 1.601 361 1HB ARG 337 2HB ARG 37 5.795 2.114 2.114 362 2HB ARG 337 1HB ARG 37 4.832 2.531 2.531 363 1HG ARG 337 2HG ARG 37 7.222 3.765 3.765 364 2HG ARG 337 1HG ARG 37 7.128 3.944 3.944 365 1HD ARG 337 2HD ARG 37 4.786 4.823 4.823 366 2HD ARG 337 1HD ARG 37 5.049 4.803 4.803 367 HE ARG 337 HE ARG 37 6.039 6.905 6.905 368 1HH1 ARG 337 2HH1 ARG 37 5.741 5.966 5.966 369 2HH1 ARG 337 1HH1 ARG 37 7.306 6.466 6.466 370 1HH2 ARG 337 1HH2 ARG 37 8.544 7.003 7.003 371 2HH2 ARG 337 2HH2 ARG 37 8.894 7.053 7.053 372 H PHE 338 H PHE 38 7.097 -0.177 -0.177 373 HA PHE 338 HA PHE 38 4.870 -1.956 -1.956 374 1HB PHE 338 2HB PHE 38 6.297 -1.856 -1.856 375 2HB PHE 338 1HB PHE 38 7.689 -2.403 -2.403 376 HD1 PHE 338 HD2 PHE 38 4.451 -3.390 -3.390 377 HD2 PHE 338 HD1 PHE 38 7.913 -4.718 -4.718 378 HE1 PHE 338 HE2 PHE 38 3.796 -5.747 -5.747 379 HE2 PHE 338 HE1 PHE 38 7.256 -7.075 -7.075 380 HZ PHE 338 HZ PHE 38 5.194 -7.588 -7.588 381 H GLU 339 H GLU 39 8.162 -2.320 -2.320 382 HA GLU 339 HA GLU 39 7.679 -4.860 -4.860 383 1HB GLU 339 2HB GLU 39 9.548 -2.659 -2.659 384 2HB GLU 339 1HB GLU 39 9.648 -4.365 -4.365 385 1HG GLU 339 2HG GLU 39 9.666 -4.673 -4.673 386 2HG GLU 339 1HG GLU 39 10.312 -3.032 -3.032 387 H MET 340 H MET 40 7.017 -1.560 -1.560 388 HA MET 340 HA MET 40 6.472 -2.042 -2.042 389 1HB MET 340 2HB MET 40 5.842 0.031 0.031 390 2HB MET 340 1HB MET 40 4.588 -0.152 -0.152 391 1HG MET 340 2HG MET 40 6.218 0.125 0.125 392 2HG MET 340 1HG MET 40 7.540 0.157 0.157 393 1HE MET 340 2HE MET 40 4.019 1.564 1.564 394 2HE MET 340 1HE MET 40 4.114 3.192 3.192 395 3HE MET 340 3HE MET 40 4.295 1.785 1.785 396 H PHE 341 H PHE 41 4.161 -1.974 -1.974 397 HA PHE 341 HA PHE 41 1.928 -2.944 -2.944 398 1HB PHE 341 2HB PHE 41 2.668 -3.108 -3.108 399 2HB PHE 341 1HB PHE 41 1.146 -3.746 -3.746 400 HD1 PHE 341 HD2 PHE 41 0.265 -1.900 -1.900 401 HD2 PHE 341 HD1 PHE 41 2.289 -1.080 -1.080 402 HE1 PHE 341 HE2 PHE 41 -0.708 0.380 0.380 403 HE2 PHE 341 HE1 PHE 41 1.317 1.201 1.201 404 HZ PHE 341 HZ PHE 41 -0.178 1.931 1.931 405 H ARG 342 H ARG 42 4.596 -4.588 -4.588 406 HA ARG 342 HA ARG 42 3.636 -7.219 -7.219 407 1HB ARG 342 2HB ARG 42 6.047 -6.037 -6.037 408 2HB ARG 342 1HB ARG 42 6.432 -6.936 -6.936 409 1HG ARG 342 2HG ARG 42 5.590 -9.001 -9.001 410 2HG ARG 342 1HG ARG 42 5.092 -8.123 -8.123 411 1HD ARG 342 2HD ARG 42 7.319 -7.707 -7.707 412 2HD ARG 342 1HD ARG 42 7.954 -8.053 -8.053 413 HE ARG 342 HE ARG 42 6.736 -10.230 -10.230 414 1HH1 ARG 342 1HH2 ARG 42 7.568 -11.729 -11.729 415 2HH1 ARG 342 2HH2 ARG 42 9.292 -11.890 -11.890 416 1HH2 ARG 342 2HH1 ARG 42 9.720 -9.178 -9.178 417 2HH2 ARG 342 1HH1 ARG 42 10.509 -10.446 -10.446 418 H GLU 343 H GLU 43 4.867 -5.289 -5.289 419 HA GLU 343 HA GLU 43 4.964 -7.505 -7.505 420 1HB GLU 343 2HB GLU 43 6.305 -5.380 -5.380 421 2HB GLU 343 1HB GLU 43 4.804 -4.546 -4.546 422 1HG GLU 343 2HG GLU 43 5.461 -5.103 -5.103 423 2HG GLU 343 1HG GLU 43 4.604 -6.591 -6.591 424 H LEU 344 H LEU 44 2.729 -4.699 -4.699 425 HA LEU 344 HA LEU 44 0.918 -5.444 -5.444 426 1HB LEU 344 2HB LEU 44 0.406 -4.128 -4.128 427 2HB LEU 344 1HB LEU 44 -0.849 -4.327 -4.327 428 HG LEU 344 HG LEU 44 -0.074 -2.182 -2.182 429 1HD1 LEU 344 1HD1 LEU 44 0.209 -3.851 -3.851 430 2HD1 LEU 344 3HD1 LEU 44 1.940 -3.698 -3.698 431 3HD1 LEU 344 2HD1 LEU 44 0.995 -2.278 -2.278 432 1HD2 LEU 344 2HD2 LEU 44 1.878 -2.612 -2.612 433 2HD2 LEU 344 1HD2 LEU 44 2.076 -1.379 -1.379 434 3HD2 LEU 344 3HD2 LEU 44 2.817 -2.968 -2.968 435 H ASN 345 H ASN 45 0.575 -6.255 -6.255 436 HA ASN 345 HA ASN 45 -1.551 -8.099 -8.099 437 1HB ASN 345 2HB ASN 45 -1.326 -8.579 -8.579 438 2HB ASN 345 1HB ASN 45 -0.442 -7.061 -7.061 439 1HD2 ASN 345 2HD2 ASN 45 2.445 -8.591 -8.591 440 2HD2 ASN 345 1HD2 ASN 45 1.465 -7.209 -7.209 441 H GLU 346 H GLU 46 1.848 -8.388 -8.388 442 HA GLU 346 HA GLU 46 2.048 -11.254 -11.254 443 1HB GLU 346 2HB GLU 46 3.702 -9.010 -9.010 444 2HB GLU 346 1HB GLU 46 3.868 -10.412 -10.412 445 1HG GLU 346 2HG GLU 46 4.237 -11.831 -11.831 446 2HG GLU 346 1HG GLU 46 4.234 -10.359 -10.359 447 H ALA 347 H ALA 47 1.328 -8.971 -8.971 448 HA ALA 347 HA ALA 47 1.043 -11.070 -11.070 449 1HB ALA 347 2HB ALA 47 1.500 -8.604 -8.604 450 2HB ALA 347 1HB ALA 47 -0.203 -8.315 -8.315 451 3HB ALA 347 3HB ALA 47 0.252 -9.352 -9.352 452 H LEU 348 H LEU 48 -1.311 -9.110 -9.110 453 HA LEU 348 HA LEU 48 -3.689 -10.199 -10.199 454 1HB LEU 348 2HB LEU 48 -3.036 -9.495 -9.495 455 2HB LEU 348 1HB LEU 48 -4.664 -9.731 -9.731 456 HG LEU 348 HG LEU 48 -2.718 -7.697 -7.697 457 1HD1 LEU 348 1HD1 LEU 48 -3.992 -7.614 -7.614 458 2HD1 LEU 348 3HD1 LEU 48 -5.008 -6.630 -6.630 459 3HD1 LEU 348 2HD1 LEU 48 -3.297 -6.245 -6.245 460 1HD2 LEU 348 3HD2 LEU 48 -4.756 -8.679 -8.679 461 2HD2 LEU 348 2HD2 LEU 48 -4.534 -6.931 -6.931 462 3HD2 LEU 348 1HD2 LEU 48 -5.723 -7.691 -7.691 463 H GLU 349 H GLU 49 -1.619 -11.485 -11.485 464 HA GLU 349 HA GLU 49 -3.212 -13.803 -13.803 465 1HB GLU 349 2HB GLU 49 -1.227 -12.842 -12.842 466 2HB GLU 349 1HB GLU 49 -0.202 -13.741 -13.741 467 1HG GLU 349 2HG GLU 49 -1.688 -15.775 -15.775 468 2HG GLU 349 1HG GLU 49 -2.257 -14.818 -14.818 469 H LEU 350 H LEU 50 -0.661 -13.117 -13.117 470 HA LEU 350 HA LEU 50 -0.371 -15.815 -15.815 471 1HB LEU 350 2HB LEU 50 1.257 -14.868 -14.868 472 2HB LEU 350 1HB LEU 50 0.812 -13.319 -13.319 473 HG LEU 350 HG LEU 50 -0.971 -13.180 -13.180 474 1HD1 LEU 350 1HD1 LEU 50 0.054 -15.780 -15.780 475 2HD1 LEU 350 3HD1 LEU 50 0.539 -14.771 -14.771 476 3HD1 LEU 350 2HD1 LEU 50 -1.163 -14.905 -14.905 477 1HD2 LEU 350 1HD2 LEU 50 1.198 -11.911 -11.911 478 2HD2 LEU 350 3HD2 LEU 50 0.630 -12.277 -12.277 479 3HD2 LEU 350 2HD2 LEU 50 1.933 -13.227 -13.227 480 H LYS 351 H LYS 51 -2.744 -13.342 -13.342 481 HA LYS 351 HA LYS 51 -3.895 -14.324 -14.324 482 1HB LYS 351 2HB LYS 51 -4.360 -12.056 -12.056 483 2HB LYS 351 1HB LYS 51 -5.232 -12.809 -12.809 484 1HG LYS 351 2HG LYS 51 -7.064 -13.212 -13.212 485 2HG LYS 351 1HG LYS 51 -6.098 -13.755 -13.755 486 1HD LYS 351 2HD LYS 51 -7.358 -11.675 -11.675 487 2HD LYS 351 1HD LYS 51 -5.613 -11.433 -11.433 488 1HE LYS 351 2HE LYS 51 -6.040 -9.642 -9.642 489 2HE LYS 351 1HE LYS 51 -6.046 -10.857 -10.857 490 1HZ LYS 351 3HZ LYS 51 -8.563 -10.746 -10.746 491 2HZ LYS 351 2HZ LYS 51 -8.126 -9.206 -9.206 492 3HZ LYS 351 1HZ LYS 51 -8.195 -10.521 -10.521 493 H ASP 352 H ASP 52 -4.548 -14.934 -14.934 494 HA ASP 352 HA ASP 52 -6.803 -16.655 -16.655 495 1HB ASP 352 2HB ASP 52 -5.348 -15.663 -15.663 496 2HB ASP 352 1HB ASP 52 -5.221 -17.419 -17.419 497 H ALA 353 H ALA 53 -3.313 -17.259 -17.259 498 HA ALA 353 HA ALA 53 -3.620 -20.150 -20.150 499 1HB ALA 353 1HB ALA 53 -1.619 -19.060 -19.060 500 2HB ALA 353 3HB ALA 53 -1.182 -18.439 -18.439 501 3HB ALA 353 2HB ALA 53 -1.193 -20.177 -20.177 502 H GLN 354 H GLN 54 -4.081 -17.677 -17.677 503 HA GLN 354 HA GLN 54 -2.976 -19.044 -19.044 504 1HB GLN 354 2HB GLN 54 -4.213 -16.461 -16.461 505 2HB GLN 354 1HB GLN 54 -4.796 -17.157 -17.157 506 1HG GLN 354 2HG GLN 54 -2.073 -17.660 -17.660 507 2HG GLN 354 1HG GLN 54 -2.160 -16.065 -16.065 508 1HE2 GLN 354 2HE2 GLN 54 -4.213 -14.959 -14.959 509 2HE2 GLN 354 1HE2 GLN 54 -4.584 -15.173 -15.173 510 H ALA 355 HN ALA 55 -6.290 -17.821 -17.821 511 HA ALA 355 HA ALA 55 -8.337 -18.912 -18.912 512 1HB ALA 355 2HB ALA 55 -7.061 -20.616 -20.616 513 2HB ALA 355 1HB ALA 55 -7.119 -21.624 -21.624 514 3HB ALA 355 3HB ALA 55 -8.613 -21.008 -21.008 515 1H GLY 325 1H GLY 25 11.809 -0.596 -0.596 516 2H GLY 325 3H GLY 25 12.222 -2.059 -2.059 517 3H GLY 325 2H GLY 25 11.012 -1.074 -1.074 518 1HA GLY 325 2HA GLY 25 9.613 -2.454 -2.454 519 2HA GLY 325 1HA GLY 25 10.864 -2.968 -2.968 520 H GLU 326 H GLU 26 8.650 -0.292 -0.292 521 HA GLU 326 HA GLU 26 8.373 0.203 0.203 522 1HB GLU 326 2HB GLU 26 10.062 1.807 1.807 523 2HB GLU 326 1HB GLU 26 8.587 2.747 2.747 524 1HG GLU 326 2HG GLU 26 9.178 1.537 1.537 525 2HG GLU 326 1HG GLU 26 10.685 2.226 2.226 526 H TYR 327 H TYR 27 6.884 2.589 2.589 527 HA TYR 327 HA TYR 27 4.515 1.586 1.586 528 1HB TYR 327 2HB TYR 27 4.845 2.652 2.652 529 2HB TYR 327 1HB TYR 27 3.665 3.591 3.591 530 HD1 TYR 327 HD2 TYR 27 2.017 2.085 2.085 531 HD2 TYR 327 HD1 TYR 27 4.076 0.762 0.762 532 HE1 TYR 327 HE2 TYR 27 0.345 0.278 0.278 533 HE2 TYR 327 HE1 TYR 27 2.404 -1.045 -1.045 534 HH TYR 327 HH TYR 27 -0.452 -1.117 -1.117 535 H PHE 328 H PHE 28 3.501 2.981 2.981 536 HA PHE 328 HA PHE 28 4.539 5.766 5.766 537 1HB PHE 328 2HB PHE 28 4.651 3.623 3.623 538 2HB PHE 328 1HB PHE 28 4.403 5.296 5.296 539 HD1 PHE 328 HD2 PHE 28 6.593 3.235 3.235 540 HD2 PHE 328 HD1 PHE 28 6.260 6.681 6.681 541 HE1 PHE 328 HE2 PHE 28 9.015 3.683 3.683 542 HE2 PHE 328 HE1 PHE 28 8.682 7.128 7.128 543 HZ PHE 328 HZ PHE 28 10.059 5.629 5.629 544 H THR 329 H THR 29 3.015 7.237 7.237 545 HA THR 329 HA THR 29 0.248 6.124 6.124 546 HB THR 329 HB THR 29 0.519 9.040 9.040 547 HG1 THR 329 HG1 THR 29 2.189 8.687 8.687 548 1HG2 THR 329 3HG2 THR 29 -1.502 7.390 7.390 549 2HG2 THR 329 2HG2 THR 29 -0.847 7.213 7.213 550 3HG2 THR 329 1HG2 THR 29 -1.350 8.800 8.800 551 H LEU 330 H LEU 30 -0.962 6.525 6.525 552 HA LEU 330 HA LEU 30 0.360 8.135 8.135 553 1HB LEU 330 2HB LEU 30 -0.413 5.382 5.382 554 2HB LEU 330 1HB LEU 30 -1.485 6.251 6.251 555 HG LEU 330 HG LEU 30 1.520 6.594 6.594 556 1HD1 LEU 330 1HD1 LEU 30 -0.138 4.386 4.386 557 2HD1 LEU 330 3HD1 LEU 30 0.786 5.149 5.149 558 3HD1 LEU 330 2HD1 LEU 30 1.618 4.499 4.499 559 1HD2 LEU 330 3HD2 LEU 30 0.094 8.369 8.369 560 2HD2 LEU 330 2HD2 LEU 30 1.080 7.525 7.525 561 3HD2 LEU 330 1HD2 LEU 30 -0.635 7.146 7.146 562 H GLN 331 H GLN 31 -0.867 10.006 10.006 563 HA GLN 331 HA GLN 31 -3.788 9.841 9.841 564 1HB GLN 331 2HB GLN 31 -1.934 12.241 12.241 565 2HB GLN 331 1HB GLN 31 -3.664 12.294 12.294 566 1HG GLN 331 2HG GLN 31 -3.377 10.898 10.898 567 2HG GLN 331 1HG GLN 31 -1.668 10.667 10.667 568 1HE2 GLN 331 2HE2 GLN 31 -2.775 13.896 13.896 569 2HE2 GLN 331 1HE2 GLN 31 -3.814 12.590 12.590 570 H ILE 332 H ILE 32 -4.972 9.716 9.716 571 HA ILE 332 HA ILE 32 -3.972 11.168 11.168 572 HB ILE 332 HB ILE 32 -5.530 8.575 8.575 573 1HG1 ILE 332 2HG1 ILE 32 -3.158 8.626 8.626 574 2HG1 ILE 332 1HG1 ILE 32 -2.775 9.125 9.125 575 1HG2 ILE 332 3HG2 ILE 32 -5.001 10.445 10.445 576 2HG2 ILE 332 2HG2 ILE 32 -5.153 8.711 8.711 577 3HG2 ILE 332 1HG2 ILE 32 -6.493 9.608 9.608 578 1HD1 ILE 332 2HD1 ILE 32 -4.421 7.007 7.007 579 2HD1 ILE 332 1HD1 ILE 32 -3.653 6.489 6.489 580 3HD1 ILE 332 3HD1 ILE 32 -2.664 6.882 6.882 581 H ARG 333 H ARG 33 -5.622 12.188 12.188 582 HA ARG 333 HA ARG 33 -8.021 12.918 12.918 583 1HB ARG 333 2HB ARG 33 -7.309 14.173 14.173 584 2HB ARG 333 1HB ARG 33 -8.121 14.892 14.892 585 1HG ARG 333 2HG ARG 33 -5.900 14.532 14.532 586 2HG ARG 333 1HG ARG 33 -5.185 14.267 14.267 587 1HD ARG 333 2HD ARG 33 -6.637 16.554 16.554 588 2HD ARG 333 1HD ARG 33 -6.121 16.770 16.770 589 HE ARG 333 HE ARG 33 -3.875 15.919 15.919 590 1HH1 ARG 333 2HH1 ARG 33 -5.271 17.984 17.984 591 2HH1 ARG 333 1HH1 ARG 33 -4.454 19.434 19.434 592 1HH2 ARG 333 1HH2 ARG 33 -3.131 18.046 18.046 593 2HH2 ARG 333 2HH2 ARG 33 -3.242 19.469 19.469 594 H GLY 334 H GLY 34 -10.135 12.948 12.948 595 1HA GLY 334 2HA GLY 34 -11.523 12.300 12.300 596 2HA GLY 334 1HA GLY 34 -10.292 11.107 11.107 597 H ARG 335 H ARG 35 -11.105 9.099 9.099 598 HA ARG 335 HA ARG 35 -11.798 8.136 8.136 599 1HB ARG 335 2HB ARG 35 -13.819 9.663 9.663 600 2HB ARG 335 1HB ARG 35 -14.262 8.357 8.357 601 1HG ARG 335 2HG ARG 35 -14.725 6.881 6.881 602 2HG ARG 335 1HG ARG 35 -13.557 7.622 7.622 603 1HD ARG 335 2HD ARG 35 -15.086 9.625 9.625 604 2HD ARG 335 1HD ARG 35 -16.283 8.700 8.700 605 HE ARG 335 HE ARG 35 -15.302 7.307 7.307 606 1HH1 ARG 335 1HH2 ARG 35 -16.636 10.214 10.214 607 2HH1 ARG 335 2HH2 ARG 35 -18.200 9.720 9.720 608 1HH2 ARG 335 2HH1 ARG 35 -17.715 6.377 6.377 609 2HH2 ARG 335 1HH1 ARG 35 -18.811 7.547 7.547 610 H GLU 336 H GLU 36 -12.723 7.760 7.760 611 HA GLU 336 HA GLU 36 -12.871 4.884 4.884 612 1HB GLU 336 2HB GLU 36 -13.167 6.947 6.947 613 2HB GLU 336 1HB GLU 36 -12.280 5.557 5.557 614 1HG GLU 336 2HG GLU 36 -14.554 5.010 5.010 615 2HG GLU 336 1HG GLU 36 -14.127 4.121 4.121 616 H ARG 337 H ARG 37 -10.397 7.042 7.042 617 HA ARG 337 HA ARG 37 -8.511 5.065 5.065 618 1HB ARG 337 2HB ARG 37 -7.809 7.782 7.782 619 2HB ARG 337 1HB ARG 37 -6.848 6.809 6.809 620 1HG ARG 337 2HG ARG 37 -9.234 7.018 7.018 621 2HG ARG 337 1HG ARG 37 -9.129 8.587 8.587 622 1HD ARG 337 2HD ARG 37 -6.783 8.801 8.801 623 2HD ARG 337 1HD ARG 37 -7.059 7.327 7.327 624 HE ARG 337 HE ARG 37 -8.033 8.795 8.795 625 1HH1 ARG 337 2HH1 ARG 37 -7.719 10.874 10.874 626 2HH1 ARG 337 1HH1 ARG 37 -9.279 11.617 11.617 627 1HH2 ARG 337 1HH2 ARG 37 -10.541 9.235 9.235 628 2HH2 ARG 337 2HH2 ARG 37 -10.877 10.688 10.688 629 H PHE 338 H PHE 38 -9.118 6.639 6.639 630 HA PHE 338 HA PHE 38 -6.893 5.583 5.583 631 1HB PHE 338 2HB PHE 38 -8.291 7.294 7.294 632 2HB PHE 338 1HB PHE 38 -9.697 6.229 6.229 633 HD1 PHE 338 HD2 PHE 38 -6.449 6.881 6.881 634 HD2 PHE 338 HD1 PHE 38 -9.943 4.384 4.384 635 HE1 PHE 338 HE2 PHE 38 -5.809 5.932 5.932 636 HE2 PHE 338 HE1 PHE 38 -9.303 3.434 3.434 637 HZ PHE 338 HZ PHE 38 -7.236 4.209 4.209 638 H GLU 339 H GLU 39 -10.189 4.251 4.251 639 HA GLU 339 HA GLU 39 -9.722 1.853 1.853 640 1HB GLU 339 2HB GLU 39 -11.590 2.269 2.269 641 2HB GLU 339 1HB GLU 39 -11.699 0.977 0.977 642 1HG GLU 339 2HG GLU 39 -11.700 3.037 3.037 643 2HG GLU 339 1HG GLU 39 -12.342 3.882 3.882 644 H MET 340 H MET 40 -9.054 2.747 2.747 645 HA MET 340 HA MET 40 -8.525 0.180 0.180 646 1HB MET 340 2HB MET 40 -7.869 2.961 2.961 647 2HB MET 340 1HB MET 40 -6.627 1.815 1.815 648 1HG MET 340 2HG MET 40 -8.269 0.493 0.493 649 2HG MET 340 1HG MET 40 -9.582 1.494 1.494 650 1HE MET 340 2HE MET 40 -6.065 1.875 1.875 651 2HE MET 340 1HE MET 40 -6.150 3.319 3.319 652 3HE MET 340 3HE MET 40 -6.320 3.448 3.448 653 H PHE 341 H PHE 41 -6.204 2.495 2.495 654 HA PHE 341 HA PHE 41 -3.986 0.708 0.708 655 1HB PHE 341 2HB PHE 41 -4.696 3.089 3.089 656 2HB PHE 341 1HB PHE 41 -3.182 2.204 2.204 657 HD1 PHE 341 HD2 PHE 41 -2.293 1.524 1.524 658 HD2 PHE 341 HD1 PHE 41 -4.319 5.088 5.088 659 HE1 PHE 341 HE2 PHE 41 -1.319 2.761 2.761 660 HE2 PHE 341 HE1 PHE 41 -3.344 6.328 6.328 661 HZ PHE 341 HZ PHE 41 -1.846 5.163 5.163 662 H ARG 342 H ARG 42 -6.655 1.176 1.176 663 HA ARG 342 HA ARG 42 -5.708 -0.257 -0.257 664 1HB ARG 342 2HB ARG 42 -8.106 0.878 0.878 665 2HB ARG 342 1HB ARG 42 -8.506 -0.841 -0.841 666 1HG ARG 342 2HG ARG 42 -7.653 -1.094 -1.094 667 2HG ARG 342 1HG ARG 42 -7.143 0.594 0.594 668 1HD ARG 342 2HD ARG 42 -9.359 1.393 1.393 669 2HD ARG 342 1HD ARG 42 -10.011 -0.140 -0.140 670 HE ARG 342 HE ARG 42 -8.793 0.056 0.056 671 1HH1 ARG 342 1HH2 ARG 42 -9.640 -2.442 -2.442 672 2HH1 ARG 342 2HH2 ARG 42 -11.363 -2.453 -2.453 673 1HH2 ARG 342 2HH1 ARG 42 -11.768 0.799 0.799 674 2HH2 ARG 342 1HH1 ARG 42 -12.567 -0.620 -0.620 675 H GLU 343 H GLU 43 -6.918 -1.426 -1.426 676 HA GLU 343 HA GLU 43 -7.046 -4.211 -4.211 677 1HB GLU 343 2HB GLU 43 -8.378 -3.226 -3.226 678 2HB GLU 343 1HB GLU 43 -6.875 -3.131 -3.131 679 1HG GLU 343 2HG GLU 43 -7.560 -5.220 -5.220 680 2HG GLU 343 1HG GLU 43 -6.703 -5.691 -5.691 681 H LEU 344 H LEU 44 -4.806 -2.416 -2.416 682 HA LEU 344 HA LEU 44 -2.998 -4.509 -4.509 683 1HB LEU 344 2HB LEU 44 -2.499 -1.539 -1.539 684 2HB LEU 344 1HB LEU 44 -1.234 -2.663 -2.663 685 HG LEU 344 HG LEU 44 -2.018 -1.907 -1.907 686 1HD1 LEU 344 1HD1 LEU 44 -2.265 -4.462 -4.462 687 2HD1 LEU 344 3HD1 LEU 44 -3.999 -4.146 -4.146 688 3HD1 LEU 344 2HD1 LEU 44 -3.051 -3.747 -3.747 689 1HD2 LEU 344 2HD2 LEU 44 -4.041 -0.796 -0.796 690 2HD2 LEU 344 1HD2 LEU 44 -4.155 -1.110 -1.110 691 3HD2 LEU 344 3HD2 LEU 44 -4.917 -2.211 -2.211 692 H ASN 345 H ASN 45 -2.634 -2.031 -2.031 693 HA ASN 345 HA ASN 45 -0.517 -3.376 -3.376 694 1HB ASN 345 2HB ASN 45 -0.719 -1.763 -1.763 695 2HB ASN 345 1HB ASN 45 -1.580 -0.961 -0.961 696 1HD2 ASN 345 2HD2 ASN 45 -4.489 -0.701 -0.701 697 2HD2 ASN 345 1HD2 ASN 45 -3.499 -0.049 -0.049 698 H GLU 346 H GLU 46 -3.915 -4.013 -4.013 699 HA GLU 346 HA GLU 46 -4.120 -5.483 -5.483 700 1HB GLU 346 2HB GLU 46 -5.778 -4.981 -4.981 701 2HB GLU 346 1HB GLU 46 -5.956 -6.630 -6.630 702 1HG GLU 346 2HG GLU 46 -6.315 -5.690 -5.690 703 2HG GLU 346 1HG GLU 46 -6.301 -4.074 -4.074 704 H ALA 347 H ALA 47 -3.438 -6.465 -6.465 705 HA ALA 347 HA ALA 47 -3.174 -9.269 -9.269 706 1HB ALA 347 2HB ALA 47 -3.678 -8.319 -8.319 707 2HB ALA 347 1HB ALA 47 -1.975 -7.872 -7.872 708 3HB ALA 347 3HB ALA 47 -2.436 -9.569 -9.569 709 H LEU 348 H LEU 48 -0.821 -6.634 -6.634 710 HA LEU 348 HA LEU 48 1.555 -8.114 -8.114 711 1HB LEU 348 2HB LEU 48 0.944 -5.302 -5.302 712 2HB LEU 348 1HB LEU 48 2.562 -5.989 -5.989 713 HG LEU 348 HG LEU 48 0.618 -5.809 -5.809 714 1HD1 LEU 348 1HD1 LEU 48 1.917 -3.679 -3.679 715 2HD1 LEU 348 3HD1 LEU 48 2.927 -4.045 -4.045 716 3HD1 LEU 348 2HD1 LEU 48 1.220 -3.661 -3.661 717 1HD2 LEU 348 3HD2 LEU 48 2.624 -7.477 -7.477 718 2HD2 LEU 348 2HD2 LEU 48 2.433 -6.480 -6.480 719 3HD2 LEU 348 1HD2 LEU 48 3.621 -6.039 -6.039 720 H GLU 349 H GLU 49 -0.490 -6.602 -6.602 721 HA GLU 349 HA GLU 49 1.101 -7.420 -7.420 722 1HB GLU 349 2HB GLU 49 -0.878 -5.750 -5.750 723 2HB GLU 349 1HB GLU 49 -1.908 -7.175 -7.175 724 1HG GLU 349 2HG GLU 49 -0.424 -7.816 -7.816 725 2HG GLU 349 1HG GLU 49 0.157 -6.150 -6.150 726 H LEU 350 H LEU 50 -1.459 -9.019 -9.019 727 HA LEU 350 HA LEU 50 -1.753 -11.265 -11.265 728 1HB LEU 350 2HB LEU 50 -3.389 -11.801 -11.801 729 2HB LEU 350 1HB LEU 50 -2.943 -10.370 -10.370 730 HG LEU 350 HG LEU 50 -1.171 -11.853 -11.853 731 1HD1 LEU 350 1HD1 LEU 50 -2.210 -13.680 -13.680 732 2HD1 LEU 350 3HD1 LEU 50 -2.681 -14.270 -14.270 733 3HD1 LEU 350 2HD1 LEU 50 -0.982 -13.978 -13.978 734 1HD2 LEU 350 1HD2 LEU 50 -3.330 -11.121 -11.121 735 2HD2 LEU 350 3HD2 LEU 50 -2.791 -12.700 -12.700 736 3HD2 LEU 350 2HD2 LEU 50 -4.085 -12.586 -12.586 737 H LYS 351 H LYS 51 0.623 -10.348 -10.348 738 HA LYS 351 HA LYS 51 1.749 -12.954 -12.954 739 1HB LYS 351 2HB LYS 51 2.223 -10.952 -10.952 740 2HB LYS 351 1HB LYS 51 3.102 -10.238 -10.238 741 1HG LYS 351 2HG LYS 51 4.925 -11.538 -11.538 742 2HG LYS 351 1HG LYS 51 3.950 -12.980 -12.980 743 1HD LYS 351 2HD LYS 51 5.213 -12.295 -12.295 744 2HD LYS 351 1HD LYS 51 3.469 -12.236 -12.236 745 1HE LYS 351 2HE LYS 51 3.906 -10.136 -10.136 746 2HE LYS 351 1HE LYS 51 3.920 -9.719 -9.719 747 1HZ LYS 351 3HZ LYS 51 6.428 -10.769 -10.769 748 2HZ LYS 351 2HZ LYS 51 5.998 -9.456 -9.456 749 3HZ LYS 351 1HZ LYS 51 6.072 -9.266 -9.266 750 H ASP 352 H ASP 52 2.418 -10.398 -10.398 751 HA ASP 352 HA ASP 52 4.668 -11.682 -11.682 752 1HB ASP 352 2HB ASP 52 3.227 -9.289 -9.289 753 2HB ASP 352 1HB ASP 52 3.098 -10.147 -10.147 754 H ALA 353 H ALA 53 1.176 -11.878 -11.878 755 HA ALA 353 HA ALA 53 1.472 -13.590 -13.590 756 1HB ALA 353 1HB ALA 53 -0.518 -12.130 -12.130 757 2HB ALA 353 3HB ALA 53 -0.963 -13.129 -13.129 758 3HB ALA 353 2HB ALA 53 -0.958 -13.822 -13.822 759 H GLN 354 H GLN 54 1.934 -14.119 -14.119 760 HA GLN 354 HA GLN 54 0.804 -16.819 -16.819 761 1HB GLN 354 2HB GLN 54 2.052 -14.936 -14.936 762 2HB GLN 354 1HB GLN 54 2.620 -16.589 -16.589 763 1HG GLN 354 2HG GLN 54 -0.099 -16.928 -16.928 764 2HG GLN 354 1HG GLN 54 -0.014 -15.434 -15.434 765 1HE2 GLN 354 2HE2 GLN 54 2.022 -17.323 -17.323 766 2HE2 GLN 354 1HE2 GLN 54 2.408 -16.073 -16.073 767 H ALA 355 HN ALA 55 4.122 -16.055 -16.055 768 HA ALA 355 HA ALA 55 6.165 -16.980 -16.980 769 1HB ALA 355 2HB ALA 55 4.899 -16.509 -16.509 770 2HB ALA 355 1HB ALA 55 4.945 -18.271 -18.271 771 3HB ALA 355 3HB ALA 55 6.444 -17.354 -17.354 772 1H GLY 325 1H GLY 25 -15.674 12.670 12.670 773 2H GLY 325 3H GLY 25 -15.889 12.806 12.806 774 3H GLY 325 2H GLY 25 -14.672 11.794 11.794 775 1HA GLY 325 2HA GLY 25 -13.329 13.523 13.523 776 2HA GLY 325 1HA GLY 25 -14.675 14.665 14.665 777 H GLU 326 H GLU 26 -12.574 12.734 12.734 778 HA GLU 326 HA GLU 26 -12.691 14.911 14.911 779 1HB GLU 326 2HB GLU 26 -14.272 12.593 12.593 780 2HB GLU 326 1HB GLU 26 -12.903 12.377 12.377 781 1HG GLU 326 2HG GLU 26 -13.718 15.086 15.086 782 2HG GLU 326 1HG GLU 26 -15.181 14.104 14.104 783 H TYR 327 H TYR 27 -11.344 13.531 13.531 784 HA TYR 327 HA TYR 27 -8.745 12.954 12.954 785 1HB TYR 327 2HB TYR 27 -9.475 14.604 14.604 786 2HB TYR 327 1HB TYR 27 -8.255 13.411 13.411 787 HD1 TYR 327 HD2 TYR 27 -6.337 13.085 13.085 788 HD2 TYR 327 HD1 TYR 27 -8.726 16.618 16.618 789 HE1 TYR 327 HE2 TYR 27 -4.598 14.429 14.429 790 HE2 TYR 327 HE1 TYR 27 -6.985 17.962 17.962 791 HH TYR 327 HH TYR 27 -4.004 17.199 17.199 792 H PHE 328 H PHE 28 -7.657 11.052 11.052 793 HA PHE 328 HA PHE 28 -8.848 9.314 9.314 794 1HB PHE 328 2HB PHE 28 -8.551 8.712 8.712 795 2HB PHE 328 1HB PHE 28 -8.357 7.403 7.403 796 HD1 PHE 328 HD2 PHE 28 -10.662 10.251 10.251 797 HD2 PHE 328 HD1 PHE 28 -10.254 6.277 6.277 798 HE1 PHE 328 HE2 PHE 28 -13.127 10.089 10.089 799 HE2 PHE 328 HE1 PHE 28 -12.717 6.114 6.114 800 HZ PHE 328 HZ PHE 28 -14.154 8.020 8.020 801 H THR 329 H THR 29 -7.326 7.871 7.871 802 HA THR 329 HA THR 29 -4.489 8.502 8.502 803 HB THR 329 HB THR 29 -4.978 7.100 7.100 804 HG1 THR 329 HG1 THR 29 -6.774 8.293 8.293 805 1HG2 THR 329 3HG2 THR 29 -2.908 8.400 8.400 806 2HG2 THR 329 2HG2 THR 29 -3.747 9.815 9.815 807 3HG2 THR 329 1HG2 THR 29 -3.282 8.505 8.505 808 H LEU 330 H LEU 30 -3.090 6.833 6.833 809 HA LEU 330 HA LEU 30 -4.238 4.070 4.070 810 1HB LEU 330 2HB LEU 30 -3.287 5.602 5.602 811 2HB LEU 330 1HB LEU 30 -2.148 4.284 4.284 812 HG LEU 330 HG LEU 30 -5.141 3.856 3.856 813 1HD1 LEU 330 1HD1 LEU 30 -3.229 4.356 4.356 814 2HD1 LEU 330 3HD1 LEU 30 -4.035 2.795 2.795 815 3HD1 LEU 330 2HD1 LEU 30 -4.991 4.274 4.274 816 1HD2 LEU 330 3HD2 LEU 30 -3.720 2.136 2.136 817 2HD2 LEU 330 2HD2 LEU 30 -4.491 1.523 1.523 818 3HD2 LEU 330 1HD2 LEU 30 -2.786 1.976 1.976 819 H GLN 331 H GLN 31 -3.225 3.658 3.658 820 HA GLN 331 HA GLN 31 -0.337 4.051 4.051 821 1HB GLN 331 2HB GLN 31 -2.330 2.597 2.597 822 2HB GLN 331 1HB GLN 31 -0.661 2.970 2.970 823 1HG GLN 331 2HG GLN 31 -1.098 5.356 5.356 824 2HG GLN 331 1HG GLN 31 -2.729 5.054 5.054 825 1HE2 GLN 331 2HE2 GLN 31 -2.111 5.147 5.147 826 2HE2 GLN 331 1HE2 GLN 31 -0.956 5.667 5.667 827 H ILE 332 H ILE 32 1.071 2.668 2.668 828 HA ILE 332 HA ILE 32 0.284 -0.214 -0.214 829 HB ILE 332 HB ILE 32 1.976 1.461 1.461 830 1HG1 ILE 332 2HG1 ILE 32 -0.168 -0.136 -0.136 831 2HG1 ILE 332 1HG1 ILE 32 -0.786 0.949 0.949 832 1HG2 ILE 332 3HG2 ILE 32 1.609 -1.512 -1.512 833 2HG2 ILE 332 2HG2 ILE 32 1.914 -0.808 -0.808 834 3HG2 ILE 332 1HG2 ILE 32 3.091 -0.602 -0.602 835 1HD1 ILE 332 2HD1 ILE 32 0.923 2.615 2.615 836 2HD1 ILE 332 1HD1 ILE 32 0.384 1.585 1.585 837 3HD1 ILE 332 3HD1 ILE 32 -0.796 2.482 2.482 838 H ARG 333 H ARG 33 2.006 -1.747 -1.747 839 HA ARG 333 HA ARG 33 4.132 -0.648 -0.648 840 1HB ARG 333 2HB ARG 33 3.667 -3.583 -3.583 841 2HB ARG 333 1HB ARG 33 4.255 -2.757 -2.757 842 1HG ARG 333 2HG ARG 33 1.928 -1.654 -1.654 843 2HG ARG 333 1HG ARG 33 1.429 -2.889 -2.889 844 1HD ARG 333 2HD ARG 33 2.769 -4.391 -4.391 845 2HD ARG 333 1HD ARG 33 2.038 -3.143 -3.143 846 HE ARG 333 HE ARG 33 0.060 -4.126 -4.126 847 1HH1 ARG 333 2HH1 ARG 33 1.529 -6.642 -6.642 848 2HH1 ARG 333 1HH1 ARG 33 0.563 -7.082 -7.082 849 1HH2 ARG 333 1HH2 ARG 33 -1.014 -4.001 -4.001 850 2HH2 ARG 333 2HH2 ARG 33 -0.877 -5.586 -5.586 851 H GLY 334 H GLY 34 6.358 -1.429 -1.429 852 1HA GLY 334 2HA GLY 34 8.020 -2.598 -2.598 853 2HA GLY 334 1HA GLY 34 6.939 -2.390 -2.390 854 H ARG 335 H ARG 35 7.839 -0.962 -0.962 855 HA ARG 335 HA ARG 35 8.268 1.772 1.772 856 1HB ARG 335 2HB ARG 35 10.246 0.564 0.564 857 2HB ARG 335 1HB ARG 35 10.905 0.380 0.380 858 1HG ARG 335 2HG ARG 35 11.249 2.645 2.645 859 2HG ARG 335 1HG ARG 35 9.907 3.082 3.082 860 1HD ARG 335 2HD ARG 35 11.267 2.221 2.221 861 2HD ARG 335 1HD ARG 35 12.627 2.043 2.043 862 HE ARG 335 HE ARG 35 11.454 4.718 4.718 863 1HH1 ARG 335 1HH2 ARG 35 12.547 3.461 3.461 864 2HH1 ARG 335 2HH2 ARG 35 14.059 4.306 4.306 865 1HH2 ARG 335 1HH1 ARG 35 14.824 5.417 5.417 866 2HH2 ARG 335 2HH1 ARG 35 13.899 5.425 5.425 867 H GLU 336 H GLU 36 9.630 -0.841 -0.841 868 HA GLU 336 HA GLU 36 9.951 0.851 0.851 869 1HB GLU 336 2HB GLU 36 10.357 -1.948 -1.948 870 2HB GLU 336 1HB GLU 36 9.646 -1.777 -1.777 871 1HG GLU 336 2HG GLU 36 11.981 -1.642 -1.642 872 2HG GLU 336 1HG GLU 36 11.438 0.036 0.036 873 H ARG 337 H ARG 37 7.536 -1.708 -1.708 874 HA ARG 337 HA ARG 37 5.885 -1.309 -1.309 875 1HB ARG 337 2HB ARG 37 4.862 -1.875 -1.875 876 2HB ARG 337 1HB ARG 37 4.117 -2.345 -2.345 877 1HG ARG 337 2HG ARG 37 6.631 -3.425 -3.425 878 2HG ARG 337 1HG ARG 37 6.322 -3.616 -3.616 879 1HD ARG 337 2HD ARG 37 4.095 -4.637 -4.637 880 2HD ARG 337 1HD ARG 37 4.586 -4.599 -4.599 881 HE ARG 337 HE ARG 37 5.644 -6.637 -6.637 882 1HH1 ARG 337 2HH1 ARG 37 4.889 -5.719 -5.719 883 2HH1 ARG 337 1HH1 ARG 37 6.399 -6.114 -6.114 884 1HH2 ARG 337 1HH2 ARG 37 8.076 -6.566 -6.566 885 2HH2 ARG 337 2HH2 ARG 37 8.203 -6.594 -6.594 886 H PHE 338 H PHE 38 5.995 0.497 0.497 887 HA PHE 338 HA PHE 38 3.687 2.106 2.106 888 1HB PHE 338 2HB PHE 38 4.831 2.118 2.118 889 2HB PHE 338 1HB PHE 38 6.300 2.750 2.750 890 HD1 PHE 338 HD2 PHE 38 2.840 3.537 3.537 891 HD2 PHE 338 HD1 PHE 38 6.473 5.076 5.076 892 HE1 PHE 338 HE2 PHE 38 1.997 5.851 5.851 893 HE2 PHE 338 HE1 PHE 38 5.630 7.390 7.390 894 HZ PHE 338 HZ PHE 38 3.392 7.777 7.777 895 H GLU 339 H GLU 39 7.092 2.716 2.716 896 HA GLU 339 HA GLU 39 6.612 5.221 5.221 897 1HB GLU 339 2HB GLU 39 8.722 3.144 3.144 898 2HB GLU 339 1HB GLU 39 8.770 4.853 4.853 899 1HG GLU 339 2HG GLU 39 8.424 5.158 5.158 900 2HG GLU 339 1HG GLU 39 9.180 3.565 3.565 901 H MET 340 H MET 40 6.299 1.890 1.890 902 HA MET 340 HA MET 40 6.083 2.345 2.345 903 1HB MET 340 2HB MET 40 5.331 0.227 0.227 904 2HB MET 340 1HB MET 40 4.240 0.338 0.338 905 1HG MET 340 2HG MET 40 6.100 0.164 0.164 906 2HG MET 340 1HG MET 40 7.260 0.219 0.219 907 1HE MET 340 2HE MET 40 3.926 -1.416 -1.416 908 2HE MET 340 1HE MET 40 4.037 -3.035 -3.035 909 3HE MET 340 3HE MET 40 3.984 -1.621 -1.621 910 H PHE 341 H PHE 41 3.448 2.140 2.140 911 HA PHE 341 HA PHE 41 1.374 2.961 2.961 912 1HB PHE 341 2HB PHE 41 1.701 3.167 3.167 913 2HB PHE 341 1HB PHE 41 0.239 3.711 3.711 914 HD1 PHE 341 HD2 PHE 41 -0.269 1.827 1.827 915 HD2 PHE 341 HD1 PHE 41 1.327 1.106 1.106 916 HE1 PHE 341 HE2 PHE 41 -1.082 -0.510 -0.510 917 HE2 PHE 341 HE1 PHE 41 0.513 -1.235 -1.235 918 HZ PHE 341 HZ PHE 41 -0.688 -2.042 -2.042 919 H ARG 342 H ARG 42 3.704 4.779 4.779 920 HA ARG 342 HA ARG 42 2.588 7.355 7.355 921 1HB ARG 342 2HB ARG 42 4.976 6.310 6.310 922 2HB ARG 342 1HB ARG 42 5.486 7.258 7.258 923 1HG ARG 342 2HG ARG 42 4.378 9.242 9.242 924 2HG ARG 342 1HG ARG 42 3.754 8.309 8.309 925 1HD ARG 342 2HD ARG 42 5.890 8.043 8.043 926 2HD ARG 342 1HD ARG 42 6.713 8.434 8.434 927 HE ARG 342 HE ARG 42 5.157 10.523 10.523 928 1HH1 ARG 342 1HH2 ARG 42 6.140 12.076 12.076 929 2HH1 ARG 342 2HH2 ARG 42 7.826 12.347 12.347 930 1HH2 ARG 342 2HH1 ARG 42 8.150 9.667 9.667 931 2HH2 ARG 342 1HH1 ARG 42 8.963 10.983 10.983 932 H GLU 343 H GLU 43 4.247 5.475 5.475 933 HA GLU 343 HA GLU 43 4.458 7.694 7.694 934 1HB GLU 343 2HB GLU 43 5.945 5.655 5.655 935 2HB GLU 343 1HB GLU 43 4.565 4.731 4.731 936 1HG GLU 343 2HG GLU 43 5.471 5.331 5.331 937 2HG GLU 343 1HG GLU 43 4.471 6.758 6.758 938 H LEU 344 H LEU 44 2.383 4.756 4.756 939 HA LEU 344 HA LEU 44 0.798 5.373 5.373 940 1HB LEU 344 2HB LEU 44 0.068 4.007 4.007 941 2HB LEU 344 1HB LEU 44 -1.065 4.146 4.146 942 HG LEU 344 HG LEU 44 -0.123 2.061 2.061 943 1HD1 LEU 344 1HD1 LEU 44 0.287 3.759 3.759 944 2HD1 LEU 344 3HD1 LEU 44 1.974 3.722 3.722 945 3HD1 LEU 344 2HD1 LEU 44 1.190 2.246 2.246 946 1HD2 LEU 344 2HD2 LEU 44 1.635 2.567 2.567 947 2HD2 LEU 344 1HD2 LEU 44 1.989 1.344 1.344 948 3HD2 LEU 344 3HD2 LEU 44 2.691 2.957 2.957 949 H ASN 345 H ASN 45 -0.044 6.169 6.169 950 HA ASN 345 HA ASN 45 -2.216 7.869 7.869 951 1HB ASN 345 2HB ASN 45 -2.329 8.385 8.385 952 2HB ASN 345 1HB ASN 45 -1.366 6.915 6.915 953 1HD2 ASN 345 2HD2 ASN 45 1.243 8.611 8.611 954 2HD2 ASN 345 1HD2 ASN 45 0.368 7.173 7.173 955 H GLU 346 H GLU 46 1.203 8.373 8.373 956 HA GLU 346 HA GLU 46 1.201 11.249 11.249 957 1HB GLU 346 2HB GLU 46 3.096 9.116 9.116 958 2HB GLU 346 1HB GLU 46 3.311 10.527 10.527 959 1HG GLU 346 2HG GLU 46 3.318 11.964 11.964 960 2HG GLU 346 1HG GLU 46 3.282 10.493 10.493 961 H ALA 347 H ALA 47 0.992 8.923 8.923 962 HA ALA 347 HA ALA 47 0.832 10.994 10.994 963 1HB ALA 347 2HB ALA 47 1.510 8.574 8.574 964 2HB ALA 347 1HB ALA 47 -0.196 8.155 8.155 965 3HB ALA 347 3HB ALA 47 0.335 9.221 9.221 966 H LEU 348 H LEU 48 -1.609 8.893 8.893 967 HA LEU 348 HA LEU 48 -3.903 9.827 9.827 968 1HB LEU 348 2HB LEU 48 -3.594 9.157 9.157 969 2HB LEU 348 1HB LEU 48 -5.133 9.289 9.289 970 HG LEU 348 HG LEU 48 -2.927 7.389 7.389 971 1HD1 LEU 348 1HD1 LEU 48 -4.516 7.215 7.215 972 2HD1 LEU 348 3HD1 LEU 48 -5.318 6.173 6.173 973 3HD1 LEU 348 2HD1 LEU 48 -3.626 5.897 5.897 974 1HD2 LEU 348 3HD2 LEU 48 -4.816 8.234 8.234 975 2HD2 LEU 348 2HD2 LEU 48 -4.509 6.500 6.500 976 3HD2 LEU 348 1HD2 LEU 48 -5.870 7.204 7.204 977 H GLU 349 H GLU 49 -2.285 11.235 11.235 978 HA GLU 349 HA GLU 49 -4.073 13.445 13.445 979 1HB GLU 349 2HB GLU 49 -2.221 12.615 12.615 980 2HB GLU 349 1HB GLU 49 -1.121 13.579 13.579 981 1HG GLU 349 2HG GLU 49 -2.794 15.512 15.512 982 2HG GLU 349 1HG GLU 49 -3.473 14.521 14.521 983 H LEU 350 H LEU 50 -1.199 12.938 12.938 984 HA LEU 350 HA LEU 50 -0.965 15.652 15.652 985 1HB LEU 350 2HB LEU 50 0.864 14.810 14.810 986 2HB LEU 350 1HB LEU 50 0.432 13.235 13.235 987 HG LEU 350 HG LEU 50 -1.103 12.992 12.992 988 1HD1 LEU 350 1HD1 LEU 50 -0.208 15.642 15.642 989 2HD1 LEU 350 3HD1 LEU 50 0.579 14.676 14.676 990 3HD1 LEU 350 2HD1 LEU 50 -1.178 14.672 14.672 991 1HD2 LEU 350 1HD2 LEU 50 1.097 11.827 11.827 992 2HD2 LEU 350 3HD2 LEU 50 0.738 12.189 12.189 993 3HD2 LEU 350 2HD2 LEU 50 1.886 13.188 13.188 994 H LYS 351 H LYS 51 -3.092 13.033 13.033 995 HA LYS 351 HA LYS 51 -3.974 13.952 13.952 996 1HB LYS 351 2HB LYS 51 -4.400 11.652 11.652 997 2HB LYS 351 1HB LYS 51 -5.484 12.329 12.329 998 1HG LYS 351 2HG LYS 51 -7.163 12.626 12.626 999 2HG LYS 351 1HG LYS 51 -6.068 13.234 13.234 1000 1HD LYS 351 2HD LYS 51 -7.114 11.078 11.078 1001 2HD LYS 351 1HD LYS 51 -5.359 10.949 10.949 1002 1HE LYS 351 2HE LYS 51 -5.837 9.133 9.133 1003 2HE LYS 351 1HE LYS 51 -6.092 10.340 10.340 1004 1HZ LYS 351 3HZ LYS 51 -8.403 10.067 10.067 1005 2HZ LYS 351 2HZ LYS 51 -7.945 8.557 8.557 1006 3HZ LYS 351 1HZ LYS 51 -8.241 9.863 9.863 1007 H ASP 352 H ASP 52 -5.107 14.504 14.504 1008 HA ASP 352 HA ASP 52 -7.400 16.071 16.071 1009 1HB ASP 352 2HB ASP 52 -6.183 15.170 15.170 1010 2HB ASP 352 1HB ASP 52 -6.185 16.931 16.931 1011 H ALA 353 H ALA 53 -4.002 16.896 16.896 1012 HA ALA 353 HA ALA 53 -4.469 19.763 19.763 1013 1HB ALA 353 1HB ALA 53 -2.555 18.801 18.801 1014 2HB ALA 353 3HB ALA 53 -1.874 18.212 18.212 1015 3HB ALA 353 2HB ALA 53 -2.033 19.947 19.947 1016 H GLN 354 H GLN 54 -4.472 17.274 17.274 1017 HA GLN 354 HA GLN 54 -3.157 18.730 18.730 1018 1HB GLN 354 2HB GLN 54 -4.249 16.057 16.057 1019 2HB GLN 354 1HB GLN 54 -4.707 16.715 16.715 1020 1HG GLN 354 2HG GLN 54 -2.051 17.443 17.443 1021 2HG GLN 354 1HG GLN 54 -2.064 15.868 15.868 1022 1HE2 GLN 354 2HE2 GLN 54 -3.660 14.479 14.479 1023 2HE2 GLN 354 1HE2 GLN 54 -4.244 14.716 14.716 1024 H ALA 355 HN ALA 55 -6.375 17.279 17.279 1025 HA ALA 355 HA ALA 55 -8.424 18.232 18.232 1026 1HB ALA 355 2HB ALA 55 -7.492 20.012 20.012 1027 2HB ALA 355 1HB ALA 55 -7.427 21.018 21.018 1028 3HB ALA 355 3HB ALA 55 -8.956 20.301 20.301 Start of MODEL 3 1 1H GLY 325 3H GLY 25 10.748 2.627 2.627 2 2H GLY 325 2H GLY 25 11.347 3.436 3.436 3 3H GLY 325 1H GLY 25 12.299 3.312 3.312 4 1HA GLY 325 2HA GLY 25 13.248 1.644 1.644 5 2HA GLY 325 1HA GLY 25 11.761 1.327 1.327 6 H GLU 326 H GLU 26 10.658 -0.471 -0.471 7 HA GLU 326 HA GLU 26 10.951 -1.423 -1.423 8 1HB GLU 326 2HB GLU 26 11.958 -2.698 -2.698 9 2HB GLU 326 1HB GLU 26 10.594 -3.656 -3.656 10 1HG GLU 326 2HG GLU 26 11.693 -4.306 -4.306 11 2HG GLU 326 1HG GLU 26 12.400 -2.709 -2.709 12 H TYR 327 H TYR 27 9.199 -3.253 -3.253 13 HA TYR 327 HA TYR 27 6.637 -2.126 -2.126 14 1HB TYR 327 2HB TYR 27 7.493 -3.560 -3.560 15 2HB TYR 327 1HB TYR 27 5.879 -3.944 -3.944 16 HD1 TYR 327 HD2 TYR 27 8.074 -1.264 -1.264 17 HD2 TYR 327 HD1 TYR 27 4.107 -2.286 -2.286 18 HE1 TYR 327 HE2 TYR 27 7.214 0.856 0.856 19 HE2 TYR 327 HE1 TYR 27 3.248 -0.167 -0.167 20 HH TYR 327 HH TYR 27 4.581 2.286 2.286 21 H PHE 328 H PHE 28 6.019 -3.165 -3.165 22 HA PHE 328 HA PHE 28 6.431 -6.124 -6.124 23 1HB PHE 328 2HB PHE 28 6.008 -4.072 -4.072 24 2HB PHE 328 1HB PHE 28 6.099 -5.813 -5.813 25 HD1 PHE 328 HD1 PHE 28 8.197 -6.813 -6.813 26 HD2 PHE 328 HD2 PHE 28 7.983 -3.016 -3.016 27 HE1 PHE 328 HE1 PHE 28 10.674 -6.683 -6.683 28 HE2 PHE 328 HE2 PHE 28 10.460 -2.887 -2.887 29 HZ PHE 328 HZ PHE 28 11.805 -4.719 -4.719 30 H THR 329 H THR 29 4.614 -7.336 -7.336 31 HA THR 329 HA THR 29 1.964 -6.034 -6.034 32 HB THR 329 HB THR 29 2.052 -8.961 -8.961 33 HG1 THR 329 HG1 THR 29 3.655 -9.082 -9.082 34 1HG2 THR 329 2HG2 THR 29 0.263 -7.148 -7.148 35 2HG2 THR 329 1HG2 THR 29 1.203 -7.100 -7.100 36 3HG2 THR 329 3HG2 THR 29 0.469 -8.613 -8.613 37 H LEU 330 H LEU 30 0.432 -6.278 -6.278 38 HA LEU 330 HA LEU 30 1.147 -8.022 -8.022 39 1HB LEU 330 2HB LEU 30 0.674 -5.243 -5.243 40 2HB LEU 330 1HB LEU 30 -0.770 -5.967 -5.967 41 HG LEU 330 HG LEU 30 1.349 -7.351 -7.351 42 1HD1 LEU 330 3HD1 LEU 30 2.467 -5.044 -5.044 43 2HD1 LEU 330 2HD1 LEU 30 2.020 -4.561 -4.561 44 3HD1 LEU 330 1HD1 LEU 30 3.086 -5.944 -5.944 45 1HD2 LEU 330 3HD2 LEU 30 -0.491 -5.121 -5.121 46 2HD2 LEU 330 2HD2 LEU 30 -0.543 -6.825 -6.825 47 3HD2 LEU 330 1HD2 LEU 30 0.700 -5.771 -5.771 48 H GLN 331 H GLN 31 -0.034 -9.828 -9.828 49 HA GLN 331 HA GLN 31 -2.824 -9.444 -9.444 50 1HB GLN 331 2HB GLN 31 -1.179 -11.971 -11.971 51 2HB GLN 331 1HB GLN 31 -2.796 -11.896 -11.896 52 1HG GLN 331 2HG GLN 31 -2.034 -11.164 -11.164 53 2HG GLN 331 1HG GLN 31 -0.948 -9.995 -9.995 54 1HE2 GLN 331 2HE2 GLN 31 0.449 -13.791 -13.791 55 2HE2 GLN 331 1HE2 GLN 31 -1.224 -13.537 -13.537 56 H ILE 332 H ILE 32 -4.332 -9.204 -9.204 57 HA ILE 332 HA ILE 32 -3.929 -10.650 -10.650 58 HB ILE 332 HB ILE 32 -5.526 -8.157 -8.157 59 1HG1 ILE 332 2HG1 ILE 32 -3.660 -7.805 -7.805 60 2HG1 ILE 332 1HG1 ILE 32 -2.807 -8.644 -8.644 61 1HG2 ILE 332 3HG2 ILE 32 -5.276 -9.788 -9.788 62 2HG2 ILE 332 2HG2 ILE 32 -5.840 -8.117 -8.117 63 3HG2 ILE 332 1HG2 ILE 32 -6.753 -9.363 -9.363 64 1HD1 ILE 332 1HD1 ILE 32 -4.475 -6.148 -6.148 65 2HD1 ILE 332 3HD1 ILE 32 -2.724 -6.142 -6.142 66 3HD1 ILE 332 2HD1 ILE 32 -3.444 -6.941 -6.941 67 H ARG 333 H ARG 33 -5.341 -12.263 -12.263 68 HA ARG 333 HA ARG 33 -7.603 -12.725 -12.725 69 1HB ARG 333 2HB ARG 33 -6.413 -14.376 -14.376 70 2HB ARG 333 1HB ARG 33 -7.807 -14.882 -14.882 71 1HG ARG 333 2HG ARG 33 -6.483 -15.545 -15.545 72 2HG ARG 333 1HG ARG 33 -5.656 -13.987 -13.987 73 1HD ARG 333 2HD ARG 33 -4.122 -15.903 -15.903 74 2HD ARG 333 1HD ARG 33 -4.162 -14.693 -14.693 75 HE ARG 333 HE ARG 33 -6.111 -16.754 -16.754 76 1HH1 ARG 333 2HH1 ARG 33 -2.951 -17.356 -17.356 77 2HH1 ARG 333 1HH1 ARG 33 -2.482 -17.905 -17.905 78 1HH2 ARG 333 1HH2 ARG 33 -5.431 -16.895 -16.895 79 2HH2 ARG 333 2HH2 ARG 33 -3.887 -17.646 -17.646 80 H GLY 334 H GLY 34 -9.207 -11.252 -11.252 81 1HA GLY 334 2HA GLY 34 -11.010 -11.868 -11.868 82 2HA GLY 334 1HA GLY 34 -9.886 -10.714 -10.714 83 H ARG 335 H ARG 35 -11.106 -8.858 -8.858 84 HA ARG 335 HA ARG 35 -11.620 -7.463 -7.463 85 1HB ARG 335 2HB ARG 35 -13.619 -9.108 -9.108 86 2HB ARG 335 1HB ARG 35 -14.089 -7.925 -7.925 87 1HG ARG 335 2HG ARG 35 -14.677 -6.363 -6.363 88 2HG ARG 335 1HG ARG 35 -13.331 -6.773 -6.773 89 1HD ARG 335 2HD ARG 35 -14.709 -9.009 -9.009 90 2HD ARG 335 1HD ARG 35 -16.062 -7.993 -7.993 91 HE ARG 335 HE ARG 35 -14.292 -7.170 -7.170 92 1HH1 ARG 335 1HH2 ARG 35 -17.219 -8.639 -8.639 93 2HH1 ARG 335 2HH2 ARG 35 -18.192 -7.726 -7.726 94 1HH2 ARG 335 2HH1 ARG 35 -15.598 -5.638 -5.638 95 2HH2 ARG 335 1HH1 ARG 35 -17.274 -6.025 -6.025 96 H GLU 336 H GLU 36 -12.605 -7.587 -7.587 97 HA GLU 336 HA GLU 36 -12.719 -4.709 -4.709 98 1HB GLU 336 2HB GLU 36 -12.320 -6.733 -6.733 99 2HB GLU 336 1HB GLU 36 -12.993 -5.109 -5.109 100 1HG GLU 336 2HG GLU 36 -14.906 -5.747 -5.747 101 2HG GLU 336 1HG GLU 36 -14.226 -7.360 -7.360 102 H ARG 337 H ARG 37 -10.313 -7.130 -7.130 103 HA ARG 337 HA ARG 37 -8.429 -5.223 -5.223 104 1HB ARG 337 2HB ARG 37 -8.477 -8.079 -8.079 105 2HB ARG 337 1HB ARG 37 -6.927 -7.366 -7.366 106 1HG ARG 337 2HG ARG 37 -6.482 -6.629 -6.629 107 2HG ARG 337 1HG ARG 37 -8.183 -6.675 -6.675 108 1HD ARG 337 2HD ARG 37 -6.633 -9.177 -9.177 109 2HD ARG 337 1HD ARG 37 -6.713 -8.549 -8.549 110 HE ARG 337 HE ARG 37 -9.330 -8.691 -8.691 111 1HH1 ARG 337 1HH2 ARG 37 -8.715 -10.388 -10.388 112 2HH1 ARG 337 2HH2 ARG 37 -8.871 -11.987 -11.987 113 1HH2 ARG 337 2HH1 ARG 37 -8.704 -10.951 -10.951 114 2HH2 ARG 337 1HH1 ARG 37 -8.863 -12.306 -12.306 115 H PHE 338 H PHE 38 -9.006 -6.556 -6.556 116 HA PHE 338 HA PHE 38 -6.685 -5.454 -5.454 117 1HB PHE 338 2HB PHE 38 -8.042 -7.148 -7.148 118 2HB PHE 338 1HB PHE 38 -9.435 -6.066 -6.066 119 HD1 PHE 338 HD1 PHE 38 -5.930 -6.407 -6.407 120 HD2 PHE 338 HD2 PHE 38 -9.738 -4.480 -4.480 121 HE1 PHE 338 HE1 PHE 38 -5.154 -5.410 -5.410 122 HE2 PHE 338 HE2 PHE 38 -8.960 -3.482 -3.482 123 HZ PHE 338 HZ PHE 38 -6.668 -3.947 -3.947 124 H GLU 339 H GLU 39 -9.958 -4.163 -4.163 125 HA GLU 339 HA GLU 39 -9.575 -1.725 -1.725 126 1HB GLU 339 2HB GLU 39 -11.397 -2.521 -2.521 127 2HB GLU 339 1HB GLU 39 -11.393 -0.877 -0.877 128 1HG GLU 339 2HG GLU 39 -11.429 -2.559 -2.559 129 2HG GLU 339 1HG GLU 39 -12.578 -3.263 -3.263 130 H MET 340 H MET 40 -8.774 -2.735 -2.735 131 HA MET 340 HA MET 40 -8.134 -0.239 -0.239 132 1HB MET 340 2HB MET 40 -7.094 -3.021 -3.021 133 2HB MET 340 1HB MET 40 -6.361 -1.668 -1.668 134 1HG MET 340 2HG MET 40 -8.365 -1.154 -1.154 135 2HG MET 340 1HG MET 40 -9.348 -2.090 -2.090 136 1HE MET 340 2HE MET 40 -6.064 -2.529 -2.529 137 2HE MET 340 1HE MET 40 -6.109 -4.196 -4.196 138 3HE MET 340 3HE MET 40 -6.021 -3.851 -3.851 139 H PHE 341 H PHE 41 -5.944 -2.505 -2.505 140 HA PHE 341 HA PHE 41 -3.688 -0.805 -0.805 141 1HB PHE 341 2HB PHE 41 -4.614 -3.147 -3.147 142 2HB PHE 341 1HB PHE 41 -3.132 -2.305 -2.305 143 HD1 PHE 341 HD1 PHE 41 -2.101 -1.567 -1.567 144 HD2 PHE 341 HD2 PHE 41 -3.942 -5.191 -5.191 145 HE1 PHE 341 HE1 PHE 41 -0.975 -2.844 -2.844 146 HE2 PHE 341 HE2 PHE 41 -2.818 -6.463 -6.463 147 HZ PHE 341 HZ PHE 41 -1.350 -5.289 -5.289 148 H ARG 342 H ARG 42 -6.427 -1.155 -1.155 149 HA ARG 342 HA ARG 42 -5.553 0.308 0.308 150 1HB ARG 342 2HB ARG 42 -8.135 -0.499 -0.499 151 2HB ARG 342 1HB ARG 42 -8.218 1.026 1.026 152 1HG ARG 342 2HG ARG 42 -6.608 -0.622 -0.622 153 2HG ARG 342 1HG ARG 42 -7.910 -1.673 -1.673 154 1HD ARG 342 2HD ARG 42 -8.877 0.970 0.970 155 2HD ARG 342 1HD ARG 42 -8.073 0.128 0.128 156 HE ARG 342 HE ARG 42 -9.911 -1.630 -1.630 157 1HH1 ARG 342 2HH1 ARG 42 -9.377 -1.073 -1.073 158 2HH1 ARG 342 1HH1 ARG 42 -10.954 -0.552 -0.552 159 1HH2 ARG 342 1HH2 ARG 42 -12.087 -0.067 -0.067 160 2HH2 ARG 342 2HH2 ARG 42 -12.489 0.018 0.018 161 H GLU 343 H GLU 43 -6.932 1.432 1.432 162 HA GLU 343 HA GLU 43 -7.011 4.219 4.219 163 1HB GLU 343 2HB GLU 43 -8.284 3.078 3.078 164 2HB GLU 343 1HB GLU 43 -6.781 3.222 3.222 165 1HG GLU 343 2HG GLU 43 -7.381 5.331 5.331 166 2HG GLU 343 1HG GLU 43 -7.165 5.741 5.741 167 H LEU 344 H LEU 44 -4.715 2.304 2.304 168 HA LEU 344 HA LEU 44 -2.922 4.386 4.386 169 1HB LEU 344 2HB LEU 44 -2.436 1.448 1.448 170 2HB LEU 344 1HB LEU 44 -1.164 2.529 2.529 171 HG LEU 344 HG LEU 44 -1.933 1.641 1.641 172 1HD1 LEU 344 3HD1 LEU 44 -2.196 4.213 4.213 173 2HD1 LEU 344 2HD1 LEU 44 -3.930 3.887 3.887 174 3HD1 LEU 344 1HD1 LEU 44 -2.971 3.397 3.397 175 1HD2 LEU 344 1HD2 LEU 44 -3.921 0.560 0.560 176 2HD2 LEU 344 3HD2 LEU 44 -4.096 0.855 0.855 177 3HD2 LEU 344 2HD2 LEU 44 -4.830 1.961 1.961 178 H ASN 345 H ASN 45 -2.535 2.083 2.083 179 HA ASN 345 HA ASN 45 -0.445 3.568 3.568 180 1HB ASN 345 2HB ASN 45 -0.596 2.043 2.043 181 2HB ASN 345 1HB ASN 45 -1.283 1.120 1.120 182 1HD2 ASN 345 2HD2 ASN 45 -4.268 0.616 0.616 183 2HD2 ASN 345 1HD2 ASN 45 -3.130 0.027 0.027 184 H GLU 346 H GLU 46 -3.862 4.089 4.089 185 HA GLU 346 HA GLU 46 -4.100 5.566 5.566 186 1HB GLU 346 2HB GLU 46 -6.074 4.695 4.695 187 2HB GLU 346 1HB GLU 46 -5.737 5.763 5.763 188 1HG GLU 346 2HG GLU 46 -6.494 7.623 7.623 189 2HG GLU 346 1HG GLU 46 -5.889 7.073 7.073 190 H ALA 347 H ALA 47 -3.601 6.615 6.615 191 HA ALA 347 HA ALA 47 -3.385 9.414 9.414 192 1HB ALA 347 1HB ALA 47 -3.866 8.434 8.434 193 2HB ALA 347 3HB ALA 47 -2.142 8.074 8.074 194 3HB ALA 347 2HB ALA 47 -2.688 9.746 9.746 195 H LEU 348 H LEU 48 -0.959 6.863 6.863 196 HA LEU 348 HA LEU 48 1.362 8.456 8.456 197 1HB LEU 348 2HB LEU 48 0.980 5.639 5.639 198 2HB LEU 348 1HB LEU 48 2.517 6.398 6.398 199 HG LEU 348 HG LEU 48 0.296 6.108 6.108 200 1HD1 LEU 348 3HD1 LEU 48 2.428 4.132 4.132 201 2HD1 LEU 348 2HD1 LEU 48 1.732 4.124 4.124 202 3HD1 LEU 348 1HD1 LEU 48 0.700 3.851 3.851 203 1HD2 LEU 348 2HD2 LEU 48 2.514 7.607 7.607 204 2HD2 LEU 348 1HD2 LEU 48 1.879 6.777 6.777 205 3HD2 LEU 348 3HD2 LEU 48 3.214 6.071 6.071 206 H GLU 349 H GLU 49 -0.481 6.770 6.770 207 HA GLU 349 HA GLU 49 1.058 7.697 7.697 208 1HB GLU 349 2HB GLU 49 -1.777 6.750 6.750 209 2HB GLU 349 1HB GLU 49 -1.260 7.437 7.437 210 1HG GLU 349 2HG GLU 49 0.812 5.710 5.710 211 2HG GLU 349 1HG GLU 49 -0.629 4.834 4.834 212 H LEU 350 H LEU 50 -1.484 9.212 9.212 213 HA LEU 350 HA LEU 50 -1.920 11.406 11.406 214 1HB LEU 350 2HB LEU 50 -3.568 11.887 11.887 215 2HB LEU 350 1HB LEU 50 -3.071 10.465 10.465 216 HG LEU 350 HG LEU 50 -1.369 11.967 11.967 217 1HD1 LEU 350 1HD1 LEU 50 -2.423 13.764 13.764 218 2HD1 LEU 350 3HD1 LEU 50 -2.812 14.386 14.386 219 3HD1 LEU 350 2HD1 LEU 50 -1.136 14.052 14.052 220 1HD2 LEU 350 3HD2 LEU 50 -3.717 11.254 11.254 221 2HD2 LEU 350 2HD2 LEU 50 -2.933 12.613 12.613 222 3HD2 LEU 350 1HD2 LEU 50 -4.195 12.906 12.906 223 H LYS 351 H LYS 51 0.376 10.684 10.684 224 HA LYS 351 HA LYS 51 1.446 13.268 13.268 225 1HB LYS 351 2HB LYS 51 2.046 11.160 11.160 226 2HB LYS 351 1HB LYS 51 3.042 10.700 10.700 227 1HG LYS 351 2HG LYS 51 4.447 12.630 12.630 228 2HG LYS 351 1HG LYS 51 3.354 13.338 13.338 229 1HD LYS 351 2HD LYS 51 4.079 10.703 10.703 230 2HD LYS 351 1HD LYS 51 5.550 11.592 11.592 231 1HE LYS 351 2HE LYS 51 3.823 13.392 13.392 232 2HE LYS 351 1HE LYS 51 3.860 11.892 11.892 233 1HZ LYS 351 2HZ LYS 51 6.322 11.974 11.974 234 2HZ LYS 351 1HZ LYS 51 6.179 13.524 13.524 235 3HZ LYS 351 3HZ LYS 51 5.658 13.245 13.245 236 H ASP 352 H ASP 52 2.193 10.827 10.827 237 HA ASP 352 HA ASP 52 4.230 12.408 12.408 238 1HB ASP 352 2HB ASP 52 2.595 10.017 10.017 239 2HB ASP 352 1HB ASP 52 3.928 10.699 10.699 240 H ALA 353 H ALA 53 0.751 12.243 12.243 241 HA ALA 353 HA ALA 53 0.633 13.647 13.647 242 1HB ALA 353 3HB ALA 53 -1.053 11.901 11.901 243 2HB ALA 353 2HB ALA 53 -1.632 13.052 13.052 244 3HB ALA 353 1HB ALA 53 -1.759 13.435 13.435 245 H GLN 354 H GLN 54 1.147 14.558 14.558 246 HA GLN 354 HA GLN 54 -0.450 16.795 16.795 247 1HB GLN 354 2HB GLN 54 2.447 16.218 16.218 248 2HB GLN 354 1HB GLN 54 1.737 17.769 17.769 249 1HG GLN 354 2HG GLN 54 -0.186 16.109 16.109 250 2HG GLN 354 1HG GLN 54 1.220 15.060 15.060 251 1HE2 GLN 354 2HE2 GLN 54 0.658 18.028 18.028 252 2HE2 GLN 354 1HE2 GLN 54 -0.526 17.539 17.539 253 H ALA 355 HN ALA 55 0.022 19.125 19.125 254 HA ALA 355 HA ALA 55 1.908 20.010 20.010 255 1HB ALA 355 1HB ALA 55 -0.739 19.071 19.071 256 2HB ALA 355 3HB ALA 55 -0.194 20.622 20.622 257 3HB ALA 355 2HB ALA 55 0.796 19.179 19.179 258 1H GLY 325 3H GLY 25 -12.008 -14.584 -14.584 259 2H GLY 325 2H GLY 25 -12.755 -13.910 -13.910 260 3H GLY 325 1H GLY 25 -13.579 -15.059 -15.059 261 1HA GLY 325 2HA GLY 25 -14.551 -13.206 -13.206 262 2HA GLY 325 1HA GLY 25 -13.131 -12.215 -12.215 263 H GLU 326 H GLU 26 -11.892 -11.694 -11.694 264 HA GLU 326 HA GLU 26 -11.923 -13.534 -13.534 265 1HB GLU 326 2HB GLU 26 -13.054 -10.918 -10.918 266 2HB GLU 326 1HB GLU 26 -11.612 -10.824 -10.824 267 1HG GLU 326 2HG GLU 26 -12.533 -12.090 -12.090 268 2HG GLU 326 1HG GLU 26 -13.290 -13.197 -13.197 269 H TYR 327 H TYR 27 -10.079 -12.747 -12.747 270 HA TYR 327 HA TYR 27 -7.644 -12.405 -12.405 271 1HB TYR 327 2HB TYR 27 -8.262 -13.727 -13.727 272 2HB TYR 327 1HB TYR 27 -6.682 -12.953 -12.953 273 HD1 TYR 327 HD2 TYR 27 -8.878 -15.577 -15.577 274 HD2 TYR 327 HD1 TYR 27 -4.987 -13.762 -13.762 275 HE1 TYR 327 HE2 TYR 27 -8.035 -17.493 -17.493 276 HE2 TYR 327 HE1 TYR 27 -4.144 -15.679 -15.679 277 HH TYR 327 HH TYR 27 -5.552 -17.515 -17.515 278 H PHE 328 H PHE 28 -7.184 -10.240 -10.240 279 HA PHE 328 HA PHE 28 -7.441 -8.530 -8.530 280 1HB PHE 328 2HB PHE 28 -7.284 -7.796 -7.796 281 2HB PHE 328 1HB PHE 28 -7.322 -6.624 -6.624 282 HD1 PHE 328 HD1 PHE 28 -9.244 -7.527 -7.527 283 HD2 PHE 328 HD2 PHE 28 -9.342 -7.909 -7.909 284 HE1 PHE 328 HE1 PHE 28 -11.718 -7.685 -7.685 285 HE2 PHE 328 HE2 PHE 28 -11.816 -8.068 -8.068 286 HZ PHE 328 HZ PHE 28 -13.004 -7.955 -7.955 287 H THR 329 H THR 29 -5.664 -6.921 -6.921 288 HA THR 329 HA THR 29 -3.057 -7.955 -7.955 289 HB THR 329 HB THR 29 -2.848 -6.511 -6.511 290 HG1 THR 329 HG1 THR 29 -4.403 -7.469 -7.469 291 1HG2 THR 329 2HG2 THR 29 -1.254 -8.147 -8.147 292 2HG2 THR 329 1HG2 THR 29 -2.168 -9.399 -9.399 293 3HG2 THR 329 3HG2 THR 29 -1.298 -8.173 -8.173 294 H LEU 330 H LEU 30 -1.543 -6.397 -6.397 295 HA LEU 330 HA LEU 30 -2.457 -3.550 -3.550 296 1HB LEU 330 2HB LEU 30 -2.050 -5.155 -5.155 297 2HB LEU 330 1HB LEU 30 -0.664 -4.068 -4.068 298 HG LEU 330 HG LEU 30 -2.899 -2.486 -2.486 299 1HD1 LEU 330 3HD1 LEU 30 -3.851 -4.707 -4.707 300 2HD1 LEU 330 2HD1 LEU 30 -3.560 -3.589 -3.589 301 3HD1 LEU 330 1HD1 LEU 30 -4.630 -3.125 -3.125 302 1HD2 LEU 330 3HD2 LEU 30 -1.129 -2.833 -2.833 303 2HD2 LEU 330 2HD2 LEU 30 -1.076 -1.560 -1.560 304 3HD2 LEU 330 1HD2 LEU 30 -2.390 -1.601 -1.601 305 H GLN 331 H GLN 31 -1.130 -3.274 -3.274 306 HA GLN 331 HA GLN 31 1.709 -3.931 -3.931 307 1HB GLN 331 2HB GLN 31 0.135 -2.314 -2.314 308 2HB GLN 331 1HB GLN 31 1.814 -2.820 -2.820 309 1HG GLN 331 2HG GLN 31 1.220 -4.927 -4.927 310 2HG GLN 331 1HG GLN 31 0.045 -5.033 -5.033 311 1HE2 GLN 331 2HE2 GLN 31 -1.190 -3.663 -3.663 312 2HE2 GLN 331 1HE2 GLN 31 0.459 -3.608 -3.608 313 H ILE 332 H ILE 32 3.078 -2.700 -2.700 314 HA ILE 332 HA ILE 32 2.520 0.232 0.232 315 HB ILE 332 HB ILE 32 4.060 -1.616 -1.616 316 1HG1 ILE 332 2HG1 ILE 32 2.030 -0.121 -0.121 317 2HG1 ILE 332 1HG1 ILE 32 1.309 -0.776 -0.776 318 1HG2 ILE 332 3HG2 ILE 32 3.693 1.389 1.389 319 2HG2 ILE 332 2HG2 ILE 32 4.174 0.490 0.490 320 3HG2 ILE 332 1HG2 ILE 32 5.208 0.488 0.488 321 1HD1 ILE 332 1HD1 ILE 32 2.897 -2.418 -2.418 322 2HD1 ILE 332 3HD1 ILE 32 1.135 -2.330 -2.330 323 3HD1 ILE 332 2HD1 ILE 32 2.009 -3.025 -3.025 324 H ARG 333 H ARG 33 3.965 1.556 1.556 325 HA ARG 333 HA ARG 33 6.374 0.341 0.341 326 1HB ARG 333 2HB ARG 33 5.096 3.081 3.081 327 2HB ARG 333 1HB ARG 33 6.581 2.611 2.611 328 1HG ARG 333 2HG ARG 33 5.425 1.501 1.501 329 2HG ARG 333 1HG ARG 33 4.531 0.594 0.594 330 1HD ARG 333 2HD ARG 33 3.056 2.000 2.000 331 2HD ARG 333 1HD ARG 33 2.936 2.412 2.412 332 HE ARG 333 HE ARG 33 4.933 4.041 4.041 333 1HH1 ARG 333 2HH1 ARG 33 1.866 3.640 3.640 334 2HH1 ARG 333 1HH1 ARG 33 1.302 5.238 5.238 335 1HH2 ARG 333 1HH2 ARG 33 4.079 6.077 6.077 336 2HH2 ARG 333 2HH2 ARG 33 2.555 6.618 6.618 337 H GLY 334 H GLY 34 7.857 0.106 0.106 338 1HA GLY 334 2HA GLY 34 9.533 2.222 2.222 339 2HA GLY 334 1HA GLY 34 8.312 2.161 2.161 340 H ARG 335 H ARG 35 9.439 1.269 1.269 341 HA ARG 335 HA ARG 35 10.090 -1.559 -1.559 342 1HB ARG 335 2HB ARG 35 12.113 -0.213 -0.213 343 2HB ARG 335 1HB ARG 35 12.438 0.190 0.190 344 1HG ARG 335 2HG ARG 35 13.099 -1.927 -1.927 345 2HG ARG 335 1HG ARG 35 11.850 -2.661 -2.661 346 1HD ARG 335 2HD ARG 35 13.326 -1.676 -1.676 347 2HD ARG 335 1HD ARG 35 14.602 -1.749 -1.749 348 HE ARG 335 HE ARG 35 12.977 -4.170 -4.170 349 1HH1 ARG 335 1HH2 ARG 35 15.893 -2.522 -2.522 350 2HH1 ARG 335 2HH2 ARG 35 16.905 -3.905 -3.905 351 1HH2 ARG 335 2HH1 ARG 35 14.304 -5.960 -5.960 352 2HH2 ARG 335 1HH1 ARG 35 16.007 -5.851 -5.851 353 H GLU 336 H GLU 36 10.809 1.434 1.434 354 HA GLU 336 HA GLU 36 10.791 0.090 0.090 355 1HB GLU 336 2HB GLU 36 10.292 3.032 3.032 356 2HB GLU 336 1HB GLU 36 10.878 2.307 2.307 357 1HG GLU 336 2HG GLU 36 12.922 1.558 1.558 358 2HG GLU 336 1HG GLU 36 12.337 2.224 2.224 359 H ARG 337 H ARG 37 8.392 2.198 2.198 360 HA ARG 337 HA ARG 37 6.363 1.900 1.900 361 1HB ARG 337 2HB ARG 37 6.571 2.975 2.975 362 2HB ARG 337 1HB ARG 37 5.026 2.159 2.159 363 1HG ARG 337 2HG ARG 37 4.418 3.578 3.578 364 2HG ARG 337 1HG ARG 37 6.086 4.056 4.056 365 1HD ARG 337 2HD ARG 37 4.699 4.739 4.739 366 2HD ARG 337 1HD ARG 37 4.602 5.789 5.789 367 HE ARG 337 HE ARG 37 7.261 5.562 5.562 368 1HH1 ARG 337 1HH2 ARG 37 6.914 4.422 4.422 369 2HH1 ARG 337 2HH2 ARG 37 7.087 5.845 5.845 370 1HH2 ARG 337 2HH1 ARG 37 6.617 8.034 8.034 371 2HH2 ARG 337 1HH1 ARG 37 6.917 7.890 7.890 372 H PHE 338 H PHE 38 7.229 -0.054 -0.054 373 HA PHE 338 HA PHE 38 4.966 -1.822 -1.822 374 1HB PHE 338 2HB PHE 38 6.486 -1.768 -1.768 375 2HB PHE 338 1HB PHE 38 7.828 -2.303 -2.303 376 HD1 PHE 338 HD1 PHE 38 4.448 -3.303 -3.303 377 HD2 PHE 338 HD2 PHE 38 8.203 -4.601 -4.601 378 HE1 PHE 338 HE1 PHE 38 3.803 -5.663 -5.663 379 HE2 PHE 338 HE2 PHE 38 7.557 -6.963 -6.963 380 HZ PHE 338 HZ PHE 38 5.356 -7.494 -7.494 381 H GLU 339 H GLU 39 8.133 -1.917 -1.917 382 HA GLU 339 HA GLU 39 7.756 -4.470 -4.470 383 1HB GLU 339 2HB GLU 39 9.430 -2.053 -2.053 384 2HB GLU 339 1HB GLU 39 9.418 -3.497 -3.497 385 1HG GLU 339 2HG GLU 39 9.719 -4.418 -4.418 386 2HG GLU 339 1HG GLU 39 10.814 -3.045 -3.045 387 H MET 340 H MET 40 6.780 -1.192 -1.192 388 HA MET 340 HA MET 40 5.937 -1.637 -1.637 389 1HB MET 340 2HB MET 40 4.994 0.203 0.203 390 2HB MET 340 1HB MET 40 4.146 0.153 0.153 391 1HG MET 340 2HG MET 40 6.034 0.903 0.903 392 2HG MET 340 1HG MET 40 7.140 0.490 0.490 393 1HE MET 340 2HE MET 40 3.778 2.242 2.242 394 2HE MET 340 1HE MET 40 3.871 3.635 3.635 395 3HE MET 340 3HE MET 40 3.852 1.996 1.996 396 H PHE 341 H PHE 41 3.954 -1.771 -1.771 397 HA PHE 341 HA PHE 41 1.644 -2.899 -2.899 398 1HB PHE 341 2HB PHE 41 2.729 -2.983 -2.983 399 2HB PHE 341 1HB PHE 41 1.215 -3.776 -3.776 400 HD1 PHE 341 HD1 PHE 41 0.063 -1.948 -1.948 401 HD2 PHE 341 HD2 PHE 41 2.138 -1.083 -1.083 402 HE1 PHE 341 HE1 PHE 41 -1.122 0.225 0.225 403 HE2 PHE 341 HE2 PHE 41 0.955 1.089 1.089 404 HZ PHE 341 HZ PHE 41 -0.674 1.743 1.743 405 H ARG 342 H ARG 42 4.629 -4.338 -4.338 406 HA ARG 342 HA ARG 42 3.814 -7.053 -7.053 407 1HB ARG 342 2HB ARG 42 6.339 -5.575 -5.575 408 2HB ARG 342 1HB ARG 42 6.421 -7.141 -7.141 409 1HG ARG 342 2HG ARG 42 5.000 -7.642 -7.642 410 2HG ARG 342 1HG ARG 42 6.296 -6.548 -6.548 411 1HD ARG 342 2HD ARG 42 7.213 -8.607 -8.607 412 2HD ARG 342 1HD ARG 42 6.551 -9.288 -9.288 413 HE ARG 342 HE ARG 42 8.347 -7.105 -7.105 414 1HH1 ARG 342 2HH1 ARG 42 8.031 -9.961 -9.961 415 2HH1 ARG 342 1HH1 ARG 42 9.619 -10.585 -10.585 416 1HH2 ARG 342 1HH2 ARG 42 10.470 -8.090 -8.090 417 2HH2 ARG 342 2HH2 ARG 42 10.999 -9.527 -9.527 418 H GLU 343 H GLU 43 4.882 -5.049 -5.049 419 HA GLU 343 HA GLU 43 4.915 -7.228 -7.228 420 1HB GLU 343 2HB GLU 43 6.084 -4.941 -4.941 421 2HB GLU 343 1HB GLU 43 4.512 -4.316 -4.316 422 1HG GLU 343 2HG GLU 43 4.979 -5.013 -5.013 423 2HG GLU 343 1HG GLU 43 4.874 -6.670 -6.670 424 H LEU 344 H LEU 44 2.555 -4.629 -4.629 425 HA LEU 344 HA LEU 44 0.629 -5.325 -5.325 426 1HB LEU 344 2HB LEU 44 0.297 -4.204 -4.204 427 2HB LEU 344 1HB LEU 44 -1.048 -4.382 -4.382 428 HG LEU 344 HG LEU 44 -0.399 -2.178 -2.178 429 1HD1 LEU 344 3HD1 LEU 44 -0.211 -3.719 -3.719 430 2HD1 LEU 344 2HD1 LEU 44 1.531 -3.498 -3.498 431 3HD1 LEU 344 1HD1 LEU 44 0.488 -2.102 -2.102 432 1HD2 LEU 344 1HD2 LEU 44 1.696 -2.576 -2.576 433 2HD2 LEU 344 3HD2 LEU 44 1.771 -1.314 -1.314 434 3HD2 LEU 344 2HD2 LEU 44 2.530 -2.879 -2.879 435 H ASN 345 H ASN 45 0.556 -6.327 -6.327 436 HA ASN 345 HA ASN 45 -1.480 -8.282 -8.282 437 1HB ASN 345 2HB ASN 45 -1.111 -8.860 -8.860 438 2HB ASN 345 1HB ASN 45 -0.456 -7.230 -7.230 439 1HD2 ASN 345 2HD2 ASN 45 2.650 -8.373 -8.373 440 2HD2 ASN 345 1HD2 ASN 45 1.474 -7.151 -7.151 441 H GLU 346 H GLU 46 1.879 -8.347 -8.347 442 HA GLU 346 HA GLU 46 2.243 -11.213 -11.213 443 1HB GLU 346 2HB GLU 46 4.163 -9.674 -9.674 444 2HB GLU 346 1HB GLU 46 3.684 -9.120 -9.120 445 1HG GLU 346 2HG GLU 46 4.433 -11.022 -11.022 446 2HG GLU 346 1HG GLU 46 3.975 -12.057 -12.057 447 H ALA 347 H ALA 47 1.474 -8.958 -8.958 448 HA ALA 347 HA ALA 47 1.193 -11.040 -11.040 449 1HB ALA 347 1HB ALA 47 1.527 -8.547 -8.547 450 2HB ALA 347 3HB ALA 47 -0.183 -8.346 -8.346 451 3HB ALA 347 2HB ALA 47 0.303 -9.341 -9.341 452 H LEU 348 H LEU 48 -1.171 -9.267 -9.267 453 HA LEU 348 HA LEU 48 -3.530 -10.442 -10.442 454 1HB LEU 348 2HB LEU 48 -2.937 -9.779 -9.779 455 2HB LEU 348 1HB LEU 48 -4.535 -9.930 -9.930 456 HG LEU 348 HG LEU 48 -2.494 -7.967 -7.967 457 1HD1 LEU 348 3HD1 LEU 48 -4.470 -7.665 -7.665 458 2HD1 LEU 348 2HD1 LEU 48 -3.891 -6.278 -6.278 459 3HD1 LEU 348 1HD1 LEU 48 -2.752 -7.268 -7.268 460 1HD2 LEU 348 2HD2 LEU 48 -4.778 -8.810 -8.810 461 2HD2 LEU 348 1HD2 LEU 48 -4.239 -7.137 -7.137 462 3HD2 LEU 348 3HD2 LEU 48 -5.453 -7.575 -7.575 463 H GLU 349 H GLU 49 -1.434 -11.594 -11.594 464 HA GLU 349 HA GLU 49 -2.865 -13.994 -13.994 465 1HB GLU 349 2HB GLU 49 -0.007 -13.131 -13.131 466 2HB GLU 349 1HB GLU 49 -0.460 -14.809 -14.809 467 1HG GLU 349 2HG GLU 49 -2.467 -13.364 -13.364 468 2HG GLU 349 1HG GLU 49 -1.014 -12.418 -12.418 469 H LEU 350 H LEU 50 -0.470 -13.167 -13.167 470 HA LEU 350 HA LEU 50 -0.029 -15.843 -15.843 471 1HB LEU 350 2HB LEU 50 1.448 -14.802 -14.802 472 2HB LEU 350 1HB LEU 50 0.954 -13.287 -13.287 473 HG LEU 350 HG LEU 50 -0.930 -13.211 -13.211 474 1HD1 LEU 350 1HD1 LEU 50 0.211 -15.771 -15.771 475 2HD1 LEU 350 3HD1 LEU 50 0.438 -14.723 -14.723 476 3HD1 LEU 350 2HD1 LEU 50 -1.181 -14.997 -14.997 477 1HD2 LEU 350 3HD2 LEU 50 1.359 -11.996 -11.996 478 2HD2 LEU 350 2HD2 LEU 50 0.462 -12.116 -12.116 479 3HD2 LEU 350 1HD2 LEU 50 1.815 -13.204 -13.204 480 H LYS 351 H LYS 51 -2.495 -13.419 -13.419 481 HA LYS 351 HA LYS 51 -3.709 -14.526 -14.526 482 1HB LYS 351 2HB LYS 51 -4.315 -12.332 -12.332 483 2HB LYS 351 1HB LYS 51 -5.180 -13.273 -13.273 484 1HG LYS 351 2HG LYS 51 -6.685 -14.169 -14.169 485 2HG LYS 351 1HG LYS 51 -5.720 -13.509 -13.509 486 1HD LYS 351 2HD LYS 51 -6.393 -11.376 -11.376 487 2HD LYS 351 1HD LYS 51 -7.868 -12.255 -12.255 488 1HE LYS 351 2HE LYS 51 -6.335 -12.011 -12.011 489 2HE LYS 351 1HE LYS 51 -6.380 -10.420 -10.420 490 1HZ LYS 351 2HZ LYS 51 -8.818 -10.728 -10.728 491 2HZ LYS 351 1HZ LYS 51 -8.693 -12.137 -12.137 492 3HZ LYS 351 3HZ LYS 51 -8.287 -10.633 -10.633 493 H ASP 352 H ASP 52 -4.140 -15.278 -15.278 494 HA ASP 352 HA ASP 52 -6.151 -17.316 -17.316 495 1HB ASP 352 2HB ASP 52 -4.403 -16.755 -16.755 496 2HB ASP 352 1HB ASP 52 -5.743 -17.902 -17.902 497 H ALA 353 H ALA 53 -2.686 -17.199 -17.199 498 HA ALA 353 HA ALA 53 -2.417 -20.129 -20.129 499 1HB ALA 353 3HB ALA 53 -0.724 -18.511 -18.511 500 2HB ALA 353 2HB ALA 53 -0.280 -18.099 -18.099 501 3HB ALA 353 1HB ALA 53 -0.039 -19.741 -19.741 502 H GLN 354 H GLN 54 -3.224 -17.992 -17.992 503 HA GLN 354 HA GLN 54 -1.759 -18.740 -18.740 504 1HB GLN 354 2HB GLN 54 -4.662 -18.044 -18.044 505 2HB GLN 354 1HB GLN 54 -4.064 -18.501 -18.501 506 1HG GLN 354 2HG GLN 54 -2.142 -16.741 -16.741 507 2HG GLN 354 1HG GLN 54 -3.501 -16.065 -16.065 508 1HE2 GLN 354 2HE2 GLN 54 -3.309 -15.448 -15.448 509 2HE2 GLN 354 1HE2 GLN 54 -2.010 -16.047 -16.047 510 H ALA 355 HN ALA 55 -2.298 -20.334 -20.334 511 HA ALA 355 HA ALA 55 -4.065 -22.542 -22.542 512 1HB ALA 355 1HB ALA 55 -1.321 -22.721 -22.721 513 2HB ALA 355 3HB ALA 55 -1.864 -24.120 -24.120 514 3HB ALA 355 2HB ALA 55 -2.787 -23.578 -23.578 515 1H GLY 325 3H GLY 25 9.773 -1.959 -1.959 516 2H GLY 325 2H GLY 25 10.521 -2.729 -2.729 517 3H GLY 325 1H GLY 25 11.353 -2.556 -2.556 518 1HA GLY 325 2HA GLY 25 12.295 -0.836 -0.836 519 2HA GLY 325 1HA GLY 25 10.864 -0.597 -0.597 520 H GLU 326 H GLU 26 9.613 1.128 1.128 521 HA GLU 326 HA GLU 26 9.654 2.094 2.094 522 1HB GLU 326 2HB GLU 26 10.751 3.425 3.425 523 2HB GLU 326 1HB GLU 26 9.300 4.306 4.306 524 1HG GLU 326 2HG GLU 26 10.231 5.013 5.013 525 2HG GLU 326 1HG GLU 26 11.002 3.456 3.456 526 H TYR 327 H TYR 27 7.789 3.824 3.824 527 HA TYR 327 HA TYR 27 5.360 2.575 2.575 528 1HB TYR 327 2HB TYR 27 5.978 4.033 4.033 529 2HB TYR 327 1HB TYR 27 4.389 4.337 4.337 530 HD1 TYR 327 HD2 TYR 27 6.627 1.771 1.771 531 HD2 TYR 327 HD1 TYR 27 2.716 2.580 2.580 532 HE1 TYR 327 HE2 TYR 27 5.817 -0.399 -0.399 533 HE2 TYR 327 HE1 TYR 27 1.907 0.412 0.412 534 HH TYR 327 HH TYR 27 3.337 -1.968 -1.968 535 H PHE 328 H PHE 28 4.870 3.575 3.575 536 HA PHE 328 HA PHE 28 5.100 6.551 6.551 537 1HB PHE 328 2HB PHE 28 4.939 4.481 4.481 538 2HB PHE 328 1HB PHE 28 4.956 6.225 6.225 539 HD1 PHE 328 HD1 PHE 28 6.878 7.333 7.333 540 HD2 PHE 328 HD2 PHE 28 7.008 3.534 3.534 541 HE1 PHE 328 HE1 PHE 28 9.353 7.337 7.337 542 HE2 PHE 328 HE2 PHE 28 9.483 3.538 3.538 543 HZ PHE 328 HZ PHE 28 10.656 5.439 5.439 544 H THR 329 H THR 29 3.304 7.671 7.671 545 HA THR 329 HA THR 29 0.715 6.212 6.212 546 HB THR 329 HB THR 29 0.549 9.130 9.130 547 HG1 THR 329 HG1 THR 29 2.083 9.382 9.382 548 1HG2 THR 329 2HG2 THR 29 -1.097 7.159 7.159 549 2HG2 THR 329 1HG2 THR 29 -0.220 7.175 7.175 550 3HG2 THR 329 3HG2 THR 29 -1.064 8.623 8.623 551 H LEU 330 H LEU 30 -0.772 6.443 6.443 552 HA LEU 330 HA LEU 30 0.058 8.161 8.161 553 1HB LEU 330 2HB LEU 30 -0.277 5.361 5.361 554 2HB LEU 330 1HB LEU 30 -1.698 5.992 5.992 555 HG LEU 330 HG LEU 30 0.453 7.475 7.475 556 1HD1 LEU 330 3HD1 LEU 30 1.564 5.203 5.203 557 2HD1 LEU 330 2HD1 LEU 30 1.263 4.703 4.703 558 3HD1 LEU 330 1HD1 LEU 30 2.260 6.120 6.120 559 1HD2 LEU 330 3HD2 LEU 30 -1.255 5.195 5.195 560 2HD2 LEU 330 2HD2 LEU 30 -1.342 6.903 6.903 561 3HD2 LEU 330 1HD2 LEU 30 -0.020 5.905 5.905 562 H GLN 331 H GLN 31 -1.287 9.881 9.881 563 HA GLN 331 HA GLN 31 -4.123 9.379 9.379 564 1HB GLN 331 2HB GLN 31 -2.574 11.973 11.973 565 2HB GLN 331 1HB GLN 31 -4.247 11.840 11.840 566 1HG GLN 331 2HG GLN 31 -3.630 11.176 11.176 567 2HG GLN 331 1HG GLN 31 -2.443 10.036 10.036 568 1HE2 GLN 331 2HE2 GLN 31 -1.256 13.883 13.883 569 2HE2 GLN 331 1HE2 GLN 31 -2.903 13.557 13.557 570 H ILE 332 H ILE 32 -5.510 9.074 9.074 571 HA ILE 332 HA ILE 32 -4.970 10.507 10.507 572 HB ILE 332 HB ILE 32 -6.480 7.933 7.933 573 1HG1 ILE 332 2HG1 ILE 32 -4.461 7.677 7.677 574 2HG1 ILE 332 1HG1 ILE 32 -3.740 8.561 8.561 575 1HG2 ILE 332 3HG2 ILE 32 -6.147 9.576 9.576 576 2HG2 ILE 332 2HG2 ILE 32 -6.615 7.876 7.876 577 3HG2 ILE 332 1HG2 ILE 32 -7.653 9.066 9.066 578 1HD1 ILE 332 1HD1 ILE 32 -5.295 5.975 5.975 579 2HD1 ILE 332 3HD1 ILE 32 -3.535 6.072 6.072 580 3HD1 ILE 332 2HD1 ILE 32 -4.407 6.826 6.826 581 H ARG 333 H ARG 33 -6.444 12.039 12.039 582 HA ARG 333 HA ARG 33 -8.845 12.368 12.368 583 1HB ARG 333 2HB ARG 33 -7.601 14.095 14.095 584 2HB ARG 333 1HB ARG 33 -9.087 14.513 14.513 585 1HG ARG 333 2HG ARG 33 -7.933 15.246 15.246 586 2HG ARG 333 1HG ARG 33 -7.020 13.738 13.738 587 1HD ARG 333 2HD ARG 33 -5.568 15.742 15.742 588 2HD ARG 333 1HD ARG 33 -5.444 14.538 14.538 589 HE ARG 333 HE ARG 33 -7.465 16.491 16.491 590 1HH1 ARG 333 2HH1 ARG 33 -4.399 17.259 17.259 591 2HH1 ARG 333 1HH1 ARG 33 -3.850 17.833 17.833 592 1HH2 ARG 333 1HH2 ARG 33 -6.626 16.668 16.668 593 2HH2 ARG 333 2HH2 ARG 33 -5.111 17.499 17.499 594 H GLY 334 H GLY 34 -10.321 10.812 10.812 595 1HA GLY 334 2HA GLY 34 -12.024 11.336 11.336 596 2HA GLY 334 1HA GLY 34 -10.795 10.253 10.253 597 H ARG 335 H ARG 35 -11.899 8.331 8.331 598 HA ARG 335 HA ARG 35 -12.507 6.894 6.894 599 1HB ARG 335 2HB ARG 35 -14.556 8.432 8.432 600 2HB ARG 335 1HB ARG 35 -14.873 7.234 7.234 601 1HG ARG 335 2HG ARG 35 -15.504 5.644 5.644 602 2HG ARG 335 1HG ARG 35 -14.251 6.102 6.102 603 1HD ARG 335 2HD ARG 35 -15.748 8.274 8.274 604 2HD ARG 335 1HD ARG 35 -17.016 7.202 7.202 605 HE ARG 335 HE ARG 35 -15.368 6.452 6.452 606 1HH1 ARG 335 1HH2 ARG 35 -18.303 7.765 7.765 607 2HH1 ARG 335 2HH2 ARG 35 -19.299 6.796 6.796 608 1HH2 ARG 335 2HH1 ARG 35 -16.671 4.849 4.849 609 2HH2 ARG 335 1HH1 ARG 35 -18.376 5.144 5.144 610 H GLU 336 H GLU 36 -13.263 6.976 6.976 611 HA GLU 336 HA GLU 36 -13.204 4.101 4.101 612 1HB GLU 336 2HB GLU 36 -12.744 6.160 6.160 613 2HB GLU 336 1HB GLU 36 -13.313 4.502 4.502 614 1HG GLU 336 2HG GLU 36 -15.356 5.022 5.022 615 2HG GLU 336 1HG GLU 36 -14.787 6.669 6.669 616 H ARG 337 H ARG 37 -10.848 6.650 6.650 617 HA ARG 337 HA ARG 37 -8.799 4.850 4.850 618 1HB ARG 337 2HB ARG 37 -9.040 7.696 7.696 619 2HB ARG 337 1HB ARG 37 -7.486 7.063 7.063 620 1HG ARG 337 2HG ARG 37 -6.871 6.359 6.359 621 2HG ARG 337 1HG ARG 37 -8.539 6.328 6.328 622 1HD ARG 337 2HD ARG 37 -7.182 8.897 8.897 623 2HD ARG 337 1HD ARG 37 -7.089 8.281 8.281 624 HE ARG 337 HE ARG 37 -9.744 8.273 8.273 625 1HH1 ARG 337 1HH2 ARG 37 -9.401 9.995 9.995 626 2HH1 ARG 337 2HH2 ARG 37 -9.597 11.585 11.585 627 1HH2 ARG 337 2HH1 ARG 37 -9.139 10.567 10.567 628 2HH2 ARG 337 1HH1 ARG 37 -9.448 11.909 11.909 629 H PHE 338 H PHE 38 -9.671 6.139 6.139 630 HA PHE 338 HA PHE 38 -7.385 5.169 5.169 631 1HB PHE 338 2HB PHE 38 -8.913 6.776 6.776 632 2HB PHE 338 1HB PHE 38 -10.239 5.617 5.617 633 HD1 PHE 338 HD1 PHE 38 -6.855 6.158 6.158 634 HD2 PHE 338 HD2 PHE 38 -10.571 4.014 4.014 635 HE1 PHE 338 HE1 PHE 38 -6.175 5.203 5.203 636 HE2 PHE 338 HE2 PHE 38 -9.890 3.061 3.061 637 HZ PHE 338 HZ PHE 38 -7.692 3.655 3.655 638 H GLU 339 H GLU 39 -10.534 3.694 3.694 639 HA GLU 339 HA GLU 39 -10.111 1.265 1.265 640 1HB GLU 339 2HB GLU 39 -11.806 1.969 1.969 641 2HB GLU 339 1HB GLU 39 -11.770 0.334 0.334 642 1HG GLU 339 2HG GLU 39 -12.077 2.052 2.052 643 2HG GLU 339 1HG GLU 39 -13.190 2.649 2.649 644 H MET 340 H MET 40 -9.165 2.336 2.336 645 HA MET 340 HA MET 40 -8.302 -0.133 -0.133 646 1HB MET 340 2HB MET 40 -7.397 2.721 2.721 647 2HB MET 340 1HB MET 40 -6.533 1.409 1.409 648 1HG MET 340 2HG MET 40 -8.414 0.788 0.788 649 2HG MET 340 1HG MET 40 -9.531 1.637 1.637 650 1HE MET 340 2HE MET 40 -6.198 2.290 2.290 651 2HE MET 340 1HE MET 40 -6.313 3.950 3.950 652 3HE MET 340 3HE MET 40 -6.269 3.616 3.616 653 H PHE 341 H PHE 41 -6.341 2.308 2.308 654 HA PHE 341 HA PHE 41 -4.007 0.701 0.701 655 1HB PHE 341 2HB PHE 41 -5.106 3.005 3.005 656 2HB PHE 341 1HB PHE 41 -3.581 2.225 2.225 657 HD1 PHE 341 HD1 PHE 41 -2.430 1.581 1.581 658 HD2 PHE 341 HD2 PHE 41 -4.549 5.091 5.091 659 HE1 PHE 341 HE1 PHE 41 -1.270 2.918 2.918 660 HE2 PHE 341 HE2 PHE 41 -3.393 6.426 6.426 661 HZ PHE 341 HZ PHE 41 -1.752 5.342 5.342 662 H ARG 342 H ARG 42 -6.974 0.855 0.855 663 HA ARG 342 HA ARG 42 -6.126 -0.534 -0.534 664 1HB ARG 342 2HB ARG 42 -8.672 0.131 0.131 665 2HB ARG 342 1HB ARG 42 -8.725 -1.397 -1.397 666 1HG ARG 342 2HG ARG 42 -7.310 0.333 0.333 667 2HG ARG 342 1HG ARG 42 -8.625 1.317 1.317 668 1HD ARG 342 2HD ARG 42 -9.499 -1.377 -1.377 669 2HD ARG 342 1HD ARG 42 -8.840 -0.485 -0.485 670 HE ARG 342 HE ARG 42 -10.670 1.162 1.162 671 1HH1 ARG 342 2HH1 ARG 42 -10.326 0.627 0.627 672 2HH1 ARG 342 1HH1 ARG 42 -11.905 0.023 0.023 673 1HH2 ARG 342 1HH2 ARG 42 -12.772 -0.510 -0.510 674 2HH2 ARG 342 2HH2 ARG 42 -13.291 -0.620 -0.620 675 H GLU 343 H GLU 43 -7.199 -1.724 -1.724 676 HA GLU 343 HA GLU 43 -7.192 -4.512 -4.512 677 1HB GLU 343 2HB GLU 43 -8.391 -3.441 -3.441 678 2HB GLU 343 1HB GLU 43 -6.823 -3.501 -3.501 679 1HG GLU 343 2HG GLU 43 -7.269 -5.639 -5.639 680 2HG GLU 343 1HG GLU 43 -7.145 -6.036 -6.036 681 H LEU 344 H LEU 44 -4.873 -2.460 -2.460 682 HA LEU 344 HA LEU 44 -2.924 -4.439 -4.439 683 1HB LEU 344 2HB LEU 44 -2.626 -1.481 -1.481 684 2HB LEU 344 1HB LEU 44 -1.271 -2.500 -2.500 685 HG LEU 344 HG LEU 44 -1.946 -1.640 -1.640 686 1HD1 LEU 344 3HD1 LEU 44 -2.098 -4.225 -4.225 687 2HD1 LEU 344 2HD1 LEU 44 -3.842 -3.981 -3.981 688 3HD1 LEU 344 1HD1 LEU 44 -2.805 -3.444 -3.444 689 1HD2 LEU 344 1HD2 LEU 44 -4.070 -0.660 -0.660 690 2HD2 LEU 344 3HD2 LEU 44 -4.119 -0.975 -0.975 691 3HD2 LEU 344 2HD2 LEU 44 -4.867 -2.108 -2.108 692 H ASN 345 H ASN 45 -2.854 -2.114 -2.114 693 HA ASN 345 HA ASN 45 -0.789 -3.491 -3.491 694 1HB ASN 345 2HB ASN 45 -1.140 -1.974 -1.974 695 2HB ASN 345 1HB ASN 45 -1.785 -1.091 -1.091 696 1HD2 ASN 345 2HD2 ASN 45 -4.910 -0.753 -0.753 697 2HD2 ASN 345 1HD2 ASN 45 -3.736 -0.107 -0.107 698 H GLU 346 H GLU 46 -4.142 -4.222 -4.222 699 HA GLU 346 HA GLU 46 -4.468 -5.706 -5.706 700 1HB GLU 346 2HB GLU 46 -6.411 -4.930 -4.930 701 2HB GLU 346 1HB GLU 46 -5.935 -5.963 -5.963 702 1HG GLU 346 2HG GLU 46 -6.646 -7.877 -7.877 703 2HG GLU 346 1HG GLU 46 -6.189 -7.301 -7.301 704 H ALA 347 H ALA 47 -3.722 -6.688 -6.688 705 HA ALA 347 HA ALA 47 -3.407 -9.475 -9.475 706 1HB ALA 347 1HB ALA 47 -3.801 -8.486 -8.486 707 2HB ALA 347 3HB ALA 47 -2.096 -8.036 -8.036 708 3HB ALA 347 2HB ALA 47 -2.558 -9.734 -9.734 709 H LEU 348 H LEU 48 -1.083 -6.791 -6.791 710 HA LEU 348 HA LEU 48 1.300 -8.253 -8.253 711 1HB LEU 348 2HB LEU 48 0.682 -5.468 -5.468 712 2HB LEU 348 1HB LEU 48 2.287 -6.143 -6.143 713 HG LEU 348 HG LEU 48 0.232 -5.972 -5.972 714 1HD1 LEU 348 3HD1 LEU 48 2.188 -3.888 -3.888 715 2HD1 LEU 348 2HD1 LEU 48 1.606 -3.908 -3.908 716 3HD1 LEU 348 1HD1 LEU 48 0.467 -3.697 -3.697 717 1HD2 LEU 348 2HD2 LEU 48 2.539 -7.344 -7.344 718 2HD2 LEU 348 1HD2 LEU 48 1.973 -6.564 -6.564 719 3HD2 LEU 348 3HD2 LEU 48 3.185 -5.771 -5.771 720 H GLU 349 H GLU 49 -0.787 -6.671 -6.671 721 HA GLU 349 HA GLU 49 0.669 -7.519 -7.519 722 1HB GLU 349 2HB GLU 49 -2.202 -6.769 -6.769 723 2HB GLU 349 1HB GLU 49 -1.730 -7.427 -7.427 724 1HG GLU 349 2HG GLU 49 0.252 -5.556 -5.556 725 2HG GLU 349 1HG GLU 49 -1.213 -4.779 -4.779 726 H LEU 350 H LEU 50 -1.721 -9.164 -9.164 727 HA LEU 350 HA LEU 50 -2.120 -11.412 -11.412 728 1HB LEU 350 2HB LEU 50 -3.599 -12.009 -12.009 729 2HB LEU 350 1HB LEU 50 -3.134 -10.551 -10.551 730 HG LEU 350 HG LEU 50 -1.234 -11.934 -11.934 731 1HD1 LEU 350 1HD1 LEU 50 -2.341 -13.843 -13.843 732 2HD1 LEU 350 3HD1 LEU 50 -2.572 -14.444 -14.444 733 3HD1 LEU 350 2HD1 LEU 50 -0.954 -14.035 -14.035 734 1HD2 LEU 350 3HD2 LEU 50 -3.534 -11.342 -11.342 735 2HD2 LEU 350 2HD2 LEU 50 -2.628 -12.667 -12.667 736 3HD2 LEU 350 1HD2 LEU 50 -3.971 -13.013 -13.013 737 H LYS 351 H LYS 51 0.312 -10.584 -10.584 738 HA LYS 351 HA LYS 51 1.562 -13.103 -13.103 739 1HB LYS 351 2HB LYS 51 2.129 -10.957 -10.957 740 2HB LYS 351 1HB LYS 51 2.998 -10.440 -10.440 741 1HG LYS 351 2HG LYS 51 4.529 -12.286 -12.286 742 2HG LYS 351 1HG LYS 51 3.566 -13.051 -13.051 743 1HD LYS 351 2HD LYS 51 4.192 -10.373 -10.373 744 2HD LYS 351 1HD LYS 51 5.682 -11.178 -11.178 745 1HE LYS 351 2HE LYS 51 4.158 -13.063 -13.063 746 2HE LYS 351 1HE LYS 51 4.178 -11.559 -11.559 747 1HZ LYS 351 2HZ LYS 51 6.618 -11.504 -11.504 748 2HZ LYS 351 1HZ LYS 51 6.520 -13.057 -13.057 749 3HZ LYS 351 3HZ LYS 51 6.094 -12.817 -12.817 750 H ASP 352 H ASP 52 1.976 -10.627 -10.627 751 HA ASP 352 HA ASP 52 4.020 -12.125 -12.125 752 1HB ASP 352 2HB ASP 52 2.252 -9.812 -9.812 753 2HB ASP 352 1HB ASP 52 3.608 -10.439 -10.439 754 H ALA 353 H ALA 53 0.557 -12.155 -12.155 755 HA ALA 353 HA ALA 53 0.325 -13.539 -13.539 756 1HB ALA 353 3HB ALA 53 -1.395 -11.874 -11.874 757 2HB ALA 353 2HB ALA 53 -1.837 -13.050 -13.050 758 3HB ALA 353 1HB ALA 53 -2.056 -13.441 -13.441 759 H GLN 354 H GLN 54 1.122 -14.410 -14.410 760 HA GLN 354 HA GLN 54 -0.322 -16.724 -16.724 761 1HB GLN 354 2HB GLN 54 2.570 -15.985 -15.985 762 2HB GLN 354 1HB GLN 54 1.984 -17.578 -17.578 763 1HG GLN 354 2HG GLN 54 0.036 -16.048 -16.048 764 2HG GLN 354 1HG GLN 54 1.381 -14.909 -14.909 765 1HE2 GLN 354 2HE2 GLN 54 1.202 -17.882 -17.882 766 2HE2 GLN 354 1HE2 GLN 54 -0.092 -17.463 -17.463 767 H ALA 355 HN ALA 55 0.246 -19.023 -19.023 768 HA ALA 355 HA ALA 55 2.039 -19.811 -19.811 769 1HB ALA 355 1HB ALA 55 -0.715 -19.016 -19.016 770 2HB ALA 355 3HB ALA 55 -0.139 -20.541 -20.541 771 3HB ALA 355 2HB ALA 55 0.759 -19.051 -19.051 772 1H GLY 325 3H GLY 25 -13.264 13.970 13.970 773 2H GLY 325 2H GLY 25 -13.875 13.258 13.258 774 3H GLY 325 1H GLY 25 -14.825 14.359 14.359 775 1HA GLY 325 2HA GLY 25 -15.750 12.456 12.456 776 2HA GLY 325 1HA GLY 25 -14.259 11.544 11.544 777 H GLU 326 H GLU 26 -13.118 11.085 11.085 778 HA GLU 326 HA GLU 26 -13.413 12.918 12.918 779 1HB GLU 326 2HB GLU 26 -14.390 10.248 10.248 780 2HB GLU 326 1HB GLU 26 -13.017 10.226 10.226 781 1HG GLU 326 2HG GLU 26 -14.116 11.431 11.431 782 2HG GLU 326 1HG GLU 26 -14.843 12.507 12.507 783 H TYR 327 H TYR 27 -11.644 12.231 12.231 784 HA TYR 327 HA TYR 27 -9.084 12.021 12.021 785 1HB TYR 327 2HB TYR 27 -9.949 13.307 13.307 786 2HB TYR 327 1HB TYR 27 -8.324 12.621 12.621 787 HD1 TYR 327 HD2 TYR 27 -10.559 15.123 15.123 788 HD2 TYR 327 HD1 TYR 27 -6.575 13.523 13.523 789 HE1 TYR 327 HE2 TYR 27 -9.731 17.086 17.086 790 HE2 TYR 327 HE1 TYR 27 -5.748 15.486 15.486 791 HH TYR 327 HH TYR 27 -7.125 17.243 17.243 792 H PHE 328 H PHE 28 -8.494 9.884 9.884 793 HA PHE 328 HA PHE 28 -8.836 8.154 8.154 794 1HB PHE 328 2HB PHE 28 -8.419 7.447 7.447 795 2HB PHE 328 1HB PHE 28 -8.487 6.266 6.266 796 HD1 PHE 328 HD1 PHE 28 -10.585 7.054 7.054 797 HD2 PHE 328 HD2 PHE 28 -10.401 7.451 7.451 798 HE1 PHE 328 HE1 PHE 28 -13.062 7.077 7.077 799 HE2 PHE 328 HE2 PHE 28 -12.878 7.474 7.474 800 HZ PHE 328 HZ PHE 28 -14.208 7.289 7.289 801 H THR 329 H THR 29 -6.999 6.629 6.629 802 HA THR 329 HA THR 29 -4.389 7.830 7.830 803 HB THR 329 HB THR 29 -4.354 6.413 6.413 804 HG1 THR 329 HG1 THR 29 -5.999 7.364 7.364 805 1HG2 THR 329 2HG2 THR 29 -2.680 8.065 8.065 806 2HG2 THR 329 1HG2 THR 29 -3.673 9.300 9.300 807 3HG2 THR 329 3HG2 THR 29 -2.849 8.090 8.090 808 H LEU 330 H LEU 30 -2.789 6.384 6.384 809 HA LEU 330 HA LEU 30 -3.509 3.481 3.481 810 1HB LEU 330 2HB LEU 30 -3.065 5.080 5.080 811 2HB LEU 330 1HB LEU 30 -1.610 4.102 4.102 812 HG LEU 330 HG LEU 30 -3.733 2.347 2.347 813 1HD1 LEU 330 3HD1 LEU 30 -4.832 4.458 4.458 814 2HD1 LEU 330 2HD1 LEU 30 -4.384 3.352 3.352 815 3HD1 LEU 330 1HD1 LEU 30 -5.461 2.811 2.811 816 1HD2 LEU 330 3HD2 LEU 30 -1.864 2.841 2.841 817 2HD2 LEU 330 2HD2 LEU 30 -1.811 1.552 1.552 818 3HD2 LEU 330 1HD2 LEU 30 -3.040 1.530 1.530 819 H GLN 331 H GLN 31 -2.301 3.269 3.269 820 HA GLN 331 HA GLN 31 0.505 4.087 4.087 821 1HB GLN 331 2HB GLN 31 -1.123 2.382 2.382 822 2HB GLN 331 1HB GLN 31 0.508 2.978 2.978 823 1HG GLN 331 2HG GLN 31 -0.238 5.050 5.050 824 2HG GLN 331 1HG GLN 31 -1.329 5.091 5.091 825 1HE2 GLN 331 2HE2 GLN 31 -2.723 3.637 3.637 826 2HE2 GLN 331 1HE2 GLN 31 -1.050 3.672 3.672 827 H ILE 332 H ILE 32 2.026 2.929 2.929 828 HA ILE 332 HA ILE 32 1.630 -0.026 -0.026 829 HB ILE 332 HB ILE 32 3.197 1.900 1.900 830 1HG1 ILE 332 2HG1 ILE 32 1.345 0.299 0.299 831 2HG1 ILE 332 1HG1 ILE 32 0.489 0.911 0.911 832 1HG2 ILE 332 3HG2 ILE 32 2.988 -1.121 -1.121 833 2HG2 ILE 332 2HG2 ILE 32 3.526 -0.193 -0.193 834 3HG2 ILE 332 1HG2 ILE 32 4.451 -0.142 -0.142 835 1HD1 ILE 332 1HD1 ILE 32 2.119 2.641 2.641 836 2HD1 ILE 332 3HD1 ILE 32 0.368 2.455 2.455 837 3HD1 ILE 332 2HD1 ILE 32 1.102 3.195 3.195 838 H ARG 333 H ARG 33 3.075 -1.286 -1.286 839 HA ARG 333 HA ARG 33 5.326 0.046 0.046 840 1HB ARG 333 2HB ARG 33 4.179 -2.753 -2.753 841 2HB ARG 333 1HB ARG 33 5.578 -2.209 -2.209 842 1HG ARG 333 2HG ARG 33 4.263 -1.162 -1.162 843 2HG ARG 333 1HG ARG 33 3.406 -0.301 -0.301 844 1HD ARG 333 2HD ARG 33 1.909 -1.785 -1.785 845 2HD ARG 333 1HD ARG 33 1.932 -2.203 -2.203 846 HE ARG 333 HE ARG 33 3.919 -3.721 -3.721 847 1HH1 ARG 333 2HH1 ARG 33 0.763 -3.489 -3.489 848 2HH1 ARG 333 1HH1 ARG 33 0.313 -5.114 -5.114 849 1HH2 ARG 333 1HH2 ARG 33 3.258 -5.798 -5.798 850 2HH2 ARG 333 2HH2 ARG 33 1.727 -6.423 -6.423 851 H GLY 334 H GLY 34 6.919 0.369 0.369 852 1HA GLY 334 2HA GLY 34 8.756 -1.641 -1.641 853 2HA GLY 334 1HA GLY 34 7.627 -1.650 -1.650 854 H ARG 335 H ARG 35 8.826 -0.697 -0.697 855 HA ARG 335 HA ARG 35 9.303 2.167 2.167 856 1HB ARG 335 2HB ARG 35 11.324 0.933 0.933 857 2HB ARG 335 1HB ARG 35 11.783 0.552 0.552 858 1HG ARG 335 2HG ARG 35 12.362 2.702 2.702 859 2HG ARG 335 1HG ARG 35 11.005 3.364 3.364 860 1HD ARG 335 2HD ARG 35 12.384 2.463 2.463 861 2HD ARG 335 1HD ARG 35 13.740 2.605 2.605 862 HE ARG 335 HE ARG 35 11.943 4.935 4.935 863 1HH1 ARG 335 1HH2 ARG 35 14.893 3.440 3.440 864 2HH1 ARG 335 2HH2 ARG 35 15.848 4.875 4.875 865 1HH2 ARG 335 2HH1 ARG 35 13.223 6.793 6.793 866 2HH2 ARG 335 1HH1 ARG 35 14.902 6.774 6.774 867 H GLU 336 H GLU 36 10.319 -0.774 -0.774 868 HA GLU 336 HA GLU 36 10.396 0.569 0.569 869 1HB GLU 336 2HB GLU 36 10.020 -2.395 -2.395 870 2HB GLU 336 1HB GLU 36 10.665 -1.639 -1.639 871 1HG GLU 336 2HG GLU 36 12.586 -0.785 -0.785 872 2HG GLU 336 1HG GLU 36 11.935 -1.482 -1.482 873 H ARG 337 H ARG 37 8.014 -1.681 -1.681 874 HA ARG 337 HA ARG 37 6.111 -1.484 -1.484 875 1HB ARG 337 2HB ARG 37 6.189 -2.558 -2.558 876 2HB ARG 337 1HB ARG 37 4.626 -1.821 -1.821 877 1HG ARG 337 2HG ARG 37 4.206 -3.259 -3.259 878 2HG ARG 337 1HG ARG 37 5.913 -3.650 -3.650 879 1HD ARG 337 2HD ARG 37 4.391 -4.418 -4.418 880 2HD ARG 337 1HD ARG 37 4.450 -5.465 -5.465 881 HE ARG 337 HE ARG 37 7.072 -5.099 -5.099 882 1HH1 ARG 337 1HH2 ARG 37 6.466 -3.981 -3.981 883 2HH1 ARG 337 2HH2 ARG 37 6.650 -5.393 -5.393 884 1HH2 ARG 337 2HH1 ARG 37 6.490 -7.601 -7.601 885 2HH2 ARG 337 1HH1 ARG 37 6.663 -7.443 -7.443 886 H PHE 338 H PHE 38 6.682 0.506 0.506 887 HA PHE 338 HA PHE 38 4.335 2.132 2.132 888 1HB PHE 338 2HB PHE 38 5.710 2.175 2.175 889 2HB PHE 338 1HB PHE 38 7.088 2.785 2.785 890 HD1 PHE 338 HD1 PHE 38 3.580 3.591 3.591 891 HD2 PHE 338 HD2 PHE 38 7.356 5.103 5.103 892 HE1 PHE 338 HE1 PHE 38 2.770 5.910 5.910 893 HE2 PHE 338 HE2 PHE 38 6.548 7.424 7.424 894 HZ PHE 338 HZ PHE 38 4.256 7.828 7.828 895 H GLU 339 H GLU 39 7.589 2.428 2.428 896 HA GLU 339 HA GLU 39 7.161 4.955 4.955 897 1HB GLU 339 2HB GLU 39 9.005 2.632 2.632 898 2HB GLU 339 1HB GLU 39 8.985 4.073 4.073 899 1HG GLU 339 2HG GLU 39 9.052 5.008 5.008 900 2HG GLU 339 1HG GLU 39 10.232 3.699 3.699 901 H MET 340 H MET 40 6.420 1.633 1.633 902 HA MET 340 HA MET 40 5.744 2.038 2.038 903 1HB MET 340 2HB MET 40 4.751 0.147 0.147 904 2HB MET 340 1HB MET 40 4.007 0.155 0.155 905 1HG MET 340 2HG MET 40 6.006 -0.496 -0.496 906 2HG MET 340 1HG MET 40 7.000 -0.022 -0.022 907 1HE MET 340 2HE MET 40 3.777 -1.950 -1.950 908 2HE MET 340 1HE MET 40 3.870 -3.343 -3.343 909 3HE MET 340 3HE MET 40 3.710 -1.714 -1.714 910 H PHE 341 H PHE 41 3.550 2.061 2.061 911 HA PHE 341 HA PHE 41 1.277 3.062 3.062 912 1HB PHE 341 2HB PHE 41 2.150 3.206 3.206 913 2HB PHE 341 1HB PHE 41 0.629 3.914 3.914 914 HD1 PHE 341 HD1 PHE 41 -0.289 2.026 2.026 915 HD2 PHE 341 HD2 PHE 41 1.587 1.274 1.274 916 HE1 PHE 341 HE1 PHE 41 -1.358 -0.211 -0.211 917 HE2 PHE 341 HE2 PHE 41 0.519 -0.961 -0.961 918 HZ PHE 341 HZ PHE 41 -0.953 -1.704 -1.704 919 H ARG 342 H ARG 42 4.087 4.662 4.662 920 HA ARG 342 HA ARG 42 3.121 7.332 7.332 921 1HB ARG 342 2HB ARG 42 5.727 5.991 5.991 922 2HB ARG 342 1HB ARG 42 5.777 7.565 7.565 923 1HG ARG 342 2HG ARG 42 4.166 7.968 7.968 924 2HG ARG 342 1HG ARG 42 5.486 6.947 6.947 925 1HD ARG 342 2HD ARG 42 6.411 9.067 9.067 926 2HD ARG 342 1HD ARG 42 5.608 9.699 9.699 927 HE ARG 342 HE ARG 42 7.480 7.620 7.620 928 1HH1 ARG 342 2HH1 ARG 42 6.925 10.449 10.449 929 2HH1 ARG 342 1HH1 ARG 42 8.493 11.162 11.162 930 1HH2 ARG 342 1HH2 ARG 42 9.632 8.726 8.726 931 2HH2 ARG 342 2HH2 ARG 42 10.024 10.186 10.186 932 H GLU 343 H GLU 43 4.478 5.382 5.382 933 HA GLU 343 HA GLU 43 4.530 7.565 7.565 934 1HB GLU 343 2HB GLU 43 5.835 5.345 5.345 935 2HB GLU 343 1HB GLU 43 4.335 4.636 4.636 936 1HG GLU 343 2HG GLU 43 4.903 5.363 5.363 937 2HG GLU 343 1HG GLU 43 4.671 7.011 7.011 938 H LEU 344 H LEU 44 2.276 4.838 4.838 939 HA LEU 344 HA LEU 44 0.454 5.425 5.425 940 1HB LEU 344 2HB LEU 44 0.007 4.270 4.270 941 2HB LEU 344 1HB LEU 44 -1.286 4.406 4.406 942 HG LEU 344 HG LEU 44 -0.542 2.243 2.243 943 1HD1 LEU 344 3HD1 LEU 44 -0.256 3.800 3.800 944 2HD1 LEU 344 2HD1 LEU 44 1.476 3.661 3.661 945 3HD1 LEU 344 1HD1 LEU 44 0.528 2.221 2.221 946 1HD2 LEU 344 1HD2 LEU 44 1.444 2.663 2.663 947 2HD2 LEU 344 3HD2 LEU 44 1.609 1.414 1.414 948 3HD2 LEU 344 2HD2 LEU 44 2.362 2.992 2.992 949 H ASN 345 H ASN 45 0.073 6.435 6.435 950 HA ASN 345 HA ASN 45 -2.032 8.274 8.274 951 1HB ASN 345 2HB ASN 45 -1.876 8.913 8.913 952 2HB ASN 345 1HB ASN 45 -1.165 7.302 7.302 953 1HD2 ASN 345 2HD2 ASN 45 1.813 8.558 8.558 954 2HD2 ASN 345 1HD2 ASN 45 0.692 7.289 7.289 955 H GLU 346 H GLU 46 1.363 8.517 8.517 956 HA GLU 346 HA GLU 46 1.564 11.400 11.400 957 1HB GLU 346 2HB GLU 46 3.565 9.969 9.969 958 2HB GLU 346 1HB GLU 46 3.236 9.392 9.392 959 1HG GLU 346 2HG GLU 46 3.947 11.336 11.336 960 2HG GLU 346 1HG GLU 46 3.341 12.339 12.339 961 H ALA 347 H ALA 47 1.112 9.101 9.101 962 HA ALA 347 HA ALA 47 0.856 11.163 11.163 963 1HB ALA 347 1HB ALA 47 1.356 8.694 8.694 964 2HB ALA 347 3HB ALA 47 -0.362 8.397 8.397 965 3HB ALA 347 2HB ALA 47 0.157 9.416 9.416 966 H LEU 348 H LEU 48 -1.540 9.260 9.260 967 HA LEU 348 HA LEU 48 -3.886 10.308 10.308 968 1HB LEU 348 2HB LEU 48 -3.450 9.676 9.676 969 2HB LEU 348 1HB LEU 48 -5.003 9.744 9.744 970 HG LEU 348 HG LEU 48 -2.798 7.889 7.889 971 1HD1 LEU 348 3HD1 LEU 48 -4.904 7.488 7.488 972 2HD1 LEU 348 2HD1 LEU 48 -4.193 6.132 6.132 973 3HD1 LEU 348 1HD1 LEU 48 -3.172 7.181 7.181 974 1HD2 LEU 348 2HD2 LEU 48 -5.050 8.615 8.615 975 2HD2 LEU 348 1HD2 LEU 48 -4.404 6.978 6.978 976 3HD2 LEU 348 3HD2 LEU 48 -5.718 7.335 7.335 977 H GLU 349 H GLU 49 -2.048 11.569 11.569 978 HA GLU 349 HA GLU 49 -3.640 13.884 13.884 979 1HB GLU 349 2HB GLU 49 -0.775 13.177 13.177 980 2HB GLU 349 1HB GLU 49 -1.333 14.829 14.829 981 1HG GLU 349 2HG GLU 49 -3.348 13.283 13.283 982 2HG GLU 349 1HG GLU 49 -1.874 12.417 12.417 983 H LEU 350 H LEU 50 -1.038 13.208 13.208 984 HA LEU 350 HA LEU 50 -0.685 15.912 15.912 985 1HB LEU 350 2HB LEU 50 0.929 14.963 14.963 986 2HB LEU 350 1HB LEU 50 0.487 13.424 13.424 987 HG LEU 350 HG LEU 50 -1.287 13.225 13.225 988 1HD1 LEU 350 1HD1 LEU 50 -0.257 15.843 15.843 989 2HD1 LEU 350 3HD1 LEU 50 0.099 14.795 14.795 990 3HD1 LEU 350 2HD1 LEU 50 -1.563 14.985 14.985 991 1HD2 LEU 350 3HD2 LEU 50 1.046 12.121 12.121 992 2HD2 LEU 350 2HD2 LEU 50 0.264 12.223 12.223 993 3HD2 LEU 350 1HD2 LEU 50 1.537 13.365 13.365 994 H LYS 351 H LYS 51 -2.959 13.353 13.353 995 HA LYS 351 HA LYS 51 -4.078 14.395 14.395 996 1HB LYS 351 2HB LYS 51 -4.637 12.172 12.172 997 2HB LYS 351 1HB LYS 51 -5.629 13.064 13.064 998 1HG LYS 351 2HG LYS 51 -7.074 13.874 13.874 999 2HG LYS 351 1HG LYS 51 -5.990 13.282 13.282 1000 1HD LYS 351 2HD LYS 51 -6.654 11.102 11.102 1001 2HD LYS 351 1HD LYS 51 -8.144 11.893 11.893 1002 1HE LYS 351 2HE LYS 51 -6.433 11.747 11.747 1003 2HE LYS 351 1HE LYS 51 -6.441 10.153 10.153 1004 1HZ LYS 351 2HZ LYS 51 -8.908 10.330 10.330 1005 2HZ LYS 351 1HZ LYS 51 -8.786 11.737 11.737 1006 3HZ LYS 351 3HZ LYS 51 -8.254 10.251 10.251 1007 H ASP 352 H ASP 52 -4.788 15.121 15.121 1008 HA ASP 352 HA ASP 52 -6.870 17.046 17.046 1009 1HB ASP 352 2HB ASP 52 -5.267 16.574 16.574 1010 2HB ASP 352 1HB ASP 52 -6.663 17.646 17.646 1011 H ALA 353 H ALA 53 -3.410 17.119 17.119 1012 HA ALA 353 HA ALA 53 -3.319 20.059 20.059 1013 1HB ALA 353 3HB ALA 53 -1.615 18.526 18.526 1014 2HB ALA 353 2HB ALA 53 -1.032 18.149 18.149 1015 3HB ALA 353 1HB ALA 53 -0.923 19.798 19.798 1016 H GLN 354 H GLN 54 -3.838 17.890 17.890 1017 HA GLN 354 HA GLN 54 -2.246 18.730 18.730 1018 1HB GLN 354 2HB GLN 54 -5.116 17.843 17.843 1019 2HB GLN 354 1HB GLN 54 -4.432 18.347 18.347 1020 1HG GLN 354 2HG GLN 54 -2.449 16.734 16.734 1021 2HG GLN 354 1HG GLN 54 -3.792 15.967 15.967 1022 1HE2 GLN 354 2HE2 GLN 54 -3.334 15.239 15.239 1023 2HE2 GLN 354 1HE2 GLN 54 -2.141 15.963 15.963 1024 H ALA 355 HN ALA 55 -2.751 20.287 20.287 1025 HA ALA 355 HA ALA 55 -4.676 22.388 22.388 1026 1HB ALA 355 1HB ALA 55 -2.025 22.723 22.723 1027 2HB ALA 355 3HB ALA 55 -2.590 24.091 24.091 1028 3HB ALA 355 2HB ALA 55 -3.567 23.488 23.488 Start of MODEL 4 1 1H GLY 325 3H GLY 25 11.054 2.259 2.259 2 2H GLY 325 2H GLY 25 11.450 2.684 2.684 3 3H GLY 325 1H GLY 25 12.389 3.262 3.262 4 1HA GLY 325 2HA GLY 25 13.734 1.538 1.538 5 2HA GLY 325 1HA GLY 25 12.659 0.853 0.853 6 H GLU 326 H GLU 26 11.504 -0.945 -0.945 7 HA GLU 326 HA GLU 26 11.433 -1.668 -1.668 8 1HB GLU 326 2HB GLU 26 11.803 -3.371 -3.371 9 2HB GLU 326 1HB GLU 26 11.268 -4.067 -4.067 10 1HG GLU 326 2HG GLU 26 13.641 -2.270 -2.270 11 2HG GLU 326 1HG GLU 26 13.869 -3.854 -3.854 12 H TYR 327 H TYR 27 9.601 -3.587 -3.587 13 HA TYR 327 HA TYR 27 7.157 -2.334 -2.334 14 1HB TYR 327 2HB TYR 27 7.795 -3.063 -3.063 15 2HB TYR 327 1HB TYR 27 6.525 -4.155 -4.155 16 HD1 TYR 327 HD2 TYR 27 4.596 -2.968 -2.968 17 HD2 TYR 327 HD1 TYR 27 7.160 -0.992 -0.992 18 HE1 TYR 327 HE2 TYR 27 2.923 -1.154 -1.154 19 HE2 TYR 327 HE1 TYR 27 5.487 0.822 0.822 20 HH TYR 327 HH TYR 27 2.324 0.559 0.559 21 H PHE 328 H PHE 28 6.567 -3.512 -3.512 22 HA PHE 328 HA PHE 28 6.882 -6.479 -6.479 23 1HB PHE 328 2HB PHE 28 6.561 -4.591 -4.591 24 2HB PHE 328 1HB PHE 28 6.545 -6.349 -6.349 25 HD1 PHE 328 HD2 PHE 28 8.568 -7.548 -7.548 26 HD2 PHE 328 HD1 PHE 28 8.599 -3.521 -3.521 27 HE1 PHE 328 HE2 PHE 28 11.047 -7.571 -7.571 28 HE2 PHE 328 HE1 PHE 28 11.079 -3.543 -3.543 29 HZ PHE 328 HZ PHE 28 12.303 -5.568 -5.568 30 H THR 329 H THR 29 5.077 -7.801 -7.801 31 HA THR 329 HA THR 29 2.445 -6.416 -6.416 32 HB THR 329 HB THR 29 2.450 -9.330 -9.330 33 HG1 THR 329 HG1 THR 29 4.146 -7.769 -7.769 34 1HG2 THR 329 1HG2 THR 29 0.743 -7.505 -7.505 35 2HG2 THR 329 3HG2 THR 29 1.768 -7.397 -7.397 36 3HG2 THR 329 2HG2 THR 29 0.995 -8.926 -8.926 37 H LEU 330 H LEU 30 1.002 -6.511 -6.511 38 HA LEU 330 HA LEU 30 1.684 -8.339 -8.339 39 1HB LEU 330 2HB LEU 30 1.000 -5.516 -5.516 40 2HB LEU 330 1HB LEU 30 -0.176 -6.397 -6.397 41 HG LEU 330 HG LEU 30 2.794 -6.805 -6.805 42 1HD1 LEU 330 3HD1 LEU 30 1.320 -4.413 -4.413 43 2HD1 LEU 330 2HD1 LEU 30 1.717 -5.190 -5.190 44 3HD1 LEU 330 1HD1 LEU 30 3.000 -4.777 -4.777 45 1HD2 LEU 330 2HD2 LEU 30 0.354 -7.813 -7.813 46 2HD2 LEU 330 1HD2 LEU 30 2.018 -8.332 -8.332 47 3HD2 LEU 330 3HD2 LEU 30 1.341 -7.004 -7.004 48 H GLN 331 H GLN 31 0.476 -10.124 -10.124 49 HA GLN 331 HA GLN 31 -2.327 -9.714 -9.714 50 1HB GLN 331 2HB GLN 31 -0.793 -12.303 -12.303 51 2HB GLN 331 1HB GLN 31 -2.324 -12.101 -12.101 52 1HG GLN 331 2HG GLN 31 -1.259 -10.725 -10.725 53 2HG GLN 331 1HG GLN 31 0.266 -10.752 -10.752 54 1HE2 GLN 331 2HE2 GLN 31 -0.893 -14.093 -14.093 55 2HE2 GLN 331 1HE2 GLN 31 -2.039 -12.894 -12.894 56 H ILE 332 H ILE 32 -3.931 -9.705 -9.705 57 HA ILE 332 HA ILE 32 -3.488 -11.190 -11.190 58 HB ILE 332 HB ILE 32 -4.854 -8.521 -8.521 59 1HG1 ILE 332 2HG1 ILE 32 -2.831 -8.774 -8.774 60 2HG1 ILE 332 1HG1 ILE 32 -2.188 -9.145 -9.145 61 1HG2 ILE 332 3HG2 ILE 32 -5.076 -10.529 -10.529 62 2HG2 ILE 332 2HG2 ILE 32 -4.817 -8.866 -8.866 63 3HG2 ILE 332 1HG2 ILE 32 -6.205 -9.264 -9.264 64 1HD1 ILE 332 3HD1 ILE 32 -3.217 -7.000 -7.000 65 2HD1 ILE 332 2HD1 ILE 32 -3.630 -6.616 -6.616 66 3HD1 ILE 332 1HD1 ILE 32 -1.939 -6.766 -6.766 67 H ARG 333 H ARG 33 -4.993 -12.752 -12.752 68 HA ARG 333 HA ARG 33 -7.344 -12.886 -12.886 69 1HB ARG 333 2HB ARG 33 -5.989 -14.919 -14.919 70 2HB ARG 333 1HB ARG 33 -6.527 -14.753 -14.753 71 1HG ARG 333 2HG ARG 33 -8.796 -15.160 -15.160 72 2HG ARG 333 1HG ARG 33 -8.484 -14.912 -14.912 73 1HD ARG 333 2HD ARG 33 -7.228 -16.954 -16.954 74 2HD ARG 333 1HD ARG 33 -7.221 -17.149 -17.149 75 HE ARG 333 HE ARG 33 -9.658 -17.439 -17.439 76 1HH1 ARG 333 2HH1 ARG 33 -11.219 -17.462 -17.462 77 2HH1 ARG 333 1HH1 ARG 33 -10.872 -18.789 -18.789 78 1HH2 ARG 333 1HH2 ARG 33 -7.733 -19.387 -19.387 79 2HH2 ARG 333 2HH2 ARG 33 -8.899 -19.878 -19.878 80 H GLY 334 H GLY 34 -8.840 -11.352 -11.352 81 1HA GLY 334 2HA GLY 34 -10.557 -11.866 -11.866 82 2HA GLY 334 1HA GLY 34 -9.372 -10.686 -10.686 83 H ARG 335 H ARG 35 -10.404 -8.754 -8.754 84 HA ARG 335 HA ARG 35 -11.016 -7.419 -7.419 85 1HB ARG 335 2HB ARG 35 -12.977 -9.143 -9.143 86 2HB ARG 335 1HB ARG 35 -13.556 -8.002 -8.002 87 1HG ARG 335 2HG ARG 35 -14.214 -6.511 -6.511 88 2HG ARG 335 1HG ARG 35 -12.701 -6.671 -6.671 89 1HD ARG 335 2HD ARG 35 -13.583 -8.899 -8.899 90 2HD ARG 335 1HD ARG 35 -15.145 -8.444 -8.444 91 HE ARG 335 HE ARG 35 -13.807 -7.114 -7.114 92 1HH1 ARG 335 2HH1 ARG 35 -15.156 -4.989 -4.989 93 2HH1 ARG 335 1HH1 ARG 35 -16.786 -5.059 -5.059 94 1HH2 ARG 335 1HH2 ARG 35 -16.460 -8.252 -8.252 95 2HH2 ARG 335 2HH2 ARG 35 -17.524 -6.907 -6.907 96 H GLU 336 H GLU 36 -12.136 -7.669 -7.669 97 HA GLU 336 HA GLU 36 -12.350 -4.792 -4.792 98 1HB GLU 336 2HB GLU 36 -13.041 -7.086 -7.086 99 2HB GLU 336 1HB GLU 36 -11.923 -6.150 -6.150 100 1HG GLU 336 2HG GLU 36 -13.352 -4.103 -4.103 101 2HG GLU 336 1HG GLU 36 -14.555 -5.267 -5.267 102 H ARG 337 H ARG 37 -9.923 -7.237 -7.237 103 HA ARG 337 HA ARG 37 -8.120 -5.346 -5.346 104 1HB ARG 337 2HB ARG 37 -7.925 -8.170 -8.170 105 2HB ARG 337 1HB ARG 37 -6.426 -7.283 -7.283 106 1HG ARG 337 2HG ARG 37 -7.310 -6.693 -6.693 107 2HG ARG 337 1HG ARG 37 -8.629 -7.825 -7.825 108 1HD ARG 337 2HD ARG 37 -5.669 -8.488 -8.488 109 2HD ARG 337 1HD ARG 37 -6.853 -8.968 -8.968 110 HE ARG 337 HE ARG 37 -7.415 -9.853 -9.853 111 1HH1 ARG 337 1HH2 ARG 37 -8.599 -11.213 -11.213 112 2HH1 ARG 337 2HH2 ARG 37 -7.598 -12.616 -12.616 113 1HH2 ARG 337 2HH1 ARG 37 -5.037 -11.358 -11.358 114 2HH2 ARG 337 1HH1 ARG 37 -5.580 -12.698 -12.698 115 H PHE 338 H PHE 38 -8.518 -6.619 -6.619 116 HA PHE 338 HA PHE 38 -6.170 -5.376 -5.376 117 1HB PHE 338 2HB PHE 38 -7.352 -7.170 -7.170 118 2HB PHE 338 1HB PHE 38 -8.781 -6.149 -6.149 119 HD1 PHE 338 HD2 PHE 38 -5.254 -6.577 -6.577 120 HD2 PHE 338 HD1 PHE 38 -8.897 -4.374 -4.374 121 HE1 PHE 338 HE2 PHE 38 -4.321 -5.572 -5.572 122 HE2 PHE 338 HE1 PHE 38 -7.965 -3.369 -3.369 123 HZ PHE 338 HZ PHE 38 -5.677 -3.969 -3.969 124 H GLU 339 H GLU 39 -9.467 -4.274 -4.274 125 HA GLU 339 HA GLU 39 -9.249 -1.836 -1.836 126 1HB GLU 339 2HB GLU 39 -11.062 -2.794 -2.794 127 2HB GLU 339 1HB GLU 39 -11.135 -1.119 -1.119 128 1HG GLU 339 2HG GLU 39 -11.077 -2.602 -2.602 129 2HG GLU 339 1HG GLU 39 -12.128 -3.532 -3.532 130 H MET 340 H MET 40 -8.620 -2.709 -2.709 131 HA MET 340 HA MET 40 -8.053 -0.115 -0.115 132 1HB MET 340 2HB MET 40 -7.125 -2.861 -2.861 133 2HB MET 340 1HB MET 40 -6.504 -1.433 -1.433 134 1HG MET 340 2HG MET 40 -9.022 -0.782 -0.782 135 2HG MET 340 1HG MET 40 -9.319 -2.491 -2.491 136 1HE MET 340 3HE MET 40 -7.263 -4.176 -4.176 137 2HE MET 340 2HE MET 40 -6.077 -2.874 -2.874 138 3HE MET 340 1HE MET 40 -6.472 -3.734 -3.734 139 H PHE 341 H PHE 41 -5.864 -2.559 -2.559 140 HA PHE 341 HA PHE 41 -3.511 -0.976 -0.976 141 1HB PHE 341 2HB PHE 41 -4.386 -3.392 -3.392 142 2HB PHE 341 1HB PHE 41 -2.842 -2.635 -2.635 143 HD1 PHE 341 HD1 PHE 41 -4.803 -3.243 -3.243 144 HD2 PHE 341 HD2 PHE 41 -1.087 -3.848 -3.848 145 HE1 PHE 341 HE1 PHE 41 -3.888 -4.390 -4.390 146 HE2 PHE 341 HE2 PHE 41 -0.171 -4.999 -4.999 147 HZ PHE 341 HZ PHE 41 -1.584 -5.269 -5.269 148 H ARG 342 H ARG 42 -6.063 -1.298 -1.298 149 HA ARG 342 HA ARG 42 -4.809 0.084 0.084 150 1HB ARG 342 2HB ARG 42 -7.438 -0.963 -0.963 151 2HB ARG 342 1HB ARG 42 -7.574 0.639 0.639 152 1HG ARG 342 2HG ARG 42 -5.678 -0.437 -0.437 153 2HG ARG 342 1HG ARG 42 -6.577 -1.893 -1.893 154 1HD ARG 342 2HD ARG 42 -7.747 -1.131 -1.131 155 2HD ARG 342 1HD ARG 42 -8.683 -0.437 -0.437 156 HE ARG 342 HE ARG 42 -6.782 1.506 1.506 157 1HH1 ARG 342 1HH2 ARG 42 -9.807 0.397 0.397 158 2HH1 ARG 342 2HH2 ARG 42 -9.885 1.360 1.360 159 1HH2 ARG 342 2HH1 ARG 42 -6.614 2.481 2.481 160 2HH2 ARG 342 1HH1 ARG 42 -8.079 2.543 2.543 161 H GLU 343 H GLU 43 -6.471 1.146 1.146 162 HA GLU 343 HA GLU 43 -6.704 3.924 3.924 163 1HB GLU 343 2HB GLU 43 -8.188 2.787 2.787 164 2HB GLU 343 1HB GLU 43 -6.817 2.893 2.893 165 1HG GLU 343 2HG GLU 43 -7.976 4.870 4.870 166 2HG GLU 343 1HG GLU 43 -6.784 5.419 5.419 167 H LEU 344 H LEU 44 -4.641 2.201 2.201 168 HA LEU 344 HA LEU 44 -3.007 4.395 4.395 169 1HB LEU 344 2HB LEU 44 -2.587 1.417 1.417 170 2HB LEU 344 1HB LEU 44 -1.209 2.456 2.456 171 HG LEU 344 HG LEU 44 -1.986 1.963 1.963 172 1HD1 LEU 344 2HD1 LEU 44 -1.925 4.480 4.480 173 2HD1 LEU 344 1HD1 LEU 44 -3.686 4.392 4.392 174 3HD1 LEU 344 3HD1 LEU 44 -2.763 3.998 3.998 175 1HD2 LEU 344 3HD2 LEU 44 -4.438 1.469 1.469 176 2HD2 LEU 344 2HD2 LEU 44 -4.000 1.002 1.002 177 3HD2 LEU 344 1HD2 LEU 44 -4.777 2.559 2.559 178 H ASN 345 H ASN 45 -2.827 2.199 2.199 179 HA ASN 345 HA ASN 45 -0.359 3.328 3.328 180 1HB ASN 345 2HB ASN 45 -2.255 1.206 1.206 181 2HB ASN 345 1HB ASN 45 -1.613 2.064 2.064 182 1HD2 ASN 345 2HD2 ASN 45 0.698 -0.731 -0.731 183 2HD2 ASN 345 1HD2 ASN 45 -0.996 -0.715 -0.715 184 H GLU 346 H GLU 46 -3.757 4.044 4.044 185 HA GLU 346 HA GLU 46 -3.619 5.559 5.559 186 1HB GLU 346 2HB GLU 46 -5.747 4.678 4.678 187 2HB GLU 346 1HB GLU 46 -5.594 5.832 5.832 188 1HG GLU 346 2HG GLU 46 -5.745 7.703 7.703 189 2HG GLU 346 1HG GLU 46 -5.664 6.633 6.633 190 H ALA 347 H ALA 47 -3.258 6.382 6.382 191 HA ALA 347 HA ALA 47 -3.063 9.234 9.234 192 1HB ALA 347 1HB ALA 47 -2.076 7.588 7.588 193 2HB ALA 347 3HB ALA 47 -2.214 9.346 9.346 194 3HB ALA 347 2HB ALA 47 -3.664 8.346 8.346 195 H LEU 348 H LEU 48 -0.668 6.630 6.630 196 HA LEU 348 HA LEU 48 1.658 8.259 8.259 197 1HB LEU 348 2HB LEU 48 1.292 5.446 5.446 198 2HB LEU 348 1HB LEU 48 2.834 6.209 6.209 199 HG LEU 348 HG LEU 48 0.637 5.946 5.946 200 1HD1 LEU 348 1HD1 LEU 48 2.345 3.856 3.856 201 2HD1 LEU 348 3HD1 LEU 48 2.538 4.019 4.019 202 3HD1 LEU 348 2HD1 LEU 48 0.944 3.705 3.705 203 1HD2 LEU 348 1HD2 LEU 48 2.633 7.522 7.522 204 2HD2 LEU 348 3HD2 LEU 48 2.403 6.348 6.348 205 3HD2 LEU 348 2HD2 LEU 48 3.641 6.076 6.076 206 H GLU 349 H GLU 49 -0.083 6.589 6.589 207 HA GLU 349 HA GLU 49 1.505 7.557 7.557 208 1HB GLU 349 2HB GLU 49 -1.296 6.536 6.536 209 2HB GLU 349 1HB GLU 49 -0.859 7.358 7.358 210 1HG GLU 349 2HG GLU 49 1.152 5.836 5.836 211 2HG GLU 349 1HG GLU 49 0.463 4.918 4.918 212 H LEU 350 H LEU 50 -1.050 9.038 9.038 213 HA LEU 350 HA LEU 50 -1.444 11.272 11.272 214 1HB LEU 350 2HB LEU 50 -3.157 11.694 11.694 215 2HB LEU 350 1HB LEU 50 -2.673 10.268 10.268 216 HG LEU 350 HG LEU 50 -1.051 11.770 11.770 217 1HD1 LEU 350 3HD1 LEU 50 -2.007 13.583 13.583 218 2HD1 LEU 350 2HD1 LEU 50 -2.483 14.188 14.188 219 3HD1 LEU 350 1HD1 LEU 50 -0.786 13.862 13.862 220 1HD2 LEU 350 1HD2 LEU 50 -3.466 11.054 11.054 221 2HD2 LEU 350 3HD2 LEU 50 -2.691 12.363 12.363 222 3HD2 LEU 350 2HD2 LEU 50 -3.883 12.729 12.729 223 H LYS 351 H LYS 51 0.743 10.520 10.520 224 HA LYS 351 HA LYS 51 1.777 13.100 13.100 225 1HB LYS 351 2HB LYS 51 2.329 10.971 10.971 226 2HB LYS 351 1HB LYS 51 3.407 10.553 10.553 227 1HG LYS 351 2HG LYS 51 4.710 12.583 12.583 228 2HG LYS 351 1HG LYS 51 3.590 13.111 13.111 229 1HD LYS 351 2HD LYS 51 4.614 10.402 10.402 230 2HD LYS 351 1HD LYS 51 5.887 11.624 11.624 231 1HE LYS 351 2HE LYS 51 4.868 12.868 12.868 232 2HE LYS 351 1HE LYS 51 3.350 11.985 11.985 233 1HZ LYS 351 3HZ LYS 51 5.856 10.583 10.583 234 2HZ LYS 351 2HZ LYS 51 4.937 11.352 11.352 235 3HZ LYS 351 1HZ LYS 51 4.255 10.097 10.097 236 H ASP 352 H ASP 52 2.535 10.748 10.748 237 HA ASP 352 HA ASP 52 4.656 12.394 12.394 238 1HB ASP 352 2HB ASP 52 4.640 9.933 9.933 239 2HB ASP 352 1HB ASP 52 3.144 10.058 10.058 240 H ALA 353 H ALA 53 1.192 12.117 12.117 241 HA ALA 353 HA ALA 53 1.165 13.620 13.620 242 1HB ALA 353 3HB ALA 53 -0.540 11.890 11.890 243 2HB ALA 353 2HB ALA 53 -1.103 12.802 12.802 244 3HB ALA 353 1HB ALA 53 -1.286 13.473 13.473 245 H GLN 354 H GLN 54 1.479 14.406 14.406 246 HA GLN 354 HA GLN 54 -0.098 16.601 16.601 247 1HB GLN 354 2HB GLN 54 2.848 16.145 16.145 248 2HB GLN 354 1HB GLN 54 2.040 17.602 17.602 249 1HG GLN 354 2HG GLN 54 0.272 15.823 15.823 250 2HG GLN 354 1HG GLN 54 1.682 14.765 14.765 251 1HE2 GLN 354 2HE2 GLN 54 1.371 17.573 17.573 252 2HE2 GLN 354 1HE2 GLN 54 0.135 17.308 17.308 253 H ALA 355 HN ALA 55 -0.717 17.996 17.996 254 HA ALA 355 HA ALA 55 1.283 19.895 19.895 255 1HB ALA 355 2HB ALA 55 -0.102 18.026 18.026 256 2HB ALA 355 1HB ALA 55 0.805 19.466 19.466 257 3HB ALA 355 3HB ALA 55 1.631 18.117 18.117 258 1H GLY 325 3H GLY 25 -11.543 -14.516 -14.516 259 2H GLY 325 2H GLY 25 -12.145 -13.437 -13.437 260 3H GLY 325 1H GLY 25 -12.963 -14.892 -14.892 261 1HA GLY 325 2HA GLY 25 -14.216 -13.846 -13.846 262 2HA GLY 325 1HA GLY 25 -13.254 -12.381 -12.381 263 H GLU 326 H GLU 26 -11.936 -11.781 -11.781 264 HA GLU 326 HA GLU 26 -11.482 -13.804 -13.804 265 1HB GLU 326 2HB GLU 26 -12.013 -10.832 -10.832 266 2HB GLU 326 1HB GLU 26 -11.271 -11.698 -11.698 267 1HG GLU 326 2HG GLU 26 -13.729 -12.899 -12.899 268 2HG GLU 326 1HG GLU 26 -13.935 -11.427 -11.427 269 H TYR 327 H TYR 27 -9.534 -12.730 -12.730 270 HA TYR 327 HA TYR 27 -7.319 -12.292 -12.292 271 1HB TYR 327 2HB TYR 27 -7.614 -14.176 -14.176 272 2HB TYR 327 1HB TYR 27 -6.349 -13.044 -13.044 273 HD1 TYR 327 HD2 TYR 27 -4.667 -12.392 -12.392 274 HD2 TYR 327 HD1 TYR 27 -7.007 -15.991 -15.991 275 HE1 TYR 327 HE2 TYR 27 -3.090 -13.492 -13.492 276 HE2 TYR 327 HE1 TYR 27 -5.430 -17.089 -17.089 277 HH TYR 327 HH TYR 27 -2.395 -15.891 -15.891 278 H PHE 328 H PHE 28 -6.873 -10.132 -10.132 279 HA PHE 328 HA PHE 28 -6.970 -8.643 -8.643 280 1HB PHE 328 2HB PHE 28 -7.037 -7.696 -7.696 281 2HB PHE 328 1HB PHE 28 -6.929 -6.609 -6.609 282 HD1 PHE 328 HD2 PHE 28 -8.709 -7.183 -7.183 283 HD2 PHE 328 HD1 PHE 28 -9.163 -8.136 -8.136 284 HE1 PHE 328 HE2 PHE 28 -11.167 -7.312 -7.312 285 HE2 PHE 328 HE1 PHE 28 -11.621 -8.265 -8.265 286 HZ PHE 328 HZ PHE 28 -12.624 -7.853 -7.853 287 H THR 329 H THR 29 -5.130 -7.564 -7.564 288 HA THR 329 HA THR 29 -2.596 -8.313 -8.313 289 HB THR 329 HB THR 29 -2.264 -6.882 -6.882 290 HG1 THR 329 HG1 THR 29 -3.981 -9.136 -9.136 291 1HG2 THR 329 1HG2 THR 29 -0.753 -8.559 -8.559 292 2HG2 THR 329 3HG2 THR 29 -1.729 -9.802 -9.802 293 3HG2 THR 329 2HG2 THR 29 -0.810 -8.661 -8.661 294 H LEU 330 H LEU 30 -1.221 -6.757 -6.757 295 HA LEU 330 HA LEU 30 -2.139 -3.918 -3.918 296 1HB LEU 330 2HB LEU 30 -1.617 -5.573 -5.573 297 2HB LEU 330 1HB LEU 30 -0.501 -4.206 -4.206 298 HG LEU 330 HG LEU 30 -3.464 -3.853 -3.853 299 1HD1 LEU 330 3HD1 LEU 30 -2.181 -4.656 -4.656 300 2HD1 LEU 330 2HD1 LEU 30 -2.679 -2.973 -2.973 301 3HD1 LEU 330 1HD1 LEU 30 -3.869 -4.205 -4.205 302 1HD2 LEU 330 2HD2 LEU 30 -1.108 -2.163 -2.163 303 2HD2 LEU 330 1HD2 LEU 30 -2.758 -1.751 -1.751 304 3HD2 LEU 330 3HD2 LEU 30 -2.267 -1.646 -1.646 305 H GLN 331 H GLN 31 -0.726 -3.710 -3.710 306 HA GLN 331 HA GLN 31 2.123 -4.247 -4.247 307 1HB GLN 331 2HB GLN 31 0.715 -2.577 -2.577 308 2HB GLN 331 1HB GLN 31 2.321 -3.299 -3.299 309 1HG GLN 331 2HG GLN 31 1.380 -5.538 -5.538 310 2HG GLN 331 1HG GLN 31 -0.234 -4.888 -4.888 311 1HE2 GLN 331 2HE2 GLN 31 1.338 -4.733 -4.733 312 2HE2 GLN 331 1HE2 GLN 31 2.358 -5.042 -5.042 313 H ILE 332 H ILE 32 3.535 -2.910 -2.910 314 HA ILE 332 HA ILE 32 2.870 0.001 0.001 315 HB ILE 332 HB ILE 32 4.127 -1.771 -1.771 316 1HG1 ILE 332 2HG1 ILE 32 1.901 -0.034 -0.034 317 2HG1 ILE 332 1HG1 ILE 32 1.458 -1.149 -1.149 318 1HG2 ILE 332 3HG2 ILE 32 4.209 1.155 1.155 319 2HG2 ILE 332 2HG2 ILE 32 3.789 0.659 0.659 320 3HG2 ILE 332 1HG2 ILE 32 5.310 0.127 0.127 321 1HD1 ILE 332 3HD1 ILE 32 2.386 -3.032 -3.032 322 2HD1 ILE 332 2HD1 ILE 32 2.678 -1.886 -1.886 323 3HD1 ILE 332 1HD1 ILE 32 1.029 -2.219 -2.219 324 H ARG 333 H ARG 33 4.429 1.236 1.236 325 HA ARG 333 HA ARG 33 6.954 -0.040 -0.040 326 1HB ARG 333 2HB ARG 33 5.677 1.477 1.477 327 2HB ARG 333 1HB ARG 33 6.022 2.813 2.813 328 1HG ARG 333 2HG ARG 33 8.362 2.680 2.680 329 2HG ARG 333 1HG ARG 33 8.221 1.090 1.090 330 1HD ARG 333 2HD ARG 33 7.127 2.007 2.007 331 2HD ARG 333 1HD ARG 33 6.938 3.578 3.578 332 HE ARG 333 HE ARG 33 9.565 2.450 2.450 333 1HH1 ARG 333 2HH1 ARG 33 10.889 4.242 4.242 334 2HH1 ARG 333 1HH1 ARG 33 10.514 5.829 5.829 335 1HH2 ARG 333 1HH2 ARG 33 7.589 4.847 4.847 336 2HH2 ARG 333 2HH2 ARG 33 8.645 6.172 6.172 337 H GLY 334 H GLY 34 8.273 -0.245 -0.245 338 1HA GLY 334 2HA GLY 34 9.791 1.941 1.941 339 2HA GLY 334 1HA GLY 34 8.483 1.725 1.725 340 H ARG 335 H ARG 35 9.364 0.700 0.700 341 HA ARG 335 HA ARG 35 10.154 -2.030 -2.030 342 1HB ARG 335 2HB ARG 35 12.181 -0.728 -0.728 343 2HB ARG 335 1HB ARG 35 12.544 -0.316 -0.316 344 1HG ARG 335 2HG ARG 35 13.269 -2.408 -2.408 345 2HG ARG 335 1HG ARG 35 11.880 -3.145 -3.145 346 1HD ARG 335 2HD ARG 35 12.998 -2.591 -2.591 347 2HD ARG 335 1HD ARG 35 14.439 -2.171 -2.171 348 HE ARG 335 HE ARG 35 13.298 -4.900 -4.900 349 1HH1 ARG 335 2HH1 ARG 35 14.350 -4.744 -4.744 350 2HH1 ARG 335 1HH1 ARG 35 16.037 -5.092 -5.092 351 1HH2 ARG 335 1HH2 ARG 35 16.043 -4.479 -4.479 352 2HH2 ARG 335 2HH2 ARG 35 16.996 -4.941 -4.941 353 H GLU 336 H GLU 36 10.911 1.001 1.001 354 HA GLU 336 HA GLU 36 10.911 -0.295 -0.295 355 1HB GLU 336 2HB GLU 36 11.545 2.271 2.271 356 2HB GLU 336 1HB GLU 36 10.272 2.513 2.513 357 1HG GLU 336 2HG GLU 36 11.649 0.958 0.958 358 2HG GLU 336 1HG GLU 36 12.969 1.208 1.208 359 H ARG 337 H ARG 37 8.534 1.627 1.627 360 HA ARG 337 HA ARG 37 6.495 1.510 1.510 361 1HB ARG 337 2HB ARG 37 6.586 2.203 2.203 362 2HB ARG 337 1HB ARG 37 5.014 1.878 1.878 363 1HG ARG 337 2HG ARG 37 5.630 3.532 3.532 364 2HG ARG 337 1HG ARG 37 7.035 3.968 3.968 365 1HD ARG 337 2HD ARG 37 4.135 4.163 4.163 366 2HD ARG 337 1HD ARG 37 5.193 5.515 5.515 367 HE ARG 337 HE ARG 37 6.128 3.753 3.753 368 1HH1 ARG 337 1HH2 ARG 37 7.115 6.529 6.529 369 2HH1 ARG 337 2HH2 ARG 37 6.183 7.387 7.387 370 1HH2 ARG 337 2HH1 ARG 37 3.792 4.895 4.895 371 2HH2 ARG 337 1HH1 ARG 37 4.301 6.463 6.463 372 H PHE 338 H PHE 38 7.314 -0.515 -0.515 373 HA PHE 338 HA PHE 38 5.038 -2.280 -2.280 374 1HB PHE 338 2HB PHE 38 6.471 -2.196 -2.196 375 2HB PHE 338 1HB PHE 38 7.839 -2.793 -2.793 376 HD1 PHE 338 HD2 PHE 38 4.493 -3.654 -3.654 377 HD2 PHE 338 HD1 PHE 38 8.036 -5.115 -5.115 378 HE1 PHE 338 HE2 PHE 38 3.747 -5.986 -5.986 379 HE2 PHE 338 HE1 PHE 38 7.289 -7.447 -7.447 380 HZ PHE 338 HZ PHE 38 5.145 -7.882 -7.882 381 H GLU 339 H GLU 39 8.171 -2.148 -2.148 382 HA GLU 339 HA GLU 39 8.000 -4.773 -4.773 383 1HB GLU 339 2HB GLU 39 9.595 -2.281 -2.281 384 2HB GLU 339 1HB GLU 39 9.639 -3.649 -3.649 385 1HG GLU 339 2HG GLU 39 9.943 -4.805 -4.805 386 2HG GLU 339 1HG GLU 39 10.934 -3.346 -3.346 387 H MET 340 H MET 40 7.065 -1.507 -1.507 388 HA MET 340 HA MET 40 6.221 -2.163 -2.163 389 1HB MET 340 2HB MET 40 5.388 -0.034 -0.034 390 2HB MET 340 1HB MET 40 4.610 -0.170 -0.170 391 1HG MET 340 2HG MET 40 7.055 -0.196 -0.196 392 2HG MET 340 1HG MET 40 7.470 0.505 0.505 393 1HE MET 340 3HE MET 40 5.499 2.347 2.347 394 2HE MET 340 2HE MET 40 4.194 1.603 1.603 395 3HE MET 340 1HE MET 40 4.517 3.326 3.326 396 H PHE 341 H PHE 41 4.340 -1.961 -1.961 397 HA PHE 341 HA PHE 41 1.889 -2.918 -2.918 398 1HB PHE 341 2HB PHE 41 3.015 -2.850 -2.850 399 2HB PHE 341 1HB PHE 41 1.453 -3.597 -3.597 400 HD1 PHE 341 HD1 PHE 41 3.155 -0.547 -0.547 401 HD2 PHE 341 HD2 PHE 41 -0.257 -2.161 -2.161 402 HE1 PHE 341 HE1 PHE 41 2.088 1.688 1.688 403 HE2 PHE 341 HE2 PHE 41 -1.324 0.078 0.078 404 HZ PHE 341 HZ PHE 41 -0.151 2.002 2.002 405 H ARG 342 H ARG 42 4.772 -4.523 -4.523 406 HA ARG 342 HA ARG 42 3.621 -7.151 -7.151 407 1HB ARG 342 2HB ARG 42 6.241 -5.946 -5.946 408 2HB ARG 342 1HB ARG 42 6.345 -7.419 -7.419 409 1HG ARG 342 2HG ARG 42 4.709 -8.284 -8.284 410 2HG ARG 342 1HG ARG 42 5.641 -7.080 -7.080 411 1HD ARG 342 2HD ARG 42 6.962 -8.995 -8.995 412 2HD ARG 342 1HD ARG 42 7.707 -8.213 -8.213 413 HE ARG 342 HE ARG 42 5.773 -9.899 -9.899 414 1HH1 ARG 342 1HH2 ARG 42 8.951 -9.925 -9.925 415 2HH1 ARG 342 2HH2 ARG 42 9.132 -11.647 -11.647 416 1HH2 ARG 342 2HH1 ARG 42 5.789 -12.248 -12.248 417 2HH2 ARG 342 1HH1 ARG 42 7.343 -12.962 -12.962 418 H GLU 343 H GLU 43 4.901 -5.241 -5.241 419 HA GLU 343 HA GLU 43 5.040 -7.473 -7.473 420 1HB GLU 343 2HB GLU 43 6.395 -5.314 -5.314 421 2HB GLU 343 1HB GLU 43 4.909 -4.527 -4.527 422 1HG GLU 343 2HG GLU 43 5.895 -5.144 -5.144 423 2HG GLU 343 1HG GLU 43 4.797 -6.491 -6.491 424 H LEU 344 H LEU 44 2.843 -4.674 -4.674 425 HA LEU 344 HA LEU 44 1.005 -5.371 -5.371 426 1HB LEU 344 2HB LEU 44 0.780 -3.843 -3.843 427 2HB LEU 344 1HB LEU 44 -0.685 -4.228 -4.228 428 HG LEU 344 HG LEU 44 -0.104 -2.115 -2.115 429 1HD1 LEU 344 2HD1 LEU 44 -0.285 -3.988 -3.988 430 2HD1 LEU 344 1HD1 LEU 44 1.465 -3.825 -3.825 431 3HD1 LEU 344 3HD1 LEU 44 0.417 -2.450 -2.450 432 1HD2 LEU 344 3HD2 LEU 44 2.503 -2.874 -2.874 433 2HD2 LEU 344 2HD2 LEU 44 1.936 -1.274 -1.274 434 3HD2 LEU 344 1HD2 LEU 44 2.625 -2.356 -2.356 435 H ASN 345 H ASN 45 1.317 -6.496 -6.496 436 HA ASN 345 HA ASN 45 -1.114 -8.108 -8.108 437 1HB ASN 345 2HB ASN 45 0.972 -7.469 -7.469 438 2HB ASN 345 1HB ASN 45 0.402 -9.136 -9.136 439 1HD2 ASN 345 2HD2 ASN 45 -1.837 -6.549 -6.549 440 2HD2 ASN 345 1HD2 ASN 45 -0.146 -6.564 -6.564 441 H GLU 346 H GLU 46 2.234 -8.510 -8.510 442 HA GLU 346 HA GLU 46 2.275 -11.401 -11.401 443 1HB GLU 346 2HB GLU 46 4.334 -9.989 -9.989 444 2HB GLU 346 1HB GLU 46 3.968 -9.526 -9.526 445 1HG GLU 346 2HG GLU 46 4.166 -11.814 -11.814 446 2HG GLU 346 1HG GLU 46 4.307 -12.397 -12.397 447 H ALA 347 H ALA 47 1.493 -8.990 -8.990 448 HA ALA 347 HA ALA 47 1.183 -10.931 -10.931 449 1HB ALA 347 1HB ALA 47 0.054 -8.126 -8.126 450 2HB ALA 347 3HB ALA 47 0.083 -9.074 -9.074 451 3HB ALA 347 2HB ALA 47 1.595 -8.545 -8.545 452 H LEU 348 H LEU 48 -1.083 -9.281 -9.281 453 HA LEU 348 HA LEU 48 -3.483 -10.383 -10.383 454 1HB LEU 348 2HB LEU 48 -2.829 -9.722 -9.722 455 2HB LEU 348 1HB LEU 48 -4.449 -9.932 -9.932 456 HG LEU 348 HG LEU 48 -2.525 -7.916 -7.916 457 1HD1 LEU 348 1HD1 LEU 48 -3.932 -7.842 -7.842 458 2HD1 LEU 348 3HD1 LEU 48 -4.339 -6.482 -6.482 459 3HD1 LEU 348 2HD1 LEU 48 -2.658 -6.789 -6.789 460 1HD2 LEU 348 1HD2 LEU 48 -4.653 -8.703 -8.703 461 2HD2 LEU 348 3HD2 LEU 48 -4.502 -6.962 -6.962 462 3HD2 LEU 348 2HD2 LEU 48 -5.550 -7.911 -7.911 463 H GLU 349 H GLU 49 -1.370 -11.585 -11.585 464 HA GLU 349 HA GLU 49 -2.810 -13.980 -13.980 465 1HB GLU 349 2HB GLU 49 0.018 -13.075 -13.075 466 2HB GLU 349 1HB GLU 49 -0.331 -14.796 -14.796 467 1HG GLU 349 2HG GLU 49 -2.183 -14.187 -14.187 468 2HG GLU 349 1HG GLU 49 -1.609 -12.520 -12.520 469 H LEU 350 H LEU 50 -0.512 -13.104 -13.104 470 HA LEU 350 HA LEU 50 -0.084 -15.777 -15.777 471 1HB LEU 350 2HB LEU 50 1.403 -14.717 -14.717 472 2HB LEU 350 1HB LEU 50 0.918 -13.210 -13.210 473 HG LEU 350 HG LEU 50 -0.953 -13.079 -13.079 474 1HD1 LEU 350 3HD1 LEU 50 0.115 -15.665 -15.665 475 2HD1 LEU 350 2HD1 LEU 50 0.364 -14.618 -14.618 476 3HD1 LEU 350 1HD1 LEU 50 -1.258 -14.849 -14.849 477 1HD2 LEU 350 1HD2 LEU 50 1.403 -11.955 -11.955 478 2HD2 LEU 350 3HD2 LEU 50 0.450 -11.978 -11.978 479 3HD2 LEU 350 2HD2 LEU 50 1.760 -13.137 -13.137 480 H LYS 351 H LYS 51 -2.514 -13.301 -13.301 481 HA LYS 351 HA LYS 51 -3.762 -14.352 -14.352 482 1HB LYS 351 2HB LYS 51 -4.315 -12.164 -12.164 483 2HB LYS 351 1HB LYS 51 -5.209 -13.107 -13.107 484 1HG LYS 351 2HG LYS 51 -6.670 -13.999 -13.999 485 2HG LYS 351 1HG LYS 51 -5.736 -13.171 -13.171 486 1HD LYS 351 2HD LYS 51 -6.633 -11.375 -11.375 487 2HD LYS 351 1HD LYS 51 -7.968 -12.139 -12.139 488 1HE LYS 351 2HE LYS 51 -7.232 -11.291 -11.291 489 2HE LYS 351 1HE LYS 51 -5.654 -10.845 -10.845 490 1HZ LYS 351 3HZ LYS 51 -8.129 -9.662 -9.662 491 2HZ LYS 351 2HZ LYS 51 -7.399 -9.021 -9.021 492 3HZ LYS 351 1HZ LYS 51 -6.544 -9.065 -9.065 493 H ASP 352 H ASP 52 -4.072 -15.242 -15.242 494 HA ASP 352 HA ASP 52 -6.169 -17.207 -17.207 495 1HB ASP 352 2HB ASP 52 -5.997 -16.088 -16.088 496 2HB ASP 352 1HB ASP 52 -4.413 -16.825 -16.825 497 H ALA 353 H ALA 53 -2.692 -17.137 -17.137 498 HA ALA 353 HA ALA 53 -2.461 -20.071 -20.071 499 1HB ALA 353 3HB ALA 53 -0.718 -18.655 -18.655 500 2HB ALA 353 2HB ALA 53 -0.367 -17.944 -17.944 501 3HB ALA 353 1HB ALA 53 -0.043 -19.654 -19.654 502 H GLN 354 H GLN 54 -3.208 -17.813 -17.813 503 HA GLN 354 HA GLN 54 -1.815 -18.458 -18.458 504 1HB GLN 354 2HB GLN 54 -4.758 -17.960 -17.960 505 2HB GLN 354 1HB GLN 54 -4.115 -18.259 -18.259 506 1HG GLN 354 2HG GLN 54 -2.344 -16.424 -16.424 507 2HG GLN 354 1HG GLN 54 -3.630 -15.944 -15.944 508 1HE2 GLN 354 2HE2 GLN 54 -3.940 -15.018 -15.018 509 2HE2 GLN 354 1HE2 GLN 54 -2.541 -15.721 -15.721 510 H ALA 355 HN ALA 55 -1.114 -20.545 -20.545 511 HA ALA 355 HA ALA 55 -3.106 -22.511 -22.511 512 1HB ALA 355 2HB ALA 55 -1.392 -23.028 -23.028 513 2HB ALA 355 1HB ALA 55 -2.327 -24.262 -24.262 514 3HB ALA 355 3HB ALA 55 -3.152 -22.926 -22.926 515 1H GLY 325 3H GLY 25 9.393 -1.561 -1.561 516 2H GLY 325 2H GLY 25 9.996 -1.948 -1.948 517 3H GLY 325 1H GLY 25 10.811 -2.480 -2.480 518 1HA GLY 325 2HA GLY 25 12.069 -0.677 -0.677 519 2HA GLY 325 1HA GLY 25 11.106 -0.047 -0.047 520 H GLU 326 H GLU 26 9.790 1.675 1.675 521 HA GLU 326 HA GLU 26 9.342 2.375 2.375 522 1HB GLU 326 2HB GLU 26 9.874 4.110 4.110 523 2HB GLU 326 1HB GLU 26 9.130 4.763 4.763 524 1HG GLU 326 2HG GLU 26 11.588 3.120 3.120 525 2HG GLU 326 1HG GLU 26 11.795 4.721 4.721 526 H TYR 327 H TYR 27 7.393 4.182 4.182 527 HA TYR 327 HA TYR 27 5.178 2.785 2.785 528 1HB TYR 327 2HB TYR 27 5.476 3.521 3.521 529 2HB TYR 327 1HB TYR 27 4.213 4.545 4.545 530 HD1 TYR 327 HD2 TYR 27 2.526 3.257 3.257 531 HD2 TYR 327 HD1 TYR 27 4.862 1.416 1.416 532 HE1 TYR 327 HE2 TYR 27 0.945 1.346 1.346 533 HE2 TYR 327 HE1 TYR 27 3.281 -0.495 -0.495 534 HH TYR 327 HH TYR 27 0.250 -0.411 -0.411 535 H PHE 328 H PHE 28 4.732 3.942 3.942 536 HA PHE 328 HA PHE 28 4.837 6.919 6.919 537 1HB PHE 328 2HB PHE 28 4.899 5.029 5.029 538 2HB PHE 328 1HB PHE 28 4.792 6.783 6.783 539 HD1 PHE 328 HD2 PHE 28 6.573 8.095 8.095 540 HD2 PHE 328 HD1 PHE 28 7.026 4.087 4.087 541 HE1 PHE 328 HE2 PHE 28 9.032 8.273 8.273 542 HE2 PHE 328 HE1 PHE 28 9.485 4.266 4.266 543 HZ PHE 328 HZ PHE 28 10.487 6.359 6.359 544 H THR 329 H THR 29 3.003 8.134 8.134 545 HA THR 329 HA THR 29 0.460 6.592 6.592 546 HB THR 329 HB THR 29 0.200 9.489 9.489 547 HG1 THR 329 HG1 THR 29 1.849 8.081 8.081 548 1HG2 THR 329 1HG2 THR 29 -1.392 7.524 7.524 549 2HG2 THR 329 3HG2 THR 29 -0.456 7.456 7.456 550 3HG2 THR 329 2HG2 THR 29 -1.327 8.929 8.929 551 H LEU 330 H LEU 30 -0.845 6.654 6.654 552 HA LEU 330 HA LEU 30 0.007 8.459 8.459 553 1HB LEU 330 2HB LEU 30 -0.519 5.615 5.615 554 2HB LEU 330 1HB LEU 30 -1.630 6.406 6.406 555 HG LEU 330 HG LEU 30 1.331 6.995 6.995 556 1HD1 LEU 330 3HD1 LEU 30 0.052 4.526 4.526 557 2HD1 LEU 330 2HD1 LEU 30 0.590 5.311 5.311 558 3HD1 LEU 330 1HD1 LEU 30 1.747 4.971 4.971 559 1HD2 LEU 330 2HD2 LEU 30 -1.021 7.874 7.874 560 2HD2 LEU 330 1HD2 LEU 30 0.630 8.489 8.489 561 3HD2 LEU 330 3HD2 LEU 30 0.136 7.134 7.134 562 H GLN 331 H GLN 31 -1.391 10.152 10.152 563 HA GLN 331 HA GLN 31 -4.250 9.629 9.629 564 1HB GLN 331 2HB GLN 31 -2.834 12.299 12.299 565 2HB GLN 331 1HB GLN 31 -4.432 12.002 12.002 566 1HG GLN 331 2HG GLN 31 -3.461 10.692 10.692 567 2HG GLN 331 1HG GLN 31 -1.855 10.832 10.832 568 1HE2 GLN 331 2HE2 GLN 31 -3.466 14.060 14.060 569 2HE2 GLN 331 1HE2 GLN 31 -4.476 12.783 12.783 570 H ILE 332 H ILE 32 -5.666 9.534 9.534 571 HA ILE 332 HA ILE 32 -4.991 11.015 11.015 572 HB ILE 332 HB ILE 32 -6.247 8.273 8.273 573 1HG1 ILE 332 2HG1 ILE 32 -4.026 8.629 8.629 574 2HG1 ILE 332 1HG1 ILE 32 -3.585 9.066 9.066 575 1HG2 ILE 332 3HG2 ILE 32 -6.338 10.265 10.265 576 2HG2 ILE 332 2HG2 ILE 32 -5.930 8.619 8.619 577 3HG2 ILE 332 1HG2 ILE 32 -7.442 8.940 8.940 578 1HD1 ILE 332 3HD1 ILE 32 -4.554 6.879 6.879 579 2HD1 ILE 332 2HD1 ILE 32 -4.782 6.440 6.440 580 3HD1 ILE 332 1HD1 ILE 32 -3.157 6.698 6.698 581 H ARG 333 H ARG 33 -6.541 12.492 12.492 582 HA ARG 333 HA ARG 33 -9.075 12.475 12.475 583 1HB ARG 333 2HB ARG 33 -7.795 14.589 14.589 584 2HB ARG 333 1HB ARG 33 -8.145 14.401 14.401 585 1HG ARG 333 2HG ARG 33 -10.482 14.664 14.664 586 2HG ARG 333 1HG ARG 33 -10.341 14.417 14.417 587 1HD ARG 333 2HD ARG 33 -9.246 16.534 16.534 588 2HD ARG 333 1HD ARG 33 -9.052 16.744 16.744 589 HE ARG 333 HE ARG 33 -11.679 16.872 16.872 590 1HH1 ARG 333 2HH1 ARG 33 -13.002 16.809 16.809 591 2HH1 ARG 333 1HH1 ARG 33 -12.621 18.159 18.159 592 1HH2 ARG 333 1HH2 ARG 33 -9.697 18.943 18.943 593 2HH2 ARG 333 2HH2 ARG 33 -10.751 19.371 19.371 594 H GLY 334 H GLY 34 -10.402 10.863 10.863 595 1HA GLY 334 2HA GLY 34 -11.925 11.286 11.286 596 2HA GLY 334 1HA GLY 34 -10.616 10.198 10.198 597 H ARG 335 H ARG 35 -11.515 8.194 8.194 598 HA ARG 335 HA ARG 35 -12.293 6.795 6.795 599 1HB ARG 335 2HB ARG 35 -14.314 8.395 8.395 600 2HB ARG 335 1HB ARG 35 -14.680 7.228 7.228 601 1HG ARG 335 2HG ARG 35 -15.424 5.696 5.696 602 2HG ARG 335 1HG ARG 35 -14.031 5.935 5.935 603 1HD ARG 335 2HD ARG 35 -15.131 8.102 8.102 604 2HD ARG 335 1HD ARG 35 -16.578 7.564 7.564 605 HE ARG 335 HE ARG 35 -15.431 6.300 6.300 606 1HH1 ARG 335 2HH1 ARG 35 -16.476 4.109 4.109 607 2HH1 ARG 335 1HH1 ARG 35 -18.162 4.076 4.076 608 1HH2 ARG 335 1HH2 ARG 35 -18.182 7.271 7.271 609 2HH2 ARG 335 2HH2 ARG 35 -19.127 5.865 5.865 610 H GLU 336 H GLU 36 -13.051 6.993 6.993 611 HA GLU 336 HA GLU 36 -13.058 4.114 4.114 612 1HB GLU 336 2HB GLU 36 -13.690 6.376 6.376 613 2HB GLU 336 1HB GLU 36 -12.411 5.510 5.510 614 1HG GLU 336 2HG GLU 36 -13.784 3.380 3.380 615 2HG GLU 336 1HG GLU 36 -15.109 4.470 4.470 616 H ARG 337 H ARG 37 -10.679 6.696 6.696 617 HA ARG 337 HA ARG 37 -8.639 4.926 4.926 618 1HB ARG 337 2HB ARG 37 -8.731 7.745 7.745 619 2HB ARG 337 1HB ARG 37 -7.159 6.954 6.954 620 1HG ARG 337 2HG ARG 37 -7.755 6.329 6.329 621 2HG ARG 337 1HG ARG 37 -9.159 7.386 7.386 622 1HD ARG 337 2HD ARG 37 -6.259 8.208 8.208 623 2HD ARG 337 1HD ARG 37 -7.315 8.622 8.622 624 HE ARG 337 HE ARG 37 -8.246 9.472 9.472 625 1HH1 ARG 337 1HH2 ARG 37 -9.234 10.765 10.765 626 2HH1 ARG 337 2HH2 ARG 37 -8.300 12.222 12.222 627 1HH2 ARG 337 2HH1 ARG 37 -5.907 11.113 11.113 628 2HH2 ARG 337 1HH1 ARG 37 -6.417 12.419 12.419 629 H PHE 338 H PHE 38 -9.469 6.158 6.158 630 HA PHE 338 HA PHE 38 -7.192 5.050 5.050 631 1HB PHE 338 2HB PHE 38 -8.612 6.762 6.762 632 2HB PHE 338 1HB PHE 38 -9.983 5.652 5.652 633 HD1 PHE 338 HD2 PHE 38 -6.630 6.294 6.294 634 HD2 PHE 338 HD1 PHE 38 -10.174 3.870 3.870 635 HE1 PHE 338 HE2 PHE 38 -5.881 5.339 5.339 636 HE2 PHE 338 HE1 PHE 38 -9.424 2.916 2.916 637 HZ PHE 338 HZ PHE 38 -7.278 3.651 3.651 638 H GLU 339 H GLU 39 -10.326 3.759 3.759 639 HA GLU 339 HA GLU 39 -10.149 1.322 1.322 640 1HB GLU 339 2HB GLU 39 -11.742 2.194 2.194 641 2HB GLU 339 1HB GLU 39 -11.786 0.516 0.516 642 1HG GLU 339 2HG GLU 39 -12.094 2.006 2.006 643 2HG GLU 339 1HG GLU 39 -13.082 2.852 2.852 644 H MET 340 H MET 40 -9.201 2.245 2.245 645 HA MET 340 HA MET 40 -8.360 -0.325 -0.325 646 1HB MET 340 2HB MET 40 -7.521 2.489 2.489 647 2HB MET 340 1HB MET 40 -6.740 1.096 1.096 648 1HG MET 340 2HG MET 40 -9.188 0.310 0.310 649 2HG MET 340 1HG MET 40 -9.598 2.004 2.004 650 1HE MET 340 3HE MET 40 -7.633 3.827 3.827 651 2HE MET 340 2HE MET 40 -6.321 2.658 2.658 652 3HE MET 340 1HE MET 40 -6.647 3.448 3.448 653 H PHE 341 H PHE 41 -6.477 2.316 2.316 654 HA PHE 341 HA PHE 41 -4.031 0.845 0.845 655 1HB PHE 341 2HB PHE 41 -5.151 3.229 3.229 656 2HB PHE 341 1HB PHE 41 -3.590 2.537 2.537 657 HD1 PHE 341 HD1 PHE 41 -5.293 3.060 3.060 658 HD2 PHE 341 HD2 PHE 41 -1.876 3.884 3.884 659 HE1 PHE 341 HE1 PHE 41 -4.225 4.266 4.266 660 HE2 PHE 341 HE2 PHE 41 -0.807 5.089 5.089 661 HZ PHE 341 HZ PHE 41 -1.982 5.281 5.281 662 H ARG 342 H ARG 42 -6.917 0.934 0.934 663 HA ARG 342 HA ARG 42 -5.774 -0.332 -0.332 664 1HB ARG 342 2HB ARG 42 -8.388 0.541 0.541 665 2HB ARG 342 1HB ARG 42 -8.494 -1.066 -1.066 666 1HG ARG 342 2HG ARG 42 -6.856 0.131 0.131 667 2HG ARG 342 1HG ARG 42 -7.791 1.529 1.529 668 1HD ARG 342 2HD ARG 42 -9.104 0.694 0.694 669 2HD ARG 342 1HD ARG 42 -9.855 -0.044 -0.044 670 HE ARG 342 HE ARG 42 -7.918 -1.878 -1.878 671 1HH1 ARG 342 1HH2 ARG 42 -11.097 -0.960 -0.960 672 2HH1 ARG 342 2HH2 ARG 42 -11.280 -1.938 -1.938 673 1HH2 ARG 342 2HH1 ARG 42 -7.939 -2.856 -2.856 674 2HH2 ARG 342 1HH1 ARG 42 -9.492 -3.011 -3.011 675 H GLU 343 H GLU 43 -7.029 -1.470 -1.470 676 HA GLU 343 HA GLU 43 -7.180 -4.265 -4.265 677 1HB GLU 343 2HB GLU 43 -8.530 -3.194 -3.194 678 2HB GLU 343 1HB GLU 43 -7.044 -3.217 -3.217 679 1HG GLU 343 2HG GLU 43 -8.044 -5.250 -5.250 680 2HG GLU 343 1HG GLU 43 -6.945 -5.740 -5.740 681 H LEU 344 H LEU 44 -4.980 -2.375 -2.375 682 HA LEU 344 HA LEU 44 -3.139 -4.463 -4.463 683 1HB LEU 344 2HB LEU 44 -2.916 -1.465 -1.465 684 2HB LEU 344 1HB LEU 44 -1.451 -2.422 -2.422 685 HG LEU 344 HG LEU 44 -2.019 -1.977 -1.977 686 1HD1 LEU 344 2HD1 LEU 44 -1.883 -4.489 -4.489 687 2HD1 LEU 344 1HD1 LEU 44 -3.629 -4.498 -4.498 688 3HD1 LEU 344 3HD1 LEU 44 -2.552 -4.058 -4.058 689 1HD2 LEU 344 3HD2 LEU 44 -4.638 -1.642 -1.642 690 2HD2 LEU 344 2HD2 LEU 44 -4.045 -1.132 -1.132 691 3HD2 LEU 344 1HD2 LEU 44 -4.751 -2.739 -2.739 692 H ASN 345 H ASN 45 -3.453 -2.291 -2.291 693 HA ASN 345 HA ASN 45 -1.021 -3.262 -3.262 694 1HB ASN 345 2HB ASN 45 -3.105 -1.259 -1.259 695 2HB ASN 345 1HB ASN 45 -2.548 -2.096 -2.096 696 1HD2 ASN 345 2HD2 ASN 45 -0.288 0.846 0.846 697 2HD2 ASN 345 1HD2 ASN 45 -1.979 0.730 0.730 698 H GLU 346 H GLU 46 -4.360 -4.205 -4.205 699 HA GLU 346 HA GLU 46 -4.388 -5.726 -5.726 700 1HB GLU 346 2HB GLU 46 -6.459 -4.952 -4.952 701 2HB GLU 346 1HB GLU 46 -6.108 -6.076 -6.076 702 1HG GLU 346 2HG GLU 46 -6.287 -7.976 -7.976 703 2HG GLU 346 1HG GLU 46 -6.442 -6.912 -6.912 704 H ALA 347 H ALA 47 -3.630 -6.457 -6.457 705 HA ALA 347 HA ALA 47 -3.336 -9.305 -9.305 706 1HB ALA 347 1HB ALA 47 -2.258 -7.553 -7.553 707 2HB ALA 347 3HB ALA 47 -2.291 -9.317 -9.317 708 3HB ALA 347 2HB ALA 47 -3.801 -8.406 -8.406 709 H LEU 348 H LEU 48 -1.090 -6.541 -6.541 710 HA LEU 348 HA LEU 48 1.318 -8.055 -8.055 711 1HB LEU 348 2HB LEU 48 0.686 -5.268 -5.268 712 2HB LEU 348 1HB LEU 48 2.301 -5.953 -5.953 713 HG LEU 348 HG LEU 48 0.383 -5.809 -5.809 714 1HD1 LEU 348 1HD1 LEU 48 1.808 -3.623 -3.623 715 2HD1 LEU 348 3HD1 LEU 48 2.197 -3.755 -3.755 716 3HD1 LEU 348 2HD1 LEU 48 0.521 -3.552 -3.552 717 1HD2 LEU 348 1HD2 LEU 48 2.508 -7.242 -7.242 718 2HD2 LEU 348 3HD2 LEU 48 2.361 -6.087 -6.087 719 3HD2 LEU 348 2HD2 LEU 48 3.408 -5.726 -5.726 720 H GLU 349 H GLU 49 -0.793 -6.520 -6.520 721 HA GLU 349 HA GLU 49 0.651 -7.393 -7.393 722 1HB GLU 349 2HB GLU 49 -2.177 -6.568 -6.568 723 2HB GLU 349 1HB GLU 49 -1.831 -7.375 -7.375 724 1HG GLU 349 2HG GLU 49 0.027 -5.713 -5.713 725 2HG GLU 349 1HG GLU 49 -0.542 -4.847 -4.847 726 H LEU 350 H LEU 50 -1.639 -9.021 -9.021 727 HA LEU 350 HA LEU 50 -2.068 -11.304 -11.304 728 1HB LEU 350 2HB LEU 50 -3.559 -11.840 -11.840 729 2HB LEU 350 1HB LEU 50 -3.071 -10.378 -10.378 730 HG LEU 350 HG LEU 50 -1.199 -11.764 -11.764 731 1HD1 LEU 350 3HD1 LEU 50 -2.288 -13.684 -13.684 732 2HD1 LEU 350 2HD1 LEU 50 -2.538 -14.277 -14.277 733 3HD1 LEU 350 1HD1 LEU 50 -0.914 -13.870 -13.870 734 1HD2 LEU 350 1HD2 LEU 50 -3.556 -11.175 -11.175 735 2HD2 LEU 350 3HD2 LEU 50 -2.593 -12.415 -12.415 736 3HD2 LEU 350 2HD2 LEU 50 -3.908 -12.881 -12.881 737 H LYS 351 H LYS 51 0.370 -10.408 -10.408 738 HA LYS 351 HA LYS 51 1.607 -12.929 -12.929 739 1HB LYS 351 2HB LYS 51 2.162 -10.757 -10.757 740 2HB LYS 351 1HB LYS 51 3.059 -10.280 -10.280 741 1HG LYS 351 2HG LYS 51 4.517 -12.226 -12.226 742 2HG LYS 351 1HG LYS 51 3.580 -12.810 -12.810 743 1HD LYS 351 2HD LYS 51 4.476 -10.040 -10.040 744 2HD LYS 351 1HD LYS 51 5.812 -11.179 -11.179 745 1HE LYS 351 2HE LYS 51 5.079 -12.472 -12.472 746 2HE LYS 351 1HE LYS 51 3.501 -11.684 -11.684 747 1HZ LYS 351 3HZ LYS 51 5.978 -10.128 -10.128 748 2HZ LYS 351 2HZ LYS 51 5.251 -10.943 -10.943 749 3HZ LYS 351 1HZ LYS 51 4.393 -9.739 -9.739 750 H ASP 352 H ASP 52 1.909 -10.570 -10.570 751 HA ASP 352 HA ASP 52 4.011 -12.092 -12.092 752 1HB ASP 352 2HB ASP 52 3.837 -9.636 -9.636 753 2HB ASP 352 1HB ASP 52 2.254 -9.834 -9.834 754 H ALA 353 H ALA 53 0.535 -12.029 -12.029 755 HA ALA 353 HA ALA 53 0.298 -13.522 -13.522 756 1HB ALA 353 3HB ALA 53 -1.440 -11.880 -11.880 757 2HB ALA 353 2HB ALA 53 -1.789 -12.812 -12.812 758 3HB ALA 353 1HB ALA 53 -2.120 -13.502 -13.502 759 H GLN 354 H GLN 54 1.048 -14.267 -14.267 760 HA GLN 354 HA GLN 54 -0.343 -16.542 -16.542 761 1HB GLN 354 2HB GLN 54 2.600 -15.904 -15.904 762 2HB GLN 354 1HB GLN 54 1.957 -17.419 -17.419 763 1HG GLN 354 2HG GLN 54 0.187 -15.805 -15.805 764 2HG GLN 354 1HG GLN 54 1.472 -14.615 -14.615 765 1HE2 GLN 354 2HE2 GLN 54 1.786 -17.383 -17.383 766 2HE2 GLN 354 1HE2 GLN 54 0.390 -17.230 -17.230 767 H ALA 355 HN ALA 55 -1.049 -17.986 -17.986 768 HA ALA 355 HA ALA 55 0.937 -19.765 -19.765 769 1HB ALA 355 2HB ALA 55 -0.777 -17.995 -17.995 770 2HB ALA 355 1HB ALA 55 0.152 -19.379 -19.379 771 3HB ALA 355 3HB ALA 55 0.982 -17.979 -17.979 772 1H GLY 325 3H GLY 25 -13.198 13.820 13.820 773 2H GLY 325 2H GLY 25 -13.592 12.705 12.705 774 3H GLY 325 1H GLY 25 -14.530 14.107 14.107 775 1HA GLY 325 2HA GLY 25 -15.879 12.989 12.989 776 2HA GLY 325 1HA GLY 25 -14.815 11.584 11.584 777 H GLU 326 H GLU 26 -13.659 11.061 11.061 778 HA GLU 326 HA GLU 26 -13.572 13.102 13.102 779 1HB GLU 326 2HB GLU 26 -13.940 10.104 10.104 780 2HB GLU 326 1HB GLU 26 -13.402 11.008 11.008 781 1HG GLU 326 2HG GLU 26 -15.779 12.066 12.066 782 2HG GLU 326 1HG GLU 26 -16.004 10.583 10.583 783 H TYR 327 H TYR 27 -11.738 12.140 12.140 784 HA TYR 327 HA TYR 27 -9.296 11.839 11.839 785 1HB TYR 327 2HB TYR 27 -9.936 13.698 13.698 786 2HB TYR 327 1HB TYR 27 -8.666 12.642 12.642 787 HD1 TYR 327 HD2 TYR 27 -6.738 12.099 12.099 788 HD2 TYR 327 HD1 TYR 27 -9.295 15.548 15.548 789 HE1 TYR 327 HE2 TYR 27 -5.065 13.294 13.294 790 HE2 TYR 327 HE1 TYR 27 -7.621 16.744 16.744 791 HH TYR 327 HH TYR 27 -4.460 15.728 15.728 792 H PHE 328 H PHE 28 -8.722 9.707 9.707 793 HA PHE 328 HA PHE 28 -9.017 8.207 8.207 794 1HB PHE 328 2HB PHE 28 -8.699 7.268 7.268 795 2HB PHE 328 1HB PHE 28 -8.683 6.184 6.184 796 HD1 PHE 328 HD2 PHE 28 -10.698 6.645 6.645 797 HD2 PHE 328 HD1 PHE 28 -10.743 7.579 7.579 798 HE1 PHE 328 HE2 PHE 28 -13.178 6.630 6.630 799 HE2 PHE 328 HE1 PHE 28 -13.223 7.563 7.563 800 HZ PHE 328 HZ PHE 28 -14.440 7.088 7.088 801 H THR 329 H THR 29 -7.212 7.236 7.236 802 HA THR 329 HA THR 29 -4.590 8.158 8.158 803 HB THR 329 HB THR 29 -4.523 6.761 6.761 804 HG1 THR 329 HG1 THR 29 -6.278 8.947 8.947 805 1HG2 THR 329 1HG2 THR 29 -2.904 8.461 8.461 806 2HG2 THR 329 3HG2 THR 29 -3.999 9.684 9.684 807 3HG2 THR 329 2HG2 THR 29 -3.169 8.578 8.578 808 H LEU 330 H LEU 30 -3.098 6.708 6.708 809 HA LEU 330 HA LEU 30 -3.802 3.807 3.807 810 1HB LEU 330 2HB LEU 30 -3.117 5.470 5.470 811 2HB LEU 330 1HB LEU 30 -1.938 4.169 4.169 812 HG LEU 330 HG LEU 30 -4.908 3.644 3.644 813 1HD1 LEU 330 3HD1 LEU 30 -3.424 4.512 4.512 814 2HD1 LEU 330 2HD1 LEU 30 -3.811 2.804 2.804 815 3HD1 LEU 330 1HD1 LEU 30 -5.101 3.973 3.973 816 1HD2 LEU 330 2HD2 LEU 30 -2.465 2.098 2.098 817 2HD2 LEU 330 1HD2 LEU 30 -4.129 1.586 1.586 818 3HD2 LEU 330 3HD2 LEU 30 -3.449 1.513 1.513 819 H GLN 331 H GLN 31 -2.601 3.629 3.629 820 HA GLN 331 HA GLN 31 0.226 4.371 4.371 821 1HB GLN 331 2HB GLN 31 -1.305 2.619 2.619 822 2HB GLN 331 1HB GLN 31 0.220 3.453 3.453 823 1HG GLN 331 2HG GLN 31 -0.865 5.620 5.620 824 2HG GLN 331 1HG GLN 31 -2.384 4.849 4.849 825 1HE2 GLN 331 2HE2 GLN 31 -1.211 4.805 4.805 826 2HE2 GLN 331 1HE2 GLN 31 -0.075 5.169 5.169 827 H ILE 332 H ILE 32 1.818 3.131 3.131 828 HA ILE 332 HA ILE 32 1.346 0.183 0.183 829 HB ILE 332 HB ILE 32 2.723 2.025 2.025 830 1HG1 ILE 332 2HG1 ILE 32 0.712 0.134 0.134 831 2HG1 ILE 332 1HG1 ILE 32 0.059 1.242 1.242 832 1HG2 ILE 332 3HG2 ILE 32 2.945 -0.889 -0.889 833 2HG2 ILE 332 2HG2 ILE 32 2.686 -0.422 -0.422 834 3HG2 ILE 332 1HG2 ILE 32 4.074 0.208 0.208 835 1HD1 ILE 332 3HD1 ILE 32 1.066 3.145 3.145 836 2HD1 ILE 332 2HD1 ILE 32 1.509 1.989 1.989 837 3HD1 ILE 332 1HD1 ILE 32 -0.191 2.275 2.275 838 H ARG 333 H ARG 33 2.849 -0.959 -0.959 839 HA ARG 333 HA ARG 33 5.194 0.452 0.452 840 1HB ARG 333 2HB ARG 33 3.849 -1.146 -1.146 841 2HB ARG 333 1HB ARG 33 4.399 -2.454 -2.454 842 1HG ARG 333 2HG ARG 33 6.665 -2.176 -2.176 843 2HG ARG 333 1HG ARG 33 6.344 -0.597 -0.597 844 1HD ARG 333 2HD ARG 33 5.104 -1.578 -1.578 845 2HD ARG 333 1HD ARG 33 5.095 -3.157 -3.157 846 HE ARG 333 HE ARG 33 7.535 -1.875 -1.875 847 1HH1 ARG 333 2HH1 ARG 33 9.097 -3.580 -3.580 848 2HH1 ARG 333 1HH1 ARG 33 8.754 -5.188 -5.188 849 1HH2 ARG 333 1HH2 ARG 33 5.617 -4.387 -4.387 850 2HH2 ARG 333 2HH2 ARG 33 6.784 -5.646 -5.646 851 H GLY 334 H GLY 34 6.705 0.745 0.745 852 1HA GLY 334 2HA GLY 34 8.450 -1.331 -1.331 853 2HA GLY 334 1HA GLY 34 7.272 -1.207 -1.207 854 H ARG 335 H ARG 35 8.299 -0.140 -0.140 855 HA ARG 335 HA ARG 35 8.887 2.644 2.644 856 1HB ARG 335 2HB ARG 35 10.857 1.472 1.472 857 2HB ARG 335 1HB ARG 35 11.426 1.069 1.069 858 1HG ARG 335 2HG ARG 35 12.090 3.192 3.192 859 2HG ARG 335 1HG ARG 35 10.576 3.857 3.857 860 1HD ARG 335 2HD ARG 35 11.453 3.376 3.376 861 2HD ARG 335 1HD ARG 35 13.017 3.050 3.050 862 HE ARG 335 HE ARG 35 11.680 5.697 5.697 863 1HH1 ARG 335 2HH1 ARG 35 13.036 5.619 5.619 864 2HH1 ARG 335 1HH1 ARG 35 14.665 6.072 6.072 865 1HH2 ARG 335 1HH2 ARG 35 14.330 5.441 5.441 866 2HH2 ARG 335 2HH2 ARG 35 15.398 5.968 5.968 867 H GLU 336 H GLU 36 10.019 -0.327 -0.327 868 HA GLU 336 HA GLU 36 10.230 0.973 0.973 869 1HB GLU 336 2HB GLU 36 10.901 -1.552 -1.552 870 2HB GLU 336 1HB GLU 36 9.779 -1.868 -1.868 871 1HG GLU 336 2HG GLU 36 11.213 -0.232 -0.232 872 2HG GLU 336 1HG GLU 36 12.418 -0.405 -0.405 873 H ARG 337 H ARG 37 7.787 -1.112 -1.112 874 HA ARG 337 HA ARG 37 5.981 -1.103 -1.103 875 1HB ARG 337 2HB ARG 37 5.791 -1.801 -1.801 876 2HB ARG 337 1HB ARG 37 4.291 -1.554 -1.554 877 1HG ARG 337 2HG ARG 37 5.184 -3.161 -3.161 878 2HG ARG 337 1HG ARG 37 6.498 -3.530 -3.530 879 1HD ARG 337 2HD ARG 37 3.536 -3.892 -3.892 880 2HD ARG 337 1HD ARG 37 4.715 -5.177 -5.177 881 HE ARG 337 HE ARG 37 5.282 -3.358 -3.358 882 1HH1 ARG 337 1HH2 ARG 37 6.465 -6.069 -6.069 883 2HH1 ARG 337 2HH2 ARG 37 5.464 -6.983 -6.983 884 1HH2 ARG 337 2HH1 ARG 37 2.902 -4.645 -4.645 885 2HH2 ARG 337 1HH1 ARG 37 3.445 -6.177 -6.177 886 H PHE 338 H PHE 38 6.370 0.961 0.961 887 HA PHE 338 HA PHE 38 4.026 2.564 2.564 888 1HB PHE 338 2HB PHE 38 5.218 2.588 2.588 889 2HB PHE 338 1HB PHE 38 6.644 3.270 3.270 890 HD1 PHE 338 HD2 PHE 38 3.119 3.917 3.917 891 HD2 PHE 338 HD1 PHE 38 6.756 5.600 5.600 892 HE1 PHE 338 HE2 PHE 38 2.187 6.197 6.197 893 HE2 PHE 338 HE1 PHE 38 5.824 7.880 7.880 894 HZ PHE 338 HZ PHE 38 3.539 8.178 8.178 895 H GLU 339 H GLU 39 7.321 2.665 2.665 896 HA GLU 339 HA GLU 39 7.119 5.268 5.268 897 1HB GLU 339 2HB GLU 39 8.915 2.876 2.876 898 2HB GLU 339 1HB GLU 39 8.999 4.245 4.245 899 1HG GLU 339 2HG GLU 39 8.950 5.412 5.412 900 2HG GLU 339 1HG GLU 39 10.017 4.018 4.018 901 H MET 340 H MET 40 6.487 1.954 1.954 902 HA MET 340 HA MET 40 5.911 2.564 2.564 903 1HB MET 340 2HB MET 40 4.990 0.385 0.385 904 2HB MET 340 1HB MET 40 4.382 0.480 0.480 905 1HG MET 340 2HG MET 40 6.910 0.653 0.653 906 2HG MET 340 1HG MET 40 7.188 -0.031 -0.031 907 1HE MET 340 3HE MET 40 5.241 -1.982 -1.982 908 2HE MET 340 2HE MET 40 3.996 -1.324 -1.324 909 3HE MET 340 1HE MET 40 4.448 -3.021 -3.021 910 H PHE 341 H PHE 41 3.722 2.264 2.264 911 HA PHE 341 HA PHE 41 1.361 3.066 3.066 912 1HB PHE 341 2HB PHE 41 2.158 3.062 3.062 913 2HB PHE 341 1HB PHE 41 0.603 3.713 3.713 914 HD1 PHE 341 HD1 PHE 41 2.631 0.777 0.777 915 HD2 PHE 341 HD2 PHE 41 -1.082 2.170 2.170 916 HE1 PHE 341 HE1 PHE 41 1.712 -1.521 -1.521 917 HE2 PHE 341 HE2 PHE 41 -2.002 -0.129 -0.129 918 HZ PHE 341 HZ PHE 41 -0.605 -1.975 -1.975 919 H ARG 342 H ARG 42 3.996 4.846 4.846 920 HA ARG 342 HA ARG 42 2.679 7.413 7.413 921 1HB ARG 342 2HB ARG 42 5.318 6.347 6.347 922 2HB ARG 342 1HB ARG 42 5.440 7.835 7.835 923 1HG ARG 342 2HG ARG 42 3.538 8.572 8.572 924 2HG ARG 342 1HG ARG 42 4.442 7.419 7.419 925 1HD ARG 342 2HD ARG 42 5.594 9.419 9.419 926 2HD ARG 342 1HD ARG 42 6.544 8.692 8.692 927 HE ARG 342 HE ARG 42 4.642 10.259 10.259 928 1HH1 ARG 342 1HH2 ARG 42 7.669 10.474 10.474 929 2HH1 ARG 342 2HH2 ARG 42 7.748 12.205 12.205 930 1HH2 ARG 342 2HH1 ARG 42 4.477 12.603 12.603 931 2HH2 ARG 342 1HH1 ARG 42 5.941 13.410 13.410 932 H GLU 343 H GLU 43 4.335 5.555 5.555 933 HA GLU 343 HA GLU 43 4.563 7.791 7.791 934 1HB GLU 343 2HB GLU 43 6.043 5.707 5.707 935 2HB GLU 343 1HB GLU 43 4.673 4.843 4.843 936 1HG GLU 343 2HG GLU 43 5.857 5.520 5.520 937 2HG GLU 343 1HG GLU 43 4.651 6.797 6.797 938 H LEU 344 H LEU 44 2.503 4.865 4.865 939 HA LEU 344 HA LEU 44 0.858 5.456 5.456 940 1HB LEU 344 2HB LEU 44 0.458 3.906 3.906 941 2HB LEU 344 1HB LEU 44 -0.932 4.215 4.215 942 HG LEU 344 HG LEU 44 -0.177 2.155 2.155 943 1HD1 LEU 344 2HD1 LEU 44 -0.219 4.020 4.020 944 2HD1 LEU 344 1HD1 LEU 44 1.542 3.948 3.948 945 3HD1 LEU 344 3HD1 LEU 44 0.618 2.526 2.526 946 1HD2 LEU 344 3HD2 LEU 44 2.292 3.000 3.000 947 2HD2 LEU 344 2HD2 LEU 44 1.821 1.380 1.380 948 3HD2 LEU 344 1HD2 LEU 44 2.609 2.472 2.472 949 H ASN 345 H ASN 45 0.731 6.589 6.589 950 HA ASN 345 HA ASN 45 -1.765 8.051 8.051 951 1HB ASN 345 2HB ASN 45 0.119 7.533 7.533 952 2HB ASN 345 1HB ASN 45 -0.549 9.166 9.166 953 1HD2 ASN 345 2HD2 ASN 45 -2.842 6.462 6.462 954 2HD2 ASN 345 1HD2 ASN 45 -1.148 6.567 6.567 955 H GLU 346 H GLU 46 1.622 8.658 8.658 956 HA GLU 346 HA GLU 46 1.471 11.548 11.548 957 1HB GLU 346 2HB GLU 46 3.604 10.265 10.265 958 2HB GLU 346 1HB GLU 46 3.460 9.784 9.784 959 1HG GLU 346 2HG GLU 46 3.594 12.084 12.084 960 2HG GLU 346 1HG GLU 46 3.516 12.667 12.667 961 H ALA 347 H ALA 47 1.130 9.085 9.085 962 HA ALA 347 HA ALA 47 0.942 10.998 10.998 963 1HB ALA 347 1HB ALA 47 -0.043 8.133 8.133 964 2HB ALA 347 3HB ALA 47 0.095 9.080 9.080 965 3HB ALA 347 2HB ALA 47 1.544 8.643 8.643 966 H LEU 348 H LEU 48 -1.453 9.227 9.227 967 HA LEU 348 HA LEU 48 -3.783 10.187 10.187 968 1HB LEU 348 2HB LEU 48 -3.412 9.561 9.561 969 2HB LEU 348 1HB LEU 48 -4.959 9.675 9.675 970 HG LEU 348 HG LEU 48 -2.803 7.780 7.780 971 1HD1 LEU 348 1HD1 LEU 48 -4.498 7.616 7.616 972 2HD1 LEU 348 3HD1 LEU 48 -4.683 6.234 6.234 973 3HD1 LEU 348 2HD1 LEU 48 -3.091 6.651 6.651 974 1HD2 LEU 348 1HD2 LEU 48 -4.820 8.444 8.444 975 2HD2 LEU 348 3HD2 LEU 48 -4.603 6.714 6.714 976 3HD2 LEU 348 2HD2 LEU 48 -5.816 7.606 7.606 977 H GLU 349 H GLU 49 -2.044 11.509 11.509 978 HA GLU 349 HA GLU 49 -3.674 13.812 13.812 979 1HB GLU 349 2HB GLU 49 -0.860 13.075 13.075 980 2HB GLU 349 1HB GLU 49 -1.324 14.774 14.774 981 1HG GLU 349 2HG GLU 49 -3.308 14.057 14.057 982 2HG GLU 349 1HG GLU 49 -2.633 12.427 12.427 983 H LEU 350 H LEU 50 -1.067 13.088 13.088 984 HA LEU 350 HA LEU 50 -0.695 15.789 15.789 985 1HB LEU 350 2HB LEU 50 0.984 14.824 14.824 986 2HB LEU 350 1HB LEU 50 0.519 13.293 13.293 987 HG LEU 350 HG LEU 50 -1.155 13.030 13.030 988 1HD1 LEU 350 3HD1 LEU 50 -0.191 15.680 15.680 989 2HD1 LEU 350 2HD1 LEU 50 0.278 14.643 14.643 990 3HD1 LEU 350 1HD1 LEU 50 -1.418 14.771 14.771 991 1HD2 LEU 350 1HD2 LEU 50 1.256 12.050 12.050 992 2HD2 LEU 350 3HD2 LEU 50 0.463 12.013 12.013 993 3HD2 LEU 350 2HD2 LEU 50 1.673 13.247 13.247 994 H LYS 351 H LYS 51 -2.900 13.174 13.174 995 HA LYS 351 HA LYS 51 -3.942 14.156 14.156 996 1HB LYS 351 2HB LYS 51 -4.485 11.935 11.935 997 2HB LYS 351 1HB LYS 51 -5.564 12.821 12.821 998 1HG LYS 351 2HG LYS 51 -6.871 13.622 13.622 999 2HG LYS 351 1HG LYS 51 -5.754 12.853 12.853 1000 1HD LYS 351 2HD LYS 51 -6.772 11.003 11.003 1001 2HD LYS 351 1HD LYS 51 -8.048 11.686 11.686 1002 1HE LYS 351 2HE LYS 51 -7.033 10.890 10.890 1003 2HE LYS 351 1HE LYS 51 -5.514 10.536 10.536 1004 1HZ LYS 351 3HZ LYS 51 -8.028 9.205 9.205 1005 2HZ LYS 351 2HZ LYS 51 -7.085 8.606 8.606 1006 3HZ LYS 351 1HZ LYS 51 -6.432 8.710 8.710 1007 H ASP 352 H ASP 52 -4.686 15.019 15.019 1008 HA ASP 352 HA ASP 52 -6.824 16.855 16.855 1009 1HB ASP 352 2HB ASP 52 -6.829 15.743 15.743 1010 2HB ASP 352 1HB ASP 52 -5.331 16.577 16.577 1011 H ALA 353 H ALA 53 -3.376 16.996 16.996 1012 HA ALA 353 HA ALA 53 -3.336 19.938 19.938 1013 1HB ALA 353 3HB ALA 53 -1.640 18.619 18.619 1014 2HB ALA 353 2HB ALA 53 -1.070 17.940 17.940 1015 3HB ALA 353 1HB ALA 53 -0.883 19.664 19.664 1016 H GLN 354 H GLN 54 -3.676 17.648 17.648 1017 HA GLN 354 HA GLN 54 -2.065 18.393 18.393 1018 1HB GLN 354 2HB GLN 54 -4.989 17.672 17.672 1019 2HB GLN 354 1HB GLN 54 -4.206 18.054 18.054 1020 1HG GLN 354 2HG GLN 54 -2.374 16.365 16.365 1021 2HG GLN 354 1HG GLN 54 -3.679 15.771 15.771 1022 1HE2 GLN 354 2HE2 GLN 54 -3.605 14.726 14.726 1023 2HE2 GLN 354 1HE2 GLN 54 -2.324 15.544 15.544 1024 H ALA 355 HN ALA 55 -1.465 20.504 20.504 1025 HA ALA 355 HA ALA 55 -3.467 22.347 22.347 1026 1HB ALA 355 2HB ALA 55 -2.072 22.962 22.962 1027 2HB ALA 355 1HB ALA 55 -2.979 24.139 24.139 1028 3HB ALA 355 3HB ALA 55 -3.807 22.753 22.753 Start of MODEL 5 1 1H GLY 325 3H GLY 25 12.586 3.025 3.025 2 2H GLY 325 2H GLY 25 12.414 3.525 3.525 3 3H GLY 325 1H GLY 25 13.961 3.238 3.238 4 1HA GLY 325 2HA GLY 25 13.857 1.171 1.171 5 2HA GLY 325 1HA GLY 25 12.183 1.421 1.421 6 H GLU 326 H GLU 26 11.031 -0.250 -0.250 7 HA GLU 326 HA GLU 26 11.077 -0.570 -0.570 8 1HB GLU 326 2HB GLU 26 12.434 -2.367 -2.367 9 2HB GLU 326 1HB GLU 26 10.956 -3.189 -3.189 10 1HG GLU 326 2HG GLU 26 11.665 -3.394 -3.394 11 2HG GLU 326 1HG GLU 26 12.296 -1.747 -1.747 12 H TYR 327 H TYR 27 9.364 -2.650 -2.650 13 HA TYR 327 HA TYR 27 6.910 -1.625 -1.625 14 1HB TYR 327 2HB TYR 27 7.503 -2.956 -2.956 15 2HB TYR 327 1HB TYR 27 5.946 -3.317 -3.317 16 HD1 TYR 327 HD1 TYR 27 8.167 -0.479 -0.479 17 HD2 TYR 327 HD2 TYR 27 4.164 -1.779 -1.779 18 HE1 TYR 327 HE1 TYR 27 7.290 1.708 1.708 19 HE2 TYR 327 HE2 TYR 27 3.288 0.407 0.407 20 HH TYR 327 HH TYR 27 3.824 2.478 2.478 21 H PHE 328 H PHE 28 6.108 -2.807 -2.807 22 HA PHE 328 HA PHE 28 6.794 -5.718 -5.718 23 1HB PHE 328 2HB PHE 28 6.365 -3.711 -3.711 24 2HB PHE 328 1HB PHE 28 6.397 -5.453 -5.453 25 HD1 PHE 328 HD1 PHE 28 8.455 -6.746 -6.746 26 HD2 PHE 328 HD2 PHE 28 8.376 -2.504 -2.504 27 HE1 PHE 328 HE1 PHE 28 10.935 -6.698 -6.698 28 HE2 PHE 328 HE2 PHE 28 10.857 -2.457 -2.457 29 HZ PHE 328 HZ PHE 28 12.136 -4.554 -4.554 30 H THR 329 H THR 29 5.099 -7.086 -7.086 31 HA THR 329 HA THR 29 2.347 -5.976 -5.976 32 HB THR 329 HB THR 29 2.749 -8.899 -8.899 33 HG1 THR 329 HG1 THR 29 3.701 -8.792 -8.792 34 1HG2 THR 329 2HG2 THR 29 0.715 -7.267 -7.267 35 2HG2 THR 329 1HG2 THR 29 1.512 -7.242 -7.242 36 3HG2 THR 329 3HG2 THR 29 0.976 -8.773 -8.773 37 H LEU 330 H LEU 30 0.917 -6.243 -6.243 38 HA LEU 330 HA LEU 30 1.828 -7.925 -7.925 39 1HB LEU 330 2HB LEU 30 1.076 -5.181 -5.181 40 2HB LEU 330 1HB LEU 30 -0.225 -6.031 -6.031 41 HG LEU 330 HG LEU 30 2.580 -6.704 -6.704 42 1HD1 LEU 330 3HD1 LEU 30 1.153 -4.123 -4.123 43 2HD1 LEU 330 2HD1 LEU 30 2.478 -4.775 -4.775 44 3HD1 LEU 330 1HD1 LEU 30 2.756 -4.305 -4.305 45 1HD2 LEU 330 2HD2 LEU 30 -0.081 -7.099 -7.099 46 2HD2 LEU 330 1HD2 LEU 30 1.425 -7.712 -7.712 47 3HD2 LEU 330 3HD2 LEU 30 0.797 -6.147 -6.147 48 H GLN 331 H GLN 31 0.761 -9.808 -9.808 49 HA GLN 331 HA GLN 31 -2.096 -9.636 -9.636 50 1HB GLN 331 2HB GLN 31 0.043 -11.370 -11.370 51 2HB GLN 331 1HB GLN 31 -1.112 -12.329 -12.329 52 1HG GLN 331 2HG GLN 31 -2.928 -11.587 -11.587 53 2HG GLN 331 1HG GLN 31 -1.772 -10.620 -10.620 54 1HE2 GLN 331 2HE2 GLN 31 -0.253 -13.467 -13.467 55 2HE2 GLN 331 1HE2 GLN 31 0.039 -11.868 -11.868 56 H ILE 332 H ILE 32 -3.560 -9.638 -9.638 57 HA ILE 332 HA ILE 32 -2.923 -11.197 -11.197 58 HB ILE 332 HB ILE 32 -4.509 -8.630 -8.630 59 1HG1 ILE 332 2HG1 ILE 32 -2.294 -8.804 -8.804 60 2HG1 ILE 332 1HG1 ILE 32 -1.787 -9.002 -9.002 61 1HG2 ILE 332 2HG2 ILE 32 -4.252 -10.607 -10.607 62 2HG2 ILE 332 1HG2 ILE 32 -4.398 -8.892 -8.892 63 3HG2 ILE 332 3HG2 ILE 32 -5.669 -9.702 -9.702 64 1HD1 ILE 332 1HD1 ILE 32 -3.703 -6.796 -6.796 65 2HD1 ILE 332 3HD1 ILE 32 -2.003 -6.583 -6.583 66 3HD1 ILE 332 2HD1 ILE 32 -2.465 -6.871 -6.871 67 H ARG 333 H ARG 33 -4.545 -12.553 -12.553 68 HA ARG 333 HA ARG 33 -6.769 -13.087 -13.087 69 1HB ARG 333 2HB ARG 33 -5.550 -15.037 -15.037 70 2HB ARG 333 1HB ARG 33 -5.725 -14.568 -14.568 71 1HG ARG 333 2HG ARG 33 -8.039 -15.039 -15.039 72 2HG ARG 333 1HG ARG 33 -8.142 -15.024 -15.024 73 1HD ARG 333 2HD ARG 33 -6.601 -17.045 -17.045 74 2HD ARG 333 1HD ARG 33 -6.843 -17.120 -17.120 75 HE ARG 333 HE ARG 33 -9.361 -17.022 -17.022 76 1HH1 ARG 333 1HH2 ARG 33 -7.956 -18.701 -18.701 77 2HH1 ARG 333 2HH2 ARG 33 -8.349 -20.290 -20.290 78 1HH2 ARG 333 2HH1 ARG 33 -9.356 -19.209 -19.209 79 2HH2 ARG 333 1HH1 ARG 33 -9.141 -20.577 -20.577 80 H GLY 334 H GLY 34 -8.850 -12.502 -12.502 81 1HA GLY 334 2HA GLY 34 -10.527 -12.454 -12.454 82 2HA GLY 334 1HA GLY 34 -9.395 -11.289 -11.289 83 H ARG 335 H ARG 35 -10.429 -9.341 -9.341 84 HA ARG 335 HA ARG 35 -10.798 -8.102 -8.102 85 1HB ARG 335 2HB ARG 35 -12.815 -9.686 -9.686 86 2HB ARG 335 1HB ARG 35 -13.389 -8.620 -8.620 87 1HG ARG 335 2HG ARG 35 -14.014 -7.017 -7.017 88 2HG ARG 335 1HG ARG 35 -12.512 -7.157 -7.157 89 1HD ARG 335 2HD ARG 35 -13.342 -8.985 -8.985 90 2HD ARG 335 1HD ARG 35 -14.707 -9.225 -9.225 91 HE ARG 335 HE ARG 35 -14.467 -6.754 -6.754 92 1HH1 ARG 335 1HH2 ARG 35 -15.885 -9.762 -9.762 93 2HH1 ARG 335 2HH2 ARG 35 -17.519 -9.199 -9.199 94 1HH2 ARG 335 2HH1 ARG 35 -16.704 -5.887 -5.887 95 2HH2 ARG 335 1HH1 ARG 35 -17.983 -7.006 -7.006 96 H GLU 336 H GLU 36 -12.517 -7.922 -7.922 97 HA GLU 336 HA GLU 36 -12.557 -5.120 -5.120 98 1HB GLU 336 2HB GLU 36 -13.477 -7.085 -7.085 99 2HB GLU 336 1HB GLU 36 -12.023 -6.678 -6.678 100 1HG GLU 336 2HG GLU 36 -12.746 -4.510 -4.510 101 2HG GLU 336 1HG GLU 36 -13.829 -4.471 -4.471 102 H ARG 337 H ARG 37 -10.069 -7.345 -7.345 103 HA ARG 337 HA ARG 37 -8.341 -5.330 -5.330 104 1HB ARG 337 2HB ARG 37 -8.217 -8.162 -8.162 105 2HB ARG 337 1HB ARG 37 -6.737 -7.434 -7.434 106 1HG ARG 337 2HG ARG 37 -6.059 -6.683 -6.683 107 2HG ARG 337 1HG ARG 37 -7.711 -6.469 -6.469 108 1HD ARG 337 2HD ARG 37 -6.380 -9.161 -9.161 109 2HD ARG 337 1HD ARG 37 -6.535 -8.363 -8.363 110 HE ARG 337 HE ARG 37 -9.126 -8.421 -8.421 111 1HH1 ARG 337 2HH1 ARG 37 -7.607 -10.690 -10.690 112 2HH1 ARG 337 1HH1 ARG 37 -8.245 -12.077 -12.077 113 1HH2 ARG 337 1HH2 ARG 37 -9.545 -10.251 -10.251 114 2HH2 ARG 337 2HH2 ARG 37 -9.342 -11.829 -11.829 115 H PHE 338 H PHE 38 -8.431 -6.873 -6.873 116 HA PHE 338 HA PHE 38 -6.245 -5.495 -5.495 117 1HB PHE 338 2HB PHE 38 -7.484 -7.357 -7.357 118 2HB PHE 338 1HB PHE 38 -8.838 -6.259 -6.259 119 HD1 PHE 338 HD1 PHE 38 -5.377 -7.091 -7.091 120 HD2 PHE 338 HD2 PHE 38 -8.678 -4.425 -4.425 121 HE1 PHE 338 HE1 PHE 38 -4.280 -6.248 -6.248 122 HE2 PHE 338 HE2 PHE 38 -7.581 -3.582 -3.582 123 HZ PHE 338 HZ PHE 38 -5.382 -4.494 -4.494 124 H GLU 339 H GLU 39 -9.519 -4.406 -4.406 125 HA GLU 339 HA GLU 39 -9.360 -2.012 -2.012 126 1HB GLU 339 2HB GLU 39 -11.103 -2.711 -2.711 127 2HB GLU 339 1HB GLU 39 -11.311 -1.269 -1.269 128 1HG GLU 339 2HG GLU 39 -11.326 -3.009 -3.009 129 2HG GLU 339 1HG GLU 39 -11.783 -4.144 -4.144 130 H MET 340 H MET 40 -8.679 -2.771 -2.771 131 HA MET 340 HA MET 40 -8.139 -0.108 -0.108 132 1HB MET 340 2HB MET 40 -6.776 -2.577 -2.577 133 2HB MET 340 1HB MET 40 -7.087 -1.072 -1.072 134 1HG MET 340 2HG MET 40 -9.553 -1.495 -1.495 135 2HG MET 340 1HG MET 40 -9.136 -3.086 -3.086 136 1HE MET 340 2HE MET 40 -6.991 -4.324 -4.324 137 2HE MET 340 1HE MET 40 -6.332 -2.793 -2.793 138 3HE MET 340 3HE MET 40 -6.736 -4.072 -4.072 139 H PHE 341 H PHE 41 -6.061 -2.592 -2.592 140 HA PHE 341 HA PHE 41 -3.644 -1.057 -1.057 141 1HB PHE 341 2HB PHE 41 -4.535 -3.520 -3.520 142 2HB PHE 341 1HB PHE 41 -2.990 -2.786 -2.786 143 HD1 PHE 341 HD2 PHE 41 -4.924 -3.298 -3.298 144 HD2 PHE 341 HD1 PHE 41 -1.221 -3.930 -3.930 145 HE1 PHE 341 HE2 PHE 41 -3.981 -4.385 -4.385 146 HE2 PHE 341 HE1 PHE 41 -0.276 -5.023 -5.023 147 HZ PHE 341 HZ PHE 41 -1.665 -5.250 -5.250 148 H ARG 342 H ARG 42 -6.140 -1.468 -1.468 149 HA ARG 342 HA ARG 42 -4.844 -0.232 -0.232 150 1HB ARG 342 2HB ARG 42 -7.201 -1.438 -1.438 151 2HB ARG 342 1HB ARG 42 -7.774 0.216 0.216 152 1HG ARG 342 2HG ARG 42 -6.695 0.899 0.899 153 2HG ARG 342 1HG ARG 42 -6.070 -0.734 -0.734 154 1HD ARG 342 2HD ARG 42 -8.362 -1.615 -1.615 155 2HD ARG 342 1HD ARG 42 -9.009 0.005 0.005 156 HE ARG 342 HE ARG 42 -7.230 -0.045 -0.045 157 1HH1 ARG 342 1HH2 ARG 42 -9.819 1.468 1.468 158 2HH1 ARG 342 2HH2 ARG 42 -10.809 0.579 0.579 159 1HH2 ARG 342 2HH1 ARG 42 -8.748 -2.208 -2.208 160 2HH2 ARG 342 1HH1 ARG 42 -10.203 -1.501 -1.501 161 H GLU 343 H GLU 43 -6.761 1.144 1.144 162 HA GLU 343 HA GLU 43 -6.551 3.866 3.866 163 1HB GLU 343 2HB GLU 43 -8.366 3.026 3.026 164 2HB GLU 343 1HB GLU 43 -7.162 2.966 2.966 165 1HG GLU 343 2HG GLU 43 -7.561 5.145 5.145 166 2HG GLU 343 1HG GLU 43 -6.885 5.508 5.508 167 H LEU 344 H LEU 44 -4.791 1.923 1.923 168 HA LEU 344 HA LEU 44 -3.189 3.974 3.974 169 1HB LEU 344 2HB LEU 44 -2.972 1.027 1.027 170 2HB LEU 344 1HB LEU 44 -1.447 1.868 1.868 171 HG LEU 344 HG LEU 44 -2.119 1.356 1.356 172 1HD1 LEU 344 1HD1 LEU 44 -1.965 3.983 3.983 173 2HD1 LEU 344 3HD1 LEU 44 -3.553 3.938 3.938 174 3HD1 LEU 344 2HD1 LEU 44 -2.129 3.418 3.418 175 1HD2 LEU 344 3HD2 LEU 44 -4.372 0.553 0.553 176 2HD2 LEU 344 2HD2 LEU 44 -4.429 1.613 1.613 177 3HD2 LEU 344 1HD2 LEU 44 -4.923 2.222 2.222 178 H ASN 345 H ASN 45 -2.327 1.778 1.778 179 HA ASN 345 HA ASN 45 0.026 3.244 3.244 180 1HB ASN 345 2HB ASN 45 0.224 1.734 1.734 181 2HB ASN 345 1HB ASN 45 -0.689 0.801 0.801 182 1HD2 ASN 345 2HD2 ASN 45 -3.437 0.407 0.407 183 2HD2 ASN 345 1HD2 ASN 45 -2.609 -0.110 -0.110 184 H GLU 346 H GLU 46 -3.352 3.713 3.713 185 HA GLU 346 HA GLU 46 -3.056 5.186 5.186 186 1HB GLU 346 2HB GLU 46 -5.206 4.315 4.315 187 2HB GLU 346 1HB GLU 46 -5.197 5.989 5.989 188 1HG GLU 346 2HG GLU 46 -5.336 6.827 6.827 189 2HG GLU 346 1HG GLU 46 -5.003 5.236 5.236 190 H ALA 347 H ALA 47 -3.046 6.193 6.193 191 HA ALA 347 HA ALA 47 -2.773 9.011 9.011 192 1HB ALA 347 1HB ALA 47 -3.654 8.166 8.166 193 2HB ALA 347 3HB ALA 47 -2.054 7.527 7.527 194 3HB ALA 347 2HB ALA 47 -2.293 9.267 9.267 195 H LEU 348 H LEU 48 -0.439 6.504 6.504 196 HA LEU 348 HA LEU 48 1.860 8.122 8.122 197 1HB LEU 348 2HB LEU 48 1.659 5.276 5.276 198 2HB LEU 348 1HB LEU 48 3.140 6.066 6.066 199 HG LEU 348 HG LEU 48 0.701 5.757 5.757 200 1HD1 LEU 348 3HD1 LEU 48 2.389 3.697 3.697 201 2HD1 LEU 348 2HD1 LEU 48 2.952 4.079 4.079 202 3HD1 LEU 348 1HD1 LEU 48 1.270 3.623 3.623 203 1HD2 LEU 348 3HD2 LEU 48 3.007 7.310 7.310 204 2HD2 LEU 348 2HD2 LEU 48 1.924 6.874 6.874 205 3HD2 LEU 348 1HD2 LEU 48 3.355 5.895 5.895 206 H GLU 349 H GLU 49 0.553 6.358 6.358 207 HA GLU 349 HA GLU 49 2.432 7.368 7.368 208 1HB GLU 349 2HB GLU 49 0.603 5.488 5.488 209 2HB GLU 349 1HB GLU 49 -0.427 6.818 6.818 210 1HG GLU 349 2HG GLU 49 1.022 7.335 7.335 211 2HG GLU 349 1HG GLU 49 2.305 6.306 6.306 212 H LEU 350 H LEU 50 -0.534 8.717 8.717 213 HA LEU 350 HA LEU 50 -0.821 10.849 10.849 214 1HB LEU 350 2HB LEU 50 -2.642 11.320 11.320 215 2HB LEU 350 1HB LEU 50 -2.233 9.885 9.885 216 HG LEU 350 HG LEU 50 -0.643 11.534 11.534 217 1HD1 LEU 350 1HD1 LEU 50 -2.028 13.235 13.235 218 2HD1 LEU 350 3HD1 LEU 50 -2.443 13.686 13.686 219 3HD1 LEU 350 2HD1 LEU 50 -0.755 13.644 13.644 220 1HD2 LEU 350 2HD2 LEU 50 -3.586 11.099 11.099 221 2HD2 LEU 350 1HD2 LEU 50 -2.304 10.631 10.631 222 3HD2 LEU 350 3HD2 LEU 50 -2.855 12.303 12.303 223 H LYS 351 H LYS 51 1.175 10.326 10.326 224 HA LYS 351 HA LYS 51 2.032 13.006 13.006 225 1HB LYS 351 2HB LYS 51 2.467 10.956 10.956 226 2HB LYS 351 1HB LYS 51 3.765 10.559 10.559 227 1HG LYS 351 2HG LYS 51 4.866 12.681 12.681 228 2HG LYS 351 1HG LYS 51 3.523 13.204 13.204 229 1HD LYS 351 2HD LYS 51 4.143 10.826 10.826 230 2HD LYS 351 1HD LYS 51 5.735 11.338 11.338 231 1HE LYS 351 2HE LYS 51 4.964 13.667 13.667 232 2HE LYS 351 1HE LYS 51 3.924 12.628 12.628 233 1HZ LYS 351 2HZ LYS 51 6.765 11.944 11.944 234 2HZ LYS 351 1HZ LYS 51 6.321 13.169 13.169 235 3HZ LYS 351 3HZ LYS 51 5.705 11.601 11.601 236 H ASP 352 H ASP 52 3.343 10.423 10.423 237 HA ASP 352 HA ASP 52 5.558 11.895 11.895 238 1HB ASP 352 2HB ASP 52 4.457 9.357 9.357 239 2HB ASP 352 1HB ASP 52 4.355 10.155 10.155 240 H ALA 353 H ALA 53 2.137 11.897 11.897 241 HA ALA 353 HA ALA 53 2.640 13.672 13.672 242 1HB ALA 353 3HB ALA 53 0.861 11.738 11.738 243 2HB ALA 353 2HB ALA 53 -0.098 12.965 12.965 244 3HB ALA 353 1HB ALA 53 0.441 13.236 13.236 245 H GLN 354 H GLN 54 3.186 14.576 14.576 246 HA GLN 354 HA GLN 54 1.136 16.747 16.747 247 1HB GLN 354 2HB GLN 54 2.673 15.133 15.133 248 2HB GLN 354 1HB GLN 54 2.707 16.862 16.862 249 1HG GLN 354 2HG GLN 54 0.055 16.341 16.341 250 2HG GLN 354 1HG GLN 54 0.513 14.981 14.981 251 1HE2 GLN 354 2HE2 GLN 54 1.507 17.367 17.367 252 2HE2 GLN 354 1HE2 GLN 54 2.293 16.161 16.161 253 H ALA 355 HN ALA 55 2.259 17.920 17.920 254 HA ALA 355 HA ALA 55 5.020 18.762 18.762 255 1HB ALA 355 1HB ALA 55 3.814 18.587 18.587 256 2HB ALA 355 3HB ALA 55 2.939 20.051 20.051 257 3HB ALA 355 2HB ALA 55 4.692 20.096 20.096 258 1H GLY 325 3H GLY 25 -13.024 -15.343 -15.343 259 2H GLY 325 2H GLY 25 -13.040 -14.253 -14.253 260 3H GLY 325 1H GLY 25 -14.497 -14.721 -14.721 261 1HA GLY 325 2HA GLY 25 -14.364 -12.985 -12.985 262 2HA GLY 325 1HA GLY 25 -12.781 -12.585 -12.585 263 H GLU 326 H GLU 26 -11.419 -12.332 -12.332 264 HA GLU 326 HA GLU 26 -11.111 -14.618 -14.618 265 1HB GLU 326 2HB GLU 26 -12.532 -12.288 -12.288 266 2HB GLU 326 1HB GLU 26 -10.956 -12.163 -12.163 267 1HG GLU 326 2HG GLU 26 -11.396 -13.879 -13.879 268 2HG GLU 326 1HG GLU 26 -12.120 -14.858 -14.858 269 H TYR 327 H TYR 27 -9.243 -13.616 -13.616 270 HA TYR 327 HA TYR 27 -7.025 -12.913 -12.913 271 1HB TYR 327 2HB TYR 27 -7.233 -14.403 -14.403 272 2HB TYR 327 1HB TYR 27 -5.751 -13.488 -13.488 273 HD1 TYR 327 HD1 TYR 27 -8.015 -16.004 -16.004 274 HD2 TYR 327 HD2 TYR 27 -4.066 -14.321 -14.321 275 HE1 TYR 327 HE1 TYR 27 -7.195 -17.781 -17.781 276 HE2 TYR 327 HE2 TYR 27 -3.246 -16.098 -16.098 277 HH TYR 327 HH TYR 27 -3.833 -17.798 -17.798 278 H PHE 328 H PHE 28 -6.334 -10.830 -10.830 279 HA PHE 328 HA PHE 28 -6.842 -9.210 -9.210 280 1HB PHE 328 2HB PHE 28 -6.818 -8.411 -8.411 281 2HB PHE 328 1HB PHE 28 -6.769 -7.235 -7.235 282 HD1 PHE 328 HD1 PHE 28 -8.686 -6.915 -6.915 283 HD2 PHE 328 HD2 PHE 28 -8.813 -9.762 -9.762 284 HE1 PHE 328 HE1 PHE 28 -11.149 -7.081 -7.081 285 HE2 PHE 328 HE2 PHE 28 -11.276 -9.927 -9.927 286 HZ PHE 328 HZ PHE 28 -12.443 -8.587 -8.587 287 H THR 329 H THR 29 -5.197 -7.534 -7.534 288 HA THR 329 HA THR 29 -2.509 -8.323 -8.323 289 HB THR 329 HB THR 29 -2.468 -6.846 -6.846 290 HG1 THR 329 HG1 THR 29 -3.292 -8.661 -8.661 291 1HG2 THR 329 2HG2 THR 29 -0.731 -8.372 -8.372 292 2HG2 THR 329 1HG2 THR 29 -1.529 -9.664 -9.664 293 3HG2 THR 329 3HG2 THR 29 -0.769 -8.330 -8.330 294 H LEU 330 H LEU 30 -1.137 -6.645 -6.645 295 HA LEU 330 HA LEU 30 -2.301 -3.892 -3.892 296 1HB LEU 330 2HB LEU 30 -1.745 -5.477 -5.477 297 2HB LEU 330 1HB LEU 30 -0.483 -4.247 -4.247 298 HG LEU 330 HG LEU 30 -3.282 -3.363 -3.363 299 1HD1 LEU 330 3HD1 LEU 30 -2.176 -4.161 -4.161 300 2HD1 LEU 330 2HD1 LEU 30 -3.542 -3.063 -3.063 301 3HD1 LEU 330 1HD1 LEU 30 -3.663 -4.728 -4.728 302 1HD2 LEU 330 2HD2 LEU 30 -0.714 -2.225 -2.225 303 2HD2 LEU 330 1HD2 LEU 30 -2.229 -1.382 -1.382 304 3HD2 LEU 330 3HD2 LEU 30 -1.780 -1.786 -1.786 305 H GLN 331 H GLN 31 -0.993 -3.632 -3.632 306 HA GLN 331 HA GLN 31 1.900 -3.929 -3.929 307 1HB GLN 331 2HB GLN 31 -0.037 -3.561 -3.561 308 2HB GLN 331 1HB GLN 31 1.140 -2.252 -2.252 309 1HG GLN 331 2HG GLN 31 2.980 -3.869 -3.869 310 2HG GLN 331 1HG GLN 31 1.837 -5.197 -5.197 311 1HE2 GLN 331 2HE2 GLN 31 0.694 -5.091 -5.091 312 2HE2 GLN 331 1HE2 GLN 31 0.266 -5.567 -5.567 313 H ILE 332 H ILE 32 3.165 -2.482 -2.482 314 HA ILE 332 HA ILE 32 2.312 0.385 0.385 315 HB ILE 332 HB ILE 32 3.755 -1.191 -1.191 316 1HG1 ILE 332 2HG1 ILE 32 1.348 0.384 0.384 317 2HG1 ILE 332 1HG1 ILE 32 1.055 -0.945 -0.945 318 1HG2 ILE 332 2HG2 ILE 32 3.382 1.747 1.747 319 2HG2 ILE 332 1HG2 ILE 32 3.361 1.138 1.138 320 3HG2 ILE 332 3HG2 ILE 32 4.782 0.888 0.888 321 1HD1 ILE 332 1HD1 ILE 32 2.737 -1.476 -1.476 322 2HD1 ILE 332 3HD1 ILE 32 0.991 -1.348 -1.348 323 3HD1 ILE 332 2HD1 ILE 32 1.663 -2.566 -2.566 324 H ARG 333 H ARG 33 3.911 1.879 1.879 325 HA ARG 333 HA ARG 33 6.369 0.729 0.729 326 1HB ARG 333 2HB ARG 33 5.207 2.333 2.333 327 2HB ARG 333 1HB ARG 33 5.162 3.510 3.510 328 1HG ARG 333 2HG ARG 33 7.486 3.908 3.908 329 2HG ARG 333 1HG ARG 33 7.781 2.429 2.429 330 1HD ARG 333 2HD ARG 33 6.391 3.437 3.437 331 2HD ARG 333 1HD ARG 33 6.434 4.957 4.957 332 HE ARG 333 HE ARG 33 9.089 3.852 3.852 333 1HH1 ARG 333 1HH2 ARG 33 7.536 6.667 6.667 334 2HH1 ARG 333 2HH2 ARG 33 8.091 7.079 7.079 335 1HH2 ARG 333 2HH1 ARG 33 9.369 3.923 3.923 336 2HH2 ARG 333 1HH1 ARG 33 9.130 5.525 5.525 337 H GLY 334 H GLY 34 8.345 0.908 0.908 338 1HA GLY 334 2HA GLY 34 9.773 2.645 2.645 339 2HA GLY 334 1HA GLY 34 8.497 2.513 2.513 340 H ARG 335 H ARG 35 9.421 1.398 1.398 341 HA ARG 335 HA ARG 35 10.001 -1.402 -1.402 342 1HB ARG 335 2HB ARG 35 12.081 -0.263 -0.263 343 2HB ARG 335 1HB ARG 35 12.437 0.262 0.262 344 1HG ARG 335 2HG ARG 35 13.117 -1.804 -1.804 345 2HG ARG 335 1HG ARG 35 11.742 -2.580 -2.580 346 1HD ARG 335 2HD ARG 35 12.834 -2.601 -2.601 347 2HD ARG 335 1HD ARG 35 14.078 -1.477 -1.477 348 HE ARG 335 HE ARG 35 13.870 -4.233 -4.233 349 1HH1 ARG 335 1HH2 ARG 35 15.478 -2.583 -2.583 350 2HH1 ARG 335 2HH2 ARG 35 17.076 -2.890 -2.890 351 1HH2 ARG 335 2HH1 ARG 35 15.987 -4.219 -4.219 352 2HH2 ARG 335 1HH1 ARG 35 17.364 -3.815 -3.815 353 H GLU 336 H GLU 36 11.333 1.244 1.244 354 HA GLU 336 HA GLU 36 11.189 -0.099 -0.099 355 1HB GLU 336 2HB GLU 36 12.014 2.354 2.354 356 2HB GLU 336 1HB GLU 36 10.441 2.791 2.791 357 1HG GLU 336 2HG GLU 36 10.993 2.045 2.045 358 2HG GLU 336 1HG GLU 36 12.217 0.924 0.924 359 H ARG 337 H ARG 37 8.689 2.016 2.016 360 HA ARG 337 HA ARG 37 6.733 1.656 1.656 361 1HB ARG 337 2HB ARG 37 6.845 2.781 2.781 362 2HB ARG 337 1HB ARG 37 5.394 1.786 1.786 363 1HG ARG 337 2HG ARG 37 4.468 3.106 3.106 364 2HG ARG 337 1HG ARG 37 6.037 3.574 3.574 365 1HD ARG 337 2HD ARG 37 4.965 4.535 4.535 366 2HD ARG 337 1HD ARG 37 4.833 5.448 5.448 367 HE ARG 337 HE ARG 37 7.507 5.008 5.008 368 1HH1 ARG 337 2HH1 ARG 37 6.358 4.712 4.712 369 2HH1 ARG 337 1HH1 ARG 37 6.989 6.191 6.191 370 1HH2 ARG 337 1HH2 ARG 37 7.846 7.479 7.479 371 2HH2 ARG 337 2HH2 ARG 37 7.833 7.759 7.759 372 H PHE 338 H PHE 38 7.254 -0.202 -0.202 373 HA PHE 338 HA PHE 38 5.149 -2.078 -2.078 374 1HB PHE 338 2HB PHE 38 6.637 -1.886 -1.886 375 2HB PHE 338 1HB PHE 38 7.938 -2.629 -2.629 376 HD1 PHE 338 HD1 PHE 38 4.676 -3.178 -3.178 377 HD2 PHE 338 HD2 PHE 38 7.851 -4.983 -4.983 378 HE1 PHE 338 HE1 PHE 38 3.777 -5.426 -5.426 379 HE2 PHE 338 HE2 PHE 38 6.952 -7.232 -7.232 380 HZ PHE 338 HZ PHE 38 4.915 -7.454 -7.454 381 H GLU 339 H GLU 39 8.234 -1.836 -1.836 382 HA GLU 339 HA GLU 39 8.153 -4.512 -4.512 383 1HB GLU 339 2HB GLU 39 9.630 -2.008 -2.008 384 2HB GLU 339 1HB GLU 39 9.873 -3.601 -3.601 385 1HG GLU 339 2HG GLU 39 10.222 -4.330 -4.330 386 2HG GLU 339 1HG GLU 39 10.608 -2.623 -2.623 387 H MET 340 H MET 40 7.143 -1.294 -1.294 388 HA MET 340 HA MET 40 6.337 -2.094 -2.094 389 1HB MET 340 2HB MET 40 5.016 0.070 0.070 390 2HB MET 340 1HB MET 40 5.159 -0.012 -0.012 391 1HG MET 340 2HG MET 40 7.662 0.103 0.103 392 2HG MET 340 1HG MET 40 7.397 0.413 0.413 393 1HE MET 340 2HE MET 40 5.249 2.179 2.179 394 2HE MET 340 1HE MET 40 4.390 1.786 1.786 395 3HE MET 340 3HE MET 40 4.784 3.468 3.468 396 H PHE 341 H PHE 41 4.580 -1.941 -1.941 397 HA PHE 341 HA PHE 41 2.059 -2.812 -2.812 398 1HB PHE 341 2HB PHE 41 3.214 -2.660 -2.660 399 2HB PHE 341 1HB PHE 41 1.646 -3.416 -3.416 400 HD1 PHE 341 HD2 PHE 41 3.356 -0.410 -0.410 401 HD2 PHE 341 HD1 PHE 41 -0.073 -1.966 -1.966 402 HE1 PHE 341 HE2 PHE 41 2.291 1.829 1.829 403 HE2 PHE 341 HE1 PHE 41 -1.137 0.272 0.272 404 HZ PHE 341 HZ PHE 41 0.046 2.169 2.169 405 H ARG 342 H ARG 42 4.900 -4.448 -4.448 406 HA ARG 342 HA ARG 42 3.733 -7.033 -7.033 407 1HB ARG 342 2HB ARG 42 6.125 -6.082 -6.082 408 2HB ARG 342 1HB ARG 42 6.565 -6.742 -6.742 409 1HG ARG 342 2HG ARG 42 5.713 -8.945 -8.945 410 2HG ARG 342 1HG ARG 42 5.190 -8.300 -8.300 411 1HD ARG 342 2HD ARG 42 7.522 -7.752 -7.752 412 2HD ARG 342 1HD ARG 42 8.055 -8.370 -8.370 413 HE ARG 342 HE ARG 42 6.550 -10.365 -10.365 414 1HH1 ARG 342 1HH2 ARG 42 9.006 -10.919 -10.919 415 2HH1 ARG 342 2HH2 ARG 42 10.171 -11.303 -11.303 416 1HH2 ARG 342 2HH1 ARG 42 8.304 -9.937 -9.937 417 2HH2 ARG 342 1HH1 ARG 42 9.775 -10.744 -10.744 418 H GLU 343 H GLU 43 5.235 -5.439 -5.439 419 HA GLU 343 HA GLU 43 4.968 -7.773 -7.773 420 1HB GLU 343 2HB GLU 43 6.658 -5.924 -5.924 421 2HB GLU 343 1HB GLU 43 5.326 -4.882 -4.882 422 1HG GLU 343 2HG GLU 43 5.532 -5.717 -5.717 423 2HG GLU 343 1HG GLU 43 5.018 -7.283 -7.283 424 H LEU 344 H LEU 44 3.082 -4.817 -4.817 425 HA LEU 344 HA LEU 44 1.236 -5.090 -5.090 426 1HB LEU 344 2HB LEU 44 1.264 -3.736 -3.736 427 2HB LEU 344 1HB LEU 44 -0.335 -4.087 -4.087 428 HG LEU 344 HG LEU 44 0.126 -1.946 -1.946 429 1HD1 LEU 344 1HD1 LEU 44 -0.161 -3.998 -3.998 430 2HD1 LEU 344 3HD1 LEU 44 1.330 -3.258 -3.258 431 3HD1 LEU 344 2HD1 LEU 44 -0.142 -2.295 -2.295 432 1HD2 LEU 344 3HD2 LEU 44 2.493 -1.903 -1.903 433 2HD2 LEU 344 2HD2 LEU 44 2.301 -1.296 -1.296 434 3HD2 LEU 344 1HD2 LEU 44 2.915 -2.926 -2.926 435 H ASN 345 H ASN 45 0.892 -6.225 -6.225 436 HA ASN 345 HA ASN 45 -1.496 -7.738 -7.738 437 1HB ASN 345 2HB ASN 45 -1.385 -8.397 -8.397 438 2HB ASN 345 1HB ASN 45 -0.517 -6.867 -6.867 439 1HD2 ASN 345 2HD2 ASN 45 2.448 -8.358 -8.358 440 2HD2 ASN 345 1HD2 ASN 45 1.532 -6.945 -6.945 441 H GLU 346 H GLU 46 1.893 -8.407 -8.407 442 HA GLU 346 HA GLU 46 1.773 -11.272 -11.272 443 1HB GLU 346 2HB GLU 46 3.810 -9.530 -9.530 444 2HB GLU 346 1HB GLU 46 3.631 -9.980 -9.980 445 1HG GLU 346 2HG GLU 46 3.965 -12.299 -12.299 446 2HG GLU 346 1HG GLU 46 3.812 -12.026 -12.026 447 H ALA 347 H ALA 47 1.348 -8.947 -8.947 448 HA ALA 347 HA ALA 47 0.954 -10.988 -10.988 449 1HB ALA 347 1HB ALA 47 1.624 -8.649 -8.649 450 2HB ALA 347 3HB ALA 47 0.032 -8.099 -8.099 451 3HB ALA 347 2HB ALA 47 0.185 -9.150 -9.150 452 H LEU 348 H LEU 48 -1.332 -8.872 -8.872 453 HA LEU 348 HA LEU 48 -3.732 -9.817 -9.817 454 1HB LEU 348 2HB LEU 48 -3.191 -9.133 -9.133 455 2HB LEU 348 1HB LEU 48 -4.784 -9.214 -9.214 456 HG LEU 348 HG LEU 48 -2.578 -7.399 -7.399 457 1HD1 LEU 348 3HD1 LEU 48 -4.023 -7.164 -7.164 458 2HD1 LEU 348 2HD1 LEU 48 -4.780 -6.038 -6.038 459 3HD1 LEU 348 1HD1 LEU 48 -3.054 -5.919 -5.919 460 1HD2 LEU 348 3HD2 LEU 48 -4.985 -8.235 -8.235 461 2HD2 LEU 348 2HD2 LEU 48 -4.057 -6.811 -6.811 462 3HD2 LEU 348 1HD2 LEU 48 -5.371 -6.660 -6.660 463 H GLU 349 H GLU 49 -2.000 -11.150 -11.150 464 HA GLU 349 HA GLU 49 -3.734 -13.380 -13.380 465 1HB GLU 349 2HB GLU 49 -1.772 -12.459 -12.459 466 2HB GLU 349 1HB GLU 49 -0.777 -13.558 -13.558 467 1HG GLU 349 2HG GLU 49 -2.035 -15.462 -15.462 468 2HG GLU 349 1HG GLU 49 -3.317 -14.455 -14.455 469 H LEU 350 H LEU 50 -1.005 -12.825 -12.825 470 HA LEU 350 HA LEU 50 -0.647 -15.532 -15.532 471 1HB LEU 350 2HB LEU 50 0.962 -14.620 -14.620 472 2HB LEU 350 1HB LEU 50 0.563 -13.090 -13.090 473 HG LEU 350 HG LEU 50 -1.300 -12.968 -12.968 474 1HD1 LEU 350 1HD1 LEU 50 0.196 -15.338 -15.338 475 2HD1 LEU 350 3HD1 LEU 50 0.333 -14.138 -14.138 476 3HD1 LEU 350 2HD1 LEU 50 -1.258 -14.686 -14.686 477 1HD2 LEU 350 2HD2 LEU 50 1.618 -12.357 -12.357 478 2HD2 LEU 350 1HD2 LEU 50 0.238 -11.264 -11.264 479 3HD2 LEU 350 3HD2 LEU 50 0.721 -12.206 -12.206 480 H LYS 351 H LYS 51 -2.930 -13.021 -13.021 481 HA LYS 351 HA LYS 51 -3.988 -14.164 -14.164 482 1HB LYS 351 2HB LYS 51 -4.472 -11.850 -11.850 483 2HB LYS 351 1HB LYS 51 -5.609 -12.667 -12.667 484 1HG LYS 351 2HG LYS 51 -6.877 -13.508 -13.508 485 2HG LYS 351 1HG LYS 51 -5.689 -12.855 -12.855 486 1HD LYS 351 2HD LYS 51 -6.291 -10.618 -10.618 487 2HD LYS 351 1HD LYS 51 -7.837 -11.464 -11.464 488 1HE LYS 351 2HE LYS 51 -7.349 -11.824 -11.824 489 2HE LYS 351 1HE LYS 51 -6.359 -10.381 -10.381 490 1HZ LYS 351 2HZ LYS 51 -9.093 -10.433 -10.433 491 2HZ LYS 351 1HZ LYS 51 -8.862 -10.162 -10.162 492 3HZ LYS 351 3HZ LYS 51 -8.167 -9.109 -9.109 493 H ASP 352 H ASP 52 -4.928 -14.569 -14.569 494 HA ASP 352 HA ASP 52 -7.088 -16.366 -16.366 495 1HB ASP 352 2HB ASP 52 -5.799 -15.266 -15.266 496 2HB ASP 352 1HB ASP 52 -5.580 -17.008 -17.008 497 H ALA 353 H ALA 53 -3.619 -16.829 -16.829 498 HA ALA 353 HA ALA 53 -3.942 -19.776 -19.776 499 1HB ALA 353 3HB ALA 53 -2.088 -18.450 -18.450 500 2HB ALA 353 2HB ALA 53 -1.305 -18.358 -18.358 501 3HB ALA 353 1HB ALA 53 -1.655 -19.930 -19.930 502 H GLN 354 H GLN 54 -4.851 -17.964 -17.964 503 HA GLN 354 HA GLN 54 -3.000 -18.846 -18.846 504 1HB GLN 354 2HB GLN 54 -4.582 -16.417 -16.417 505 2HB GLN 354 1HB GLN 54 -4.813 -17.101 -17.101 506 1HG GLN 354 2HG GLN 54 -2.079 -17.319 -17.319 507 2HG GLN 354 1HG GLN 54 -2.466 -15.767 -15.767 508 1HE2 GLN 354 2HE2 GLN 54 -3.975 -14.650 -14.650 509 2HE2 GLN 354 1HE2 GLN 54 -4.557 -14.861 -14.861 510 H ALA 355 HN ALA 55 -3.973 -21.012 -21.012 511 HA ALA 355 HA ALA 55 -6.816 -21.325 -21.325 512 1HB ALA 355 1HB ALA 55 -5.351 -23.028 -23.028 513 2HB ALA 355 3HB ALA 55 -4.638 -23.395 -23.395 514 3HB ALA 355 2HB ALA 55 -6.356 -23.680 -23.680 515 1H GLY 325 3H GLY 25 10.776 -2.437 -2.437 516 2H GLY 325 2H GLY 25 10.823 -2.933 -2.933 517 3H GLY 325 1H GLY 25 12.265 -2.578 -2.578 518 1HA GLY 325 2HA GLY 25 12.156 -0.511 -0.511 519 2HA GLY 325 1HA GLY 25 10.571 -0.837 -0.837 520 H GLU 326 H GLU 26 9.227 0.753 0.753 521 HA GLU 326 HA GLU 26 8.906 1.061 1.061 522 1HB GLU 326 2HB GLU 26 10.354 2.940 2.940 523 2HB GLU 326 1HB GLU 26 8.783 3.674 3.674 524 1HG GLU 326 2HG GLU 26 9.216 3.908 3.908 525 2HG GLU 326 1HG GLU 26 9.929 2.299 2.299 526 H TYR 327 H TYR 27 7.058 3.063 3.063 527 HA TYR 327 HA TYR 27 4.839 1.908 1.908 528 1HB TYR 327 2HB TYR 27 5.039 3.251 3.251 529 2HB TYR 327 1HB TYR 27 3.567 3.532 3.532 530 HD1 TYR 327 HD1 TYR 27 5.800 0.813 0.813 531 HD2 TYR 327 HD2 TYR 27 1.868 1.898 1.898 532 HE1 TYR 327 HE1 TYR 27 4.956 -1.425 -1.425 533 HE2 TYR 327 HE2 TYR 27 1.024 -0.338 -0.338 534 HH TYR 327 HH TYR 27 1.588 -2.378 -2.378 535 H PHE 328 H PHE 28 4.182 3.058 3.058 536 HA PHE 328 HA PHE 28 4.725 6.001 6.001 537 1HB PHE 328 2HB PHE 28 4.673 3.986 3.986 538 2HB PHE 328 1HB PHE 28 4.644 5.728 5.728 539 HD1 PHE 328 HD1 PHE 28 6.577 7.129 7.129 540 HD2 PHE 328 HD2 PHE 28 6.651 2.885 2.885 541 HE1 PHE 328 HE1 PHE 28 9.039 7.216 7.216 542 HE2 PHE 328 HE2 PHE 28 9.113 2.971 2.971 543 HZ PHE 328 HZ PHE 28 10.308 5.137 5.137 544 H THR 329 H THR 29 3.097 7.296 7.296 545 HA THR 329 HA THR 29 0.393 6.019 6.019 546 HB THR 329 HB THR 29 0.496 8.953 8.953 547 HG1 THR 329 HG1 THR 29 1.273 8.917 8.917 548 1HG2 THR 329 2HG2 THR 29 -1.391 7.125 7.125 549 2HG2 THR 329 1HG2 THR 29 -0.696 7.126 7.126 550 3HG2 THR 329 3HG2 THR 29 -1.339 8.619 8.619 551 H LEU 330 H LEU 30 -0.903 6.286 6.286 552 HA LEU 330 HA LEU 30 0.219 7.950 7.950 553 1HB LEU 330 2HB LEU 30 -0.370 5.180 5.180 554 2HB LEU 330 1HB LEU 30 -1.623 5.935 5.935 555 HG LEU 330 HG LEU 30 1.188 6.819 6.819 556 1HD1 LEU 330 3HD1 LEU 30 0.071 4.124 4.124 557 2HD1 LEU 330 2HD1 LEU 30 1.445 4.877 4.877 558 3HD1 LEU 330 1HD1 LEU 30 1.555 4.444 4.444 559 1HD2 LEU 330 2HD2 LEU 30 -1.369 7.027 7.027 560 2HD2 LEU 330 1HD2 LEU 30 0.158 7.735 7.735 561 3HD2 LEU 330 3HD2 LEU 30 -0.311 6.130 6.130 562 H GLN 331 H GLN 31 -1.058 9.761 9.761 563 HA GLN 331 HA GLN 31 -3.965 9.481 9.481 564 1HB GLN 331 2HB GLN 31 -2.013 11.383 11.383 565 2HB GLN 331 1HB GLN 31 -3.165 12.221 12.221 566 1HG GLN 331 2HG GLN 31 -5.033 11.368 11.368 567 2HG GLN 331 1HG GLN 31 -3.911 10.459 10.459 568 1HE2 GLN 331 2HE2 GLN 31 -2.759 13.355 13.355 569 2HE2 GLN 331 1HE2 GLN 31 -2.336 11.775 11.775 570 H ILE 332 H ILE 32 -5.220 9.431 9.431 571 HA ILE 332 HA ILE 32 -4.331 10.983 10.983 572 HB ILE 332 HB ILE 32 -5.811 8.339 8.339 573 1HG1 ILE 332 2HG1 ILE 32 -3.393 8.634 8.634 574 2HG1 ILE 332 1HG1 ILE 32 -3.104 8.852 8.852 575 1HG2 ILE 332 2HG2 ILE 32 -5.404 10.329 10.329 576 2HG2 ILE 332 1HG2 ILE 32 -5.403 8.611 8.611 577 3HG2 ILE 332 3HG2 ILE 32 -6.818 9.340 9.340 578 1HD1 ILE 332 1HD1 ILE 32 -4.807 6.552 6.552 579 2HD1 ILE 332 3HD1 ILE 32 -3.061 6.430 6.430 580 3HD1 ILE 332 2HD1 ILE 32 -3.739 6.685 6.685 581 H ARG 333 H ARG 33 -5.919 12.264 12.264 582 HA ARG 333 HA ARG 33 -8.377 12.662 12.662 583 1HB ARG 333 2HB ARG 33 -7.189 14.683 14.683 584 2HB ARG 333 1HB ARG 33 -7.145 14.225 14.225 585 1HG ARG 333 2HG ARG 33 -9.464 14.566 14.566 586 2HG ARG 333 1HG ARG 33 -9.765 14.526 14.526 587 1HD ARG 333 2HD ARG 33 -8.354 16.631 16.631 588 2HD ARG 333 1HD ARG 33 -8.388 16.709 16.709 589 HE ARG 333 HE ARG 33 -11.052 16.462 16.462 590 1HH1 ARG 333 1HH2 ARG 33 -9.470 18.237 18.237 591 2HH1 ARG 333 2HH2 ARG 33 -10.012 19.797 19.797 592 1HH2 ARG 333 2HH1 ARG 33 -11.324 18.636 18.636 593 2HH2 ARG 333 1HH1 ARG 33 -11.061 20.023 20.023 594 H GLY 334 H GLY 34 -10.354 11.963 11.963 595 1HA GLY 334 2HA GLY 34 -11.784 11.840 11.840 596 2HA GLY 334 1HA GLY 34 -10.516 10.743 10.743 597 H ARG 335 H ARG 35 -11.469 8.746 8.746 598 HA ARG 335 HA ARG 35 -12.063 7.462 7.462 599 1HB ARG 335 2HB ARG 35 -14.126 8.942 8.942 600 2HB ARG 335 1HB ARG 35 -14.491 7.854 7.854 601 1HG ARG 335 2HG ARG 35 -15.187 6.206 6.206 602 2HG ARG 335 1HG ARG 35 -13.818 6.438 6.438 603 1HD ARG 335 2HD ARG 35 -14.907 8.209 8.209 604 2HD ARG 335 1HD ARG 35 -16.137 8.372 8.372 605 HE ARG 335 HE ARG 35 -15.966 5.913 5.913 606 1HH1 ARG 335 1HH2 ARG 35 -17.541 8.838 8.838 607 2HH1 ARG 335 2HH2 ARG 35 -19.146 8.190 8.190 608 1HH2 ARG 335 2HH1 ARG 35 -18.089 4.930 4.930 609 2HH2 ARG 335 1HH1 ARG 35 -19.456 5.978 5.978 610 H GLU 336 H GLU 36 -13.389 7.220 7.220 611 HA GLU 336 HA GLU 36 -13.270 4.426 4.426 612 1HB GLU 336 2HB GLU 36 -14.066 6.358 6.358 613 2HB GLU 336 1HB GLU 36 -12.491 6.024 6.024 614 1HG GLU 336 2HG GLU 36 -13.052 3.831 3.831 615 2HG GLU 336 1HG GLU 36 -14.286 3.726 3.726 616 H ARG 337 H ARG 37 -10.747 6.782 6.782 617 HA ARG 337 HA ARG 37 -8.802 4.873 4.873 618 1HB ARG 337 2HB ARG 37 -8.897 7.701 7.701 619 2HB ARG 337 1HB ARG 37 -7.460 7.044 7.044 620 1HG ARG 337 2HG ARG 37 -6.510 6.363 6.363 621 2HG ARG 337 1HG ARG 37 -8.071 6.081 6.081 622 1HD ARG 337 2HD ARG 37 -6.974 8.831 8.831 623 2HD ARG 337 1HD ARG 37 -6.842 8.063 8.063 624 HE ARG 337 HE ARG 37 -9.519 7.938 7.938 625 1HH1 ARG 337 2HH1 ARG 37 -8.354 10.286 10.286 626 2HH1 ARG 337 1HH1 ARG 37 -8.970 11.637 11.637 627 1HH2 ARG 337 1HH2 ARG 37 -9.834 9.749 9.749 628 2HH2 ARG 337 2HH2 ARG 37 -9.809 11.334 11.334 629 H PHE 338 H PHE 38 -9.352 6.388 6.388 630 HA PHE 338 HA PHE 38 -7.254 5.120 5.120 631 1HB PHE 338 2HB PHE 38 -8.726 6.901 6.901 632 2HB PHE 338 1HB PHE 38 -10.036 5.725 5.725 633 HD1 PHE 338 HD1 PHE 38 -6.765 6.744 6.744 634 HD2 PHE 338 HD2 PHE 38 -9.972 3.898 3.898 635 HE1 PHE 338 HE1 PHE 38 -5.881 5.950 5.950 636 HE2 PHE 338 HE2 PHE 38 -9.089 3.106 3.106 637 HZ PHE 338 HZ PHE 38 -7.044 4.132 4.132 638 H GLU 339 H GLU 39 -10.343 3.862 3.862 639 HA GLU 339 HA GLU 39 -10.281 1.470 1.470 640 1HB GLU 339 2HB GLU 39 -11.739 2.104 2.104 641 2HB GLU 339 1HB GLU 39 -11.996 0.641 0.641 642 1HG GLU 339 2HG GLU 39 -12.347 2.363 2.363 643 2HG GLU 339 1HG GLU 39 -12.709 3.478 3.478 644 H MET 340 H MET 40 -9.246 2.265 2.265 645 HA MET 340 HA MET 40 -8.451 -0.380 -0.380 646 1HB MET 340 2HB MET 40 -7.104 2.173 2.173 647 2HB MET 340 1HB MET 40 -7.257 0.656 0.656 648 1HG MET 340 2HG MET 40 -9.760 0.980 0.980 649 2HG MET 340 1HG MET 40 -9.479 2.586 2.586 650 1HE MET 340 2HE MET 40 -7.310 3.991 3.991 651 2HE MET 340 1HE MET 40 -6.465 2.519 2.519 652 3HE MET 340 3HE MET 40 -6.837 3.753 3.753 653 H PHE 341 H PHE 41 -6.691 2.278 2.278 654 HA PHE 341 HA PHE 41 -4.181 0.856 0.856 655 1HB PHE 341 2HB PHE 41 -5.312 3.285 3.285 656 2HB PHE 341 1HB PHE 41 -3.759 2.611 2.611 657 HD1 PHE 341 HD2 PHE 41 -5.428 3.035 3.035 658 HD2 PHE 341 HD1 PHE 41 -2.017 3.890 3.890 659 HE1 PHE 341 HE2 PHE 41 -4.327 4.165 4.165 660 HE2 PHE 341 HE1 PHE 41 -0.917 5.019 5.019 661 HZ PHE 341 HZ PHE 41 -2.072 5.158 5.158 662 H ARG 342 H ARG 42 -7.025 1.069 1.069 663 HA ARG 342 HA ARG 42 -5.891 -0.073 -0.073 664 1HB ARG 342 2HB ARG 42 -8.271 0.996 0.996 665 2HB ARG 342 1HB ARG 42 -8.719 -0.682 -0.682 666 1HG ARG 342 2HG ARG 42 -7.891 -1.345 -1.345 667 2HG ARG 342 1HG ARG 42 -7.352 0.304 0.304 668 1HD ARG 342 2HD ARG 42 -9.673 1.107 1.107 669 2HD ARG 342 1HD ARG 42 -10.223 -0.535 -0.535 670 HE ARG 342 HE ARG 42 -8.732 -0.412 -0.412 671 1HH1 ARG 342 1HH2 ARG 42 -11.197 -2.061 -2.061 672 2HH1 ARG 342 2HH2 ARG 42 -12.364 -1.234 -1.234 673 1HH2 ARG 342 2HH1 ARG 42 -10.476 1.663 1.663 674 2HH2 ARG 342 1HH1 ARG 42 -11.956 0.875 0.875 675 H GLU 343 H GLU 43 -7.380 -1.533 -1.533 676 HA GLU 343 HA GLU 43 -7.140 -4.248 -4.248 677 1HB GLU 343 2HB GLU 43 -8.811 -3.495 -3.495 678 2HB GLU 343 1HB GLU 43 -7.469 -3.365 -3.365 679 1HG GLU 343 2HG GLU 43 -7.696 -5.559 -5.559 680 2HG GLU 343 1HG GLU 43 -7.199 -5.892 -5.892 681 H LEU 344 H LEU 44 -5.221 -2.172 -2.172 682 HA LEU 344 HA LEU 44 -3.392 -4.126 -4.126 683 1HB LEU 344 2HB LEU 44 -3.387 -1.173 -1.173 684 2HB LEU 344 1HB LEU 44 -1.796 -1.918 -1.918 685 HG LEU 344 HG LEU 44 -2.220 -1.466 -1.466 686 1HD1 LEU 344 1HD1 LEU 44 -2.025 -4.074 -4.074 687 2HD1 LEU 344 3HD1 LEU 44 -3.530 -4.112 -4.112 688 3HD1 LEU 344 2HD1 LEU 44 -2.049 -3.529 -3.529 689 1HD2 LEU 344 3HD2 LEU 44 -4.578 -0.771 -0.771 690 2HD2 LEU 344 2HD2 LEU 44 -4.390 -1.788 -1.788 691 3HD2 LEU 344 1HD2 LEU 44 -5.056 -2.469 -2.469 692 H ASN 345 H ASN 45 -3.041 -1.933 -1.933 693 HA ASN 345 HA ASN 45 -0.671 -3.255 -3.255 694 1HB ASN 345 2HB ASN 45 -0.764 -1.758 -1.758 695 2HB ASN 345 1HB ASN 45 -1.582 -0.864 -0.864 696 1HD2 ASN 345 2HD2 ASN 45 -4.589 -0.654 -0.654 697 2HD2 ASN 345 1HD2 ASN 45 -3.642 -0.089 -0.089 698 H GLU 346 H GLU 46 -4.070 -3.919 -3.919 699 HA GLU 346 HA GLU 46 -3.980 -5.409 -5.409 700 1HB GLU 346 2HB GLU 46 -6.000 -4.631 -4.631 701 2HB GLU 346 1HB GLU 46 -5.838 -6.297 -6.297 702 1HG GLU 346 2HG GLU 46 -6.193 -7.158 -7.158 703 2HG GLU 346 1HG GLU 46 -6.030 -5.556 -5.556 704 H ALA 347 H ALA 47 -3.540 -6.360 -6.360 705 HA ALA 347 HA ALA 47 -3.187 -9.164 -9.164 706 1HB ALA 347 1HB ALA 47 -3.858 -8.358 -8.358 707 2HB ALA 347 3HB ALA 47 -2.279 -7.594 -7.594 708 3HB ALA 347 2HB ALA 47 -2.403 -9.350 -9.350 709 H LEU 348 H LEU 48 -0.871 -6.538 -6.538 710 HA LEU 348 HA LEU 48 1.512 -8.004 -8.004 711 1HB LEU 348 2HB LEU 48 1.004 -5.188 -5.188 712 2HB LEU 348 1HB LEU 48 2.588 -5.885 -5.885 713 HG LEU 348 HG LEU 48 0.390 -5.701 -5.701 714 1HD1 LEU 348 3HD1 LEU 48 1.855 -3.572 -3.572 715 2HD1 LEU 348 2HD1 LEU 48 2.623 -3.911 -3.911 716 3HD1 LEU 348 1HD1 LEU 48 0.901 -3.537 -3.537 717 1HD2 LEU 348 3HD2 LEU 48 2.772 -7.144 -7.144 718 2HD2 LEU 348 2HD2 LEU 48 1.860 -6.746 -6.746 719 3HD2 LEU 348 1HD2 LEU 48 3.187 -5.708 -5.708 720 H GLU 349 H GLU 49 -0.222 -6.343 -6.343 721 HA GLU 349 HA GLU 49 1.489 -7.250 -7.250 722 1HB GLU 349 2HB GLU 49 -0.458 -5.487 -5.487 723 2HB GLU 349 1HB GLU 49 -1.469 -6.880 -6.880 724 1HG GLU 349 2HG GLU 49 -0.230 -7.346 -7.346 725 2HG GLU 349 1HG GLU 49 1.066 -6.246 -6.246 726 H LEU 350 H LEU 50 -1.241 -8.735 -8.735 727 HA LEU 350 HA LEU 50 -1.628 -10.915 -10.915 728 1HB LEU 350 2HB LEU 50 -3.237 -11.512 -11.512 729 2HB LEU 350 1HB LEU 50 -2.823 -10.035 -10.035 730 HG LEU 350 HG LEU 50 -0.971 -11.549 -11.549 731 1HD1 LEU 350 1HD1 LEU 50 -2.510 -13.417 -13.417 732 2HD1 LEU 350 3HD1 LEU 50 -2.617 -13.832 -13.832 733 3HD1 LEU 350 2HD1 LEU 50 -1.041 -13.701 -13.701 734 1HD2 LEU 350 2HD2 LEU 50 -3.884 -11.257 -11.257 735 2HD2 LEU 350 1HD2 LEU 50 -2.494 -10.756 -10.756 736 3HD2 LEU 350 3HD2 LEU 50 -2.998 -12.446 -12.446 737 H LYS 351 H LYS 51 0.680 -10.292 -10.292 738 HA LYS 351 HA LYS 51 1.712 -12.929 -12.929 739 1HB LYS 351 2HB LYS 51 2.221 -10.838 -10.838 740 2HB LYS 351 1HB LYS 51 3.356 -10.392 -10.392 741 1HG LYS 351 2HG LYS 51 4.607 -12.452 -12.452 742 2HG LYS 351 1HG LYS 51 3.420 -13.028 -13.028 743 1HD LYS 351 2HD LYS 51 4.051 -10.613 -10.613 744 2HD LYS 351 1HD LYS 51 5.589 -11.042 -11.042 745 1HE LYS 351 2HE LYS 51 5.084 -13.399 -13.399 746 2HE LYS 351 1HE LYS 51 4.106 -12.416 -12.416 747 1HZ LYS 351 2HZ LYS 51 6.845 -11.565 -11.565 748 2HZ LYS 351 1HZ LYS 51 6.609 -12.809 -12.809 749 3HZ LYS 351 3HZ LYS 51 5.926 -11.280 -11.280 750 H ASP 352 H ASP 52 2.673 -10.299 -10.299 751 HA ASP 352 HA ASP 52 4.805 -11.683 -11.683 752 1HB ASP 352 2HB ASP 52 3.529 -9.204 -9.204 753 2HB ASP 352 1HB ASP 52 3.299 -10.006 -10.006 754 H ALA 353 H ALA 53 1.330 -11.908 -11.908 755 HA ALA 353 HA ALA 53 1.620 -13.610 -13.610 756 1HB ALA 353 3HB ALA 53 -0.213 -11.767 -11.767 757 2HB ALA 353 2HB ALA 53 -1.003 -13.036 -13.036 758 3HB ALA 353 1HB ALA 53 -0.664 -13.284 -13.284 759 H GLN 354 H GLN 54 2.543 -14.469 -14.469 760 HA GLN 354 HA GLN 54 0.669 -16.750 -16.750 761 1HB GLN 354 2HB GLN 54 2.280 -15.055 -15.055 762 2HB GLN 354 1HB GLN 54 2.490 -16.778 -16.778 763 1HG GLN 354 2HG GLN 54 -0.245 -16.538 -16.538 764 2HG GLN 354 1HG GLN 54 0.167 -15.072 -15.072 765 1HE2 GLN 354 2HE2 GLN 54 1.667 -17.181 -17.181 766 2HE2 GLN 354 1HE2 GLN 54 2.255 -15.981 -15.981 767 H ALA 355 HN ALA 55 1.623 -17.890 -17.890 768 HA ALA 355 HA ALA 55 4.457 -18.557 -18.557 769 1HB ALA 355 1HB ALA 55 2.978 -18.467 -18.467 770 2HB ALA 355 3HB ALA 55 2.252 -19.977 -19.977 771 3HB ALA 355 2HB ALA 55 3.969 -19.919 -19.919 772 1H GLY 325 3H GLY 25 -14.586 14.528 14.528 773 2H GLY 325 2H GLY 25 -14.436 13.436 13.436 774 3H GLY 325 1H GLY 25 -15.974 13.855 13.855 775 1HA GLY 325 2HA GLY 25 -15.909 12.106 12.106 776 2HA GLY 325 1HA GLY 25 -14.237 11.795 11.795 777 H GLU 326 H GLU 26 -13.091 11.607 11.607 778 HA GLU 326 HA GLU 26 -13.131 13.905 13.905 779 1HB GLU 326 2HB GLU 26 -14.501 11.499 11.499 780 2HB GLU 326 1HB GLU 26 -13.026 11.462 11.462 781 1HG GLU 326 2HG GLU 26 -13.727 13.149 13.149 782 2HG GLU 326 1HG GLU 26 -14.342 14.088 14.088 783 H TYR 327 H TYR 27 -11.430 13.001 13.001 784 HA TYR 327 HA TYR 27 -8.970 12.418 12.418 785 1HB TYR 327 2HB TYR 27 -9.560 13.900 13.900 786 2HB TYR 327 1HB TYR 27 -8.011 13.061 13.061 787 HD1 TYR 327 HD1 TYR 27 -10.195 15.455 15.455 788 HD2 TYR 327 HD2 TYR 27 -6.213 13.984 13.984 789 HE1 TYR 327 HE1 TYR 27 -9.291 17.275 17.275 790 HE2 TYR 327 HE2 TYR 27 -5.308 15.802 15.802 791 HH TYR 327 HH TYR 27 -5.816 17.470 17.470 792 H PHE 328 H PHE 28 -8.182 10.374 10.374 793 HA PHE 328 HA PHE 28 -8.906 8.724 8.724 794 1HB PHE 328 2HB PHE 28 -8.460 7.948 7.948 795 2HB PHE 328 1HB PHE 28 -8.507 6.765 6.765 796 HD1 PHE 328 HD1 PHE 28 -10.574 6.332 6.332 797 HD2 PHE 328 HD2 PHE 28 -10.459 9.178 9.178 798 HE1 PHE 328 HE1 PHE 28 -13.054 6.363 6.363 799 HE2 PHE 328 HE2 PHE 28 -12.938 9.208 9.208 800 HZ PHE 328 HZ PHE 28 -14.235 7.801 7.801 801 H THR 329 H THR 29 -7.231 7.121 7.121 802 HA THR 329 HA THR 29 -4.486 8.092 8.092 803 HB THR 329 HB THR 29 -4.792 6.664 6.664 804 HG1 THR 329 HG1 THR 29 -5.798 8.410 8.410 805 1HG2 THR 329 2HG2 THR 29 -2.856 8.126 8.126 806 2HG2 THR 329 1HG2 THR 29 -3.732 9.440 9.440 807 3HG2 THR 329 3HG2 THR 29 -3.109 8.100 8.100 808 H LEU 330 H LEU 30 -3.008 6.534 6.534 809 HA LEU 330 HA LEU 30 -3.961 3.697 3.697 810 1HB LEU 330 2HB LEU 30 -3.215 5.291 5.291 811 2HB LEU 330 1HB LEU 30 -1.902 4.139 4.139 812 HG LEU 330 HG LEU 30 -4.690 3.094 3.094 813 1HD1 LEU 330 3HD1 LEU 30 -3.314 3.949 3.949 814 2HD1 LEU 330 2HD1 LEU 30 -4.634 2.781 2.781 815 3HD1 LEU 330 1HD1 LEU 30 -4.906 4.439 4.439 816 1HD2 LEU 330 2HD2 LEU 30 -2.018 2.101 2.101 817 2HD2 LEU 330 1HD2 LEU 30 -3.512 1.174 1.174 818 3HD2 LEU 330 3HD2 LEU 30 -2.882 1.607 1.607 819 H GLN 331 H GLN 31 -2.897 3.449 3.449 820 HA GLN 331 HA GLN 31 -0.019 3.938 3.938 821 1HB GLN 331 2HB GLN 31 -2.166 3.472 3.472 822 2HB GLN 331 1HB GLN 31 -0.951 2.223 2.223 823 1HG GLN 331 2HG GLN 31 0.793 3.929 3.929 824 2HG GLN 331 1HG GLN 31 -0.381 5.199 5.199 825 1HE2 GLN 331 2HE2 GLN 31 -1.915 5.025 5.025 826 2HE2 GLN 331 1HE2 GLN 31 -2.180 5.478 5.478 827 H ILE 332 H ILE 32 1.438 2.561 2.561 828 HA ILE 332 HA ILE 32 0.742 -0.349 -0.349 829 HB ILE 332 HB ILE 32 2.353 1.301 1.301 830 1HG1 ILE 332 2HG1 ILE 32 0.134 -0.406 -0.406 831 2HG1 ILE 332 1HG1 ILE 32 -0.369 0.900 0.900 832 1HG2 ILE 332 2HG2 ILE 32 2.086 -1.654 -1.654 833 2HG2 ILE 332 1HG2 ILE 32 2.243 -1.047 -1.047 834 3HG2 ILE 332 3HG2 ILE 32 3.508 -0.720 -0.720 835 1HD1 ILE 332 1HD1 ILE 32 1.559 1.530 1.530 836 2HD1 ILE 332 3HD1 ILE 32 -0.142 1.310 1.310 837 3HD1 ILE 332 2HD1 ILE 32 0.333 2.559 2.559 838 H ARG 333 H ARG 33 2.344 -1.767 -1.767 839 HA ARG 333 HA ARG 33 4.572 -0.495 -0.495 840 1HB ARG 333 2HB ARG 33 3.337 -2.157 -2.157 841 2HB ARG 333 1HB ARG 33 3.518 -3.335 -3.335 842 1HG ARG 333 2HG ARG 33 5.828 -3.606 -3.606 843 2HG ARG 333 1HG ARG 33 5.930 -2.110 -2.110 844 1HD ARG 333 2HD ARG 33 4.381 -3.190 -3.190 845 2HD ARG 333 1HD ARG 33 4.610 -4.706 -4.706 846 HE ARG 333 HE ARG 33 7.139 -3.462 -3.462 847 1HH1 ARG 333 1HH2 ARG 33 5.714 -6.358 -6.358 848 2HH1 ARG 333 2HH2 ARG 33 6.096 -6.734 -6.734 849 1HH2 ARG 333 2HH1 ARG 33 7.121 -3.515 -3.515 850 2HH2 ARG 333 1HH1 ARG 33 6.892 -5.126 -5.126 851 H GLY 334 H GLY 34 6.660 -0.569 -0.569 852 1HA GLY 334 2HA GLY 34 8.332 -2.216 -2.216 853 2HA GLY 334 1HA GLY 34 7.211 -2.156 -2.156 854 H ARG 335 H ARG 35 8.280 -0.996 -0.996 855 HA ARG 335 HA ARG 35 8.655 1.838 1.838 856 1HB ARG 335 2HB ARG 35 10.661 0.817 0.817 857 2HB ARG 335 1HB ARG 35 11.244 0.317 0.317 858 1HG ARG 335 2HG ARG 35 11.872 2.421 2.421 859 2HG ARG 335 1HG ARG 35 10.371 3.114 3.114 860 1HD ARG 335 2HD ARG 35 11.200 3.200 3.200 861 2HD ARG 335 1HD ARG 35 12.557 2.141 2.141 862 HE ARG 335 HE ARG 35 12.349 4.882 4.882 863 1HH1 ARG 335 1HH2 ARG 35 13.735 3.316 3.316 864 2HH1 ARG 335 2HH2 ARG 35 15.376 3.702 3.702 865 1HH2 ARG 335 2HH1 ARG 35 14.594 4.974 4.974 866 2HH2 ARG 335 1HH1 ARG 35 15.862 4.641 4.641 867 H GLU 336 H GLU 36 10.372 -0.726 -0.726 868 HA GLU 336 HA GLU 36 10.454 0.609 0.609 869 1HB GLU 336 2HB GLU 36 11.323 -1.796 -1.796 870 2HB GLU 336 1HB GLU 36 9.866 -2.318 -2.318 871 1HG GLU 336 2HG GLU 36 10.619 -1.539 -1.539 872 2HG GLU 336 1HG GLU 36 11.706 -0.356 -0.356 873 H ARG 337 H ARG 37 7.920 -1.647 -1.647 874 HA ARG 337 HA ARG 37 6.205 -1.390 -1.390 875 1HB ARG 337 2HB ARG 37 6.062 -2.523 -2.523 876 2HB ARG 337 1HB ARG 37 4.589 -1.597 -1.597 877 1HG ARG 337 2HG ARG 37 3.921 -2.945 -2.945 878 2HG ARG 337 1HG ARG 37 5.576 -3.338 -3.338 879 1HD ARG 337 2HD ARG 37 4.243 -4.359 -4.359 880 2HD ARG 337 1HD ARG 37 4.337 -5.273 -5.273 881 HE ARG 337 HE ARG 37 6.955 -4.709 -4.709 882 1HH1 ARG 337 2HH1 ARG 37 5.430 -4.463 -4.463 883 2HH1 ARG 337 1HH1 ARG 37 6.061 -5.903 -5.903 884 1HH2 ARG 337 1HH2 ARG 37 7.364 -7.145 -7.145 885 2HH2 ARG 337 2HH2 ARG 37 7.157 -7.422 -7.422 886 H PHE 338 H PHE 38 6.280 0.487 0.487 887 HA PHE 338 HA PHE 38 4.120 2.217 2.217 888 1HB PHE 338 2HB PHE 38 5.357 2.134 2.134 889 2HB PHE 338 1HB PHE 38 6.716 2.947 2.947 890 HD1 PHE 338 HD1 PHE 38 3.251 3.316 3.316 891 HD2 PHE 338 HD2 PHE 38 6.576 5.291 5.291 892 HE1 PHE 338 HE1 PHE 38 2.170 5.513 5.513 893 HE2 PHE 338 HE2 PHE 38 5.494 7.487 7.487 894 HZ PHE 338 HZ PHE 38 3.292 7.598 7.598 895 H GLU 339 H GLU 39 7.388 2.186 2.186 896 HA GLU 339 HA GLU 39 7.282 4.849 4.849 897 1HB GLU 339 2HB GLU 39 8.991 2.437 2.437 898 2HB GLU 339 1HB GLU 39 9.228 4.046 4.046 899 1HG GLU 339 2HG GLU 39 9.231 4.784 4.784 900 2HG GLU 339 1HG GLU 39 9.678 3.098 3.098 901 H MET 340 H MET 40 6.594 1.581 1.581 902 HA MET 340 HA MET 40 6.061 2.344 2.344 903 1HB MET 340 2HB MET 40 4.669 0.108 0.108 904 2HB MET 340 1HB MET 40 5.017 0.202 0.202 905 1HG MET 340 2HG MET 40 7.472 0.222 0.222 906 2HG MET 340 1HG MET 40 7.019 -0.104 -0.104 907 1HE MET 340 2HE MET 40 4.918 -1.988 -1.988 908 2HE MET 340 1HE MET 40 4.227 -1.633 -1.633 909 3HE MET 340 3HE MET 40 4.659 -3.295 -3.295 910 H PHE 341 H PHE 41 3.961 2.096 2.096 911 HA PHE 341 HA PHE 41 1.549 2.832 2.832 912 1HB PHE 341 2HB PHE 41 2.362 2.734 2.734 913 2HB PHE 341 1HB PHE 41 0.808 3.417 3.417 914 HD1 PHE 341 HD2 PHE 41 2.818 0.499 0.499 915 HD2 PHE 341 HD1 PHE 41 -0.901 1.884 1.884 916 HE1 PHE 341 HE2 PHE 41 1.877 -1.787 -1.787 917 HE2 PHE 341 HE1 PHE 41 -1.842 -0.400 -0.400 918 HZ PHE 341 HZ PHE 41 -0.454 -2.236 -2.236 919 H ARG 342 H ARG 42 4.124 4.616 4.616 920 HA ARG 342 HA ARG 42 2.791 7.138 7.138 921 1HB ARG 342 2HB ARG 42 5.138 6.316 6.316 922 2HB ARG 342 1HB ARG 42 5.725 7.001 7.001 923 1HG ARG 342 2HG ARG 42 4.683 9.151 9.151 924 2HG ARG 342 1HG ARG 42 4.007 8.478 8.478 925 1HD ARG 342 2HD ARG 42 6.279 8.057 8.057 926 2HD ARG 342 1HD ARG 42 6.964 8.711 8.711 927 HE ARG 342 HE ARG 42 5.183 10.612 10.612 928 1HH1 ARG 342 1HH2 ARG 42 7.783 11.300 11.300 929 2HH1 ARG 342 2HH2 ARG 42 8.772 11.744 11.744 930 1HH2 ARG 342 2HH1 ARG 42 6.685 10.279 10.279 931 2HH2 ARG 342 1HH1 ARG 42 8.151 11.166 11.166 932 H GLU 343 H GLU 43 4.696 5.621 5.621 933 HA GLU 343 HA GLU 43 4.513 7.936 7.936 934 1HB GLU 343 2HB GLU 43 6.322 6.175 6.175 935 2HB GLU 343 1HB GLU 43 5.116 5.067 5.067 936 1HG GLU 343 2HG GLU 43 5.533 5.913 5.913 937 2HG GLU 343 1HG GLU 43 4.860 7.448 7.448 938 H LEU 344 H LEU 44 2.727 4.885 4.885 939 HA LEU 344 HA LEU 44 1.144 5.064 5.064 940 1HB LEU 344 2HB LEU 44 0.930 3.700 3.700 941 2HB LEU 344 1HB LEU 44 -0.607 3.989 3.989 942 HG LEU 344 HG LEU 44 0.003 1.883 1.883 943 1HD1 LEU 344 1HD1 LEU 44 -0.111 3.917 3.917 944 2HD1 LEU 344 3HD1 LEU 44 1.483 3.264 3.264 945 3HD1 LEU 344 2HD1 LEU 44 0.065 2.224 2.224 946 1HD2 LEU 344 3HD2 LEU 44 2.267 1.888 1.888 947 2HD2 LEU 344 2HD2 LEU 44 2.277 1.260 1.260 948 3HD2 LEU 344 1HD2 LEU 44 2.836 2.902 2.902 949 H ASN 345 H ASN 45 0.326 6.183 6.183 950 HA ASN 345 HA ASN 45 -2.047 7.570 7.570 951 1HB ASN 345 2HB ASN 45 -2.261 8.268 8.268 952 2HB ASN 345 1HB ASN 45 -1.356 6.764 6.764 953 1HD2 ASN 345 2HD2 ASN 45 1.394 8.356 8.356 954 2HD2 ASN 345 1HD2 ASN 45 0.569 6.910 6.910 955 H GLU 346 H GLU 46 1.324 8.415 8.415 956 HA GLU 346 HA GLU 46 1.041 11.270 11.270 957 1HB GLU 346 2HB GLU 46 3.182 9.638 9.638 958 2HB GLU 346 1HB GLU 46 3.191 10.080 10.080 959 1HG GLU 346 2HG GLU 46 3.336 12.413 12.413 960 2HG GLU 346 1HG GLU 46 2.988 12.127 12.127 961 H ALA 347 H ALA 47 1.048 8.920 8.920 962 HA ALA 347 HA ALA 47 0.805 10.935 10.935 963 1HB ALA 347 1HB ALA 47 1.658 8.642 8.642 964 2HB ALA 347 3HB ALA 47 0.052 7.998 7.998 965 3HB ALA 347 2HB ALA 47 0.301 9.054 9.054 966 H LEU 348 H LEU 48 -1.565 8.698 8.698 967 HA LEU 348 HA LEU 48 -3.864 9.518 9.518 968 1HB LEU 348 2HB LEU 48 -3.640 8.868 8.868 969 2HB LEU 348 1HB LEU 48 -5.132 8.859 8.859 970 HG LEU 348 HG LEU 48 -2.725 7.168 7.168 971 1HD1 LEU 348 3HD1 LEU 48 -4.446 6.851 6.851 972 2HD1 LEU 348 2HD1 LEU 48 -4.990 5.686 5.686 973 3HD1 LEU 348 1HD1 LEU 48 -3.317 5.663 5.663 974 1HD2 LEU 348 3HD2 LEU 48 -5.013 7.872 7.872 975 2HD2 LEU 348 2HD2 LEU 48 -3.963 6.497 6.497 976 3HD2 LEU 348 1HD2 LEU 48 -5.401 6.281 6.281 977 H GLU 349 H GLU 49 -2.550 10.938 10.938 978 HA GLU 349 HA GLU 49 -4.430 13.073 13.073 979 1HB GLU 349 2HB GLU 49 -2.612 12.260 12.260 980 2HB GLU 349 1HB GLU 49 -1.572 13.412 13.412 981 1HG GLU 349 2HG GLU 49 -3.006 15.245 15.245 982 2HG GLU 349 1HG GLU 49 -4.303 14.169 14.169 983 H LEU 350 H LEU 50 -1.435 12.676 12.676 984 HA LEU 350 HA LEU 50 -1.128 15.401 15.401 985 1HB LEU 350 2HB LEU 50 0.668 14.578 14.578 986 2HB LEU 350 1HB LEU 50 0.269 13.030 13.030 987 HG LEU 350 HG LEU 50 -1.360 12.800 12.800 988 1HD1 LEU 350 1HD1 LEU 50 0.095 15.239 15.239 989 2HD1 LEU 350 3HD1 LEU 50 0.418 14.029 14.029 990 3HD1 LEU 350 2HD1 LEU 50 -1.242 14.516 14.516 991 1HD2 LEU 350 2HD2 LEU 50 1.576 12.342 12.342 992 2HD2 LEU 350 1HD2 LEU 50 0.274 11.178 11.178 993 3HD2 LEU 350 3HD2 LEU 50 0.869 12.139 12.139 994 H LYS 351 H LYS 51 -3.158 12.774 12.774 995 HA LYS 351 HA LYS 51 -3.984 13.861 13.861 996 1HB LYS 351 2HB LYS 51 -4.455 11.524 11.524 997 2HB LYS 351 1HB LYS 51 -5.758 12.273 12.273 998 1HG LYS 351 2HG LYS 51 -6.828 13.044 13.044 999 2HG LYS 351 1HG LYS 51 -5.477 12.456 12.456 1000 1HD LYS 351 2HD LYS 51 -6.128 10.192 10.192 1001 2HD LYS 351 1HD LYS 51 -7.713 10.953 10.953 1002 1HE LYS 351 2HE LYS 51 -6.935 11.337 11.337 1003 2HE LYS 351 1HE LYS 51 -5.902 9.951 9.951 1004 1HZ LYS 351 2HZ LYS 51 -8.743 9.850 9.850 1005 2HZ LYS 351 1HZ LYS 51 -8.305 9.598 9.598 1006 3HZ LYS 351 3HZ LYS 51 -7.688 8.582 8.582 1007 H ASP 352 H ASP 52 -5.348 14.217 14.217 1008 HA ASP 352 HA ASP 52 -7.533 15.893 15.893 1009 1HB ASP 352 2HB ASP 52 -6.464 14.862 14.862 1010 2HB ASP 352 1HB ASP 52 -6.366 16.612 16.612 1011 H ALA 353 H ALA 53 -4.121 16.535 16.535 1012 HA ALA 353 HA ALA 53 -4.582 19.464 19.464 1013 1HB ALA 353 3HB ALA 53 -2.834 18.230 18.230 1014 2HB ALA 353 2HB ALA 53 -1.860 18.191 18.191 1015 3HB ALA 353 1HB ALA 53 -2.382 19.737 19.737 1016 H GLN 354 H GLN 54 -5.117 17.612 17.612 1017 HA GLN 354 HA GLN 54 -3.057 18.611 18.611 1018 1HB GLN 354 2HB GLN 54 -4.475 16.070 16.070 1019 2HB GLN 354 1HB GLN 54 -4.616 16.740 16.740 1020 1HG GLN 354 2HG GLN 54 -1.964 17.193 17.193 1021 2HG GLN 354 1HG GLN 54 -2.250 15.654 15.654 1022 1HE2 GLN 354 2HE2 GLN 54 -3.427 14.241 14.241 1023 2HE2 GLN 354 1HE2 GLN 54 -4.182 14.530 14.530 1024 H ALA 355 HN ALA 55 -4.162 20.705 20.705 1025 HA ALA 355 HA ALA 55 -6.926 20.852 20.852 1026 1HB ALA 355 1HB ALA 55 -5.720 22.633 22.633 1027 2HB ALA 355 3HB ALA 55 -4.834 23.038 23.038 1028 3HB ALA 355 2HB ALA 55 -6.586 23.232 23.232 Start of MODEL 6 1 1H GLY 325 1H GLY 25 14.535 -0.515 -0.515 2 2H GLY 325 3H GLY 25 14.446 1.088 1.088 3 3H GLY 325 2H GLY 25 14.498 0.760 0.760 4 1HA GLY 325 2HA GLY 25 12.335 0.038 0.038 5 2HA GLY 325 1HA GLY 25 12.246 1.330 1.330 6 H GLU 326 H GLU 26 10.469 -0.950 -0.950 7 HA GLU 326 HA GLU 26 10.699 -1.838 -1.838 8 1HB GLU 326 2HB GLU 26 11.852 -3.452 -3.452 9 2HB GLU 326 1HB GLU 26 10.350 -4.244 -4.244 10 1HG GLU 326 2HG GLU 26 11.133 -3.798 -3.798 11 2HG GLU 326 1HG GLU 26 12.723 -3.530 -3.530 12 H TYR 327 H TYR 27 8.838 -3.784 -3.784 13 HA TYR 327 HA TYR 27 6.427 -2.444 -2.444 14 1HB TYR 327 2HB TYR 27 7.037 -3.960 -3.960 15 2HB TYR 327 1HB TYR 27 5.483 -4.354 -4.354 16 HD1 TYR 327 HD2 TYR 27 4.050 -2.276 -2.276 17 HD2 TYR 327 HD1 TYR 27 7.175 -2.104 -2.104 18 HE1 TYR 327 HE2 TYR 27 3.088 -0.174 -0.174 19 HE2 TYR 327 HE1 TYR 27 6.213 -0.003 -0.003 20 HH TYR 327 HH TYR 27 3.939 1.108 1.108 21 H PHE 328 H PHE 28 5.469 -3.375 -3.375 22 HA PHE 328 HA PHE 28 5.937 -6.299 -6.299 23 1HB PHE 328 2HB PHE 28 5.479 -4.090 -4.090 24 2HB PHE 328 1HB PHE 28 5.608 -5.805 -5.805 25 HD1 PHE 328 HD2 PHE 28 7.735 -6.997 -6.997 26 HD2 PHE 328 HD1 PHE 28 7.428 -2.821 -2.821 27 HE1 PHE 328 HE2 PHE 28 10.208 -6.816 -6.816 28 HE2 PHE 328 HE1 PHE 28 9.903 -2.642 -2.642 29 HZ PHE 328 HZ PHE 28 11.292 -4.639 -4.639 30 H THR 329 H THR 29 4.104 -7.364 -7.364 31 HA THR 329 HA THR 29 1.451 -6.111 -6.111 32 HB THR 329 HB THR 29 1.646 -9.048 -9.048 33 HG1 THR 329 HG1 THR 29 3.084 -7.236 -7.236 34 1HG2 THR 329 2HG2 THR 29 -0.285 -7.306 -7.306 35 2HG2 THR 329 1HG2 THR 29 0.548 -7.146 -7.146 36 3HG2 THR 329 3HG2 THR 29 -0.065 -8.718 -8.718 37 H LEU 330 H LEU 30 -0.031 -6.365 -6.365 38 HA LEU 330 HA LEU 30 0.722 -8.181 -8.181 39 1HB LEU 330 2HB LEU 30 0.118 -5.418 -5.418 40 2HB LEU 330 1HB LEU 30 -1.280 -6.229 -6.229 41 HG LEU 330 HG LEU 30 0.876 -7.526 -7.526 42 1HD1 LEU 330 3HD1 LEU 30 2.022 -5.297 -5.297 43 2HD1 LEU 330 2HD1 LEU 30 1.452 -4.664 -4.664 44 3HD1 LEU 330 1HD1 LEU 30 2.552 -6.043 -6.043 45 1HD2 LEU 330 1HD2 LEU 30 -1.246 -6.812 -6.812 46 2HD2 LEU 330 3HD2 LEU 30 0.154 -6.311 -6.311 47 3HD2 LEU 330 2HD2 LEU 30 -0.695 -5.138 -5.138 48 H GLN 331 H GLN 31 -0.395 -10.005 -10.005 49 HA GLN 331 HA GLN 31 -3.194 -9.703 -9.703 50 1HB GLN 331 2HB GLN 31 -1.283 -11.364 -11.364 51 2HB GLN 331 1HB GLN 31 -1.938 -12.377 -12.377 52 1HG GLN 331 2HG GLN 31 -4.242 -11.921 -11.921 53 2HG GLN 331 1HG GLN 31 -3.403 -11.223 -11.223 54 1HE2 GLN 331 2HE2 GLN 31 -3.845 -14.713 -14.713 55 2HE2 GLN 331 1HE2 GLN 31 -4.755 -13.284 -13.284 56 H ILE 332 H ILE 32 -4.640 -9.453 -9.453 57 HA ILE 332 HA ILE 32 -4.239 -11.023 -11.023 58 HB ILE 332 HB ILE 32 -5.871 -8.513 -8.513 59 1HG1 ILE 332 2HG1 ILE 32 -3.755 -8.290 -8.290 60 2HG1 ILE 332 1HG1 ILE 32 -3.093 -8.877 -8.877 61 1HG2 ILE 332 2HG2 ILE 32 -5.352 -10.177 -10.177 62 2HG2 ILE 332 1HG2 ILE 32 -5.969 -8.526 -8.526 63 3HG2 ILE 332 3HG2 ILE 32 -6.912 -9.792 -9.792 64 1HD1 ILE 332 1HD1 ILE 32 -5.053 -6.643 -6.643 65 2HD1 ILE 332 3HD1 ILE 32 -3.462 -6.258 -6.258 66 3HD1 ILE 332 2HD1 ILE 32 -3.607 -6.943 -6.943 67 H ARG 333 H ARG 33 -5.610 -12.691 -12.691 68 HA ARG 333 HA ARG 33 -7.954 -13.004 -13.004 69 1HB ARG 333 2HB ARG 33 -6.247 -14.840 -14.840 70 2HB ARG 333 1HB ARG 33 -7.333 -14.871 -14.871 71 1HG ARG 333 2HG ARG 33 -8.795 -14.864 -14.864 72 2HG ARG 333 1HG ARG 33 -7.703 -16.245 -16.245 73 1HD ARG 333 2HD ARG 33 -9.409 -15.515 -15.515 74 2HD ARG 333 1HD ARG 33 -10.135 -16.394 -16.394 75 HE ARG 333 HE ARG 33 -8.030 -17.972 -17.972 76 1HH1 ARG 333 1HH2 ARG 33 -7.570 -16.529 -16.529 77 2HH1 ARG 333 2HH2 ARG 33 -8.404 -17.573 -17.573 78 1HH2 ARG 333 2HH1 ARG 33 -10.163 -19.232 -19.232 79 2HH2 ARG 333 1HH1 ARG 33 -9.872 -19.103 -19.103 80 H GLY 334 H GLY 34 -9.571 -11.594 -11.594 81 1HA GLY 334 2HA GLY 34 -11.210 -12.221 -12.221 82 2HA GLY 334 1HA GLY 34 -10.081 -10.991 -10.991 83 H ARG 335 H ARG 35 -11.191 -9.102 -9.102 84 HA ARG 335 HA ARG 35 -11.974 -7.808 -7.808 85 1HB ARG 335 2HB ARG 35 -13.851 -9.545 -9.545 86 2HB ARG 335 1HB ARG 35 -14.344 -8.541 -8.541 87 1HG ARG 335 2HG ARG 35 -14.950 -6.751 -6.751 88 2HG ARG 335 1HG ARG 35 -13.858 -7.235 -7.235 89 1HD ARG 335 2HD ARG 35 -15.337 -9.266 -9.266 90 2HD ARG 335 1HD ARG 35 -16.488 -8.527 -8.527 91 HE ARG 335 HE ARG 35 -15.628 -7.116 -7.116 92 1HH1 ARG 335 2HH1 ARG 35 -18.040 -9.164 -9.164 93 2HH1 ARG 335 1HH1 ARG 35 -19.354 -8.063 -8.063 94 1HH2 ARG 335 1HH2 ARG 35 -17.299 -5.310 -5.310 95 2HH2 ARG 335 2HH2 ARG 35 -18.934 -5.881 -5.881 96 H GLU 336 H GLU 36 -12.902 -8.000 -8.000 97 HA GLU 336 HA GLU 36 -13.123 -5.119 -5.119 98 1HB GLU 336 2HB GLU 36 -13.677 -7.396 -7.396 99 2HB GLU 336 1HB GLU 36 -12.578 -6.355 -6.355 100 1HG GLU 336 2HG GLU 36 -14.062 -4.433 -4.433 101 2HG GLU 336 1HG GLU 36 -15.150 -5.442 -5.442 102 H ARG 337 H ARG 37 -10.640 -7.514 -7.514 103 HA ARG 337 HA ARG 37 -8.811 -5.620 -5.620 104 1HB ARG 337 2HB ARG 37 -8.588 -8.398 -8.398 105 2HB ARG 337 1HB ARG 37 -7.103 -7.477 -7.477 106 1HG ARG 337 2HG ARG 37 -8.003 -6.974 -6.974 107 2HG ARG 337 1HG ARG 37 -9.173 -8.257 -8.257 108 1HD ARG 337 2HD ARG 37 -6.277 -8.821 -8.821 109 2HD ARG 337 1HD ARG 37 -6.837 -8.801 -8.801 110 HE ARG 337 HE ARG 37 -7.641 -10.753 -10.753 111 1HH1 ARG 337 2HH1 ARG 37 -10.099 -10.959 -10.959 112 2HH1 ARG 337 1HH1 ARG 37 -10.066 -11.615 -11.615 113 1HH2 ARG 337 1HH2 ARG 37 -6.710 -10.911 -10.911 114 2HH2 ARG 337 2HH2 ARG 37 -8.148 -11.587 -11.587 115 H PHE 338 H PHE 38 -9.202 -6.885 -6.885 116 HA PHE 338 HA PHE 38 -6.994 -5.514 -5.514 117 1HB PHE 338 2HB PHE 38 -8.130 -7.199 -7.199 118 2HB PHE 338 1HB PHE 38 -9.665 -6.339 -6.339 119 HD1 PHE 338 HD2 PHE 38 -6.181 -6.007 -6.007 120 HD2 PHE 338 HD1 PHE 38 -10.262 -4.691 -4.691 121 HE1 PHE 338 HE2 PHE 38 -5.624 -4.705 -4.705 122 HE2 PHE 338 HE1 PHE 38 -9.704 -3.389 -3.389 123 HZ PHE 338 HZ PHE 38 -7.385 -3.396 -3.396 124 H GLU 339 H GLU 39 -10.324 -4.479 -4.479 125 HA GLU 339 HA GLU 39 -10.194 -1.973 -1.973 126 1HB GLU 339 2HB GLU 39 -11.830 -3.066 -3.066 127 2HB GLU 339 1HB GLU 39 -11.887 -1.334 -1.334 128 1HG GLU 339 2HG GLU 39 -12.052 -2.667 -2.667 129 2HG GLU 339 1HG GLU 39 -13.186 -3.462 -3.462 130 H MET 340 H MET 40 -9.394 -2.896 -2.896 131 HA MET 340 HA MET 40 -8.712 -0.390 -0.390 132 1HB MET 340 2HB MET 40 -7.675 -3.157 -3.157 133 2HB MET 340 1HB MET 40 -6.922 -1.785 -1.785 134 1HG MET 340 2HG MET 40 -8.850 -1.273 -1.273 135 2HG MET 340 1HG MET 40 -9.911 -2.084 -2.084 136 1HE MET 340 1HE MET 40 -6.651 -2.793 -2.793 137 2HE MET 340 3HE MET 40 -6.786 -4.385 -4.385 138 3HE MET 340 2HE MET 40 -6.717 -4.244 -4.244 139 H PHE 341 H PHE 41 -6.572 -2.668 -2.668 140 HA PHE 341 HA PHE 41 -4.287 -0.989 -0.989 141 1HB PHE 341 2HB PHE 41 -5.234 -3.367 -3.367 142 2HB PHE 341 1HB PHE 41 -3.775 -2.521 -2.521 143 HD1 PHE 341 HD1 PHE 41 -5.297 -3.307 -3.307 144 HD2 PHE 341 HD2 PHE 41 -1.873 -3.751 -3.751 145 HE1 PHE 341 HE1 PHE 41 -4.100 -4.478 -4.478 146 HE2 PHE 341 HE2 PHE 41 -0.670 -4.928 -4.928 147 HZ PHE 341 HZ PHE 41 -1.803 -5.286 -5.286 148 H ARG 342 H ARG 42 -7.085 -1.257 -1.257 149 HA ARG 342 HA ARG 42 -6.188 0.186 0.186 150 1HB ARG 342 2HB ARG 42 -8.722 -0.789 -0.789 151 2HB ARG 342 1HB ARG 42 -8.905 0.800 0.800 152 1HG ARG 342 2HG ARG 42 -7.637 -0.079 -0.079 153 2HG ARG 342 1HG ARG 42 -7.726 -1.683 -1.683 154 1HD ARG 342 2HD ARG 42 -9.573 -1.487 -1.487 155 2HD ARG 342 1HD ARG 42 -10.234 -1.410 -1.410 156 HE ARG 342 HE ARG 42 -9.649 1.237 1.237 157 1HH1 ARG 342 1HH2 ARG 42 -11.263 -0.475 -0.475 158 2HH1 ARG 342 2HH2 ARG 42 -12.864 0.081 0.081 159 1HH2 ARG 342 2HH1 ARG 42 -11.965 1.562 1.562 160 2HH2 ARG 342 1HH1 ARG 42 -13.263 1.231 1.231 161 H GLU 343 H GLU 43 -7.611 1.252 1.252 162 HA GLU 343 HA GLU 43 -7.818 4.031 4.031 163 1HB GLU 343 2HB GLU 43 -8.955 2.815 2.815 164 2HB GLU 343 1HB GLU 43 -7.430 3.071 3.071 165 1HG GLU 343 2HG GLU 43 -7.904 5.248 5.248 166 2HG GLU 343 1HG GLU 43 -8.296 5.495 5.495 167 H LEU 344 H LEU 44 -5.384 2.206 2.206 168 HA LEU 344 HA LEU 44 -3.619 4.416 4.416 169 1HB LEU 344 2HB LEU 44 -3.246 1.421 1.421 170 2HB LEU 344 1HB LEU 44 -1.843 2.473 2.473 171 HG LEU 344 HG LEU 44 -2.332 2.012 2.012 172 1HD1 LEU 344 3HD1 LEU 44 -2.402 4.527 4.527 173 2HD1 LEU 344 2HD1 LEU 44 -4.129 4.403 4.403 174 3HD1 LEU 344 1HD1 LEU 44 -2.956 4.059 4.059 175 1HD2 LEU 344 2HD2 LEU 44 -4.990 1.561 1.561 176 2HD2 LEU 344 1HD2 LEU 44 -4.272 0.982 0.982 177 3HD2 LEU 344 3HD2 LEU 44 -5.063 2.556 2.556 178 H ASN 345 H ASN 45 -4.213 2.325 2.325 179 HA ASN 345 HA ASN 45 -1.855 3.174 3.174 180 1HB ASN 345 2HB ASN 45 -3.696 1.064 1.064 181 2HB ASN 345 1HB ASN 45 -4.010 2.050 2.050 182 1HD2 ASN 345 2HD2 ASN 45 -1.301 -0.253 -0.253 183 2HD2 ASN 345 1HD2 ASN 45 -2.949 -0.365 -0.365 184 H GLU 346 H GLU 46 -5.129 4.205 4.205 185 HA GLU 346 HA GLU 46 -5.345 5.777 5.777 186 1HB GLU 346 2HB GLU 46 -6.955 5.272 5.272 187 2HB GLU 346 1HB GLU 46 -7.027 6.961 6.961 188 1HG GLU 346 2HG GLU 46 -7.598 6.240 6.240 189 2HG GLU 346 1HG GLU 46 -7.559 4.557 4.557 190 H ALA 347 H ALA 47 -4.415 6.491 6.491 191 HA ALA 347 HA ALA 47 -4.031 9.314 9.314 192 1HB ALA 347 1HB ALA 47 -4.261 8.332 8.332 193 2HB ALA 347 3HB ALA 47 -2.723 7.496 7.496 194 3HB ALA 347 2HB ALA 47 -2.768 9.258 9.258 195 H LEU 348 H LEU 48 -1.746 6.543 6.543 196 HA LEU 348 HA LEU 48 0.589 8.067 8.067 197 1HB LEU 348 2HB LEU 48 -0.062 5.250 5.250 198 2HB LEU 348 1HB LEU 48 1.548 5.958 5.958 199 HG LEU 348 HG LEU 48 -0.323 5.775 5.775 200 1HD1 LEU 348 2HD1 LEU 48 1.543 3.713 3.713 201 2HD1 LEU 348 1HD1 LEU 48 1.236 3.767 3.767 202 3HD1 LEU 348 3HD1 LEU 48 -0.097 3.500 3.500 203 1HD2 LEU 348 3HD2 LEU 48 1.965 7.181 7.181 204 2HD2 LEU 348 2HD2 LEU 48 1.489 6.466 6.466 205 3HD2 LEU 348 1HD2 LEU 48 2.645 5.633 5.633 206 H GLU 349 H GLU 49 -1.830 6.551 6.551 207 HA GLU 349 HA GLU 49 -0.640 7.337 7.337 208 1HB GLU 349 2HB GLU 49 -2.706 5.726 5.726 209 2HB GLU 349 1HB GLU 49 -3.614 7.190 7.190 210 1HG GLU 349 2HG GLU 49 -3.121 7.065 7.065 211 2HG GLU 349 1HG GLU 49 -1.459 6.556 6.556 212 H LEU 350 H LEU 50 -2.565 8.978 8.978 213 HA LEU 350 HA LEU 50 -3.312 11.194 11.194 214 1HB LEU 350 2HB LEU 50 -4.581 11.765 11.765 215 2HB LEU 350 1HB LEU 50 -4.013 10.286 10.286 216 HG LEU 350 HG LEU 50 -1.995 11.662 11.662 217 1HD1 LEU 350 3HD1 LEU 50 -3.447 13.596 13.596 218 2HD1 LEU 350 2HD1 LEU 50 -3.300 14.141 14.141 219 3HD1 LEU 350 1HD1 LEU 50 -1.855 13.742 13.742 220 1HD2 LEU 350 3HD2 LEU 50 -4.822 11.900 11.900 221 2HD2 LEU 350 2HD2 LEU 50 -3.436 11.164 11.164 222 3HD2 LEU 350 1HD2 LEU 50 -3.606 12.919 12.919 223 H LYS 351 H LYS 51 -0.540 10.291 10.291 224 HA LYS 351 HA LYS 51 0.685 12.879 12.879 225 1HB LYS 351 2HB LYS 51 1.366 10.743 10.743 226 2HB LYS 351 1HB LYS 51 2.186 10.276 10.276 227 1HG LYS 351 2HG LYS 51 3.736 12.013 12.013 228 2HG LYS 351 1HG LYS 51 2.682 13.001 13.001 229 1HD LYS 351 2HD LYS 51 2.977 10.940 10.940 230 2HD LYS 351 1HD LYS 51 4.482 10.749 10.749 231 1HE LYS 351 2HE LYS 51 5.021 13.136 13.136 232 2HE LYS 351 1HE LYS 51 3.552 13.266 13.266 233 1HZ LYS 351 2HZ LYS 51 5.561 11.181 11.181 234 2HZ LYS 351 1HZ LYS 51 5.745 12.754 12.754 235 3HZ LYS 351 3HZ LYS 51 4.382 11.835 11.835 236 H ASP 352 H ASP 52 0.863 10.276 10.276 237 HA ASP 352 HA ASP 52 2.719 11.686 11.686 238 1HB ASP 352 2HB ASP 52 2.269 9.151 9.151 239 2HB ASP 352 1HB ASP 52 0.819 9.508 9.508 240 H ALA 353 H ALA 53 -0.712 11.750 11.750 241 HA ALA 353 HA ALA 53 -1.202 13.088 13.088 242 1HB ALA 353 3HB ALA 53 -2.783 11.378 11.378 243 2HB ALA 353 2HB ALA 53 -3.219 12.702 12.702 244 3HB ALA 353 1HB ALA 53 -3.507 12.849 12.849 245 H GLN 354 H GLN 54 -0.292 13.940 13.940 246 HA GLN 354 HA GLN 54 -1.666 16.249 16.249 247 1HB GLN 354 2HB GLN 54 1.223 15.476 15.476 248 2HB GLN 354 1HB GLN 54 0.732 17.109 17.109 249 1HG GLN 354 2HG GLN 54 -1.186 15.770 15.770 250 2HG GLN 354 1HG GLN 54 0.030 14.497 14.497 251 1HE2 GLN 354 2HE2 GLN 54 0.472 17.636 17.636 252 2HE2 GLN 354 1HE2 GLN 54 -0.902 17.451 17.451 253 H ALA 355 HN ALA 55 -2.402 17.547 17.547 254 HA ALA 355 HA ALA 55 -0.268 18.982 18.982 255 1HB ALA 355 3HB ALA 55 -2.634 17.498 17.498 256 2HB ALA 355 2HB ALA 55 -2.309 19.059 19.059 257 3HB ALA 355 1HB ALA 55 -1.076 17.798 17.798 258 1H GLY 325 1H GLY 25 -16.666 -12.364 -12.364 259 2H GLY 325 3H GLY 25 -16.611 -13.673 -13.673 260 3H GLY 325 2H GLY 25 -16.709 -12.086 -12.086 261 1HA GLY 325 2HA GLY 25 -14.528 -11.605 -11.605 262 2HA GLY 325 1HA GLY 25 -14.439 -13.310 -13.310 263 H GLU 326 H GLU 26 -12.609 -11.909 -11.909 264 HA GLU 326 HA GLU 26 -12.700 -13.782 -13.782 265 1HB GLU 326 2HB GLU 26 -13.902 -11.236 -11.236 266 2HB GLU 326 1HB GLU 26 -12.363 -11.180 -11.180 267 1HG GLU 326 2HG GLU 26 -13.055 -13.490 -13.490 268 2HG GLU 326 1HG GLU 26 -14.679 -13.066 -13.066 269 H TYR 327 H TYR 27 -10.794 -12.811 -12.811 270 HA TYR 327 HA TYR 27 -8.460 -12.522 -12.522 271 1HB TYR 327 2HB TYR 27 -8.933 -13.801 -13.801 272 2HB TYR 327 1HB TYR 27 -7.403 -12.932 -12.932 273 HD1 TYR 327 HD2 TYR 27 -6.050 -13.342 -13.342 274 HD2 TYR 327 HD1 TYR 27 -9.055 -15.990 -15.990 275 HE1 TYR 327 HE2 TYR 27 -5.099 -15.203 -15.203 276 HE2 TYR 327 HE1 TYR 27 -8.104 -17.850 -17.850 277 HH TYR 327 HH TYR 27 -5.859 -18.424 -18.424 278 H PHE 328 H PHE 28 -7.545 -10.533 -10.533 279 HA PHE 328 HA PHE 28 -7.966 -8.610 -8.610 280 1HB PHE 328 2HB PHE 28 -7.662 -8.063 -8.063 281 2HB PHE 328 1HB PHE 28 -7.762 -6.817 -6.817 282 HD1 PHE 328 HD2 PHE 28 -9.812 -7.226 -7.226 283 HD2 PHE 328 HD1 PHE 28 -9.639 -8.606 -8.606 284 HE1 PHE 328 HE2 PHE 28 -12.287 -7.372 -7.372 285 HE2 PHE 328 HE1 PHE 28 -12.114 -8.753 -8.753 286 HZ PHE 328 HZ PHE 28 -13.439 -8.136 -8.136 287 H THR 329 H THR 29 -6.167 -6.983 -6.983 288 HA THR 329 HA THR 29 -3.548 -8.076 -8.076 289 HB THR 329 HB THR 29 -3.403 -6.768 -6.768 290 HG1 THR 329 HG1 THR 29 -5.057 -9.027 -9.027 291 1HG2 THR 329 2HG2 THR 29 -1.763 -8.312 -8.312 292 2HG2 THR 329 1HG2 THR 29 -2.697 -9.621 -9.621 293 3HG2 THR 329 3HG2 THR 29 -1.866 -8.454 -8.454 294 H LEU 330 H LEU 30 -2.009 -6.507 -6.507 295 HA LEU 330 HA LEU 30 -2.911 -3.660 -3.660 296 1HB LEU 330 2HB LEU 30 -2.327 -5.182 -5.182 297 2HB LEU 330 1HB LEU 30 -0.969 -4.081 -4.081 298 HG LEU 330 HG LEU 30 -3.235 -2.526 -2.526 299 1HD1 LEU 330 3HD1 LEU 30 -4.211 -4.699 -4.699 300 2HD1 LEU 330 2HD1 LEU 30 -3.736 -3.721 -3.721 301 3HD1 LEU 330 1HD1 LEU 30 -4.882 -3.082 -3.082 302 1HD2 LEU 330 1HD2 LEU 30 -1.121 -1.891 -1.891 303 2HD2 LEU 330 3HD2 LEU 30 -2.562 -1.381 -1.381 304 3HD2 LEU 330 2HD2 LEU 30 -1.665 -2.805 -2.805 305 H GLN 331 H GLN 31 -1.715 -3.493 -3.493 306 HA GLN 331 HA GLN 31 1.129 -4.134 -4.134 307 1HB GLN 331 2HB GLN 31 -0.731 -3.897 -3.897 308 2HB GLN 331 1HB GLN 31 0.014 -2.301 -2.301 309 1HG GLN 331 2HG GLN 31 2.262 -3.454 -3.454 310 2HG GLN 331 1HG GLN 31 1.398 -4.984 -4.984 311 1HE2 GLN 331 2HE2 GLN 31 2.015 -3.996 -3.996 312 2HE2 GLN 331 1HE2 GLN 31 2.880 -4.630 -4.630 313 H ILE 332 H ILE 32 2.512 -2.887 -2.887 314 HA ILE 332 HA ILE 32 2.018 0.062 0.062 315 HB ILE 332 HB ILE 32 3.611 -1.678 -1.678 316 1HG1 ILE 332 2HG1 ILE 32 1.418 -0.196 -0.196 317 2HG1 ILE 332 1HG1 ILE 32 0.830 -1.175 -1.175 318 1HG2 ILE 332 2HG2 ILE 32 3.047 1.296 1.296 319 2HG2 ILE 332 1HG2 ILE 32 3.600 0.472 0.472 320 3HG2 ILE 332 3HG2 ILE 32 4.619 0.497 0.497 321 1HD1 ILE 332 1HD1 ILE 32 2.740 -2.485 -2.485 322 2HD1 ILE 332 3HD1 ILE 32 1.118 -2.170 -2.170 323 3HD1 ILE 332 2HD1 ILE 32 1.335 -3.158 -3.158 324 H ARG 333 H ARG 33 3.416 1.249 1.249 325 HA ARG 333 HA ARG 33 5.826 -0.030 -0.030 326 1HB ARG 333 2HB ARG 33 4.134 1.653 1.653 327 2HB ARG 333 1HB ARG 33 5.176 2.866 2.866 328 1HG ARG 333 2HG ARG 33 6.716 0.738 0.738 329 2HG ARG 333 1HG ARG 33 5.657 1.560 1.560 330 1HD ARG 333 2HD ARG 33 7.275 3.194 3.194 331 2HD ARG 333 1HD ARG 33 8.057 2.529 2.529 332 HE ARG 333 HE ARG 33 5.986 3.707 3.707 333 1HH1 ARG 333 1HH2 ARG 33 5.401 5.155 5.155 334 2HH1 ARG 333 2HH2 ARG 33 6.218 6.659 6.659 335 1HH2 ARG 333 2HH1 ARG 33 8.099 5.485 5.485 336 2HH2 ARG 333 1HH1 ARG 33 7.743 6.848 6.848 337 H GLY 334 H GLY 34 7.350 -0.187 -0.187 338 1HA GLY 334 2HA GLY 34 8.967 2.018 2.018 339 2HA GLY 334 1HA GLY 34 7.799 1.872 1.872 340 H ARG 335 H ARG 35 8.853 0.908 0.908 341 HA ARG 335 HA ARG 35 9.682 -1.831 -1.831 342 1HB ARG 335 2HB ARG 35 11.589 -0.560 -0.560 343 2HB ARG 335 1HB ARG 35 12.006 0.057 0.057 344 1HG ARG 335 2HG ARG 35 12.613 -2.041 -2.041 345 2HG ARG 335 1HG ARG 35 11.584 -2.892 -2.892 346 1HD ARG 335 2HD ARG 35 13.131 -2.081 -2.081 347 2HD ARG 335 1HD ARG 35 14.215 -1.504 -1.504 348 HE ARG 335 HE ARG 35 13.424 -4.384 -4.384 349 1HH1 ARG 335 2HH1 ARG 35 15.846 -2.441 -2.441 350 2HH1 ARG 335 1HH1 ARG 35 17.141 -3.218 -3.218 351 1HH2 ARG 335 1HH2 ARG 35 15.045 -5.140 -5.140 352 2HH2 ARG 335 2HH2 ARG 35 16.688 -4.745 -4.745 353 H GLU 336 H GLU 36 10.475 1.214 1.214 354 HA GLU 336 HA GLU 36 10.626 -0.102 -0.102 355 1HB GLU 336 2HB GLU 36 11.156 2.499 2.499 356 2HB GLU 336 1HB GLU 36 10.003 2.684 2.684 357 1HG GLU 336 2HG GLU 36 11.461 1.379 1.379 358 2HG GLU 336 1HG GLU 36 12.605 1.134 1.134 359 H ARG 337 H ARG 37 8.145 1.851 1.851 360 HA ARG 337 HA ARG 37 6.233 1.767 1.767 361 1HB ARG 337 2HB ARG 37 6.119 2.283 2.283 362 2HB ARG 337 1HB ARG 37 4.606 1.992 1.992 363 1HG ARG 337 2HG ARG 37 5.431 3.744 3.744 364 2HG ARG 337 1HG ARG 37 6.634 4.177 4.177 365 1HD ARG 337 2HD ARG 37 3.784 3.959 3.959 366 2HD ARG 337 1HD ARG 37 4.254 5.374 5.374 367 HE ARG 337 HE ARG 37 5.195 4.718 4.718 368 1HH1 ARG 337 2HH1 ARG 37 7.619 5.661 5.661 369 2HH1 ARG 337 1HH1 ARG 37 7.533 7.363 7.363 370 1HH2 ARG 337 1HH2 ARG 37 4.138 7.327 7.327 371 2HH2 ARG 337 2HH2 ARG 37 5.560 8.307 8.307 372 H PHE 338 H PHE 38 6.754 -0.358 -0.358 373 HA PHE 338 HA PHE 38 4.570 -2.137 -2.137 374 1HB PHE 338 2HB PHE 38 5.812 -2.293 -2.293 375 2HB PHE 338 1HB PHE 38 7.319 -2.606 -2.606 376 HD1 PHE 338 HD2 PHE 38 3.892 -3.978 -3.978 377 HD2 PHE 338 HD1 PHE 38 7.952 -4.809 -4.809 378 HE1 PHE 338 HE2 PHE 38 3.397 -6.406 -6.406 379 HE2 PHE 338 HE1 PHE 38 7.457 -7.239 -7.239 380 HZ PHE 338 HZ PHE 38 5.180 -8.038 -8.038 381 H GLU 339 H GLU 39 7.855 -2.037 -2.037 382 HA GLU 339 HA GLU 39 7.727 -4.519 -4.519 383 1HB GLU 339 2HB GLU 39 9.293 -1.978 -1.978 384 2HB GLU 339 1HB GLU 39 9.334 -3.180 -3.180 385 1HG GLU 339 2HG GLU 39 9.645 -4.575 -4.575 386 2HG GLU 339 1HG GLU 39 10.754 -3.202 -3.202 387 H MET 340 H MET 40 6.863 -1.203 -1.203 388 HA MET 340 HA MET 40 6.065 -1.681 -1.681 389 1HB MET 340 2HB MET 40 5.093 0.203 0.203 390 2HB MET 340 1HB MET 40 4.259 0.133 0.133 391 1HG MET 340 2HG MET 40 6.110 0.918 0.918 392 2HG MET 340 1HG MET 40 7.251 0.387 0.387 393 1HE MET 340 1HE MET 40 3.970 2.199 2.199 394 2HE MET 340 3HE MET 40 4.159 3.657 3.657 395 3HE MET 340 2HE MET 40 4.105 2.073 2.073 396 H PHE 341 H PHE 41 4.010 -1.829 -1.829 397 HA PHE 341 HA PHE 41 1.708 -2.882 -2.882 398 1HB PHE 341 2HB PHE 41 2.673 -2.942 -2.942 399 2HB PHE 341 1HB PHE 41 1.186 -3.763 -3.763 400 HD1 PHE 341 HD1 PHE 41 2.704 -0.525 -0.525 401 HD2 PHE 341 HD2 PHE 41 -0.618 -2.481 -2.481 402 HE1 PHE 341 HE1 PHE 41 1.485 1.628 1.628 403 HE2 PHE 341 HE2 PHE 41 -1.839 -0.325 -0.325 404 HZ PHE 341 HZ PHE 41 -0.788 1.729 1.729 405 H ARG 342 H ARG 42 4.660 -4.344 -4.344 406 HA ARG 342 HA ARG 42 3.752 -7.062 -7.062 407 1HB ARG 342 2HB ARG 42 6.282 -5.636 -5.636 408 2HB ARG 342 1HB ARG 42 6.442 -7.114 -7.114 409 1HG ARG 342 2HG ARG 42 5.275 -8.345 -8.345 410 2HG ARG 342 1HG ARG 42 5.373 -6.867 -6.867 411 1HD ARG 342 2HD ARG 42 7.272 -8.240 -8.240 412 2HD ARG 342 1HD ARG 42 7.868 -6.887 -6.887 413 HE ARG 342 HE ARG 42 7.260 -9.148 -9.148 414 1HH1 ARG 342 1HH2 ARG 42 9.000 -9.953 -9.953 415 2HH1 ARG 342 2HH2 ARG 42 10.572 -9.914 -9.914 416 1HH2 ARG 342 2HH1 ARG 42 9.514 -8.191 -8.191 417 2HH2 ARG 342 1HH1 ARG 42 10.864 -8.914 -8.914 418 H GLU 343 H GLU 43 5.044 -5.022 -5.022 419 HA GLU 343 HA GLU 43 5.196 -7.139 -7.139 420 1HB GLU 343 2HB GLU 43 6.295 -4.792 -4.792 421 2HB GLU 343 1HB GLU 43 4.732 -4.231 -4.231 422 1HG GLU 343 2HG GLU 43 5.130 -5.079 -5.079 423 2HG GLU 343 1HG GLU 43 5.575 -6.647 -6.647 424 H LEU 344 H LEU 44 2.752 -4.610 -4.610 425 HA LEU 344 HA LEU 44 0.904 -5.469 -5.469 426 1HB LEU 344 2HB LEU 44 0.630 -3.924 -3.924 427 2HB LEU 344 1HB LEU 44 -0.812 -4.421 -4.421 428 HG LEU 344 HG LEU 44 -0.412 -2.288 -2.288 429 1HD1 LEU 344 3HD1 LEU 44 -0.394 -4.192 -4.192 430 2HD1 LEU 344 2HD1 LEU 44 1.326 -3.834 -3.834 431 3HD1 LEU 344 1HD1 LEU 44 0.131 -2.587 -2.587 432 1HD2 LEU 344 2HD2 LEU 44 2.307 -2.864 -2.864 433 2HD2 LEU 344 1HD2 LEU 44 1.534 -1.302 -1.302 434 3HD2 LEU 344 3HD2 LEU 44 2.274 -2.163 -2.163 435 H ASN 345 H ASN 45 1.721 -6.665 -6.665 436 HA ASN 345 HA ASN 45 -0.640 -8.406 -8.406 437 1HB ASN 345 2HB ASN 45 1.269 -7.404 -7.404 438 2HB ASN 345 1HB ASN 45 1.588 -9.135 -9.135 439 1HD2 ASN 345 2HD2 ASN 45 -1.021 -8.716 -8.716 440 2HD2 ASN 345 1HD2 ASN 45 0.617 -8.322 -8.322 441 H GLU 346 H GLU 46 2.576 -8.513 -8.513 442 HA GLU 346 HA GLU 46 2.848 -11.405 -11.405 443 1HB GLU 346 2HB GLU 46 4.381 -9.087 -9.087 444 2HB GLU 346 1HB GLU 46 4.435 -10.414 -10.414 445 1HG GLU 346 2HG GLU 46 5.103 -11.961 -11.961 446 2HG GLU 346 1HG GLU 46 5.083 -10.618 -10.618 447 H ALA 347 H ALA 47 1.778 -8.951 -8.951 448 HA ALA 347 HA ALA 47 1.349 -10.795 -10.795 449 1HB ALA 347 1HB ALA 47 1.508 -8.349 -8.349 450 2HB ALA 347 3HB ALA 47 0.009 -8.129 -8.129 451 3HB ALA 347 2HB ALA 47 -0.008 -8.981 -8.981 452 H LEU 348 H LEU 48 -0.884 -9.372 -9.372 453 HA LEU 348 HA LEU 48 -3.219 -10.756 -10.756 454 1HB LEU 348 2HB LEU 48 -2.460 -10.018 -10.018 455 2HB LEU 348 1HB LEU 48 -4.089 -10.325 -10.325 456 HG LEU 348 HG LEU 48 -2.334 -8.177 -8.177 457 1HD1 LEU 348 2HD1 LEU 48 -4.096 -8.101 -8.101 458 2HD1 LEU 348 1HD1 LEU 48 -3.857 -6.656 -6.656 459 3HD1 LEU 348 3HD1 LEU 48 -2.476 -7.437 -7.437 460 1HD2 LEU 348 3HD2 LEU 48 -4.641 -9.258 -9.258 461 2HD2 LEU 348 2HD2 LEU 48 -4.221 -7.564 -7.564 462 3HD2 LEU 348 1HD2 LEU 48 -5.301 -8.019 -8.019 463 H GLU 349 H GLU 49 -0.672 -11.666 -11.666 464 HA GLU 349 HA GLU 49 -1.806 -14.203 -14.203 465 1HB GLU 349 2HB GLU 49 0.290 -12.809 -12.809 466 2HB GLU 349 1HB GLU 49 1.163 -13.895 -13.895 467 1HG GLU 349 2HG GLU 49 0.770 -15.710 -15.710 468 2HG GLU 349 1HG GLU 49 -0.894 -15.225 -15.225 469 H LEU 350 H LEU 50 0.005 -13.033 -13.033 470 HA LEU 350 HA LEU 50 0.761 -15.633 -15.633 471 1HB LEU 350 2HB LEU 50 1.914 -14.408 -14.408 472 2HB LEU 350 1HB LEU 50 1.371 -12.984 -12.984 473 HG LEU 350 HG LEU 50 -0.738 -13.086 -13.086 474 1HD1 LEU 350 3HD1 LEU 50 0.696 -15.411 -15.411 475 2HD1 LEU 350 2HD1 LEU 50 0.519 -14.270 -14.270 476 3HD1 LEU 350 1HD1 LEU 50 -0.908 -14.850 -14.850 477 1HD2 LEU 350 3HD2 LEU 50 2.041 -12.338 -12.338 478 2HD2 LEU 350 2HD2 LEU 50 0.633 -11.306 -11.306 479 3HD2 LEU 350 1HD2 LEU 50 0.770 -12.255 -12.255 480 H LYS 351 H LYS 51 -2.092 -13.639 -13.639 481 HA LYS 351 HA LYS 51 -3.372 -14.905 -14.905 482 1HB LYS 351 2HB LYS 51 -4.058 -12.726 -12.726 483 2HB LYS 351 1HB LYS 51 -4.805 -13.755 -13.755 484 1HG LYS 351 2HG LYS 51 -6.400 -14.592 -14.592 485 2HG LYS 351 1HG LYS 51 -5.413 -14.241 -14.241 486 1HD LYS 351 2HD LYS 51 -5.722 -11.735 -11.735 487 2HD LYS 351 1HD LYS 51 -7.183 -12.424 -12.424 488 1HE LYS 351 2HE LYS 51 -7.811 -13.323 -13.323 489 2HE LYS 351 1HE LYS 51 -6.383 -12.552 -12.552 490 1HZ LYS 351 2HZ LYS 51 -8.347 -10.990 -10.990 491 2HZ LYS 351 1HZ LYS 51 -8.598 -11.308 -11.308 492 3HZ LYS 351 3HZ LYS 51 -7.224 -10.447 -10.447 493 H ASP 352 H ASP 52 -3.388 -15.538 -15.538 494 HA ASP 352 HA ASP 52 -5.215 -17.785 -17.785 495 1HB ASP 352 2HB ASP 52 -4.709 -16.370 -16.370 496 2HB ASP 352 1HB ASP 52 -3.229 -17.320 -17.320 497 H ALA 353 H ALA 53 -1.814 -17.324 -17.324 498 HA ALA 353 HA ALA 53 -1.252 -20.222 -20.222 499 1HB ALA 353 3HB ALA 53 0.323 -18.336 -18.336 500 2HB ALA 353 2HB ALA 53 0.699 -18.103 -18.103 501 3HB ALA 353 1HB ALA 53 1.041 -19.649 -19.649 502 H GLN 354 H GLN 54 -2.307 -18.038 -18.038 503 HA GLN 354 HA GLN 54 -0.997 -18.675 -18.675 504 1HB GLN 354 2HB GLN 54 -3.871 -18.114 -18.114 505 2HB GLN 354 1HB GLN 54 -3.451 -18.629 -18.629 506 1HG GLN 354 2HG GLN 54 -1.550 -16.796 -16.796 507 2HG GLN 354 1HG GLN 54 -2.679 -16.132 -16.132 508 1HE2 GLN 354 2HE2 GLN 54 -3.426 -15.672 -15.672 509 2HE2 GLN 354 1HE2 GLN 54 -1.979 -16.340 -16.340 510 H ALA 355 HN ALA 55 -0.239 -20.771 -20.771 511 HA ALA 355 HA ALA 55 -2.341 -22.870 -22.870 512 1HB ALA 355 3HB ALA 55 0.089 -22.883 -22.883 513 2HB ALA 355 2HB ALA 55 -0.217 -24.357 -24.357 514 3HB ALA 355 1HB ALA 55 -1.434 -23.748 -23.748 515 1H GLY 325 1H GLY 25 14.240 1.574 1.574 516 2H GLY 325 3H GLY 25 14.279 -0.041 -0.041 517 3H GLY 325 2H GLY 25 14.311 0.319 0.319 518 1HA GLY 325 2HA GLY 25 12.098 0.840 0.840 519 2HA GLY 325 1HA GLY 25 12.108 -0.446 -0.446 520 H GLU 326 H GLU 26 10.164 1.708 1.708 521 HA GLU 326 HA GLU 26 10.286 2.604 2.604 522 1HB GLU 326 2HB GLU 26 11.360 4.302 4.302 523 2HB GLU 326 1HB GLU 26 9.797 4.984 4.984 524 1HG GLU 326 2HG GLU 26 10.561 4.590 4.590 525 2HG GLU 326 1HG GLU 26 12.180 4.436 4.436 526 H TYR 327 H TYR 27 8.295 4.407 4.407 527 HA TYR 327 HA TYR 27 6.001 2.918 2.918 528 1HB TYR 327 2HB TYR 27 6.457 4.454 4.454 529 2HB TYR 327 1HB TYR 27 4.896 4.747 4.747 530 HD1 TYR 327 HD2 TYR 27 3.618 2.588 2.588 531 HD2 TYR 327 HD1 TYR 27 6.697 2.601 2.601 532 HE1 TYR 327 HE2 TYR 27 2.782 0.420 0.420 533 HE2 TYR 327 HE1 TYR 27 5.861 0.435 0.435 534 HH TYR 327 HH TYR 27 3.677 -0.830 -0.830 535 H PHE 328 H PHE 28 5.014 3.801 3.801 536 HA PHE 328 HA PHE 28 5.300 6.751 6.751 537 1HB PHE 328 2HB PHE 28 5.016 4.524 4.524 538 2HB PHE 328 1HB PHE 28 5.025 6.245 6.245 539 HD1 PHE 328 HD2 PHE 28 7.048 7.578 7.578 540 HD2 PHE 328 HD1 PHE 28 7.049 3.405 3.405 541 HE1 PHE 328 HE2 PHE 28 9.527 7.572 7.572 542 HE2 PHE 328 HE1 PHE 28 9.529 3.400 3.400 543 HZ PHE 328 HZ PHE 28 10.768 5.482 5.482 544 H THR 329 H THR 29 3.415 7.697 7.697 545 HA THR 329 HA THR 29 0.872 6.242 6.242 546 HB THR 329 HB THR 29 0.745 9.164 9.164 547 HG1 THR 329 HG1 THR 29 2.372 7.518 7.518 548 1HG2 THR 329 2HG2 THR 29 -0.956 7.214 7.214 549 2HG2 THR 329 1HG2 THR 29 -0.059 7.105 7.105 550 3HG2 THR 329 3HG2 THR 29 -0.862 8.611 8.611 551 H LEU 330 H LEU 30 -0.671 6.477 6.477 552 HA LEU 330 HA LEU 30 0.030 8.289 8.289 553 1HB LEU 330 2HB LEU 30 -0.390 5.496 5.496 554 2HB LEU 330 1HB LEU 30 -1.827 6.198 6.198 555 HG LEU 330 HG LEU 30 0.279 7.639 7.639 556 1HD1 LEU 330 3HD1 LEU 30 1.522 5.484 5.484 557 2HD1 LEU 330 2HD1 LEU 30 1.030 4.805 4.805 558 3HD1 LEU 330 1HD1 LEU 30 2.047 6.244 6.244 559 1HD2 LEU 330 1HD2 LEU 30 -1.811 6.807 6.807 560 2HD2 LEU 330 3HD2 LEU 30 -0.372 6.459 6.459 561 3HD2 LEU 330 2HD2 LEU 30 -1.129 5.181 5.181 562 H GLN 331 H GLN 31 -1.225 10.020 10.020 563 HA GLN 331 HA GLN 31 -4.038 9.572 9.572 564 1HB GLN 331 2HB GLN 31 -2.242 11.425 11.425 565 2HB GLN 331 1HB GLN 31 -3.049 12.334 12.334 566 1HG GLN 331 2HG GLN 31 -5.254 11.679 11.679 567 2HG GLN 331 1HG GLN 31 -4.333 11.028 11.028 568 1HE2 GLN 331 2HE2 GLN 31 -5.075 14.467 14.467 569 2HE2 GLN 331 1HE2 GLN 31 -5.880 12.980 12.980 570 H ILE 332 H ILE 32 -5.454 9.230 9.230 571 HA ILE 332 HA ILE 32 -5.075 10.788 10.788 572 HB ILE 332 HB ILE 32 -6.549 8.176 8.176 573 1HG1 ILE 332 2HG1 ILE 32 -4.399 8.100 8.100 574 2HG1 ILE 332 1HG1 ILE 32 -3.797 8.732 8.732 575 1HG2 ILE 332 2HG2 ILE 32 -6.136 9.906 9.906 576 2HG2 ILE 332 1HG2 ILE 32 -6.581 8.203 8.203 577 3HG2 ILE 332 3HG2 ILE 32 -7.662 9.349 9.349 578 1HD1 ILE 332 1HD1 ILE 32 -5.600 6.369 6.369 579 2HD1 ILE 332 3HD1 ILE 32 -3.980 6.092 6.092 580 3HD1 ILE 332 2HD1 ILE 32 -4.187 6.768 6.768 581 H ARG 333 H ARG 33 -6.557 12.369 12.369 582 HA ARG 333 HA ARG 33 -8.936 12.508 12.508 583 1HB ARG 333 2HB ARG 33 -7.361 14.471 14.471 584 2HB ARG 333 1HB ARG 33 -8.437 14.439 14.439 585 1HG ARG 333 2HG ARG 33 -9.914 14.290 14.290 586 2HG ARG 333 1HG ARG 33 -8.927 15.748 15.748 587 1HD ARG 333 2HD ARG 33 -10.558 14.932 14.932 588 2HD ARG 333 1HD ARG 33 -11.356 15.733 15.733 589 HE ARG 333 HE ARG 33 -9.384 17.476 17.476 590 1HH1 ARG 333 1HH2 ARG 33 -8.776 16.082 16.082 591 2HH1 ARG 333 2HH2 ARG 33 -9.660 17.074 17.074 592 1HH2 ARG 333 2HH1 ARG 33 -11.565 18.596 18.596 593 2HH2 ARG 333 1HH1 ARG 33 -11.239 18.501 18.501 594 H GLY 334 H GLY 34 -10.420 10.972 10.972 595 1HA GLY 334 2HA GLY 34 -12.121 11.529 11.529 596 2HA GLY 334 1HA GLY 34 -10.916 10.395 10.395 597 H ARG 335 H ARG 35 -11.901 8.432 8.432 598 HA ARG 335 HA ARG 35 -12.593 7.056 7.056 599 1HB ARG 335 2HB ARG 35 -14.585 8.659 8.659 600 2HB ARG 335 1HB ARG 35 -14.992 7.630 7.630 601 1HG ARG 335 2HG ARG 35 -15.485 5.797 5.797 602 2HG ARG 335 1HG ARG 35 -14.443 6.346 6.346 603 1HD ARG 335 2HD ARG 35 -16.062 8.263 8.263 604 2HD ARG 335 1HD ARG 35 -17.147 7.462 7.462 605 HE ARG 335 HE ARG 35 -16.224 6.081 6.081 606 1HH1 ARG 335 2HH1 ARG 35 -18.759 7.966 7.966 607 2HH1 ARG 335 1HH1 ARG 35 -19.997 6.777 6.777 608 1HH2 ARG 335 1HH2 ARG 35 -17.765 4.171 4.171 609 2HH2 ARG 335 2HH2 ARG 35 -19.433 4.626 4.626 610 H GLU 336 H GLU 36 -13.504 7.206 7.206 611 HA GLU 336 HA GLU 36 -13.525 4.322 4.322 612 1HB GLU 336 2HB GLU 36 -14.197 6.572 6.572 613 2HB GLU 336 1HB GLU 36 -13.016 5.615 5.615 614 1HG GLU 336 2HG GLU 36 -14.374 3.593 3.593 615 2HG GLU 336 1HG GLU 36 -15.544 4.523 4.523 616 H ARG 337 H ARG 37 -11.180 6.882 6.882 617 HA ARG 337 HA ARG 37 -9.208 5.133 5.133 618 1HB ARG 337 2HB ARG 37 -9.201 7.902 7.902 619 2HB ARG 337 1HB ARG 37 -7.651 7.093 7.093 620 1HG ARG 337 2HG ARG 37 -8.485 6.558 6.558 621 2HG ARG 337 1HG ARG 37 -9.741 7.760 7.760 622 1HD ARG 337 2HD ARG 37 -6.909 8.505 8.505 623 2HD ARG 337 1HD ARG 37 -7.412 8.454 8.454 624 HE ARG 337 HE ARG 37 -8.395 10.347 10.347 625 1HH1 ARG 337 2HH1 ARG 37 -10.846 10.383 10.383 626 2HH1 ARG 337 1HH1 ARG 37 -10.827 11.042 11.042 627 1HH2 ARG 337 1HH2 ARG 37 -7.422 10.571 10.571 628 2HH2 ARG 337 2HH2 ARG 37 -8.890 11.147 11.147 629 H PHE 338 H PHE 38 -9.726 6.340 6.340 630 HA PHE 338 HA PHE 38 -7.449 5.118 5.118 631 1HB PHE 338 2HB PHE 38 -8.723 6.703 6.703 632 2HB PHE 338 1HB PHE 38 -10.190 5.737 5.737 633 HD1 PHE 338 HD2 PHE 38 -6.709 5.639 5.639 634 HD2 PHE 338 HD1 PHE 38 -10.693 4.047 4.047 635 HE1 PHE 338 HE2 PHE 38 -6.093 4.364 4.364 636 HE2 PHE 338 HE1 PHE 38 -10.078 2.773 2.773 637 HZ PHE 338 HZ PHE 38 -7.777 2.931 2.931 638 H GLU 339 H GLU 39 -10.692 3.851 3.851 639 HA GLU 339 HA GLU 39 -10.405 1.337 1.337 640 1HB GLU 339 2HB GLU 39 -12.074 2.347 2.347 641 2HB GLU 339 1HB GLU 39 -12.024 0.614 0.614 642 1HG GLU 339 2HG GLU 39 -12.344 1.931 1.931 643 2HG GLU 339 1HG GLU 39 -13.515 2.628 2.628 644 H MET 340 H MET 40 -9.662 2.337 2.337 645 HA MET 340 HA MET 40 -8.771 -0.113 -0.113 646 1HB MET 340 2HB MET 40 -7.931 2.740 2.740 647 2HB MET 340 1HB MET 40 -7.077 1.425 1.425 648 1HG MET 340 2HG MET 40 -8.947 0.788 0.788 649 2HG MET 340 1HG MET 40 -10.075 1.491 1.491 650 1HE MET 340 1HE MET 40 -6.898 2.472 2.472 651 2HE MET 340 3HE MET 40 -7.178 4.056 4.056 652 3HE MET 340 2HE MET 40 -7.048 3.904 3.904 653 H PHE 341 H PHE 41 -6.799 2.367 2.367 654 HA PHE 341 HA PHE 41 -4.415 0.796 0.796 655 1HB PHE 341 2HB PHE 41 -5.444 3.128 3.128 656 2HB PHE 341 1HB PHE 41 -3.914 2.349 2.349 657 HD1 PHE 341 HD1 PHE 41 -5.542 3.070 3.070 658 HD2 PHE 341 HD2 PHE 41 -2.181 3.751 3.751 659 HE1 PHE 341 HE1 PHE 41 -4.417 4.351 4.351 660 HE2 PHE 341 HE2 PHE 41 -1.055 5.031 5.031 661 HZ PHE 341 HZ PHE 41 -2.174 5.331 5.331 662 H ARG 342 H ARG 42 -7.322 0.809 0.809 663 HA ARG 342 HA ARG 42 -6.289 -0.533 -0.533 664 1HB ARG 342 2HB ARG 42 -8.891 0.240 0.240 665 2HB ARG 342 1HB ARG 42 -8.946 -1.357 -1.357 666 1HG ARG 342 2HG ARG 42 -7.772 -0.379 -0.379 667 2HG ARG 342 1HG ARG 42 -7.966 1.213 1.213 668 1HD ARG 342 2HD ARG 42 -9.808 0.879 0.879 669 2HD ARG 342 1HD ARG 42 -10.444 0.775 0.775 670 HE ARG 342 HE ARG 42 -9.696 -1.837 -1.837 671 1HH1 ARG 342 1HH2 ARG 42 -11.450 -0.254 -0.254 672 2HH1 ARG 342 2HH2 ARG 42 -13.007 -0.908 -0.908 673 1HH2 ARG 342 2HH1 ARG 42 -11.967 -2.304 -2.304 674 2HH2 ARG 342 1HH1 ARG 42 -13.298 -2.074 -2.074 675 H GLU 343 H GLU 43 -7.593 -1.667 -1.667 676 HA GLU 343 HA GLU 43 -7.602 -4.463 -4.463 677 1HB GLU 343 2HB GLU 43 -8.806 -3.309 -3.309 678 2HB GLU 343 1HB GLU 43 -7.255 -3.430 -3.430 679 1HG GLU 343 2HG GLU 43 -7.564 -5.625 -5.625 680 2HG GLU 343 1HG GLU 43 -7.929 -5.940 -5.940 681 H LEU 344 H LEU 44 -5.291 -2.417 -2.417 682 HA LEU 344 HA LEU 44 -3.353 -4.484 -4.484 683 1HB LEU 344 2HB LEU 44 -3.213 -1.470 -1.470 684 2HB LEU 344 1HB LEU 44 -1.730 -2.411 -2.411 685 HG LEU 344 HG LEU 44 -2.203 -2.002 -2.002 686 1HD1 LEU 344 3HD1 LEU 44 -2.089 -4.514 -4.514 687 2HD1 LEU 344 2HD1 LEU 44 -3.812 -4.529 -4.529 688 3HD1 LEU 344 1HD1 LEU 44 -2.638 -4.100 -4.100 689 1HD2 LEU 344 2HD2 LEU 44 -4.924 -1.797 -1.797 690 2HD2 LEU 344 1HD2 LEU 44 -4.212 -1.117 -1.117 691 3HD2 LEU 344 3HD2 LEU 44 -4.854 -2.758 -2.758 692 H ASN 345 H ASN 45 -4.199 -2.513 -2.513 693 HA ASN 345 HA ASN 45 -1.763 -3.183 -3.183 694 1HB ASN 345 2HB ASN 45 -3.714 -1.182 -1.182 695 2HB ASN 345 1HB ASN 45 -3.999 -2.206 -2.206 696 1HD2 ASN 345 2HD2 ASN 45 -1.422 0.212 0.212 697 2HD2 ASN 345 1HD2 ASN 45 -3.072 0.245 0.245 698 H GLU 346 H GLU 46 -4.930 -4.472 -4.472 699 HA GLU 346 HA GLU 46 -5.058 -6.052 -6.052 700 1HB GLU 346 2HB GLU 46 -6.686 -5.639 -5.639 701 2HB GLU 346 1HB GLU 46 -6.645 -7.332 -7.332 702 1HG GLU 346 2HG GLU 46 -7.281 -6.669 -6.669 703 2HG GLU 346 1HG GLU 46 -7.355 -4.983 -4.983 704 H ALA 347 H ALA 47 -4.063 -6.637 -6.637 705 HA ALA 347 HA ALA 47 -3.494 -9.431 -9.431 706 1HB ALA 347 1HB ALA 47 -3.821 -8.413 -8.413 707 2HB ALA 347 3HB ALA 47 -2.336 -7.484 -7.484 708 3HB ALA 347 2HB ALA 47 -2.270 -9.243 -9.243 709 H LEU 348 H LEU 48 -1.418 -6.515 -6.515 710 HA LEU 348 HA LEU 48 1.014 -7.893 -7.893 711 1HB LEU 348 2HB LEU 48 0.168 -5.132 -5.132 712 2HB LEU 348 1HB LEU 48 1.822 -5.739 -5.739 713 HG LEU 348 HG LEU 48 -0.004 -5.662 -5.662 714 1HD1 LEU 348 2HD1 LEU 48 1.695 -3.487 -3.487 715 2HD1 LEU 348 1HD1 LEU 48 1.413 -3.545 -3.545 716 3HD1 LEU 348 3HD1 LEU 48 0.051 -3.381 -3.381 717 1HD2 LEU 348 3HD2 LEU 48 2.376 -6.902 -6.902 718 2HD2 LEU 348 2HD2 LEU 48 1.874 -6.233 -6.233 719 3HD2 LEU 348 1HD2 LEU 48 2.946 -5.309 -5.309 720 H GLU 349 H GLU 49 -1.543 -6.561 -6.561 721 HA GLU 349 HA GLU 49 -0.308 -7.263 -7.263 722 1HB GLU 349 2HB GLU 49 -2.490 -5.816 -5.816 723 2HB GLU 349 1HB GLU 49 -3.284 -7.350 -7.350 724 1HG GLU 349 2HG GLU 49 -2.832 -7.207 -7.207 725 2HG GLU 349 1HG GLU 49 -1.205 -6.585 -6.585 726 H LEU 350 H LEU 50 -2.097 -9.031 -9.031 727 HA LEU 350 HA LEU 50 -2.714 -11.316 -11.316 728 1HB LEU 350 2HB LEU 50 -3.886 -11.977 -11.977 729 2HB LEU 350 1HB LEU 50 -3.416 -10.454 -10.454 730 HG LEU 350 HG LEU 50 -1.275 -11.675 -11.675 731 1HD1 LEU 350 3HD1 LEU 50 -2.599 -13.742 -13.742 732 2HD1 LEU 350 2HD1 LEU 50 -2.450 -14.253 -14.253 733 3HD1 LEU 350 1HD1 LEU 50 -1.014 -13.787 -13.787 734 1HD2 LEU 350 3HD2 LEU 50 -4.060 -12.061 -12.061 735 2HD2 LEU 350 2HD2 LEU 50 -2.693 -11.245 -11.245 736 3HD2 LEU 350 1HD2 LEU 50 -2.774 -13.008 -13.008 737 H LYS 351 H LYS 51 0.053 -10.225 -10.225 738 HA LYS 351 HA LYS 51 1.442 -12.737 -12.737 739 1HB LYS 351 2HB LYS 51 1.997 -10.537 -10.537 740 2HB LYS 351 1HB LYS 51 2.763 -10.032 -10.032 741 1HG LYS 351 2HG LYS 51 4.432 -11.652 -11.652 742 2HG LYS 351 1HG LYS 51 3.462 -12.704 -12.704 743 1HD LYS 351 2HD LYS 51 3.627 -10.614 -10.614 744 2HD LYS 351 1HD LYS 51 5.103 -10.318 -10.318 745 1HE LYS 351 2HE LYS 51 5.822 -12.656 -12.656 746 2HE LYS 351 1HE LYS 51 4.380 -12.883 -12.883 747 1HZ LYS 351 2HZ LYS 51 6.247 -10.656 -10.656 748 2HZ LYS 351 1HZ LYS 51 6.538 -12.205 -12.205 749 3HZ LYS 351 3HZ LYS 51 5.122 -11.370 -11.370 750 H ASP 352 H ASP 52 1.404 -10.136 -10.136 751 HA ASP 352 HA ASP 52 3.335 -11.435 -11.435 752 1HB ASP 352 2HB ASP 52 2.720 -8.937 -8.937 753 2HB ASP 352 1HB ASP 52 1.279 -9.389 -9.389 754 H ALA 353 H ALA 53 -0.064 -11.741 -11.741 755 HA ALA 353 HA ALA 53 -0.503 -13.117 -13.117 756 1HB ALA 353 3HB ALA 53 -2.184 -11.499 -11.499 757 2HB ALA 353 2HB ALA 53 -2.521 -12.824 -12.824 758 3HB ALA 353 1HB ALA 53 -2.818 -13.027 -13.027 759 H GLN 354 H GLN 54 0.520 -13.874 -13.874 760 HA GLN 354 HA GLN 54 -0.702 -16.263 -16.263 761 1HB GLN 354 2HB GLN 54 2.118 -15.279 -15.279 762 2HB GLN 354 1HB GLN 54 1.776 -16.958 -16.958 763 1HG GLN 354 2HG GLN 54 -0.225 -15.854 -15.854 764 2HG GLN 354 1HG GLN 54 0.830 -14.443 -14.443 765 1HE2 GLN 354 2HE2 GLN 54 1.668 -17.459 -17.459 766 2HE2 GLN 354 1HE2 GLN 54 0.229 -17.392 -17.392 767 H ALA 355 HN ALA 55 -1.352 -17.646 -17.646 768 HA ALA 355 HA ALA 55 0.844 -18.938 -18.938 769 1HB ALA 355 3HB ALA 55 -1.616 -17.597 -17.597 770 2HB ALA 355 2HB ALA 55 -1.238 -19.151 -19.151 771 3HB ALA 355 1HB ALA 55 -0.065 -17.834 -17.834 772 1H GLY 325 1H GLY 25 -17.602 11.207 11.207 773 2H GLY 325 3H GLY 25 -17.639 12.515 12.515 774 3H GLY 325 2H GLY 25 -17.604 10.925 10.925 775 1HA GLY 325 2HA GLY 25 -15.398 10.619 10.619 776 2HA GLY 325 1HA GLY 25 -15.440 12.326 12.326 777 H GLU 326 H GLU 26 -13.533 11.053 11.053 778 HA GLU 326 HA GLU 26 -13.780 12.920 12.920 779 1HB GLU 326 2HB GLU 26 -14.806 10.295 10.295 780 2HB GLU 326 1HB GLU 26 -13.278 10.349 10.349 781 1HG GLU 326 2HG GLU 26 -14.142 12.607 12.607 782 2HG GLU 326 1HG GLU 26 -15.725 12.066 12.066 783 H TYR 327 H TYR 27 -11.831 12.084 12.084 784 HA TYR 327 HA TYR 27 -9.464 11.937 11.937 785 1HB TYR 327 2HB TYR 27 -10.045 13.203 13.203 786 2HB TYR 327 1HB TYR 27 -8.461 12.434 12.434 787 HD1 TYR 327 HD2 TYR 27 -7.113 12.918 12.918 788 HD2 TYR 327 HD1 TYR 27 -10.302 15.371 15.371 789 HE1 TYR 327 HE2 TYR 27 -6.272 14.833 14.833 790 HE2 TYR 327 HE1 TYR 27 -9.461 17.284 17.284 791 HH TYR 327 HH TYR 27 -7.278 18.009 18.009 792 H PHE 328 H PHE 28 -8.431 10.008 10.008 793 HA PHE 328 HA PHE 28 -8.755 8.076 8.076 794 1HB PHE 328 2HB PHE 28 -8.346 7.546 7.546 795 2HB PHE 328 1HB PHE 28 -8.376 6.298 6.298 796 HD1 PHE 328 HD2 PHE 28 -10.469 6.555 6.555 797 HD2 PHE 328 HD1 PHE 28 -10.344 7.941 7.941 798 HE1 PHE 328 HE2 PHE 28 -12.948 6.523 6.523 799 HE2 PHE 328 HE1 PHE 28 -12.822 7.910 7.910 800 HZ PHE 328 HZ PHE 28 -14.124 7.201 7.201 801 H THR 329 H THR 29 -6.841 6.548 6.548 802 HA THR 329 HA THR 29 -4.293 7.856 7.856 803 HB THR 329 HB THR 29 -4.232 6.587 6.587 804 HG1 THR 329 HG1 THR 29 -5.899 8.768 8.768 805 1HG2 THR 329 2HG2 THR 29 -2.518 8.100 8.100 806 2HG2 THR 329 1HG2 THR 29 -3.468 9.416 9.416 807 3HG2 THR 329 3HG2 THR 29 -2.673 8.251 8.251 808 H LEU 330 H LEU 30 -2.694 6.416 6.416 809 HA LEU 330 HA LEU 30 -3.345 3.508 3.508 810 1HB LEU 330 2HB LEU 30 -2.863 5.024 5.024 811 2HB LEU 330 1HB LEU 30 -1.412 4.056 4.056 812 HG LEU 330 HG LEU 30 -3.500 2.289 2.289 813 1HD1 LEU 330 3HD1 LEU 30 -4.735 4.324 4.324 814 2HD1 LEU 330 2HD1 LEU 30 -4.178 3.373 3.373 815 3HD1 LEU 330 1HD1 LEU 30 -5.226 2.639 2.639 816 1HD2 LEU 330 1HD2 LEU 30 -1.346 1.880 1.880 817 2HD2 LEU 330 3HD2 LEU 30 -2.738 1.202 1.202 818 3HD2 LEU 330 2HD2 LEU 30 -2.013 2.709 2.709 819 H GLN 331 H GLN 31 -2.164 3.383 3.383 820 HA GLN 331 HA GLN 31 0.628 4.249 4.249 821 1HB GLN 331 2HB GLN 31 -1.231 3.906 3.906 822 2HB GLN 331 1HB GLN 31 -0.392 2.357 2.357 823 1HG GLN 331 2HG GLN 31 1.782 3.647 3.647 824 2HG GLN 331 1HG GLN 31 0.825 5.121 5.121 825 1HE2 GLN 331 2HE2 GLN 31 1.457 4.192 4.192 826 2HE2 GLN 331 1HE2 GLN 31 2.291 4.882 4.882 827 H ILE 332 H ILE 32 2.117 3.083 3.083 828 HA ILE 332 HA ILE 32 1.806 0.110 0.110 829 HB ILE 332 HB ILE 32 3.313 1.942 1.942 830 1HG1 ILE 332 2HG1 ILE 32 1.245 0.308 0.308 831 2HG1 ILE 332 1HG1 ILE 32 0.569 1.251 1.251 832 1HG2 ILE 332 2HG2 ILE 32 2.945 -1.063 -1.063 833 2HG2 ILE 332 1HG2 ILE 32 3.476 -0.207 -0.207 834 3HG2 ILE 332 3HG2 ILE 32 4.462 -0.164 -0.164 835 1HD1 ILE 332 1HD1 ILE 32 2.415 2.675 2.675 836 2HD1 ILE 332 3HD1 ILE 32 0.822 2.253 2.253 837 3HD1 ILE 332 2HD1 ILE 32 0.963 3.261 3.261 838 H ARG 333 H ARG 33 3.262 -0.990 -0.990 839 HA ARG 333 HA ARG 33 5.568 0.451 0.451 840 1HB ARG 333 2HB ARG 33 3.987 -1.335 -1.335 841 2HB ARG 333 1HB ARG 33 5.114 -2.481 -2.481 842 1HG ARG 333 2HG ARG 33 6.496 -0.238 -0.238 843 2HG ARG 333 1HG ARG 33 5.490 -1.125 -1.125 844 1HD ARG 333 2HD ARG 33 7.231 -2.658 -2.658 845 2HD ARG 333 1HD ARG 33 7.959 -1.922 -1.922 846 HE ARG 333 HE ARG 33 5.971 -3.228 -3.228 847 1HH1 ARG 333 1HH2 ARG 33 5.515 -4.736 -4.736 848 2HH1 ARG 333 2HH2 ARG 33 6.427 -6.181 -6.181 849 1HH2 ARG 333 2HH1 ARG 33 8.188 -4.855 -4.855 850 2HH2 ARG 333 1HH1 ARG 33 7.943 -6.248 -6.248 851 H GLY 334 H GLY 34 7.114 0.702 0.702 852 1HA GLY 334 2HA GLY 34 8.890 -1.381 -1.381 853 2HA GLY 334 1HA GLY 34 7.736 -1.327 -1.327 854 H ARG 335 H ARG 35 8.761 -0.306 -0.306 855 HA ARG 335 HA ARG 35 9.388 2.490 2.490 856 1HB ARG 335 2HB ARG 35 11.360 1.370 1.370 857 2HB ARG 335 1HB ARG 35 11.840 0.759 0.759 858 1HG ARG 335 2HG ARG 35 12.324 2.878 2.878 859 2HG ARG 335 1HG ARG 35 11.220 3.678 3.678 860 1HD ARG 335 2HD ARG 35 12.783 2.989 2.989 861 2HD ARG 335 1HD ARG 35 13.929 2.483 2.483 862 HE ARG 335 HE ARG 35 12.930 5.300 5.300 863 1HH1 ARG 335 2HH1 ARG 35 15.473 3.537 3.537 864 2HH1 ARG 335 1HH1 ARG 35 16.718 4.403 4.403 865 1HH2 ARG 335 1HH2 ARG 35 14.509 6.165 6.165 866 2HH2 ARG 335 2HH2 ARG 35 16.173 5.890 5.890 867 H GLU 336 H GLU 36 10.431 -0.497 -0.497 868 HA GLU 336 HA GLU 36 10.523 0.811 0.811 869 1HB GLU 336 2HB GLU 36 11.214 -1.742 -1.742 870 2HB GLU 336 1HB GLU 36 10.084 -2.014 -2.014 871 1HG GLU 336 2HG GLU 36 11.462 -0.627 -0.627 872 2HG GLU 336 1HG GLU 36 12.579 -0.297 -0.297 873 H ARG 337 H ARG 37 8.160 -1.309 -1.309 874 HA ARG 337 HA ARG 37 6.269 -1.362 -1.362 875 1HB ARG 337 2HB ARG 37 6.164 -1.878 -1.878 876 2HB ARG 337 1HB ARG 37 4.639 -1.677 -1.677 877 1HG ARG 337 2HG ARG 37 5.575 -3.378 -3.378 878 2HG ARG 337 1HG ARG 37 6.792 -3.741 -3.741 879 1HD ARG 337 2HD ARG 37 3.925 -3.690 -3.690 880 2HD ARG 337 1HD ARG 37 4.492 -5.077 -5.077 881 HE ARG 337 HE ARG 37 5.359 -4.350 -4.350 882 1HH1 ARG 337 2HH1 ARG 37 7.844 -5.129 -5.129 883 2HH1 ARG 337 1HH1 ARG 37 7.877 -6.835 -6.835 884 1HH2 ARG 337 1HH2 ARG 37 4.498 -7.034 -7.034 885 2HH2 ARG 337 2HH2 ARG 37 5.982 -7.913 -7.913 886 H PHE 338 H PHE 38 6.631 0.807 0.807 887 HA PHE 338 HA PHE 38 4.333 2.409 2.409 888 1HB PHE 338 2HB PHE 38 5.523 2.684 2.684 889 2HB PHE 338 1HB PHE 38 7.015 3.099 3.099 890 HD1 PHE 338 HD2 PHE 38 3.487 4.219 4.219 891 HD2 PHE 338 HD1 PHE 38 7.490 5.337 5.337 892 HE1 PHE 338 HE2 PHE 38 2.814 6.605 6.605 893 HE2 PHE 338 HE1 PHE 38 6.817 7.723 7.723 894 HZ PHE 338 HZ PHE 38 4.478 8.358 8.358 895 H GLU 339 H GLU 39 7.627 2.557 2.557 896 HA GLU 339 HA GLU 39 7.339 5.009 5.009 897 1HB GLU 339 2HB GLU 39 9.079 2.580 2.580 898 2HB GLU 339 1HB GLU 39 9.048 3.773 3.773 899 1HG GLU 339 2HG GLU 39 9.236 5.199 5.199 900 2HG GLU 339 1HG GLU 39 10.440 3.909 3.909 901 H MET 340 H MET 40 6.706 1.633 1.633 902 HA MET 340 HA MET 40 5.909 2.043 2.043 903 1HB MET 340 2HB MET 40 5.034 0.108 0.108 904 2HB MET 340 1HB MET 40 4.227 0.114 0.114 905 1HG MET 340 2HG MET 40 6.140 -0.558 -0.558 906 2HG MET 340 1HG MET 40 7.225 0.071 0.071 907 1HE MET 340 1HE MET 40 4.100 -1.953 -1.953 908 2HE MET 340 3HE MET 40 4.375 -3.421 -3.421 909 3HE MET 340 2HE MET 40 4.181 -1.868 -1.868 910 H PHE 341 H PHE 41 3.819 2.075 2.075 911 HA PHE 341 HA PHE 41 1.467 2.955 2.955 912 1HB PHE 341 2HB PHE 41 2.388 3.097 3.097 913 2HB PHE 341 1HB PHE 41 0.860 3.821 3.821 914 HD1 PHE 341 HD1 PHE 41 2.592 0.678 0.678 915 HD2 PHE 341 HD2 PHE 41 -0.869 2.430 2.430 916 HE1 PHE 341 HE1 PHE 41 1.508 -1.550 -1.550 917 HE2 PHE 341 HE2 PHE 41 -1.953 0.201 0.201 918 HZ PHE 341 HZ PHE 41 -0.764 -1.789 -1.789 919 H ARG 342 H ARG 42 4.300 4.629 4.629 920 HA ARG 342 HA ARG 42 3.203 7.285 7.285 921 1HB ARG 342 2HB ARG 42 5.826 6.039 6.039 922 2HB ARG 342 1HB ARG 42 5.890 7.521 7.521 923 1HG ARG 342 2HG ARG 42 4.614 8.672 8.672 924 2HG ARG 342 1HG ARG 42 4.797 7.207 7.207 925 1HD ARG 342 2HD ARG 42 6.586 8.708 8.708 926 2HD ARG 342 1HD ARG 42 7.291 7.397 7.397 927 HE ARG 342 HE ARG 42 6.556 9.610 9.610 928 1HH1 ARG 342 1HH2 ARG 42 8.204 10.547 10.547 929 2HH1 ARG 342 2HH2 ARG 42 9.786 10.600 10.600 930 1HH2 ARG 342 2HH1 ARG 42 8.880 8.783 8.783 931 2HH2 ARG 342 1HH1 ARG 42 10.170 9.599 9.599 932 H GLU 343 H GLU 43 4.661 5.309 5.309 933 HA GLU 343 HA GLU 43 4.688 7.417 7.417 934 1HB GLU 343 2HB GLU 43 5.944 5.147 5.147 935 2HB GLU 343 1HB GLU 43 4.432 4.485 4.485 936 1HG GLU 343 2HG GLU 43 4.800 5.354 5.354 937 2HG GLU 343 1HG GLU 43 5.140 6.948 6.948 938 H LEU 344 H LEU 44 2.419 4.731 4.731 939 HA LEU 344 HA LEU 44 0.538 5.444 5.444 940 1HB LEU 344 2HB LEU 44 0.342 3.903 3.903 941 2HB LEU 344 1HB LEU 44 -1.121 4.299 4.299 942 HG LEU 344 HG LEU 44 -0.576 2.190 2.190 943 1HD1 LEU 344 3HD1 LEU 44 -0.675 4.077 4.077 944 2HD1 LEU 344 2HD1 LEU 44 1.068 3.844 3.844 945 3HD1 LEU 344 1HD1 LEU 44 -0.030 2.511 2.511 946 1HD2 LEU 344 2HD2 LEU 44 2.093 2.946 2.946 947 2HD2 LEU 344 1HD2 LEU 44 1.425 1.336 1.336 948 3HD2 LEU 344 3HD2 LEU 44 2.115 2.237 2.237 949 H ASN 345 H ASN 45 1.228 6.720 6.720 950 HA ASN 345 HA ASN 45 -1.249 8.294 8.294 951 1HB ASN 345 2HB ASN 45 0.650 7.425 7.425 952 2HB ASN 345 1HB ASN 45 0.902 9.167 9.167 953 1HD2 ASN 345 2HD2 ASN 45 -1.768 8.725 8.725 954 2HD2 ASN 345 1HD2 ASN 45 -0.104 8.409 8.409 955 H GLU 346 H GLU 46 1.962 8.614 8.614 956 HA GLU 346 HA GLU 46 2.032 11.518 11.518 957 1HB GLU 346 2HB GLU 46 3.736 9.308 9.308 958 2HB GLU 346 1HB GLU 46 3.709 10.630 10.630 959 1HG GLU 346 2HG GLU 46 4.250 12.229 12.229 960 2HG GLU 346 1HG GLU 46 4.305 10.896 10.896 961 H ALA 347 H ALA 47 1.162 8.977 8.977 962 HA ALA 347 HA ALA 47 0.632 10.764 10.764 963 1HB ALA 347 1HB ALA 47 0.957 8.328 8.328 964 2HB ALA 347 3HB ALA 47 -0.541 8.025 8.025 965 3HB ALA 347 2HB ALA 47 -0.585 8.856 8.856 966 H LEU 348 H LEU 48 -1.529 9.220 9.220 967 HA LEU 348 HA LEU 48 -3.937 10.443 10.443 968 1HB LEU 348 2HB LEU 48 -3.165 9.777 9.777 969 2HB LEU 348 1HB LEU 48 -4.804 9.968 9.968 970 HG LEU 348 HG LEU 48 -2.891 7.938 7.938 971 1HD1 LEU 348 2HD1 LEU 48 -4.673 7.757 7.757 972 2HD1 LEU 348 1HD1 LEU 48 -4.330 6.326 6.326 973 3HD1 LEU 348 3HD1 LEU 48 -3.011 7.200 7.200 974 1HD2 LEU 348 3HD2 LEU 48 -5.253 8.852 8.852 975 2HD2 LEU 348 2HD2 LEU 48 -4.712 7.191 7.191 976 3HD2 LEU 348 1HD2 LEU 48 -5.842 7.576 7.576 977 H GLU 349 H GLU 49 -1.483 11.543 11.543 978 HA GLU 349 HA GLU 49 -2.795 14.002 14.002 979 1HB GLU 349 2HB GLU 49 -0.626 12.755 12.755 980 2HB GLU 349 1HB GLU 49 0.189 13.893 13.893 981 1HG GLU 349 2HG GLU 49 -0.350 15.685 15.685 982 2HG GLU 349 1HG GLU 49 -1.978 15.084 15.084 983 H LEU 350 H LEU 50 -0.878 12.942 12.942 984 HA LEU 350 HA LEU 50 -0.270 15.579 15.579 985 1HB LEU 350 2HB LEU 50 0.968 14.407 14.407 986 2HB LEU 350 1HB LEU 50 0.505 12.964 12.964 987 HG LEU 350 HG LEU 50 -1.594 12.905 12.905 988 1HD1 LEU 350 3HD1 LEU 50 -0.298 15.314 15.314 989 2HD1 LEU 350 2HD1 LEU 50 -0.405 14.153 14.153 990 3HD1 LEU 350 1HD1 LEU 50 -1.864 14.656 14.656 991 1HD2 LEU 350 3HD2 LEU 50 1.233 12.335 12.335 992 2HD2 LEU 350 2HD2 LEU 50 -0.110 11.219 11.219 993 3HD2 LEU 350 1HD2 LEU 50 -0.020 12.173 12.173 994 H LYS 351 H LYS 51 -2.986 13.402 13.402 995 HA LYS 351 HA LYS 51 -4.322 14.568 14.568 996 1HB LYS 351 2HB LYS 51 -4.867 12.351 12.351 997 2HB LYS 351 1HB LYS 51 -5.703 13.331 13.331 998 1HG LYS 351 2HG LYS 51 -7.327 14.049 14.049 999 2HG LYS 351 1HG LYS 51 -6.299 13.746 13.746 1000 1HD LYS 351 2HD LYS 51 -6.458 11.234 11.234 1001 2HD LYS 351 1HD LYS 51 -7.970 11.835 11.835 1002 1HE LYS 351 2HE LYS 51 -8.624 12.672 12.672 1003 2HE LYS 351 1HE LYS 51 -7.142 11.990 11.990 1004 1HZ LYS 351 2HZ LYS 51 -9.023 10.318 10.318 1005 2HZ LYS 351 1HZ LYS 51 -9.273 10.607 10.607 1006 3HZ LYS 351 3HZ LYS 51 -7.854 9.838 9.838 1007 H ASP 352 H ASP 52 -4.431 15.217 15.217 1008 HA ASP 352 HA ASP 52 -6.407 17.330 17.330 1009 1HB ASP 352 2HB ASP 52 -5.839 15.967 15.967 1010 2HB ASP 352 1HB ASP 52 -4.430 17.018 17.018 1011 H ALA 353 H ALA 53 -2.976 17.103 17.103 1012 HA ALA 353 HA ALA 53 -2.615 20.036 20.036 1013 1HB ALA 353 3HB ALA 53 -0.922 18.261 18.261 1014 2HB ALA 353 2HB ALA 53 -0.516 18.050 18.050 1015 3HB ALA 353 1HB ALA 53 -0.287 19.618 19.618 1016 H GLN 354 H GLN 54 -3.503 17.772 17.772 1017 HA GLN 354 HA GLN 54 -2.205 18.481 18.481 1018 1HB GLN 354 2HB GLN 54 -5.027 17.697 17.697 1019 2HB GLN 354 1HB GLN 54 -4.650 18.253 18.253 1020 1HG GLN 354 2HG GLN 54 -2.608 16.590 16.590 1021 2HG GLN 354 1HG GLN 54 -3.666 15.827 15.827 1022 1HE2 GLN 354 2HE2 GLN 54 -4.348 15.194 15.194 1023 2HE2 GLN 354 1HE2 GLN 54 -2.947 15.959 15.959 1024 H ALA 355 HN ALA 55 -1.591 20.614 20.614 1025 HA ALA 355 HA ALA 55 -3.822 22.570 22.570 1026 1HB ALA 355 3HB ALA 55 -1.419 22.748 22.748 1027 2HB ALA 355 2HB ALA 55 -1.817 24.198 24.198 1028 3HB ALA 355 1HB ALA 55 -3.002 23.507 23.507 Start of MODEL 7 1 1H GLY 325 3H GLY 25 13.357 0.749 0.749 2 2H GLY 325 2H GLY 25 14.686 1.338 1.338 3 3H GLY 325 1H GLY 25 13.708 2.409 2.409 4 1HA GLY 325 2HA GLY 25 11.952 2.275 2.275 5 2HA GLY 325 1HA GLY 25 13.377 2.292 2.292 6 H GLU 326 H GLU 26 11.680 -0.218 -0.218 7 HA GLU 326 HA GLU 26 11.772 -1.934 -1.934 8 1HB GLU 326 2HB GLU 26 13.155 -2.680 -2.680 9 2HB GLU 326 1HB GLU 26 11.631 -2.913 -2.913 10 1HG GLU 326 2HG GLU 26 11.143 -4.808 -4.808 11 2HG GLU 326 1HG GLU 26 11.680 -4.124 -4.124 12 H TYR 327 H TYR 27 9.916 -3.431 -3.431 13 HA TYR 327 HA TYR 27 7.431 -2.185 -2.185 14 1HB TYR 327 2HB TYR 27 8.140 -3.563 -3.563 15 2HB TYR 327 1HB TYR 27 6.513 -3.838 -3.838 16 HD1 TYR 327 HD1 TYR 27 5.114 -1.775 -1.775 17 HD2 TYR 327 HD2 TYR 27 8.664 -1.560 -1.560 18 HE1 TYR 327 HE1 TYR 27 4.411 0.451 0.451 19 HE2 TYR 327 HE2 TYR 27 7.962 0.664 0.664 20 HH TYR 327 HH TYR 27 4.796 1.932 1.932 21 H PHE 328 H PHE 28 6.475 -3.293 -3.293 22 HA PHE 328 HA PHE 28 6.939 -6.247 -6.247 23 1HB PHE 328 2HB PHE 28 6.430 -4.260 -4.260 24 2HB PHE 328 1HB PHE 28 6.527 -6.008 -6.008 25 HD1 PHE 328 HD1 PHE 28 8.677 -7.202 -7.202 26 HD2 PHE 328 HD2 PHE 28 8.390 -2.939 -2.939 27 HE1 PHE 328 HE1 PHE 28 11.148 -7.049 -7.049 28 HE2 PHE 328 HE2 PHE 28 10.861 -2.786 -2.786 29 HZ PHE 328 HZ PHE 28 12.241 -4.841 -4.841 30 H THR 329 H THR 29 5.142 -7.568 -7.568 31 HA THR 329 HA THR 29 2.483 -6.229 -6.229 32 HB THR 329 HB THR 29 2.664 -9.155 -9.155 33 HG1 THR 329 HG1 THR 29 3.782 -9.065 -9.065 34 1HG2 THR 329 2HG2 THR 29 0.826 -7.335 -7.335 35 2HG2 THR 329 1HG2 THR 29 1.747 -7.301 -7.301 36 3HG2 THR 329 3HG2 THR 29 1.035 -8.812 -8.812 37 H LEU 330 H LEU 30 1.128 -6.275 -6.275 38 HA LEU 330 HA LEU 30 1.764 -8.221 -8.221 39 1HB LEU 330 2HB LEU 30 0.971 -5.408 -5.408 40 2HB LEU 330 1HB LEU 30 -0.103 -6.373 -6.373 41 HG LEU 330 HG LEU 30 2.892 -6.650 -6.650 42 1HD1 LEU 330 3HD1 LEU 30 1.135 -4.457 -4.457 43 2HD1 LEU 330 2HD1 LEU 30 2.326 -5.099 -5.099 44 3HD1 LEU 330 1HD1 LEU 30 2.850 -4.423 -4.423 45 1HD2 LEU 330 3HD2 LEU 30 0.833 -8.064 -8.064 46 2HD2 LEU 330 2HD2 LEU 30 2.422 -7.892 -7.892 47 3HD2 LEU 330 1HD2 LEU 30 1.098 -6.836 -6.836 48 H GLN 331 H GLN 31 0.581 -9.993 -9.993 49 HA GLN 331 HA GLN 31 -2.231 -9.568 -9.568 50 1HB GLN 331 2HB GLN 31 -0.387 -11.963 -11.963 51 2HB GLN 331 1HB GLN 31 -2.112 -12.129 -12.129 52 1HG GLN 331 2HG GLN 31 -1.984 -10.652 -10.652 53 2HG GLN 331 1HG GLN 31 -0.286 -10.312 -10.312 54 1HE2 GLN 331 2HE2 GLN 31 0.519 -12.950 -12.950 55 2HE2 GLN 331 1HE2 GLN 31 0.667 -11.298 -11.298 56 H ILE 332 H ILE 32 -3.600 -9.297 -9.297 57 HA ILE 332 HA ILE 32 -3.208 -11.037 -11.037 58 HB ILE 332 HB ILE 32 -4.636 -8.372 -8.372 59 1HG1 ILE 332 2HG1 ILE 32 -2.413 -8.557 -8.557 60 2HG1 ILE 332 1HG1 ILE 32 -1.902 -8.942 -8.942 61 1HG2 ILE 332 1HG2 ILE 32 -5.525 -10.093 -10.093 62 2HG2 ILE 332 3HG2 ILE 32 -3.988 -9.887 -9.887 63 3HG2 ILE 332 2HG2 ILE 32 -5.074 -8.512 -8.512 64 1HD1 ILE 332 3HD1 ILE 32 -2.934 -6.848 -6.848 65 2HD1 ILE 332 2HD1 ILE 32 -3.437 -6.461 -6.461 66 3HD1 ILE 332 1HD1 ILE 32 -1.722 -6.519 -6.519 67 H ARG 333 H ARG 33 -4.922 -12.311 -12.311 68 HA ARG 333 HA ARG 33 -7.190 -12.531 -12.531 69 1HB ARG 333 2HB ARG 33 -5.767 -14.517 -14.517 70 2HB ARG 333 1HB ARG 33 -6.744 -14.322 -14.322 71 1HG ARG 333 2HG ARG 33 -8.756 -14.324 -14.324 72 2HG ARG 333 1HG ARG 33 -7.605 -15.135 -15.135 73 1HD ARG 333 2HD ARG 33 -8.874 -16.799 -16.799 74 2HD ARG 333 1HD ARG 33 -7.183 -16.818 -16.818 75 HE ARG 333 HE ARG 33 -9.185 -15.261 -15.261 76 1HH1 ARG 333 2HH1 ARG 33 -7.336 -14.962 -14.962 77 2HH1 ARG 333 1HH1 ARG 33 -6.967 -16.465 -16.465 78 1HH2 ARG 333 1HH2 ARG 33 -8.486 -18.402 -18.402 79 2HH2 ARG 333 2HH2 ARG 33 -7.619 -18.414 -18.414 80 H GLY 334 H GLY 34 -9.298 -12.050 -12.050 81 1HA GLY 334 2HA GLY 34 -10.809 -11.970 -11.970 82 2HA GLY 334 1HA GLY 34 -9.617 -10.798 -10.798 83 H ARG 335 H ARG 35 -10.457 -8.797 -8.797 84 HA ARG 335 HA ARG 35 -11.044 -7.560 -7.560 85 1HB ARG 335 2HB ARG 35 -13.047 -9.037 -9.037 86 2HB ARG 335 1HB ARG 35 -13.534 -8.326 -8.326 87 1HG ARG 335 2HG ARG 35 -13.844 -6.168 -6.168 88 2HG ARG 335 1HG ARG 35 -13.034 -6.656 -6.656 89 1HD ARG 335 2HD ARG 35 -15.686 -7.711 -7.711 90 2HD ARG 335 1HD ARG 35 -15.450 -6.642 -6.642 91 HE ARG 335 HE ARG 35 -13.888 -8.957 -8.957 92 1HH1 ARG 335 2HH1 ARG 35 -16.409 -7.608 -7.608 93 2HH1 ARG 335 1HH1 ARG 35 -17.374 -9.029 -9.029 94 1HH2 ARG 335 1HH2 ARG 35 -15.461 -10.983 -10.983 95 2HH2 ARG 335 2HH2 ARG 35 -16.837 -10.940 -10.940 96 H GLU 336 H GLU 36 -12.078 -7.654 -7.654 97 HA GLU 336 HA GLU 36 -12.275 -4.764 -4.764 98 1HB GLU 336 2HB GLU 36 -12.700 -7.082 -7.082 99 2HB GLU 336 1HB GLU 36 -11.890 -5.769 -5.769 100 1HG GLU 336 2HG GLU 36 -13.682 -4.226 -4.226 101 2HG GLU 336 1HG GLU 36 -14.554 -5.701 -5.701 102 H ARG 337 H ARG 37 -9.939 -7.137 -7.137 103 HA ARG 337 HA ARG 37 -8.079 -5.284 -5.284 104 1HB ARG 337 2HB ARG 37 -8.155 -8.087 -8.087 105 2HB ARG 337 1HB ARG 37 -6.661 -7.478 -7.478 106 1HG ARG 337 2HG ARG 37 -5.820 -6.743 -6.743 107 2HG ARG 337 1HG ARG 37 -7.424 -6.530 -6.530 108 1HD ARG 337 2HD ARG 37 -6.039 -9.176 -9.176 109 2HD ARG 337 1HD ARG 37 -6.351 -8.467 -8.467 110 HE ARG 337 HE ARG 37 -8.864 -8.642 -8.642 111 1HH1 ARG 337 2HH1 ARG 37 -8.489 -10.953 -10.953 112 2HH1 ARG 337 1HH1 ARG 37 -8.506 -12.272 -12.272 113 1HH2 ARG 337 1HH2 ARG 37 -7.919 -10.269 -10.269 114 2HH2 ARG 337 2HH2 ARG 37 -8.184 -11.886 -11.886 115 H PHE 338 H PHE 38 -8.241 -6.707 -6.707 116 HA PHE 338 HA PHE 38 -5.980 -5.394 -5.394 117 1HB PHE 338 2HB PHE 38 -7.178 -7.171 -7.171 118 2HB PHE 338 1HB PHE 38 -8.589 -6.127 -6.127 119 HD1 PHE 338 HD2 PHE 38 -5.045 -6.583 -6.583 120 HD2 PHE 338 HD1 PHE 38 -8.673 -4.376 -4.376 121 HE1 PHE 338 HE2 PHE 38 -4.076 -5.592 -5.592 122 HE2 PHE 338 HE1 PHE 38 -7.703 -3.385 -3.385 123 HZ PHE 338 HZ PHE 38 -5.405 -3.993 -3.993 124 H GLU 339 H GLU 39 -9.275 -4.234 -4.234 125 HA GLU 339 HA GLU 39 -8.982 -1.807 -1.807 126 1HB GLU 339 2HB GLU 39 -10.937 -2.941 -2.941 127 2HB GLU 339 1HB GLU 39 -10.836 -1.179 -1.179 128 1HG GLU 339 2HG GLU 39 -10.785 -2.272 -2.272 129 2HG GLU 339 1HG GLU 39 -12.258 -2.681 -2.681 130 H MET 340 H MET 40 -8.462 -2.635 -2.635 131 HA MET 340 HA MET 40 -7.940 -0.077 -0.077 132 1HB MET 340 2HB MET 40 -6.795 -2.767 -2.767 133 2HB MET 340 1HB MET 40 -6.358 -1.311 -1.311 134 1HG MET 340 2HG MET 40 -8.906 -0.923 -0.923 135 2HG MET 340 1HG MET 40 -9.067 -2.613 -2.613 136 1HE MET 340 3HE MET 40 -6.942 -4.059 -4.059 137 2HE MET 340 2HE MET 40 -5.775 -2.995 -2.995 138 3HE MET 340 1HE MET 40 -6.567 -4.260 -4.260 139 H PHE 341 H PHE 41 -5.587 -2.367 -2.367 140 HA PHE 341 HA PHE 41 -3.353 -0.634 -0.634 141 1HB PHE 341 2HB PHE 41 -4.081 -3.033 -3.033 142 2HB PHE 341 1HB PHE 41 -2.557 -2.196 -2.196 143 HD1 PHE 341 HD1 PHE 41 -1.757 -1.459 -1.459 144 HD2 PHE 341 HD2 PHE 41 -3.675 -5.036 -5.036 145 HE1 PHE 341 HE1 PHE 41 -0.857 -2.713 -2.713 146 HE2 PHE 341 HE2 PHE 41 -2.782 -6.285 -6.285 147 HZ PHE 341 HZ PHE 41 -1.381 -5.126 -5.126 148 H ARG 342 H ARG 42 -5.804 -1.216 -1.216 149 HA ARG 342 HA ARG 42 -4.783 0.175 0.175 150 1HB ARG 342 2HB ARG 42 -7.302 -0.845 -0.845 151 2HB ARG 342 1HB ARG 42 -7.575 0.844 0.844 152 1HG ARG 342 2HG ARG 42 -6.078 0.272 0.272 153 2HG ARG 342 1HG ARG 42 -6.536 -1.391 -1.391 154 1HD ARG 342 2HD ARG 42 -8.228 -0.697 -0.697 155 2HD ARG 342 1HD ARG 42 -8.965 -0.456 -0.456 156 HE ARG 342 HE ARG 42 -7.610 1.831 1.831 157 1HH1 ARG 342 1HH1 ARG 42 -10.692 2.656 2.656 158 2HH1 ARG 342 2HH1 ARG 42 -9.198 1.983 1.983 159 1HH2 ARG 342 1HH2 ARG 42 -10.049 1.970 1.970 160 2HH2 ARG 342 2HH2 ARG 42 -11.174 2.647 2.647 161 H GLU 343 H GLU 43 -6.350 1.429 1.429 162 HA GLU 343 HA GLU 43 -6.359 4.188 4.188 163 1HB GLU 343 2HB GLU 43 -7.773 3.029 3.029 164 2HB GLU 343 1HB GLU 43 -6.388 3.432 3.432 165 1HG GLU 343 2HG GLU 43 -7.581 5.388 5.388 166 2HG GLU 343 1HG GLU 43 -6.679 5.801 5.801 167 H LEU 344 H LEU 44 -4.422 2.516 2.516 168 HA LEU 344 HA LEU 44 -2.663 4.552 4.552 169 1HB LEU 344 2HB LEU 44 -2.098 1.600 1.600 170 2HB LEU 344 1HB LEU 44 -0.908 2.715 2.715 171 HG LEU 344 HG LEU 44 -1.876 1.927 1.927 172 1HD1 LEU 344 2HD1 LEU 44 -2.243 4.481 4.481 173 2HD1 LEU 344 1HD1 LEU 44 -3.948 4.043 4.043 174 3HD1 LEU 344 3HD1 LEU 44 -3.054 3.702 3.702 175 1HD2 LEU 344 3HD2 LEU 44 -3.680 0.729 0.729 176 2HD2 LEU 344 2HD2 LEU 44 -4.008 1.019 1.019 177 3HD2 LEU 344 1HD2 LEU 44 -4.693 2.089 2.089 178 H ASN 345 H ASN 45 -1.986 2.175 2.175 179 HA ASN 345 HA ASN 45 0.259 3.607 3.607 180 1HB ASN 345 2HB ASN 45 0.295 2.042 2.042 181 2HB ASN 345 1HB ASN 45 -0.570 1.164 1.164 182 1HD2 ASN 345 2HD2 ASN 45 -3.334 0.682 0.682 183 2HD2 ASN 345 1HD2 ASN 45 -2.360 0.105 0.105 184 H GLU 346 H GLU 46 -3.183 4.028 4.028 185 HA GLU 346 HA GLU 46 -3.047 5.519 5.519 186 1HB GLU 346 2HB GLU 46 -5.148 4.617 4.617 187 2HB GLU 346 1HB GLU 46 -5.036 5.913 5.913 188 1HG GLU 346 2HG GLU 46 -6.324 7.044 7.044 189 2HG GLU 346 1HG GLU 46 -4.772 7.345 7.345 190 H ALA 347 H ALA 47 -2.934 6.579 6.579 191 HA ALA 347 HA ALA 47 -2.661 9.387 9.387 192 1HB ALA 347 3HB ALA 47 -1.959 7.907 7.907 193 2HB ALA 347 2HB ALA 47 -2.062 9.660 9.660 194 3HB ALA 347 1HB ALA 47 -3.509 8.670 8.670 195 H LEU 348 H LEU 48 -0.367 6.793 6.793 196 HA LEU 348 HA LEU 48 1.985 8.352 8.352 197 1HB LEU 348 2HB LEU 48 1.740 5.615 5.615 198 2HB LEU 348 1HB LEU 48 3.198 6.317 6.317 199 HG LEU 348 HG LEU 48 0.691 5.941 5.941 200 1HD1 LEU 348 2HD1 LEU 48 2.217 3.863 3.863 201 2HD1 LEU 348 1HD1 LEU 48 2.714 3.954 3.954 202 3HD1 LEU 348 3HD1 LEU 48 1.015 3.718 3.718 203 1HD2 LEU 348 1HD2 LEU 48 3.598 6.512 6.512 204 2HD2 LEU 348 3HD2 LEU 48 2.179 7.317 7.317 205 3HD2 LEU 348 2HD2 LEU 48 2.641 5.720 5.720 206 H GLU 349 H GLU 49 0.559 6.808 6.808 207 HA GLU 349 HA GLU 49 2.403 7.924 7.924 208 1HB GLU 349 2HB GLU 49 0.783 6.047 6.047 209 2HB GLU 349 1HB GLU 49 -0.508 7.249 7.249 210 1HG GLU 349 2HG GLU 49 0.218 8.175 8.175 211 2HG GLU 349 1HG GLU 49 1.908 7.785 7.785 212 H LEU 350 H LEU 50 -0.492 9.214 9.214 213 HA LEU 350 HA LEU 50 -0.796 11.447 11.447 214 1HB LEU 350 2HB LEU 50 -2.668 11.677 11.677 215 2HB LEU 350 1HB LEU 50 -2.114 10.369 10.369 216 HG LEU 350 HG LEU 50 -0.758 12.097 12.097 217 1HD1 LEU 350 2HD1 LEU 50 -1.599 13.676 13.676 218 2HD1 LEU 350 1HD1 LEU 50 -2.416 14.315 14.315 219 3HD1 LEU 350 3HD1 LEU 50 -0.658 14.186 14.186 220 1HD2 LEU 350 3HD2 LEU 50 -3.174 11.200 11.200 221 2HD2 LEU 350 2HD2 LEU 50 -2.569 12.593 12.593 222 3HD2 LEU 350 1HD2 LEU 50 -3.673 12.828 12.828 223 H LYS 351 H LYS 51 1.253 10.713 10.713 224 HA LYS 351 HA LYS 51 2.110 13.378 13.378 225 1HB LYS 351 2HB LYS 51 2.562 11.285 11.285 226 2HB LYS 351 1HB LYS 51 3.823 10.902 10.902 227 1HG LYS 351 2HG LYS 51 5.189 12.601 12.601 228 2HG LYS 351 1HG LYS 51 3.838 13.668 13.668 229 1HD LYS 351 2HD LYS 51 5.058 12.913 12.913 230 2HD LYS 351 1HD LYS 51 3.371 12.402 12.402 231 1HE LYS 351 2HE LYS 51 3.969 10.234 10.234 232 2HE LYS 351 1HE LYS 51 5.011 10.432 10.432 233 1HZ LYS 351 3HZ LYS 51 6.058 11.604 11.604 234 2HZ LYS 351 2HZ LYS 51 5.873 9.918 9.918 235 3HZ LYS 351 1HZ LYS 51 6.821 10.611 10.611 236 H ASP 352 H ASP 52 3.358 10.890 10.890 237 HA ASP 352 HA ASP 52 5.598 12.352 12.352 238 1HB ASP 352 2HB ASP 52 4.997 9.896 9.896 239 2HB ASP 352 1HB ASP 52 3.920 10.507 10.507 240 H ALA 353 H ALA 53 2.176 12.420 12.420 241 HA ALA 353 HA ALA 53 2.729 14.410 14.410 242 1HB ALA 353 2HB ALA 53 0.154 13.118 13.118 243 2HB ALA 353 1HB ALA 53 0.261 14.267 14.267 244 3HB ALA 353 3HB ALA 53 1.066 12.701 12.701 245 H GLN 354 H GLN 54 3.493 15.432 15.432 246 HA GLN 354 HA GLN 54 1.331 17.419 17.419 247 1HB GLN 354 2HB GLN 54 2.799 15.624 15.624 248 2HB GLN 354 1HB GLN 54 2.853 17.314 17.314 249 1HG GLN 354 2HG GLN 54 0.202 16.813 16.813 250 2HG GLN 354 1HG GLN 54 0.656 15.466 15.466 251 1HE2 GLN 354 2HE2 GLN 54 1.459 17.787 17.787 252 2HE2 GLN 354 1HE2 GLN 54 2.222 16.517 16.517 253 H ALA 355 HN ALA 55 2.043 19.555 19.555 254 HA ALA 355 HA ALA 55 4.701 20.091 20.091 255 1HB ALA 355 2HB ALA 55 2.224 21.515 21.515 256 2HB ALA 355 1HB ALA 55 3.520 22.487 22.487 257 3HB ALA 355 3HB ALA 55 3.629 21.944 21.944 258 1H GLY 325 3H GLY 25 -13.724 -12.309 -12.309 259 2H GLY 325 2H GLY 25 -14.981 -13.445 -13.445 260 3H GLY 325 1H GLY 25 -14.175 -13.238 -13.238 261 1HA GLY 325 2HA GLY 25 -12.263 -14.298 -14.298 262 2HA GLY 325 1HA GLY 25 -13.560 -15.253 -15.253 263 H GLU 326 H GLU 26 -11.936 -12.167 -12.167 264 HA GLU 326 HA GLU 26 -11.631 -13.253 -13.253 265 1HB GLU 326 2HB GLU 26 -13.190 -11.264 -11.264 266 2HB GLU 326 1HB GLU 26 -11.766 -10.327 -10.327 267 1HG GLU 326 2HG GLU 26 -11.023 -10.197 -10.197 268 2HG GLU 326 1HG GLU 26 -11.426 -11.881 -11.881 269 H TYR 327 H TYR 27 -9.675 -12.483 -12.483 270 HA TYR 327 HA TYR 27 -7.411 -12.115 -12.115 271 1HB TYR 327 2HB TYR 27 -7.735 -13.507 -13.507 272 2HB TYR 327 1HB TYR 27 -6.178 -12.736 -12.736 273 HD1 TYR 327 HD1 TYR 27 -4.994 -13.251 -13.251 274 HD2 TYR 327 HD2 TYR 27 -8.249 -15.590 -15.590 275 HE1 TYR 327 HE1 TYR 27 -4.342 -15.136 -15.136 276 HE2 TYR 327 HE2 TYR 27 -7.596 -17.474 -17.474 277 HH TYR 327 HH TYR 27 -4.605 -17.492 -17.492 278 H PHE 328 H PHE 28 -6.572 -10.083 -10.083 279 HA PHE 328 HA PHE 28 -6.885 -8.363 -8.363 280 1HB PHE 328 2HB PHE 28 -6.760 -7.583 -7.583 281 2HB PHE 328 1HB PHE 28 -6.775 -6.435 -6.435 282 HD1 PHE 328 HD1 PHE 28 -8.744 -6.513 -6.513 283 HD2 PHE 328 HD2 PHE 28 -8.773 -8.495 -8.495 284 HE1 PHE 328 HE1 PHE 28 -11.220 -6.643 -6.643 285 HE2 PHE 328 HE2 PHE 28 -11.248 -8.625 -8.625 286 HZ PHE 328 HZ PHE 28 -12.472 -7.699 -7.699 287 H THR 329 H THR 29 -5.053 -7.281 -7.281 288 HA THR 329 HA THR 29 -2.479 -8.090 -8.090 289 HB THR 329 HB THR 29 -2.250 -6.705 -6.705 290 HG1 THR 329 HG1 THR 29 -3.213 -8.451 -8.451 291 1HG2 THR 329 2HG2 THR 29 -0.693 -8.349 -8.349 292 2HG2 THR 329 1HG2 THR 29 -1.582 -9.585 -9.585 293 3HG2 THR 329 3HG2 THR 29 -0.680 -8.348 -8.348 294 H LEU 330 H LEU 30 -1.190 -6.534 -6.534 295 HA LEU 330 HA LEU 30 -2.052 -3.688 -3.688 296 1HB LEU 330 2HB LEU 30 -1.432 -5.308 -5.308 297 2HB LEU 330 1HB LEU 30 -0.422 -3.864 -3.864 298 HG LEU 330 HG LEU 30 -3.399 -3.709 -3.709 299 1HD1 LEU 330 3HD1 LEU 30 -1.877 -4.059 -4.059 300 2HD1 LEU 330 2HD1 LEU 30 -3.150 -2.838 -2.838 301 3HD1 LEU 330 1HD1 LEU 30 -3.535 -4.515 -4.515 302 1HD2 LEU 330 3HD2 LEU 30 -1.389 -1.880 -1.880 303 2HD2 LEU 330 2HD2 LEU 30 -3.059 -1.453 -1.453 304 3HD2 LEU 330 1HD2 LEU 30 -1.868 -1.559 -1.559 305 H GLN 331 H GLN 31 -0.648 -3.570 -3.570 306 HA GLN 331 HA GLN 31 2.205 -4.085 -4.085 307 1HB GLN 331 2HB GLN 31 0.513 -2.824 -2.824 308 2HB GLN 331 1HB GLN 31 2.275 -2.858 -2.858 309 1HG GLN 331 2HG GLN 31 2.297 -5.278 -5.278 310 2HG GLN 331 1HG GLN 31 0.559 -5.319 -5.319 311 1HE2 GLN 331 2HE2 GLN 31 0.108 -5.722 -5.722 312 2HE2 GLN 331 1HE2 GLN 31 -0.150 -6.359 -6.359 313 H ILE 332 H ILE 32 3.313 -2.739 -2.739 314 HA ILE 332 HA ILE 32 2.738 0.191 0.191 315 HB ILE 332 HB ILE 32 4.023 -1.410 -1.410 316 1HG1 ILE 332 2HG1 ILE 32 1.617 0.095 0.095 317 2HG1 ILE 332 1HG1 ILE 32 1.318 -1.059 -1.059 318 1HG2 ILE 332 1HG2 ILE 32 4.812 1.003 1.003 319 2HG2 ILE 332 3HG2 ILE 32 3.177 1.491 1.491 320 3HG2 ILE 332 2HG2 ILE 32 4.187 0.630 0.630 321 1HD1 ILE 332 2HD1 ILE 32 2.611 -1.724 -1.724 322 2HD1 ILE 332 1HD1 ILE 32 0.941 -2.086 -2.086 323 3HD1 ILE 332 3HD1 ILE 32 2.267 -2.872 -2.872 324 H ARG 333 H ARG 33 4.445 1.570 1.570 325 HA ARG 333 HA ARG 33 6.921 0.252 0.252 326 1HB ARG 333 2HB ARG 33 5.532 2.031 2.031 327 2HB ARG 333 1HB ARG 33 6.321 3.194 3.194 328 1HG ARG 333 2HG ARG 33 8.510 1.907 1.907 329 2HG ARG 333 1HG ARG 33 7.540 1.404 1.404 330 1HD ARG 333 2HD ARG 33 8.757 3.460 3.460 331 2HD ARG 333 1HD ARG 33 7.026 3.790 3.790 332 HE ARG 333 HE ARG 33 8.742 4.355 4.355 333 1HH1 ARG 333 2HH1 ARG 33 6.680 5.536 5.536 334 2HH1 ARG 333 1HH1 ARG 33 6.321 6.992 6.992 335 1HH2 ARG 333 1HH2 ARG 33 8.232 6.130 6.130 336 2HH2 ARG 333 2HH2 ARG 33 7.201 7.329 7.329 337 H GLY 334 H GLY 34 8.909 0.599 0.599 338 1HA GLY 334 2HA GLY 34 10.188 2.400 2.400 339 2HA GLY 334 1HA GLY 34 8.872 2.184 2.184 340 H ARG 335 H ARG 35 9.577 0.972 0.972 341 HA ARG 335 HA ARG 35 10.358 -1.738 -1.738 342 1HB ARG 335 2HB ARG 35 12.437 -0.782 -0.782 343 2HB ARG 335 1HB ARG 35 12.699 0.129 0.129 344 1HG ARG 335 2HG ARG 35 12.980 -1.868 -1.868 345 2HG ARG 335 1HG ARG 35 12.384 -2.880 -2.880 346 1HD ARG 335 2HD ARG 35 14.956 -1.273 -1.273 347 2HD ARG 335 1HD ARG 35 14.822 -3.028 -3.028 348 HE ARG 335 HE ARG 35 13.472 -2.233 -2.233 349 1HH1 ARG 335 2HH1 ARG 35 16.047 -3.997 -3.997 350 2HH1 ARG 335 1HH1 ARG 35 17.120 -3.335 -3.335 351 1HH2 ARG 335 1HH2 ARG 35 15.102 -0.599 -0.599 352 2HH2 ARG 335 2HH2 ARG 35 16.585 -1.411 -1.411 353 H GLU 336 H GLU 36 10.991 1.214 1.214 354 HA GLU 336 HA GLU 36 10.993 -0.202 -0.202 355 1HB GLU 336 2HB GLU 36 11.336 2.541 2.541 356 2HB GLU 336 1HB GLU 36 10.360 2.466 2.466 357 1HG GLU 336 2HG GLU 36 12.165 0.896 0.896 358 2HG GLU 336 1HG GLU 36 13.162 1.420 1.420 359 H ARG 337 H ARG 37 8.649 2.042 2.042 360 HA ARG 337 HA ARG 37 6.575 1.751 1.751 361 1HB ARG 337 2HB ARG 37 6.878 2.875 2.875 362 2HB ARG 337 1HB ARG 37 5.433 1.864 1.864 363 1HG ARG 337 2HG ARG 37 4.352 3.118 3.118 364 2HG ARG 337 1HG ARG 37 5.862 3.682 3.682 365 1HD ARG 337 2HD ARG 37 4.721 4.560 4.560 366 2HD ARG 337 1HD ARG 37 4.762 5.522 5.522 367 HE ARG 337 HE ARG 37 7.419 4.833 4.833 368 1HH1 ARG 337 2HH1 ARG 37 7.373 4.836 4.836 369 2HH1 ARG 337 1HH1 ARG 37 7.344 6.501 6.501 370 1HH2 ARG 337 1HH2 ARG 37 6.310 7.649 7.649 371 2HH2 ARG 337 2HH2 ARG 37 6.743 8.093 8.093 372 H PHE 338 H PHE 38 7.174 -0.170 -0.170 373 HA PHE 338 HA PHE 38 4.995 -1.975 -1.975 374 1HB PHE 338 2HB PHE 38 6.447 -1.881 -1.881 375 2HB PHE 338 1HB PHE 38 7.798 -2.508 -2.508 376 HD1 PHE 338 HD2 PHE 38 4.438 -3.301 -3.301 377 HD2 PHE 338 HD1 PHE 38 7.965 -4.836 -4.836 378 HE1 PHE 338 HE2 PHE 38 3.658 -5.617 -5.617 379 HE2 PHE 338 HE1 PHE 38 7.186 -7.152 -7.152 380 HZ PHE 338 HZ PHE 38 5.032 -7.543 -7.543 381 H GLU 339 H GLU 39 8.112 -1.891 -1.891 382 HA GLU 339 HA GLU 39 7.876 -4.536 -4.536 383 1HB GLU 339 2HB GLU 39 9.656 -2.199 -2.199 384 2HB GLU 339 1HB GLU 39 9.459 -3.163 -3.163 385 1HG GLU 339 2HG GLU 39 9.814 -4.792 -4.792 386 2HG GLU 339 1HG GLU 39 11.196 -3.752 -3.752 387 H MET 340 H MET 40 7.039 -1.266 -1.266 388 HA MET 340 HA MET 40 6.235 -1.898 -1.898 389 1HB MET 340 2HB MET 40 5.176 0.125 0.125 390 2HB MET 340 1HB MET 40 4.574 0.027 0.027 391 1HG MET 340 2HG MET 40 7.059 0.159 0.159 392 2HG MET 340 1HG MET 40 7.356 0.712 0.712 393 1HE MET 340 3HE MET 40 5.306 2.103 2.103 394 2HE MET 340 2HE MET 40 3.967 2.104 2.104 395 3HE MET 340 1HE MET 40 4.769 3.619 3.619 396 H PHE 341 H PHE 41 4.165 -1.757 -1.757 397 HA PHE 341 HA PHE 41 1.839 -2.857 -2.857 398 1HB PHE 341 2HB PHE 41 2.859 -2.906 -2.906 399 2HB PHE 341 1HB PHE 41 1.301 -3.593 -3.593 400 HD1 PHE 341 HD1 PHE 41 0.238 -1.781 -1.781 401 HD2 PHE 341 HD2 PHE 41 2.484 -0.891 -0.891 402 HE1 PHE 341 HE1 PHE 41 -0.784 0.478 0.478 403 HE2 PHE 341 HE2 PHE 41 1.463 1.365 1.365 404 HZ PHE 341 HZ PHE 41 -0.171 2.050 2.050 405 H ARG 342 H ARG 42 4.631 -4.392 -4.392 406 HA ARG 342 HA ARG 42 3.764 -7.038 -7.038 407 1HB ARG 342 2HB ARG 42 6.245 -5.695 -5.695 408 2HB ARG 342 1HB ARG 42 6.448 -6.962 -6.962 409 1HG ARG 342 2HG ARG 42 5.236 -8.471 -8.471 410 2HG ARG 342 1HG ARG 42 5.749 -7.223 -7.223 411 1HD ARG 342 2HD ARG 42 7.555 -8.727 -8.727 412 2HD ARG 342 1HD ARG 42 8.090 -7.502 -7.502 413 HE ARG 342 HE ARG 42 6.762 -9.978 -9.978 414 1HH1 ARG 342 2HH1 ARG 42 8.021 -7.797 -7.797 415 2HH1 ARG 342 1HH1 ARG 42 9.525 -8.542 -8.542 416 1HH2 ARG 342 1HH2 ARG 42 9.323 -10.971 -10.971 417 2HH2 ARG 342 2HH2 ARG 42 10.263 -10.339 -10.339 418 H GLU 343 H GLU 43 4.879 -5.228 -5.228 419 HA GLU 343 HA GLU 43 4.838 -7.533 -7.533 420 1HB GLU 343 2HB GLU 43 6.101 -5.243 -5.243 421 2HB GLU 343 1HB GLU 43 4.587 -4.705 -4.705 422 1HG GLU 343 2HG GLU 43 5.606 -5.528 -5.528 423 2HG GLU 343 1HG GLU 43 4.861 -7.021 -7.021 424 H LEU 344 H LEU 44 2.721 -4.636 -4.636 425 HA LEU 344 HA LEU 44 0.786 -5.360 -5.360 426 1HB LEU 344 2HB LEU 44 0.406 -4.059 -4.059 427 2HB LEU 344 1HB LEU 44 -0.891 -4.211 -4.211 428 HG LEU 344 HG LEU 44 -0.097 -2.094 -2.094 429 1HD1 LEU 344 2HD1 LEU 44 0.226 -3.827 -3.827 430 2HD1 LEU 344 1HD1 LEU 44 1.945 -3.553 -3.553 431 3HD1 LEU 344 3HD1 LEU 44 0.902 -2.207 -2.207 432 1HD2 LEU 344 3HD2 LEU 44 1.871 -2.535 -2.535 433 2HD2 LEU 344 2HD2 LEU 44 2.047 -1.289 -1.289 434 3HD2 LEU 344 1HD2 LEU 44 2.797 -2.870 -2.870 435 H ASN 345 H ASN 45 0.569 -6.206 -6.206 436 HA ASN 345 HA ASN 45 -1.622 -7.994 -7.994 437 1HB ASN 345 2HB ASN 45 -1.343 -8.528 -8.528 438 2HB ASN 345 1HB ASN 45 -0.555 -6.957 -6.957 439 1HD2 ASN 345 2HD2 ASN 45 2.443 -8.296 -8.296 440 2HD2 ASN 345 1HD2 ASN 45 1.375 -6.980 -6.980 441 H GLU 346 H GLU 46 1.818 -8.441 -8.441 442 HA GLU 346 HA GLU 46 1.880 -11.300 -11.300 443 1HB GLU 346 2HB GLU 46 3.897 -9.796 -9.796 444 2HB GLU 346 1HB GLU 46 3.580 -9.519 -9.519 445 1HG GLU 346 2HG GLU 46 4.950 -11.326 -11.326 446 2HG GLU 346 1HG GLU 46 3.477 -12.233 -12.233 447 H ALA 347 H ALA 47 1.285 -9.055 -9.055 448 HA ALA 347 HA ALA 47 0.956 -11.190 -11.190 449 1HB ALA 347 3HB ALA 47 0.057 -8.293 -8.293 450 2HB ALA 347 2HB ALA 47 0.096 -9.397 -9.397 451 3HB ALA 347 1HB ALA 47 1.600 -8.911 -8.911 452 H LEU 348 H LEU 48 -1.251 -9.249 -9.249 453 HA LEU 348 HA LEU 48 -3.708 -10.087 -10.087 454 1HB LEU 348 2HB LEU 48 -3.133 -9.641 -9.641 455 2HB LEU 348 1HB LEU 48 -4.709 -9.550 -9.550 456 HG LEU 348 HG LEU 48 -2.412 -7.809 -7.809 457 1HD1 LEU 348 2HD1 LEU 48 -3.648 -7.727 -7.727 458 2HD1 LEU 348 1HD1 LEU 48 -4.341 -6.400 -6.400 459 3HD1 LEU 348 3HD1 LEU 48 -2.593 -6.510 -6.510 460 1HD2 LEU 348 1HD2 LEU 48 -5.395 -7.901 -7.901 461 2HD2 LEU 348 3HD2 LEU 48 -4.133 -7.717 -7.717 462 3HD2 LEU 348 2HD2 LEU 48 -4.540 -6.367 -6.367 463 H GLU 349 H GLU 49 -1.886 -11.560 -11.560 464 HA GLU 349 HA GLU 49 -3.587 -13.830 -13.830 465 1HB GLU 349 2HB GLU 49 -1.790 -13.115 -13.115 466 2HB GLU 349 1HB GLU 49 -0.593 -13.729 -13.729 467 1HG GLU 349 2HG GLU 49 -1.131 -15.929 -15.929 468 2HG GLU 349 1HG GLU 49 -2.822 -15.562 -15.562 469 H LEU 350 H LEU 50 -0.900 -13.128 -13.128 470 HA LEU 350 HA LEU 50 -0.548 -15.779 -15.779 471 1HB LEU 350 2HB LEU 50 1.118 -14.726 -14.726 472 2HB LEU 350 1HB LEU 50 0.511 -13.184 -13.184 473 HG LEU 350 HG LEU 50 -1.087 -13.169 -13.169 474 1HD1 LEU 350 2HD1 LEU 50 -0.162 -15.822 -15.822 475 2HD1 LEU 350 1HD1 LEU 50 0.512 -14.952 -14.952 476 3HD1 LEU 350 3HD1 LEU 50 -1.231 -14.964 -14.964 477 1HD2 LEU 350 3HD2 LEU 50 1.318 -12.127 -12.127 478 2HD2 LEU 350 2HD2 LEU 50 0.515 -12.187 -12.187 479 3HD2 LEU 350 1HD2 LEU 50 1.745 -13.384 -13.384 480 H LYS 351 H LYS 51 -2.867 -13.236 -13.236 481 HA LYS 351 HA LYS 51 -3.951 -14.291 -14.291 482 1HB LYS 351 2HB LYS 51 -4.445 -12.007 -12.007 483 2HB LYS 351 1HB LYS 51 -5.533 -12.853 -12.853 484 1HG LYS 351 2HG LYS 51 -7.072 -13.301 -13.301 485 2HG LYS 351 1HG LYS 51 -5.842 -13.483 -13.483 486 1HD LYS 351 2HD LYS 51 -7.249 -11.456 -11.456 487 2HD LYS 351 1HD LYS 51 -5.546 -11.062 -11.062 488 1HE LYS 351 2HE LYS 51 -6.009 -9.845 -9.845 489 2HE LYS 351 1HE LYS 51 -6.898 -11.186 -11.186 490 1HZ LYS 351 3HZ LYS 51 -8.278 -9.897 -9.897 491 2HZ LYS 351 2HZ LYS 51 -8.000 -8.876 -8.876 492 3HZ LYS 351 1HZ LYS 51 -8.845 -10.335 -10.335 493 H ASP 352 H ASP 52 -4.838 -14.800 -14.800 494 HA ASP 352 HA ASP 52 -7.019 -16.556 -16.556 495 1HB ASP 352 2HB ASP 52 -6.230 -15.535 -15.535 496 2HB ASP 352 1HB ASP 52 -5.051 -16.846 -16.846 497 H ALA 353 H ALA 53 -3.539 -17.115 -17.115 498 HA ALA 353 HA ALA 53 -3.945 -20.022 -20.022 499 1HB ALA 353 2HB ALA 53 -1.432 -18.339 -18.339 500 2HB ALA 353 1HB ALA 53 -1.443 -20.092 -20.092 501 3HB ALA 353 3HB ALA 53 -2.129 -19.360 -19.360 502 H GLN 354 H GLN 54 -5.057 -18.609 -18.609 503 HA GLN 354 HA GLN 54 -3.112 -19.144 -19.144 504 1HB GLN 354 2HB GLN 54 -4.606 -16.700 -16.700 505 2HB GLN 354 1HB GLN 54 -4.868 -17.264 -17.264 506 1HG GLN 354 2HG GLN 54 -2.115 -17.588 -17.588 507 2HG GLN 354 1HG GLN 54 -2.518 -16.016 -16.016 508 1HE2 GLN 354 2HE2 GLN 54 -3.845 -14.870 -14.870 509 2HE2 GLN 354 1HE2 GLN 54 -4.402 -14.957 -14.957 510 H ALA 355 HN ALA 55 -3.955 -20.316 -20.316 511 HA ALA 355 HA ALA 55 -6.498 -21.667 -21.667 512 1HB ALA 355 2HB ALA 55 -4.160 -22.059 -22.059 513 2HB ALA 355 1HB ALA 55 -5.587 -22.105 -22.105 514 3HB ALA 355 3HB ALA 55 -5.461 -23.199 -23.199 515 1H GLY 325 3H GLY 25 11.616 -0.044 -0.044 516 2H GLY 325 2H GLY 25 12.858 -0.582 -0.582 517 3H GLY 325 1H GLY 25 12.036 -1.686 -1.686 518 1HA GLY 325 2HA GLY 25 10.118 -1.640 -1.640 519 2HA GLY 325 1HA GLY 25 11.411 -1.594 -1.594 520 H GLU 326 H GLU 26 9.834 0.839 0.839 521 HA GLU 326 HA GLU 26 9.555 2.549 2.549 522 1HB GLU 326 2HB GLU 26 11.139 3.362 3.362 523 2HB GLU 326 1HB GLU 26 9.724 3.531 3.531 524 1HG GLU 326 2HG GLU 26 9.006 5.394 5.394 525 2HG GLU 326 1HG GLU 26 9.397 4.734 4.734 526 H TYR 327 H TYR 27 7.627 3.971 3.971 527 HA TYR 327 HA TYR 27 5.346 2.627 2.627 528 1HB TYR 327 2HB TYR 27 5.681 4.022 4.022 529 2HB TYR 327 1HB TYR 27 4.131 4.226 4.226 530 HD1 TYR 327 HD1 TYR 27 2.915 2.105 2.105 531 HD2 TYR 327 HD2 TYR 27 6.155 2.041 2.041 532 HE1 TYR 327 HE1 TYR 27 2.219 -0.155 -0.155 533 HE2 TYR 327 HE2 TYR 27 5.460 -0.219 -0.219 534 HH TYR 327 HH TYR 27 2.448 -1.625 -1.625 535 H PHE 328 H PHE 28 4.548 3.706 3.706 536 HA PHE 328 HA PHE 28 4.908 6.676 6.676 537 1HB PHE 328 2HB PHE 28 4.747 4.672 4.672 538 2HB PHE 328 1HB PHE 28 4.794 6.423 6.423 539 HD1 PHE 328 HD1 PHE 28 6.784 7.711 7.711 540 HD2 PHE 328 HD2 PHE 28 6.739 3.442 3.442 541 HE1 PHE 328 HE1 PHE 28 9.257 7.666 7.666 542 HE2 PHE 328 HE2 PHE 28 9.212 3.397 3.397 543 HZ PHE 328 HZ PHE 28 10.472 5.509 5.509 544 H THR 329 H THR 29 3.104 7.932 7.932 545 HA THR 329 HA THR 29 0.506 6.468 6.468 546 HB THR 329 HB THR 29 0.430 9.390 9.390 547 HG1 THR 329 HG1 THR 29 1.353 9.343 9.343 548 1HG2 THR 329 2HG2 THR 29 -1.284 7.401 7.401 549 2HG2 THR 329 1HG2 THR 29 -0.489 7.433 7.433 550 3HG2 THR 329 3HG2 THR 29 -1.291 8.880 8.880 551 H LEU 330 H LEU 30 -0.706 6.507 6.507 552 HA LEU 330 HA LEU 30 0.123 8.415 8.415 553 1HB LEU 330 2HB LEU 30 -0.540 5.577 5.577 554 2HB LEU 330 1HB LEU 30 -1.535 6.476 6.476 555 HG LEU 330 HG LEU 30 1.446 6.906 6.906 556 1HD1 LEU 330 3HD1 LEU 30 -0.078 4.618 4.618 557 2HD1 LEU 330 2HD1 LEU 30 1.208 5.303 5.303 558 3HD1 LEU 330 1HD1 LEU 30 1.576 4.674 4.674 559 1HD2 LEU 330 3HD2 LEU 30 -0.542 8.225 8.225 560 2HD2 LEU 330 2HD2 LEU 30 1.126 8.133 8.133 561 3HD2 LEU 330 1HD2 LEU 30 -0.084 7.016 7.016 562 H GLN 331 H GLN 31 -1.240 10.109 10.109 563 HA GLN 331 HA GLN 31 -4.113 9.617 9.617 564 1HB GLN 331 2HB GLN 31 -2.369 12.077 12.077 565 2HB GLN 331 1HB GLN 31 -4.130 12.181 12.181 566 1HG GLN 331 2HG GLN 31 -4.201 10.726 10.726 567 2HG GLN 331 1HG GLN 31 -2.466 10.423 10.423 568 1HE2 GLN 331 2HE2 GLN 31 -1.995 13.083 13.083 569 2HE2 GLN 331 1HE2 GLN 31 -1.758 11.436 11.436 570 H ILE 332 H ILE 32 -5.215 9.259 9.259 571 HA ILE 332 HA ILE 32 -4.598 11.019 11.019 572 HB ILE 332 HB ILE 32 -5.938 8.297 8.297 573 1HG1 ILE 332 2HG1 ILE 32 -3.519 8.572 8.572 574 2HG1 ILE 332 1HG1 ILE 32 -3.222 8.987 8.987 575 1HG2 ILE 332 1HG2 ILE 32 -6.692 9.980 9.980 576 2HG2 ILE 332 3HG2 ILE 32 -5.059 9.846 9.846 577 3HG2 ILE 332 2HG2 ILE 32 -6.100 8.423 8.423 578 1HD1 ILE 332 3HD1 ILE 32 -4.253 6.856 6.856 579 2HD1 ILE 332 2HD1 ILE 32 -4.538 6.437 6.437 580 3HD1 ILE 332 1HD1 ILE 32 -2.888 6.573 6.573 581 H ARG 333 H ARG 33 -6.289 12.211 12.211 582 HA ARG 333 HA ARG 33 -8.763 12.327 12.327 583 1HB ARG 333 2HB ARG 33 -7.338 14.380 14.380 584 2HB ARG 333 1HB ARG 33 -8.136 14.154 14.154 585 1HG ARG 333 2HG ARG 33 -10.323 14.051 14.051 586 2HG ARG 333 1HG ARG 33 -9.336 14.903 14.903 587 1HD ARG 333 2HD ARG 33 -10.530 16.519 16.519 588 2HD ARG 333 1HD ARG 33 -8.796 16.621 16.621 589 HE ARG 333 HE ARG 33 -10.535 14.993 14.993 590 1HH1 ARG 333 2HH1 ARG 33 -8.470 14.783 14.783 591 2HH1 ARG 333 1HH1 ARG 33 -8.079 16.305 16.305 592 1HH2 ARG 333 1HH2 ARG 33 -9.966 18.160 18.160 593 2HH2 ARG 333 2HH2 ARG 33 -8.926 18.217 18.217 594 H GLY 334 H GLY 34 -10.761 11.761 11.761 595 1HA GLY 334 2HA GLY 34 -12.050 11.642 11.642 596 2HA GLY 334 1HA GLY 34 -10.754 10.541 10.541 597 H ARG 335 H ARG 35 -11.505 8.491 8.491 598 HA ARG 335 HA ARG 35 -12.303 7.196 7.196 599 1HB ARG 335 2HB ARG 35 -14.359 8.580 8.580 600 2HB ARG 335 1HB ARG 35 -14.625 7.854 7.854 601 1HG ARG 335 2HG ARG 35 -14.950 5.681 5.681 602 2HG ARG 335 1HG ARG 35 -14.347 6.198 6.198 603 1HD ARG 335 2HD ARG 35 -16.899 7.142 7.142 604 2HD ARG 335 1HD ARG 35 -16.787 6.075 6.075 605 HE ARG 335 HE ARG 35 -15.396 8.452 8.452 606 1HH1 ARG 335 2HH1 ARG 35 -18.003 6.984 6.984 607 2HH1 ARG 335 1HH1 ARG 35 -19.052 8.358 8.358 608 1HH2 ARG 335 1HH2 ARG 35 -16.988 10.410 10.410 609 2HH2 ARG 335 2HH2 ARG 35 -18.478 10.298 10.298 610 H GLU 336 H GLU 36 -12.920 7.263 7.263 611 HA GLU 336 HA GLU 36 -12.965 4.370 4.370 612 1HB GLU 336 2HB GLU 36 -13.265 6.676 6.676 613 2HB GLU 336 1HB GLU 36 -12.304 5.400 5.400 614 1HG GLU 336 2HG GLU 36 -14.137 3.781 3.781 615 2HG GLU 336 1HG GLU 36 -15.114 5.216 5.216 616 H ARG 337 H ARG 37 -10.582 6.848 6.848 617 HA ARG 337 HA ARG 37 -8.531 5.083 5.083 618 1HB ARG 337 2HB ARG 37 -8.791 7.876 7.876 619 2HB ARG 337 1HB ARG 37 -7.364 7.323 7.323 620 1HG ARG 337 2HG ARG 37 -6.273 6.638 6.638 621 2HG ARG 337 1HG ARG 37 -7.779 6.378 6.378 622 1HD ARG 337 2HD ARG 37 -6.595 9.066 9.066 623 2HD ARG 337 1HD ARG 37 -6.645 8.371 8.371 624 HE ARG 337 HE ARG 37 -9.303 8.406 8.406 625 1HH1 ARG 337 2HH1 ARG 37 -9.223 10.726 10.726 626 2HH1 ARG 337 1HH1 ARG 37 -9.166 12.049 12.049 627 1HH2 ARG 337 1HH2 ARG 37 -8.157 10.094 10.094 628 2HH2 ARG 337 2HH2 ARG 37 -8.564 11.691 11.691 629 H PHE 338 H PHE 38 -9.151 6.485 6.485 630 HA PHE 338 HA PHE 38 -6.988 5.265 5.265 631 1HB PHE 338 2HB PHE 38 -8.401 6.982 6.982 632 2HB PHE 338 1HB PHE 38 -9.773 5.874 5.874 633 HD1 PHE 338 HD2 PHE 38 -6.401 6.485 6.485 634 HD2 PHE 338 HD1 PHE 38 -9.977 4.112 4.112 635 HE1 PHE 338 HE2 PHE 38 -5.645 5.527 5.527 636 HE2 PHE 338 HE1 PHE 38 -9.221 3.154 3.154 637 HZ PHE 338 HZ PHE 38 -7.055 3.861 3.861 638 H GLU 339 H GLU 39 -10.122 3.963 3.963 639 HA GLU 339 HA GLU 39 -9.920 1.541 1.541 640 1HB GLU 339 2HB GLU 39 -11.676 2.604 2.604 641 2HB GLU 339 1HB GLU 39 -11.502 0.849 0.849 642 1HG GLU 339 2HG GLU 39 -11.853 1.957 1.957 643 2HG GLU 339 1HG GLU 39 -13.225 2.272 2.272 644 H MET 340 H MET 40 -9.048 2.396 2.396 645 HA MET 340 HA MET 40 -8.283 -0.153 -0.153 646 1HB MET 340 2HB MET 40 -7.168 2.599 2.599 647 2HB MET 340 1HB MET 40 -6.591 1.156 1.156 648 1HG MET 340 2HG MET 40 -9.086 0.697 0.697 649 2HG MET 340 1HG MET 40 -9.346 2.382 2.382 650 1HE MET 340 3HE MET 40 -7.279 3.952 3.952 651 2HE MET 340 2HE MET 40 -5.948 2.982 2.982 652 3HE MET 340 1HE MET 40 -6.727 4.170 4.170 653 H PHE 341 H PHE 41 -6.180 2.311 2.311 654 HA PHE 341 HA PHE 41 -3.885 0.647 0.647 655 1HB PHE 341 2HB PHE 41 -4.865 3.011 3.011 656 2HB PHE 341 1HB PHE 41 -3.322 2.222 2.222 657 HD1 PHE 341 HD1 PHE 41 -2.261 1.559 1.559 658 HD2 PHE 341 HD2 PHE 41 -4.453 5.048 5.048 659 HE1 PHE 341 HE1 PHE 41 -1.209 2.858 2.858 660 HE2 PHE 341 HE2 PHE 41 -3.401 6.346 6.346 661 HZ PHE 341 HZ PHE 41 -1.779 5.252 5.252 662 H ARG 342 H ARG 42 -6.679 1.131 1.131 663 HA ARG 342 HA ARG 42 -5.861 -0.250 -0.250 664 1HB ARG 342 2HB ARG 42 -8.311 0.663 0.663 665 2HB ARG 342 1HB ARG 42 -8.553 -1.041 -1.041 666 1HG ARG 342 2HG ARG 42 -7.337 -0.419 -0.419 667 2HG ARG 342 1HG ARG 42 -7.822 1.226 1.226 668 1HD ARG 342 2HD ARG 42 -9.646 0.450 0.450 669 2HD ARG 342 1HD ARG 42 -10.177 0.184 0.184 670 HE ARG 342 HE ARG 42 -8.890 -2.046 -2.046 671 1HH1 ARG 342 2HH1 ARG 42 -10.135 -2.258 -2.258 672 2HH1 ARG 342 1HH1 ARG 42 -11.654 -3.002 -3.002 673 1HH2 ARG 342 1HH2 ARG 42 -11.463 -2.304 -2.304 674 2HH2 ARG 342 2HH2 ARG 42 -12.407 -3.027 -3.027 675 H GLU 343 H GLU 43 -6.957 -1.557 -1.557 676 HA GLU 343 HA GLU 43 -6.971 -4.311 -4.311 677 1HB GLU 343 2HB GLU 43 -8.198 -3.221 -3.221 678 2HB GLU 343 1HB GLU 43 -6.683 -3.562 -3.562 679 1HG GLU 343 2HG GLU 43 -7.742 -5.572 -5.572 680 2HG GLU 343 1HG GLU 43 -7.015 -5.940 -5.940 681 H LEU 344 H LEU 44 -4.817 -2.545 -2.545 682 HA LEU 344 HA LEU 44 -2.907 -4.508 -4.508 683 1HB LEU 344 2HB LEU 44 -2.507 -1.535 -1.535 684 2HB LEU 344 1HB LEU 44 -1.208 -2.608 -2.608 685 HG LEU 344 HG LEU 44 -1.974 -1.863 -1.863 686 1HD1 LEU 344 2HD1 LEU 44 -2.334 -4.433 -4.433 687 2HD1 LEU 344 1HD1 LEU 44 -4.045 -4.021 -4.021 688 3HD1 LEU 344 3HD1 LEU 44 -2.963 -3.676 -3.676 689 1HD2 LEU 344 3HD2 LEU 44 -3.974 -0.714 -0.714 690 2HD2 LEU 344 2HD2 LEU 44 -4.088 -1.006 -1.006 691 3HD2 LEU 344 1HD2 LEU 44 -4.885 -2.100 -2.100 692 H ASN 345 H ASN 45 -2.663 -2.099 -2.099 693 HA ASN 345 HA ASN 45 -0.496 -3.431 -3.431 694 1HB ASN 345 2HB ASN 45 -0.747 -1.873 -1.873 695 2HB ASN 345 1HB ASN 45 -1.490 -1.031 -1.031 696 1HD2 ASN 345 2HD2 ASN 45 -4.513 -0.685 -0.685 697 2HD2 ASN 345 1HD2 ASN 45 -3.417 -0.057 -0.057 698 H GLU 346 H GLU 46 -3.948 -4.002 -4.002 699 HA GLU 346 HA GLU 46 -4.037 -5.513 -5.513 700 1HB GLU 346 2HB GLU 46 -6.040 -4.674 -4.674 701 2HB GLU 346 1HB GLU 46 -5.747 -5.935 -5.935 702 1HG GLU 346 2HG GLU 46 -7.136 -7.162 -7.162 703 2HG GLU 346 1HG GLU 46 -5.675 -7.400 -7.400 704 H ALA 347 H ALA 47 -3.467 -6.511 -6.511 705 HA ALA 347 HA ALA 47 -3.199 -9.312 -9.312 706 1HB ALA 347 3HB ALA 47 -2.352 -7.782 -7.782 707 2HB ALA 347 2HB ALA 47 -2.336 -9.539 -9.539 708 3HB ALA 347 1HB ALA 47 -3.864 -8.664 -8.664 709 H LEU 348 H LEU 48 -0.949 -6.608 -6.608 710 HA LEU 348 HA LEU 48 1.483 -8.072 -8.072 711 1HB LEU 348 2HB LEU 48 0.960 -5.360 -5.360 712 2HB LEU 348 1HB LEU 48 2.527 -5.999 -5.999 713 HG LEU 348 HG LEU 48 0.248 -5.742 -5.742 714 1HD1 LEU 348 2HD1 LEU 48 1.521 -3.592 -3.592 715 2HD1 LEU 348 1HD1 LEU 48 2.216 -3.656 -3.656 716 3HD1 LEU 348 3HD1 LEU 48 0.471 -3.505 -3.505 717 1HD2 LEU 348 1HD2 LEU 48 3.228 -6.152 -6.152 718 2HD2 LEU 348 3HD2 LEU 48 1.954 -7.052 -7.052 719 3HD2 LEU 348 2HD2 LEU 48 2.390 -5.436 -5.436 720 H GLU 349 H GLU 49 -0.321 -6.612 -6.612 721 HA GLU 349 HA GLU 49 1.352 -7.649 -7.649 722 1HB GLU 349 2HB GLU 49 -0.423 -5.880 -5.880 723 2HB GLU 349 1HB GLU 49 -1.637 -7.154 -7.154 724 1HG GLU 349 2HG GLU 49 -1.118 -8.049 -8.049 725 2HG GLU 349 1HG GLU 49 0.581 -7.590 -7.590 726 H LEU 350 H LEU 50 -1.339 -9.029 -9.029 727 HA LEU 350 HA LEU 50 -1.735 -11.334 -11.334 728 1HB LEU 350 2HB LEU 50 -3.404 -11.635 -11.635 729 2HB LEU 350 1HB LEU 50 -2.772 -10.302 -10.302 730 HG LEU 350 HG LEU 50 -1.194 -11.961 -11.961 731 1HD1 LEU 350 2HD1 LEU 50 -2.196 -13.614 -13.614 732 2HD1 LEU 350 1HD1 LEU 50 -2.830 -14.272 -14.272 733 3HD1 LEU 350 3HD1 LEU 50 -1.092 -14.074 -14.074 734 1HD2 LEU 350 3HD2 LEU 50 -3.597 -11.200 -11.200 735 2HD2 LEU 350 2HD2 LEU 50 -2.784 -12.524 -12.524 736 3HD2 LEU 350 1HD2 LEU 50 -4.028 -12.870 -12.870 737 H LYS 351 H LYS 51 0.610 -10.516 -10.516 738 HA LYS 351 HA LYS 51 1.647 -13.141 -13.141 739 1HB LYS 351 2HB LYS 51 2.172 -11.022 -11.022 740 2HB LYS 351 1HB LYS 51 3.264 -10.581 -10.581 741 1HG LYS 351 2HG LYS 51 4.785 -12.212 -12.212 742 2HG LYS 351 1HG LYS 51 3.543 -13.340 -13.340 743 1HD LYS 351 2HD LYS 51 4.959 -12.518 -12.518 744 2HD LYS 351 1HD LYS 51 3.262 -12.078 -12.078 745 1HE LYS 351 2HE LYS 51 3.770 -9.885 -9.885 746 2HE LYS 351 1HE LYS 51 4.646 -10.053 -10.053 747 1HZ LYS 351 3HZ LYS 51 6.025 -11.163 -11.163 748 2HZ LYS 351 2HZ LYS 51 5.774 -9.486 -9.486 749 3HZ LYS 351 1HZ LYS 51 6.599 -10.137 -10.137 750 H ASP 352 H ASP 52 2.568 -10.597 -10.597 751 HA ASP 352 HA ASP 52 4.720 -11.983 -11.983 752 1HB ASP 352 2HB ASP 52 3.971 -9.556 -9.556 753 2HB ASP 352 1HB ASP 52 2.775 -10.212 -10.212 754 H ALA 353 H ALA 53 1.229 -12.219 -12.219 755 HA ALA 353 HA ALA 53 1.588 -14.161 -14.161 756 1HB ALA 353 2HB ALA 53 -0.896 -12.989 -12.989 757 2HB ALA 353 1HB ALA 53 -0.918 -14.133 -14.133 758 3HB ALA 353 3HB ALA 53 -0.206 -12.533 -12.533 759 H GLN 354 H GLN 54 2.704 -15.147 -15.147 760 HA GLN 354 HA GLN 54 0.723 -17.239 -17.239 761 1HB GLN 354 2HB GLN 54 2.245 -15.382 -15.382 762 2HB GLN 354 1HB GLN 54 2.497 -17.069 -17.069 763 1HG GLN 354 2HG GLN 54 -0.257 -16.851 -16.851 764 2HG GLN 354 1HG GLN 54 0.159 -15.404 -15.404 765 1HE2 GLN 354 2HE2 GLN 54 1.492 -17.485 -17.485 766 2HE2 GLN 354 1HE2 GLN 54 2.054 -16.210 -16.210 767 H ALA 355 HN ALA 55 1.529 -19.335 -19.335 768 HA ALA 355 HA ALA 55 4.061 -19.764 -19.764 769 1HB ALA 355 2HB ALA 55 1.698 -21.297 -21.297 770 2HB ALA 355 1HB ALA 55 3.124 -22.206 -22.206 771 3HB ALA 355 3HB ALA 55 2.974 -21.650 -21.650 772 1H GLY 325 3H GLY 25 -15.268 11.722 11.722 773 2H GLY 325 2H GLY 25 -16.592 12.786 12.786 774 3H GLY 325 1H GLY 25 -15.600 12.644 12.644 775 1HA GLY 325 2HA GLY 25 -13.846 13.786 13.786 776 2HA GLY 325 1HA GLY 25 -15.274 14.670 14.670 777 H GLU 326 H GLU 26 -13.616 11.665 11.665 778 HA GLU 326 HA GLU 26 -13.730 12.755 12.755 779 1HB GLU 326 2HB GLU 26 -15.139 10.696 10.696 780 2HB GLU 326 1HB GLU 26 -13.625 9.828 9.828 781 1HG GLU 326 2HG GLU 26 -13.157 9.730 9.730 782 2HG GLU 326 1HG GLU 26 -13.678 11.392 11.392 783 H TYR 327 H TYR 27 -11.902 12.084 12.084 784 HA TYR 327 HA TYR 27 -9.399 11.825 11.825 785 1HB TYR 327 2HB TYR 27 -10.119 13.198 13.198 786 2HB TYR 327 1HB TYR 27 -8.502 12.503 12.503 787 HD1 TYR 327 HD1 TYR 27 -7.069 13.077 13.077 788 HD2 TYR 327 HD2 TYR 27 -10.606 15.251 15.251 789 HE1 TYR 327 HE1 TYR 27 -6.325 14.991 14.991 790 HE2 TYR 327 HE2 TYR 27 -9.860 17.167 17.167 791 HH TYR 327 HH TYR 27 -6.675 17.336 17.336 792 H PHE 328 H PHE 28 -8.467 9.832 9.832 793 HA PHE 328 HA PHE 28 -9.003 8.095 8.095 794 1HB PHE 328 2HB PHE 28 -8.450 7.333 7.333 795 2HB PHE 328 1HB PHE 28 -8.582 6.180 6.180 796 HD1 PHE 328 HD1 PHE 28 -10.751 6.158 6.158 797 HD2 PHE 328 HD2 PHE 28 -10.384 8.143 8.143 798 HE1 PHE 328 HE1 PHE 28 -13.221 6.168 6.168 799 HE2 PHE 328 HE2 PHE 28 -12.852 8.153 8.153 800 HZ PHE 328 HZ PHE 28 -14.271 7.165 7.165 801 H THR 329 H THR 29 -7.234 7.101 7.101 802 HA THR 329 HA THR 29 -4.565 8.066 8.066 803 HB THR 329 HB THR 29 -4.706 6.720 6.720 804 HG1 THR 329 HG1 THR 29 -5.855 8.397 8.397 805 1HG2 THR 329 2HG2 THR 29 -2.945 8.337 8.337 806 2HG2 THR 329 1HG2 THR 29 -3.919 9.571 9.571 807 3HG2 THR 329 3HG2 THR 29 -3.137 8.311 8.311 808 H LEU 330 H LEU 30 -3.152 6.595 6.595 809 HA LEU 330 HA LEU 30 -3.843 3.704 3.704 810 1HB LEU 330 2HB LEU 30 -3.011 5.325 5.325 811 2HB LEU 330 1HB LEU 30 -1.943 3.941 3.941 812 HG LEU 330 HG LEU 30 -4.940 3.618 3.618 813 1HD1 LEU 330 3HD1 LEU 30 -3.147 4.034 4.034 814 2HD1 LEU 330 2HD1 LEU 30 -4.348 2.749 2.749 815 3HD1 LEU 330 1HD1 LEU 30 -4.860 4.407 4.407 816 1HD2 LEU 330 3HD2 LEU 30 -2.882 1.913 1.913 817 2HD2 LEU 330 2HD2 LEU 30 -4.468 1.386 1.386 818 3HD2 LEU 330 1HD2 LEU 30 -3.137 1.557 1.557 819 H GLN 331 H GLN 31 -2.696 3.579 3.579 820 HA GLN 331 HA GLN 31 0.147 4.268 4.268 821 1HB GLN 331 2HB GLN 31 -1.750 2.936 2.936 822 2HB GLN 331 1HB GLN 31 -0.020 3.049 3.049 823 1HG GLN 331 2HG GLN 31 -0.091 5.468 5.468 824 2HG GLN 331 1HG GLN 31 -1.778 5.430 5.430 825 1HE2 GLN 331 2HE2 GLN 31 -2.680 5.811 5.811 826 2HE2 GLN 331 1HE2 GLN 31 -2.771 6.431 6.431 827 H ILE 332 H ILE 32 1.483 2.985 2.985 828 HA ILE 332 HA ILE 32 1.036 0.032 0.032 829 HB ILE 332 HB ILE 32 2.525 1.700 1.700 830 1HG1 ILE 332 2HG1 ILE 32 0.300 0.066 0.066 831 2HG1 ILE 332 1HG1 ILE 32 -0.221 1.220 1.220 832 1HG2 ILE 332 1HG2 ILE 32 3.377 -0.672 -0.672 833 2HG2 ILE 332 3HG2 ILE 32 1.845 -1.241 -1.241 834 3HG2 ILE 332 2HG2 ILE 32 2.961 -0.327 -0.327 835 1HD1 ILE 332 3HD1 ILE 32 0.849 3.051 3.051 836 2HD1 ILE 332 2HD1 ILE 32 1.363 1.899 1.899 837 3HD1 ILE 332 1HD1 ILE 32 -0.354 2.220 2.220 838 H ARG 333 H ARG 33 2.738 -1.272 -1.272 839 HA ARG 333 HA ARG 33 4.994 0.168 0.168 840 1HB ARG 333 2HB ARG 33 3.542 -1.682 -1.682 841 2HB ARG 333 1HB ARG 33 4.524 -2.802 -2.802 842 1HG ARG 333 2HG ARG 33 6.535 -1.401 -1.401 843 2HG ARG 333 1HG ARG 33 5.368 -0.946 -0.946 844 1HD ARG 333 2HD ARG 33 6.611 -2.934 -2.934 845 2HD ARG 333 1HD ARG 33 4.921 -3.353 -3.353 846 HE ARG 333 HE ARG 33 6.959 -3.836 -3.836 847 1HH1 ARG 333 2HH1 ARG 33 5.102 -5.112 -5.112 848 2HH1 ARG 333 1HH1 ARG 33 4.702 -6.584 -6.584 849 1HH2 ARG 333 1HH2 ARG 33 6.190 -5.634 -5.634 850 2HH2 ARG 333 2HH2 ARG 33 5.320 -6.881 -6.881 851 H GLY 334 H GLY 34 7.107 -0.077 -0.077 852 1HA GLY 334 2HA GLY 34 8.660 -1.790 -1.790 853 2HA GLY 334 1HA GLY 34 7.503 -1.657 -1.657 854 H ARG 335 H ARG 35 8.373 -0.418 -0.418 855 HA ARG 335 HA ARG 35 8.958 2.339 2.339 856 1HB ARG 335 2HB ARG 35 10.941 1.497 1.497 857 2HB ARG 335 1HB ARG 35 11.435 0.596 0.596 858 1HG ARG 335 2HG ARG 35 11.781 2.596 2.596 859 2HG ARG 335 1HG ARG 35 10.966 3.583 3.583 860 1HD ARG 335 2HD ARG 35 13.595 2.114 2.114 861 2HD ARG 335 1HD ARG 35 13.385 3.859 3.859 862 HE ARG 335 HE ARG 35 11.781 2.996 2.996 863 1HH1 ARG 335 2HH1 ARG 35 14.330 4.882 4.882 864 2HH1 ARG 335 1HH1 ARG 35 15.267 4.271 4.271 865 1HH2 ARG 335 1HH2 ARG 35 13.310 1.442 1.442 866 2HH2 ARG 335 2HH2 ARG 35 14.691 2.323 2.323 867 H GLU 336 H GLU 36 9.976 -0.571 -0.571 868 HA GLU 336 HA GLU 36 10.229 0.848 0.848 869 1HB GLU 336 2HB GLU 36 10.589 -1.877 -1.877 870 2HB GLU 336 1HB GLU 36 9.804 -1.847 -1.847 871 1HG GLU 336 2HG GLU 36 11.629 -0.185 -0.185 872 2HG GLU 336 1HG GLU 36 12.471 -0.659 -0.659 873 H ARG 337 H ARG 37 7.834 -1.529 -1.529 874 HA ARG 337 HA ARG 37 6.003 -1.332 -1.332 875 1HB ARG 337 2HB ARG 37 6.031 -2.458 -2.458 876 2HB ARG 337 1HB ARG 37 4.549 -1.512 -1.512 877 1HG ARG 337 2HG ARG 37 3.730 -2.800 -2.800 878 2HG ARG 337 1HG ARG 37 5.340 -3.294 -3.294 879 1HD ARG 337 2HD ARG 37 3.911 -4.238 -4.238 880 2HD ARG 337 1HD ARG 37 4.196 -5.189 -5.189 881 HE ARG 337 HE ARG 37 6.731 -4.368 -4.368 882 1HH1 ARG 337 2HH1 ARG 37 6.322 -4.375 -4.375 883 2HH1 ARG 337 1HH1 ARG 37 6.313 -6.039 -6.039 884 1HH2 ARG 337 1HH2 ARG 37 5.752 -7.239 -7.239 885 2HH2 ARG 337 2HH2 ARG 37 5.992 -7.660 -7.660 886 H PHE 338 H PHE 38 6.150 0.611 0.611 887 HA PHE 338 HA PHE 38 3.921 2.274 2.274 888 1HB PHE 338 2HB PHE 38 5.090 2.281 2.281 889 2HB PHE 338 1HB PHE 38 6.521 2.975 2.975 890 HD1 PHE 338 HD2 PHE 38 2.973 3.602 3.602 891 HD2 PHE 338 HD1 PHE 38 6.641 5.310 5.310 892 HE1 PHE 338 HE2 PHE 38 2.030 5.876 5.876 893 HE2 PHE 338 HE1 PHE 38 5.698 7.584 7.584 894 HZ PHE 338 HZ PHE 38 3.393 7.867 7.867 895 H GLU 339 H GLU 39 7.226 2.400 2.400 896 HA GLU 339 HA GLU 39 6.993 5.024 5.024 897 1HB GLU 339 2HB GLU 39 8.916 2.784 2.784 898 2HB GLU 339 1HB GLU 39 8.855 3.739 3.739 899 1HG GLU 339 2HG GLU 39 8.815 5.382 5.382 900 2HG GLU 339 1HG GLU 39 10.281 4.415 4.415 901 H MET 340 H MET 40 6.471 1.717 1.717 902 HA MET 340 HA MET 40 5.977 2.315 2.315 903 1HB MET 340 2HB MET 40 4.764 0.243 0.243 904 2HB MET 340 1HB MET 40 4.380 0.314 0.314 905 1HG MET 340 2HG MET 40 6.939 0.300 0.300 906 2HG MET 340 1HG MET 40 7.043 -0.240 -0.240 907 1HE MET 340 3HE MET 40 4.952 -1.732 -1.732 908 2HE MET 340 2HE MET 40 3.774 -1.797 -1.797 909 3HE MET 340 1HE MET 40 4.589 -3.270 -3.270 910 H PHE 341 H PHE 41 3.556 2.079 2.079 911 HA PHE 341 HA PHE 41 1.360 3.062 3.062 912 1HB PHE 341 2HB PHE 41 1.995 3.151 3.151 913 2HB PHE 341 1HB PHE 41 0.477 3.766 3.766 914 HD1 PHE 341 HD1 PHE 41 -0.231 1.912 1.912 915 HD2 PHE 341 HD2 PHE 41 1.577 1.113 1.113 916 HE1 PHE 341 HE1 PHE 41 -1.143 -0.394 -0.394 917 HE2 PHE 341 HE2 PHE 41 0.666 -1.192 -1.192 918 HZ PHE 341 HZ PHE 41 -0.695 -1.946 -1.946 919 H ARG 342 H ARG 42 3.854 4.735 4.735 920 HA ARG 342 HA ARG 42 2.855 7.347 7.347 921 1HB ARG 342 2HB ARG 42 5.355 6.110 6.110 922 2HB ARG 342 1HB ARG 42 5.653 7.395 7.395 923 1HG ARG 342 2HG ARG 42 4.142 8.826 8.826 924 2HG ARG 342 1HG ARG 42 4.569 7.596 7.596 925 1HD ARG 342 2HD ARG 42 6.271 9.199 9.199 926 2HD ARG 342 1HD ARG 42 7.014 8.003 8.003 927 HE ARG 342 HE ARG 42 5.704 10.407 10.407 928 1HH1 ARG 342 2HH1 ARG 42 7.276 8.289 8.289 929 2HH1 ARG 342 1HH1 ARG 42 8.785 9.107 9.107 930 1HH2 ARG 342 1HH2 ARG 42 8.153 11.524 11.524 931 2HH2 ARG 342 2HH2 ARG 42 9.281 10.937 10.937 932 H GLU 343 H GLU 43 4.394 5.568 5.568 933 HA GLU 343 HA GLU 43 4.469 7.870 7.870 934 1HB GLU 343 2HB GLU 43 5.856 5.635 5.635 935 2HB GLU 343 1HB GLU 43 4.474 5.037 5.037 936 1HG GLU 343 2HG GLU 43 5.699 5.912 5.912 937 2HG GLU 343 1HG GLU 43 4.812 7.365 7.365 938 H LEU 344 H LEU 44 2.487 4.876 4.876 939 HA LEU 344 HA LEU 44 0.762 5.489 5.489 940 1HB LEU 344 2HB LEU 44 0.154 4.171 4.171 941 2HB LEU 344 1HB LEU 44 -1.028 4.272 4.272 942 HG LEU 344 HG LEU 44 -0.096 2.195 2.195 943 1HD1 LEU 344 2HD1 LEU 44 0.338 3.949 3.949 944 2HD1 LEU 344 1HD1 LEU 44 2.032 3.756 3.756 945 3HD1 LEU 344 3HD1 LEU 44 1.106 2.364 2.364 946 1HD2 LEU 344 3HD2 LEU 44 1.686 2.712 2.712 947 2HD2 LEU 344 2HD2 LEU 44 2.024 1.479 1.479 948 3HD2 LEU 344 1HD2 LEU 44 2.726 3.089 3.089 949 H ASN 345 H ASN 45 0.068 6.354 6.354 950 HA ASN 345 HA ASN 45 -2.149 8.022 8.022 951 1HB ASN 345 2HB ASN 45 -2.206 8.607 8.607 952 2HB ASN 345 1HB ASN 45 -1.369 7.058 7.058 953 1HD2 ASN 345 2HD2 ASN 45 1.406 8.500 8.500 954 2HD2 ASN 345 1HD2 ASN 45 0.411 7.144 7.144 955 H GLU 346 H GLU 46 1.296 8.632 8.632 956 HA GLU 346 HA GLU 46 1.200 11.492 11.492 957 1HB GLU 346 2HB GLU 46 3.280 10.089 10.089 958 2HB GLU 346 1HB GLU 46 3.204 9.796 9.796 959 1HG GLU 346 2HG GLU 46 4.509 11.665 11.665 960 2HG GLU 346 1HG GLU 46 2.963 12.503 12.503 961 H ALA 347 H ALA 47 1.081 9.217 9.217 962 HA ALA 347 HA ALA 47 0.898 11.332 11.332 963 1HB ALA 347 3HB ALA 47 0.204 8.385 8.385 964 2HB ALA 347 2HB ALA 47 0.272 9.482 9.482 965 3HB ALA 347 1HB ALA 47 1.737 9.126 9.126 966 H LEU 348 H LEU 48 -1.448 9.284 9.284 967 HA LEU 348 HA LEU 48 -3.775 10.007 10.007 968 1HB LEU 348 2HB LEU 48 -3.565 9.568 9.568 969 2HB LEU 348 1HB LEU 48 -5.022 9.413 9.413 970 HG LEU 348 HG LEU 48 -2.553 7.791 7.791 971 1HD1 LEU 348 2HD1 LEU 48 -4.078 7.625 7.625 972 2HD1 LEU 348 1HD1 LEU 48 -4.583 6.273 6.273 973 3HD1 LEU 348 3HD1 LEU 48 -2.882 6.470 6.470 974 1HD2 LEU 348 1HD2 LEU 48 -5.477 7.737 7.737 975 2HD2 LEU 348 3HD2 LEU 48 -4.076 7.638 7.638 976 3HD2 LEU 348 2HD2 LEU 48 -4.527 6.253 6.253 977 H GLU 349 H GLU 49 -2.388 11.560 11.560 978 HA GLU 349 HA GLU 49 -4.222 13.744 13.744 979 1HB GLU 349 2HB GLU 49 -2.611 13.118 13.118 980 2HB GLU 349 1HB GLU 49 -1.310 13.792 13.792 981 1HG GLU 349 2HG GLU 49 -2.003 15.961 15.961 982 2HG GLU 349 1HG GLU 49 -3.704 15.510 15.510 983 H LEU 350 H LEU 50 -1.245 13.191 13.191 984 HA LEU 350 HA LEU 50 -0.899 15.857 15.857 985 1HB LEU 350 2HB LEU 50 0.938 14.889 14.889 986 2HB LEU 350 1HB LEU 50 0.341 13.319 13.319 987 HG LEU 350 HG LEU 50 -1.012 13.231 13.231 988 1HD1 LEU 350 2HD1 LEU 50 -0.209 15.916 15.916 989 2HD1 LEU 350 1HD1 LEU 50 0.718 15.091 15.091 990 3HD1 LEU 350 3HD1 LEU 50 -1.043 14.998 14.998 991 1HD2 LEU 350 3HD2 LEU 50 1.406 12.294 12.294 992 2HD2 LEU 350 2HD2 LEU 50 0.777 12.305 12.305 993 3HD2 LEU 350 1HD2 LEU 50 1.901 13.560 13.560 994 H LYS 351 H LYS 51 -2.992 13.207 13.207 995 HA LYS 351 HA LYS 51 -3.799 14.216 14.216 996 1HB LYS 351 2HB LYS 51 -4.303 11.905 11.905 997 2HB LYS 351 1HB LYS 51 -5.564 12.680 12.680 998 1HG LYS 351 2HG LYS 51 -6.910 13.053 13.053 999 2HG LYS 351 1HG LYS 51 -5.546 13.306 13.306 1000 1HD LYS 351 2HD LYS 51 -6.782 11.204 11.204 1001 2HD LYS 351 1HD LYS 51 -5.104 10.901 10.901 1002 1HE LYS 351 2HE LYS 51 -5.740 9.660 9.660 1003 2HE LYS 351 1HE LYS 51 -6.783 10.955 10.955 1004 1HZ LYS 351 3HZ LYS 51 -7.802 9.590 9.590 1005 2HZ LYS 351 2HZ LYS 51 -7.648 8.590 8.590 1006 3HZ LYS 351 1HZ LYS 51 -8.586 10.004 10.004 1007 H ASP 352 H ASP 52 -5.163 14.655 14.655 1008 HA ASP 352 HA ASP 52 -7.344 16.312 16.312 1009 1HB ASP 352 2HB ASP 52 -6.799 15.319 15.319 1010 2HB ASP 352 1HB ASP 52 -5.704 16.687 16.687 1011 H ALA 353 H ALA 53 -3.924 17.034 17.034 1012 HA ALA 353 HA ALA 53 -4.415 19.922 19.922 1013 1HB ALA 353 2HB ALA 53 -1.878 18.359 18.359 1014 2HB ALA 353 1HB ALA 53 -1.944 20.109 20.109 1015 3HB ALA 353 3HB ALA 53 -2.779 19.349 19.349 1016 H GLN 354 H GLN 54 -5.173 18.467 18.467 1017 HA GLN 354 HA GLN 54 -2.986 19.115 19.115 1018 1HB GLN 354 2HB GLN 54 -4.350 16.574 16.574 1019 2HB GLN 354 1HB GLN 54 -4.511 17.124 17.124 1020 1HG GLN 354 2HG GLN 54 -1.844 17.663 17.663 1021 2HG GLN 354 1HG GLN 54 -2.160 16.083 16.083 1022 1HE2 GLN 354 2HE2 GLN 54 -3.154 14.762 14.762 1023 2HE2 GLN 354 1HE2 GLN 54 -3.878 14.876 14.876 1024 H ALA 355 HN ALA 55 -3.660 20.239 20.239 1025 HA ALA 355 HA ALA 55 -6.311 21.441 21.441 1026 1HB ALA 355 2HB ALA 55 -3.810 21.982 21.982 1027 2HB ALA 355 1HB ALA 55 -5.066 21.912 21.912 1028 3HB ALA 355 3HB ALA 55 -5.225 23.027 23.027 Start of MODEL 8 1 1H GLY 325 1H GLY 25 12.682 2.700 2.700 2 2H GLY 325 3H GLY 25 11.421 3.636 3.636 3 3H GLY 325 2H GLY 25 12.938 3.619 3.619 4 1HA GLY 325 2HA GLY 25 12.642 1.562 1.562 5 2HA GLY 325 1HA GLY 25 10.995 2.194 2.194 6 H GLU 326 H GLU 26 10.620 -0.274 -0.274 7 HA GLU 326 HA GLU 26 10.459 -1.190 -1.190 8 1HB GLU 326 2HB GLU 26 11.206 -2.693 -2.693 9 2HB GLU 326 1HB GLU 26 10.504 -3.545 -3.545 10 1HG GLU 326 2HG GLU 26 12.996 -1.816 -1.816 11 2HG GLU 326 1HG GLU 26 12.957 -3.578 -3.578 12 H TYR 327 H TYR 27 8.744 -3.165 -3.165 13 HA TYR 327 HA TYR 27 6.301 -2.008 -2.008 14 1HB TYR 327 2HB TYR 27 6.864 -3.551 -3.551 15 2HB TYR 327 1HB TYR 27 5.336 -3.900 -3.900 16 HD1 TYR 327 HD1 TYR 27 7.390 -1.213 -1.213 17 HD2 TYR 327 HD2 TYR 27 3.539 -2.316 -2.316 18 HE1 TYR 327 HE1 TYR 27 6.420 0.870 0.870 19 HE2 TYR 327 HE2 TYR 27 2.569 -0.233 -0.233 20 HH TYR 327 HH TYR 27 4.579 2.281 2.281 21 H PHE 328 H PHE 28 5.940 -2.948 -2.948 22 HA PHE 328 HA PHE 28 6.553 -5.841 -5.841 23 1HB PHE 328 2HB PHE 28 5.958 -3.618 -3.618 24 2HB PHE 328 1HB PHE 28 6.005 -5.315 -5.315 25 HD1 PHE 328 HD2 PHE 28 8.126 -6.665 -6.665 26 HD2 PHE 328 HD1 PHE 28 7.948 -2.383 -2.383 27 HE1 PHE 328 HE2 PHE 28 10.602 -6.570 -6.570 28 HE2 PHE 328 HE1 PHE 28 10.425 -2.288 -2.288 29 HZ PHE 328 HZ PHE 28 11.751 -4.381 -4.381 30 H THR 329 H THR 29 4.819 -7.048 -7.048 31 HA THR 329 HA THR 29 2.073 -6.116 -6.116 32 HB THR 329 HB THR 29 2.524 -9.011 -9.011 33 HG1 THR 329 HG1 THR 29 3.758 -7.144 -7.144 34 1HG2 THR 329 2HG2 THR 29 0.537 -7.314 -7.314 35 2HG2 THR 329 1HG2 THR 29 1.398 -7.369 -7.369 36 3HG2 THR 329 3HG2 THR 29 0.788 -8.858 -8.858 37 H LEU 330 H LEU 30 0.686 -6.349 -6.349 38 HA LEU 330 HA LEU 30 1.516 -8.117 -8.117 39 1HB LEU 330 2HB LEU 30 0.778 -5.401 -5.401 40 2HB LEU 330 1HB LEU 30 -0.603 -6.269 -6.269 41 HG LEU 330 HG LEU 30 1.558 -7.486 -7.486 42 1HD1 LEU 330 2HD1 LEU 30 2.598 -5.154 -5.154 43 2HD1 LEU 330 1HD1 LEU 30 2.123 -4.665 -4.665 44 3HD1 LEU 330 3HD1 LEU 30 3.241 -6.011 -6.011 45 1HD2 LEU 330 2HD2 LEU 30 -0.646 -6.732 -6.732 46 2HD2 LEU 330 1HD2 LEU 30 0.738 -6.372 -6.372 47 3HD2 LEU 330 3HD2 LEU 30 0.004 -5.093 -5.093 48 H GLN 331 H GLN 31 0.506 -10.031 -10.031 49 HA GLN 331 HA GLN 31 -2.268 -9.912 -9.912 50 1HB GLN 331 2HB GLN 31 -0.385 -12.237 -12.237 51 2HB GLN 331 1HB GLN 31 -2.019 -12.405 -12.405 52 1HG GLN 331 2HG GLN 31 -0.804 -10.404 -10.404 53 2HG GLN 331 1HG GLN 31 0.385 -11.700 -11.700 54 1HE2 GLN 331 2HE2 GLN 31 -1.480 -13.007 -13.007 55 2HE2 GLN 331 1HE2 GLN 31 -0.128 -12.060 -12.060 56 H ILE 332 H ILE 32 -3.822 -9.664 -9.664 57 HA ILE 332 HA ILE 32 -3.433 -10.983 -10.983 58 HB ILE 332 HB ILE 32 -5.171 -8.627 -8.627 59 1HG1 ILE 332 2HG1 ILE 32 -3.229 -8.222 -8.222 60 2HG1 ILE 332 1HG1 ILE 32 -2.439 -8.780 -8.780 61 1HG2 ILE 332 3HG2 ILE 32 -6.089 -10.183 -10.183 62 2HG2 ILE 332 2HG2 ILE 32 -4.689 -9.731 -9.731 63 3HG2 ILE 332 1HG2 ILE 32 -5.857 -8.503 -8.503 64 1HD1 ILE 332 1HD1 ILE 32 -3.694 -7.005 -7.005 65 2HD1 ILE 332 3HD1 ILE 32 -4.284 -6.391 -6.391 66 3HD1 ILE 332 2HD1 ILE 32 -2.558 -6.360 -6.360 67 H ARG 333 H ARG 33 -4.537 -12.872 -12.872 68 HA ARG 333 HA ARG 33 -6.821 -13.428 -13.428 69 1HB ARG 333 2HB ARG 33 -5.641 -14.962 -14.962 70 2HB ARG 333 1HB ARG 33 -6.913 -15.573 -15.573 71 1HG ARG 333 2HG ARG 33 -5.464 -15.532 -15.532 72 2HG ARG 333 1HG ARG 33 -4.232 -14.622 -14.622 73 1HD ARG 333 2HD ARG 33 -5.085 -17.488 -17.488 74 2HD ARG 333 1HD ARG 33 -3.498 -16.909 -16.909 75 HE ARG 333 HE ARG 33 -3.537 -15.724 -15.724 76 1HH1 ARG 333 2HH1 ARG 33 -3.414 -18.932 -18.932 77 2HH1 ARG 333 1HH1 ARG 33 -3.993 -19.502 -19.502 78 1HH2 ARG 333 1HH2 ARG 33 -4.972 -16.366 -16.366 79 2HH2 ARG 333 2HH2 ARG 33 -4.871 -18.051 -18.051 80 H GLY 334 H GLY 34 -8.531 -12.051 -12.051 81 1HA GLY 334 2HA GLY 34 -10.286 -12.725 -12.725 82 2HA GLY 334 1HA GLY 34 -9.279 -11.415 -11.415 83 H ARG 335 H ARG 35 -10.145 -9.443 -9.443 84 HA ARG 335 HA ARG 35 -10.960 -8.346 -8.346 85 1HB ARG 335 2HB ARG 35 -12.807 -9.913 -9.913 86 2HB ARG 335 1HB ARG 35 -13.254 -9.513 -9.513 87 1HG ARG 335 2HG ARG 35 -13.931 -7.301 -7.301 88 2HG ARG 335 1HG ARG 35 -13.199 -7.452 -7.452 89 1HD ARG 335 2HD ARG 35 -15.206 -9.524 -9.524 90 2HD ARG 335 1HD ARG 35 -15.844 -7.886 -7.886 91 HE ARG 335 HE ARG 35 -14.210 -9.161 -9.161 92 1HH1 ARG 335 2HH1 ARG 35 -15.053 -6.234 -6.234 93 2HH1 ARG 335 1HH1 ARG 35 -16.459 -6.327 -6.327 94 1HH2 ARG 335 1HH2 ARG 35 -16.815 -9.757 -9.757 95 2HH2 ARG 335 2HH2 ARG 35 -17.456 -8.320 -8.320 96 H GLU 336 H GLU 36 -12.548 -8.325 -8.325 97 HA GLU 336 HA GLU 36 -12.716 -5.487 -5.487 98 1HB GLU 336 2HB GLU 36 -12.948 -7.753 -7.753 99 2HB GLU 336 1HB GLU 36 -12.624 -6.164 -6.164 100 1HG GLU 336 2HG GLU 36 -14.905 -5.983 -5.983 101 2HG GLU 336 1HG GLU 36 -14.561 -5.493 -5.493 102 H ARG 337 H ARG 37 -10.318 -7.718 -7.718 103 HA ARG 337 HA ARG 37 -8.655 -5.731 -5.731 104 1HB ARG 337 2HB ARG 37 -8.260 -8.541 -8.541 105 2HB ARG 337 1HB ARG 37 -6.812 -7.570 -7.570 106 1HG ARG 337 2HG ARG 37 -7.799 -6.956 -6.956 107 2HG ARG 337 1HG ARG 37 -9.003 -8.212 -8.212 108 1HD ARG 337 2HD ARG 37 -6.070 -8.842 -8.842 109 2HD ARG 337 1HD ARG 37 -6.828 -8.835 -8.835 110 HE ARG 337 HE ARG 37 -8.002 -10.805 -10.805 111 1HH1 ARG 337 1HH2 ARG 37 -9.452 -10.720 -10.720 112 2HH1 ARG 337 2HH2 ARG 37 -8.497 -11.394 -11.394 113 1HH2 ARG 337 2HH1 ARG 37 -5.498 -11.061 -11.061 114 2HH2 ARG 337 1HH1 ARG 37 -6.259 -11.589 -11.589 115 H PHE 338 H PHE 38 -8.722 -7.065 -7.065 116 HA PHE 338 HA PHE 38 -6.420 -5.743 -5.743 117 1HB PHE 338 2HB PHE 38 -7.553 -7.441 -7.441 118 2HB PHE 338 1HB PHE 38 -9.020 -6.463 -6.463 119 HD1 PHE 338 HD2 PHE 38 -5.511 -6.717 -6.717 120 HD2 PHE 338 HD1 PHE 38 -9.219 -4.575 -4.575 121 HE1 PHE 338 HE2 PHE 38 -4.655 -5.551 -5.551 122 HE2 PHE 338 HE1 PHE 38 -8.363 -3.408 -3.408 123 HZ PHE 338 HZ PHE 38 -6.081 -3.897 -3.897 124 H GLU 339 H GLU 39 -9.792 -4.636 -4.636 125 HA GLU 339 HA GLU 39 -9.449 -2.128 -2.128 126 1HB GLU 339 2HB GLU 39 -11.298 -2.899 -2.899 127 2HB GLU 339 1HB GLU 39 -11.429 -1.406 -1.406 128 1HG GLU 339 2HG GLU 39 -11.374 -3.117 -3.117 129 2HG GLU 339 1HG GLU 39 -12.016 -4.213 -4.213 130 H MET 340 H MET 40 -8.924 -3.150 -3.150 131 HA MET 340 HA MET 40 -8.389 -0.667 -0.667 132 1HB MET 340 2HB MET 40 -7.694 -3.472 -3.472 133 2HB MET 340 1HB MET 40 -6.531 -2.319 -2.319 134 1HG MET 340 2HG MET 40 -8.248 -1.181 -1.181 135 2HG MET 340 1HG MET 40 -9.518 -2.109 -2.109 136 1HE MET 340 2HE MET 40 -6.074 -2.739 -2.739 137 2HE MET 340 1HE MET 40 -6.213 -4.192 -4.192 138 3HE MET 340 3HE MET 40 -6.362 -4.295 -4.295 139 H PHE 341 H PHE 41 -6.146 -2.841 -2.841 140 HA PHE 341 HA PHE 41 -3.870 -1.135 -1.135 141 1HB PHE 341 2HB PHE 41 -4.649 -3.514 -3.514 142 2HB PHE 341 1HB PHE 41 -3.201 -2.619 -2.619 143 HD1 PHE 341 HD2 PHE 41 -4.627 -3.035 -3.035 144 HD2 PHE 341 HD1 PHE 41 -1.493 -4.205 -4.205 145 HE1 PHE 341 HE2 PHE 41 -3.470 -4.184 -4.184 146 HE2 PHE 341 HE1 PHE 41 -0.330 -5.363 -5.363 147 HZ PHE 341 HZ PHE 41 -1.333 -5.352 -5.352 148 H ARG 342 H ARG 42 -6.503 -1.394 -1.394 149 HA ARG 342 HA ARG 42 -5.456 0.083 0.083 150 1HB ARG 342 2HB ARG 42 -7.999 -0.971 -0.971 151 2HB ARG 342 1HB ARG 42 -8.228 0.716 0.716 152 1HG ARG 342 2HG ARG 42 -6.420 -0.704 -0.704 153 2HG ARG 342 1HG ARG 42 -8.033 -1.417 -1.417 154 1HD ARG 342 2HD ARG 42 -8.981 0.891 0.891 155 2HD ARG 342 1HD ARG 42 -7.334 1.470 1.470 156 HE ARG 342 HE ARG 42 -7.393 -0.474 -0.474 157 1HH1 ARG 342 1HH2 ARG 42 -9.035 2.434 2.434 158 2HH1 ARG 342 2HH2 ARG 42 -10.119 2.212 2.212 159 1HH2 ARG 342 2HH1 ARG 42 -9.130 -1.055 -1.055 160 2HH2 ARG 342 1HH1 ARG 42 -10.174 0.236 0.236 161 H GLU 343 H GLU 43 -7.010 1.125 1.125 162 HA GLU 343 HA GLU 43 -7.084 3.929 3.929 163 1HB GLU 343 2HB GLU 43 -8.516 3.025 3.025 164 2HB GLU 343 1HB GLU 43 -7.081 2.619 2.619 165 1HG GLU 343 2HG GLU 43 -8.025 4.756 4.756 166 2HG GLU 343 1HG GLU 43 -6.441 5.015 5.015 167 H LEU 344 H LEU 44 -4.877 1.972 1.972 168 HA LEU 344 HA LEU 44 -3.039 4.080 4.080 169 1HB LEU 344 2HB LEU 44 -2.795 1.075 1.075 170 2HB LEU 344 1HB LEU 44 -1.361 2.060 2.060 171 HG LEU 344 HG LEU 44 -2.010 1.583 1.583 172 1HD1 LEU 344 1HD1 LEU 44 -2.069 4.143 4.143 173 2HD1 LEU 344 3HD1 LEU 44 -3.774 3.987 3.987 174 3HD1 LEU 344 2HD1 LEU 44 -2.533 3.632 3.632 175 1HD2 LEU 344 3HD2 LEU 44 -4.847 1.852 1.852 176 2HD2 LEU 344 2HD2 LEU 44 -4.052 0.404 0.404 177 3HD2 LEU 344 1HD2 LEU 44 -4.457 1.727 1.727 178 H ASN 345 H ASN 45 -3.639 2.219 2.219 179 HA ASN 345 HA ASN 45 -1.091 2.923 2.923 180 1HB ASN 345 2HB ASN 45 -3.119 0.970 0.970 181 2HB ASN 345 1HB ASN 45 -3.083 1.973 1.973 182 1HD2 ASN 345 2HD2 ASN 45 -0.521 -0.493 -0.493 183 2HD2 ASN 345 1HD2 ASN 45 -2.207 -0.310 -0.310 184 H GLU 346 H GLU 46 -4.366 4.073 4.073 185 HA GLU 346 HA GLU 46 -4.298 5.720 5.720 186 1HB GLU 346 2HB GLU 46 -6.384 4.985 4.985 187 2HB GLU 346 1HB GLU 46 -5.976 6.198 6.198 188 1HG GLU 346 2HG GLU 46 -7.588 7.045 7.045 189 2HG GLU 346 1HG GLU 46 -6.087 7.971 7.971 190 H ALA 347 H ALA 47 -3.619 6.324 6.324 191 HA ALA 347 HA ALA 47 -3.009 9.137 9.137 192 1HB ALA 347 1HB ALA 47 -3.683 7.852 7.852 193 2HB ALA 347 3HB ALA 47 -1.947 7.574 7.574 194 3HB ALA 347 2HB ALA 47 -2.575 9.221 9.221 195 H LEU 348 H LEU 48 -1.008 6.208 6.208 196 HA LEU 348 HA LEU 48 1.518 7.477 7.477 197 1HB LEU 348 2HB LEU 48 0.705 4.746 4.746 198 2HB LEU 348 1HB LEU 48 2.370 5.271 5.271 199 HG LEU 348 HG LEU 48 0.281 5.298 5.298 200 1HD1 LEU 348 1HD1 LEU 48 0.974 2.989 2.989 201 2HD1 LEU 348 3HD1 LEU 48 2.434 3.218 3.218 202 3HD1 LEU 348 2HD1 LEU 48 0.859 3.143 3.143 203 1HD2 LEU 348 3HD2 LEU 48 3.313 5.396 5.396 204 2HD2 LEU 348 2HD2 LEU 48 2.237 6.755 6.755 205 3HD2 LEU 348 1HD2 LEU 48 2.295 5.392 5.392 206 H GLU 349 H GLU 49 -0.375 6.047 6.047 207 HA GLU 349 HA GLU 49 1.376 6.919 6.919 208 1HB GLU 349 2HB GLU 49 -0.369 5.213 5.213 209 2HB GLU 349 1HB GLU 49 -1.618 6.428 6.428 210 1HG GLU 349 2HG GLU 49 -1.139 7.564 7.564 211 2HG GLU 349 1HG GLU 49 0.488 6.894 6.894 212 H LEU 350 H LEU 50 -1.095 8.572 8.572 213 HA LEU 350 HA LEU 50 -1.386 10.777 10.777 214 1HB LEU 350 2HB LEU 50 -3.071 11.267 11.267 215 2HB LEU 350 1HB LEU 50 -2.608 9.864 9.864 216 HG LEU 350 HG LEU 50 -0.836 11.531 11.531 217 1HD1 LEU 350 2HD1 LEU 50 -2.752 13.214 13.214 218 2HD1 LEU 350 1HD1 LEU 50 -2.262 13.776 13.776 219 3HD1 LEU 350 3HD1 LEU 50 -1.048 13.487 13.487 220 1HD2 LEU 350 1HD2 LEU 50 -3.698 11.030 11.030 221 2HD2 LEU 350 3HD2 LEU 50 -2.289 10.796 10.796 222 3HD2 LEU 350 2HD2 LEU 50 -2.982 12.405 12.405 223 H LYS 351 H LYS 51 0.824 9.878 9.878 224 HA LYS 351 HA LYS 51 2.016 12.421 12.421 225 1HB LYS 351 2HB LYS 51 2.362 9.975 9.975 226 2HB LYS 351 1HB LYS 51 3.760 10.015 10.015 227 1HG LYS 351 2HG LYS 51 4.493 12.135 12.135 228 2HG LYS 351 1HG LYS 51 3.072 12.153 12.153 229 1HD LYS 351 2HD LYS 51 3.880 9.845 9.845 230 2HD LYS 351 1HD LYS 51 5.417 10.253 10.253 231 1HE LYS 351 2HE LYS 51 4.571 12.523 12.523 232 2HE LYS 351 1HE LYS 51 4.424 11.107 11.107 233 1HZ LYS 351 2HZ LYS 51 6.773 10.643 10.643 234 2HZ LYS 351 1HZ LYS 51 6.793 12.341 12.341 235 3HZ LYS 351 3HZ LYS 51 6.607 11.457 11.457 236 H ASP 352 H ASP 52 2.702 9.867 9.867 237 HA ASP 352 HA ASP 52 4.964 11.141 11.141 238 1HB ASP 352 2HB ASP 52 3.937 8.712 8.712 239 2HB ASP 352 1HB ASP 52 3.071 9.486 9.486 240 H ALA 353 H ALA 53 1.474 11.437 11.437 241 HA ALA 353 HA ALA 53 1.855 13.310 13.310 242 1HB ALA 353 3HB ALA 53 -0.158 11.539 11.539 243 2HB ALA 353 2HB ALA 53 -0.836 13.097 13.097 244 3HB ALA 353 1HB ALA 53 -0.303 12.834 12.834 245 H GLN 354 H GLN 54 2.761 13.921 13.921 246 HA GLN 354 HA GLN 54 1.098 16.377 16.377 247 1HB GLN 354 2HB GLN 54 1.944 14.284 14.284 248 2HB GLN 354 1HB GLN 54 2.711 15.795 15.795 249 1HG GLN 354 2HG GLN 54 0.057 16.444 16.444 250 2HG GLN 354 1HG GLN 54 -0.041 15.000 15.000 251 1HE2 GLN 354 2HE2 GLN 54 0.048 17.910 17.910 252 2HE2 GLN 354 1HE2 GLN 54 -1.024 17.320 17.320 253 H ALA 355 HN ALA 55 2.258 17.964 17.964 254 HA ALA 355 HA ALA 55 4.782 18.822 18.822 255 1HB ALA 355 2HB ALA 55 4.776 17.210 17.210 256 2HB ALA 355 1HB ALA 55 5.885 18.576 18.576 257 3HB ALA 355 3HB ALA 55 5.977 17.265 17.265 258 1H GLY 325 1H GLY 25 -13.224 -16.701 -16.701 259 2H GLY 325 3H GLY 25 -12.090 -16.601 -16.601 260 3H GLY 325 2H GLY 25 -13.673 -16.033 -16.033 261 1HA GLY 325 2HA GLY 25 -13.353 -14.134 -14.134 262 2HA GLY 325 1HA GLY 25 -11.757 -14.366 -14.366 263 H GLU 326 H GLU 26 -11.236 -13.017 -13.017 264 HA GLU 326 HA GLU 26 -10.734 -14.897 -14.897 265 1HB GLU 326 2HB GLU 26 -11.646 -12.026 -12.026 266 2HB GLU 326 1HB GLU 26 -10.759 -12.682 -12.682 267 1HG GLU 326 2HG GLU 26 -13.325 -13.811 -13.811 268 2HG GLU 326 1HG GLU 26 -13.179 -12.920 -12.920 269 H TYR 327 H TYR 27 -8.925 -13.702 -13.702 270 HA TYR 327 HA TYR 27 -6.686 -13.152 -13.152 271 1HB TYR 327 2HB TYR 27 -6.914 -14.434 -14.434 272 2HB TYR 327 1HB TYR 27 -5.457 -13.483 -13.483 273 HD1 TYR 327 HD1 TYR 27 -7.492 -16.330 -16.330 274 HD2 TYR 327 HD2 TYR 27 -3.764 -14.216 -14.216 275 HE1 TYR 327 HE1 TYR 27 -6.550 -18.179 -18.179 276 HE2 TYR 327 HE2 TYR 27 -2.823 -16.065 -16.065 277 HH TYR 327 HH TYR 27 -4.823 -18.682 -18.682 278 H PHE 328 H PHE 28 -6.533 -10.960 -10.960 279 HA PHE 328 HA PHE 28 -6.964 -9.162 -9.162 280 1HB PHE 328 2HB PHE 28 -6.729 -8.681 -8.681 281 2HB PHE 328 1HB PHE 28 -6.727 -7.363 -7.363 282 HD1 PHE 328 HD2 PHE 28 -8.666 -7.422 -7.422 283 HD2 PHE 328 HD1 PHE 28 -8.774 -9.461 -9.461 284 HE1 PHE 328 HE2 PHE 28 -11.141 -7.523 -7.523 285 HE2 PHE 328 HE1 PHE 28 -11.248 -9.565 -9.565 286 HZ PHE 328 HZ PHE 28 -12.432 -8.595 -8.595 287 H THR 329 H THR 29 -5.328 -7.321 -7.321 288 HA THR 329 HA THR 29 -2.589 -8.215 -8.215 289 HB THR 329 HB THR 29 -2.668 -6.855 -6.855 290 HG1 THR 329 HG1 THR 29 -4.016 -9.327 -9.327 291 1HG2 THR 329 2HG2 THR 29 -0.909 -8.397 -8.397 292 2HG2 THR 329 1HG2 THR 29 -1.723 -9.655 -9.655 293 3HG2 THR 329 3HG2 THR 29 -0.956 -8.304 -8.304 294 H LEU 330 H LEU 30 -1.271 -6.571 -6.571 295 HA LEU 330 HA LEU 30 -2.327 -3.780 -3.780 296 1HB LEU 330 2HB LEU 30 -1.706 -5.274 -5.274 297 2HB LEU 330 1HB LEU 30 -0.389 -4.119 -4.119 298 HG LEU 330 HG LEU 30 -2.682 -2.638 -2.638 299 1HD1 LEU 330 2HD1 LEU 30 -3.559 -4.900 -4.900 300 2HD1 LEU 330 1HD1 LEU 30 -3.308 -3.781 -3.781 301 3HD1 LEU 330 3HD1 LEU 30 -4.391 -3.345 -3.345 302 1HD2 LEU 330 2HD2 LEU 30 -0.579 -2.053 -2.053 303 2HD2 LEU 330 1HD2 LEU 30 -2.083 -1.449 -1.449 304 3HD2 LEU 330 3HD2 LEU 30 -1.308 -2.878 -2.878 305 H GLN 331 H GLN 31 -1.116 -3.439 -3.439 306 HA GLN 331 HA GLN 31 1.739 -3.986 -3.986 307 1HB GLN 331 2HB GLN 31 -0.051 -2.386 -2.386 308 2HB GLN 331 1HB GLN 31 1.651 -2.725 -2.725 309 1HG GLN 331 2HG GLN 31 0.466 -5.199 -5.199 310 2HG GLN 331 1HG GLN 31 -0.635 -4.425 -4.425 311 1HE2 GLN 331 2HE2 GLN 31 1.593 -5.994 -5.994 312 2HE2 GLN 331 1HE2 GLN 31 0.154 -6.248 -6.248 313 H ILE 332 H ILE 32 3.109 -2.758 -2.758 314 HA ILE 332 HA ILE 32 2.498 0.153 0.153 315 HB ILE 332 HB ILE 32 4.179 -1.691 -1.691 316 1HG1 ILE 332 2HG1 ILE 32 2.009 -0.241 -0.241 317 2HG1 ILE 332 1HG1 ILE 32 1.408 -1.218 -1.218 318 1HG2 ILE 332 3HG2 ILE 32 4.997 0.713 0.713 319 2HG2 ILE 332 2HG2 ILE 32 3.480 1.210 1.210 320 3HG2 ILE 332 1HG2 ILE 32 4.619 0.201 0.201 321 1HD1 ILE 332 1HD1 ILE 32 2.689 -3.169 -3.169 322 2HD1 ILE 332 3HD1 ILE 32 3.078 -2.173 -2.173 323 3HD1 ILE 332 2HD1 ILE 32 1.400 -2.593 -2.593 324 H ARG 333 H ARG 33 3.694 1.339 1.339 325 HA ARG 333 HA ARG 33 6.162 0.302 0.302 326 1HB ARG 333 2HB ARG 33 4.842 3.030 3.030 327 2HB ARG 333 1HB ARG 33 6.254 2.544 2.544 328 1HG ARG 333 2HG ARG 33 5.020 0.833 0.833 329 2HG ARG 333 1HG ARG 33 3.648 1.007 1.007 330 1HD ARG 333 2HD ARG 33 4.616 2.996 2.996 331 2HD ARG 333 1HD ARG 33 3.059 2.168 2.168 332 HE ARG 333 HE ARG 33 2.783 3.500 3.500 333 1HH1 ARG 333 2HH1 ARG 33 2.919 4.636 4.636 334 2HH1 ARG 333 1HH1 ARG 33 3.369 6.262 6.262 335 1HH2 ARG 333 1HH2 ARG 33 4.048 5.553 5.553 336 2HH2 ARG 333 2HH2 ARG 33 4.005 6.782 6.782 337 H GLY 334 H GLY 34 7.730 0.097 0.097 338 1HA GLY 334 2HA GLY 34 9.320 2.296 2.296 339 2HA GLY 334 1HA GLY 34 8.184 2.083 2.083 340 H ARG 335 H ARG 35 8.967 0.825 0.825 341 HA ARG 335 HA ARG 35 9.949 -1.797 -1.797 342 1HB ARG 335 2HB ARG 35 11.879 -0.898 -0.898 343 2HB ARG 335 1HB ARG 35 12.133 0.305 0.305 344 1HG ARG 335 2HG ARG 35 12.744 -1.367 -1.367 345 2HG ARG 335 1HG ARG 35 12.187 -2.670 -2.670 346 1HD ARG 335 2HD ARG 35 14.228 -0.888 -0.888 347 2HD ARG 335 1HD ARG 35 14.788 -1.867 -1.867 348 HE ARG 335 HE ARG 35 13.458 -3.086 -3.086 349 1HH1 ARG 335 2HH1 ARG 35 14.138 -4.703 -4.703 350 2HH1 ARG 335 1HH1 ARG 35 15.643 -5.422 -5.422 351 1HH2 ARG 335 1HH2 ARG 35 16.159 -3.251 -3.251 352 2HH2 ARG 335 2HH2 ARG 35 16.788 -4.600 -4.600 353 H GLU 336 H GLU 36 11.198 0.983 0.983 354 HA GLU 336 HA GLU 36 11.192 -0.401 -0.401 355 1HB GLU 336 2HB GLU 36 11.334 2.443 2.443 356 2HB GLU 336 1HB GLU 36 10.852 2.153 2.153 357 1HG GLU 336 2HG GLU 36 13.121 2.111 2.111 358 2HG GLU 336 1HG GLU 36 12.925 0.430 0.430 359 H ARG 337 H ARG 37 8.769 1.865 1.865 360 HA ARG 337 HA ARG 37 6.891 1.661 1.661 361 1HB ARG 337 2HB ARG 37 6.749 2.355 2.355 362 2HB ARG 337 1HB ARG 37 5.232 2.001 2.001 363 1HG ARG 337 2HG ARG 37 5.981 3.639 3.639 364 2HG ARG 337 1HG ARG 37 7.265 4.128 4.128 365 1HD ARG 337 2HD ARG 37 4.419 4.058 4.058 366 2HD ARG 337 1HD ARG 37 4.992 5.435 5.435 367 HE ARG 337 HE ARG 37 6.333 6.082 6.082 368 1HH1 ARG 337 1HH2 ARG 37 8.002 4.215 4.215 369 2HH1 ARG 337 2HH2 ARG 37 7.222 3.463 3.463 370 1HH2 ARG 337 2HH1 ARG 37 4.050 4.544 4.544 371 2HH2 ARG 337 1HH1 ARG 37 4.985 3.651 3.651 372 H PHE 338 H PHE 38 7.348 -0.380 -0.380 373 HA PHE 338 HA PHE 38 5.100 -2.086 -2.086 374 1HB PHE 338 2HB PHE 38 6.472 -2.208 -2.208 375 2HB PHE 338 1HB PHE 38 7.877 -2.703 -2.703 376 HD1 PHE 338 HD2 PHE 38 4.528 -3.733 -3.733 377 HD2 PHE 338 HD1 PHE 38 8.122 -4.960 -4.960 378 HE1 PHE 338 HE2 PHE 38 3.823 -6.103 -6.103 379 HE2 PHE 338 HE1 PHE 38 7.417 -7.330 -7.330 380 HZ PHE 338 HZ PHE 38 5.268 -7.901 -7.901 381 H GLU 339 H GLU 39 8.362 -2.226 -2.226 382 HA GLU 339 HA GLU 39 8.020 -4.692 -4.692 383 1HB GLU 339 2HB GLU 39 9.660 -2.247 -2.247 384 2HB GLU 339 1HB GLU 39 9.811 -3.830 -3.830 385 1HG GLU 339 2HG GLU 39 10.064 -4.605 -4.605 386 2HG GLU 339 1HG GLU 39 10.651 -2.951 -2.951 387 H MET 340 H MET 40 7.244 -1.341 -1.341 388 HA MET 340 HA MET 40 6.432 -1.712 -1.712 389 1HB MET 340 2HB MET 40 5.861 0.215 0.215 390 2HB MET 340 1HB MET 40 4.572 0.075 0.075 391 1HG MET 340 2HG MET 40 6.072 0.603 0.603 392 2HG MET 340 1HG MET 40 7.479 0.470 0.470 393 1HE MET 340 2HE MET 40 3.985 1.878 1.878 394 2HE MET 340 1HE MET 40 4.137 3.497 3.497 395 3HE MET 340 3HE MET 40 4.416 2.076 2.076 396 H PHE 341 H PHE 41 4.478 -1.991 -1.991 397 HA PHE 341 HA PHE 41 2.103 -2.906 -2.906 398 1HB PHE 341 2HB PHE 41 3.107 -2.996 -2.996 399 2HB PHE 341 1HB PHE 41 1.631 -3.851 -3.851 400 HD1 PHE 341 HD2 PHE 41 2.827 -0.694 -0.694 401 HD2 PHE 341 HD1 PHE 41 0.036 -2.499 -2.499 402 HE1 PHE 341 HE2 PHE 41 1.561 1.432 1.432 403 HE2 PHE 341 HE1 PHE 41 -1.234 -0.371 -0.371 404 HZ PHE 341 HZ PHE 41 -0.471 1.595 1.595 405 H ARG 342 H ARG 42 5.030 -4.476 -4.476 406 HA ARG 342 HA ARG 42 4.068 -7.168 -7.168 407 1HB ARG 342 2HB ARG 42 6.586 -5.833 -5.833 408 2HB ARG 342 1HB ARG 42 6.751 -7.119 -7.119 409 1HG ARG 342 2HG ARG 42 5.221 -7.963 -7.963 410 2HG ARG 342 1HG ARG 42 6.858 -7.450 -7.450 411 1HD ARG 342 2HD ARG 42 7.703 -8.936 -8.936 412 2HD ARG 342 1HD ARG 42 6.060 -9.553 -9.553 413 HE ARG 342 HE ARG 42 6.427 -10.039 -10.039 414 1HH1 ARG 342 1HH2 ARG 42 7.848 -11.165 -11.165 415 2HH1 ARG 342 2HH2 ARG 42 9.075 -12.102 -12.102 416 1HH2 ARG 342 2HH1 ARG 42 8.338 -10.902 -10.902 417 2HH2 ARG 342 1HH1 ARG 42 9.353 -11.953 -11.953 418 H GLU 343 H GLU 43 5.247 -5.132 -5.132 419 HA GLU 343 HA GLU 43 5.228 -7.243 -7.243 420 1HB GLU 343 2HB GLU 43 6.517 -5.166 -5.166 421 2HB GLU 343 1HB GLU 43 5.019 -4.233 -4.233 422 1HG GLU 343 2HG GLU 43 5.769 -4.685 -4.685 423 2HG GLU 343 1HG GLU 43 4.248 -5.516 -5.516 424 H LEU 344 H LEU 44 2.940 -4.608 -4.608 425 HA LEU 344 HA LEU 44 0.932 -5.367 -5.367 426 1HB LEU 344 2HB LEU 44 0.880 -3.871 -3.871 427 2HB LEU 344 1HB LEU 44 -0.625 -4.269 -4.269 428 HG LEU 344 HG LEU 44 -0.161 -2.136 -2.136 429 1HD1 LEU 344 1HD1 LEU 44 -0.210 -4.099 -4.099 430 2HD1 LEU 344 3HD1 LEU 44 1.450 -3.575 -3.575 431 3HD1 LEU 344 2HD1 LEU 44 0.118 -2.437 -2.437 432 1HD2 LEU 344 3HD2 LEU 44 2.738 -3.003 -3.003 433 2HD2 LEU 344 2HD2 LEU 44 1.992 -1.757 -1.757 434 3HD2 LEU 344 1HD2 LEU 44 2.177 -1.500 -1.500 435 H ASN 345 H ASN 45 1.950 -6.713 -6.713 436 HA ASN 345 HA ASN 45 -0.495 -8.313 -8.313 437 1HB ASN 345 2HB ASN 45 1.691 -7.486 -7.486 438 2HB ASN 345 1HB ASN 45 1.713 -9.248 -9.248 439 1HD2 ASN 345 2HD2 ASN 45 -0.585 -8.590 -8.590 440 2HD2 ASN 345 1HD2 ASN 45 1.079 -8.666 -8.666 441 H GLU 346 H GLU 46 2.668 -8.592 -8.592 442 HA GLU 346 HA GLU 46 2.746 -11.484 -11.484 443 1HB GLU 346 2HB GLU 46 4.737 -9.920 -9.920 444 2HB GLU 346 1HB GLU 46 4.148 -9.561 -9.561 445 1HG GLU 346 2HG GLU 46 5.864 -11.377 -11.377 446 2HG GLU 346 1HG GLU 46 4.313 -11.914 -11.914 447 H ALA 347 H ALA 47 1.681 -8.938 -8.938 448 HA ALA 347 HA ALA 47 0.984 -10.835 -10.835 449 1HB ALA 347 1HB ALA 47 1.505 -8.255 -8.255 450 2HB ALA 347 3HB ALA 47 -0.218 -8.089 -8.089 451 3HB ALA 347 2HB ALA 47 0.320 -8.977 -8.977 452 H LEU 348 H LEU 48 -0.881 -8.947 -8.947 453 HA LEU 348 HA LEU 48 -3.458 -9.851 -9.851 454 1HB LEU 348 2HB LEU 48 -2.376 -9.207 -9.207 455 2HB LEU 348 1HB LEU 48 -4.087 -9.389 -9.389 456 HG LEU 348 HG LEU 48 -2.282 -7.425 -7.425 457 1HD1 LEU 348 1HD1 LEU 48 -2.718 -7.166 -7.166 458 2HD1 LEU 348 3HD1 LEU 48 -4.280 -6.567 -6.567 459 3HD1 LEU 348 2HD1 LEU 48 -2.794 -5.770 -5.770 460 1HD2 LEU 348 3HD2 LEU 48 -5.295 -7.694 -7.694 461 2HD2 LEU 348 2HD2 LEU 48 -4.342 -8.078 -8.078 462 3HD2 LEU 348 1HD2 LEU 48 -4.460 -6.410 -6.410 463 H GLU 349 H GLU 49 -1.227 -11.242 -11.242 464 HA GLU 349 HA GLU 49 -2.835 -13.535 -13.535 465 1HB GLU 349 2HB GLU 49 -0.948 -12.863 -12.863 466 2HB GLU 349 1HB GLU 49 0.182 -13.213 -13.213 467 1HG GLU 349 2HG GLU 49 -0.149 -15.522 -15.522 468 2HG GLU 349 1HG GLU 49 -1.720 -15.344 -15.344 469 H LEU 350 H LEU 50 -0.621 -12.756 -12.756 470 HA LEU 350 HA LEU 50 -0.301 -15.450 -15.450 471 1HB LEU 350 2HB LEU 50 1.178 -14.428 -14.428 472 2HB LEU 350 1HB LEU 50 0.729 -12.900 -12.900 473 HG LEU 350 HG LEU 50 -1.260 -12.977 -12.977 474 1HD1 LEU 350 2HD1 LEU 50 0.654 -15.077 -15.077 475 2HD1 LEU 350 1HD1 LEU 50 -0.028 -14.020 -14.020 476 3HD1 LEU 350 3HD1 LEU 50 -1.094 -14.985 -14.985 477 1HD2 LEU 350 1HD2 LEU 50 1.562 -12.109 -12.109 478 2HD2 LEU 350 3HD2 LEU 50 0.080 -11.177 -11.177 479 3HD2 LEU 350 2HD2 LEU 50 0.685 -12.181 -12.181 480 H LYS 351 H LYS 51 -2.726 -12.960 -12.960 481 HA LYS 351 HA LYS 51 -4.093 -13.996 -13.996 482 1HB LYS 351 2HB LYS 51 -4.418 -11.789 -11.789 483 2HB LYS 351 1HB LYS 51 -5.696 -12.795 -12.795 484 1HG LYS 351 2HG LYS 51 -6.651 -13.142 -13.142 485 2HG LYS 351 1HG LYS 51 -5.348 -12.197 -12.197 486 1HD LYS 351 2HD LYS 51 -6.094 -10.299 -10.299 487 2HD LYS 351 1HD LYS 51 -7.568 -11.242 -11.242 488 1HE LYS 351 2HE LYS 51 -7.015 -11.158 -11.158 489 2HE LYS 351 1HE LYS 51 -6.894 -9.511 -9.511 490 1HZ LYS 351 2HZ LYS 51 -9.077 -10.377 -10.377 491 2HZ LYS 351 1HZ LYS 51 -9.202 -11.255 -11.255 492 3HZ LYS 351 3HZ LYS 51 -9.113 -9.562 -9.562 493 H ASP 352 H ASP 52 -4.386 -14.655 -14.655 494 HA ASP 352 HA ASP 52 -6.591 -16.478 -16.478 495 1HB ASP 352 2HB ASP 52 -5.426 -15.353 -15.353 496 2HB ASP 352 1HB ASP 52 -4.464 -16.831 -16.831 497 H ALA 353 H ALA 53 -3.115 -16.820 -16.820 498 HA ALA 353 HA ALA 53 -3.348 -19.757 -19.757 499 1HB ALA 353 3HB ALA 53 -1.330 -18.114 -18.114 500 2HB ALA 353 2HB ALA 53 -0.774 -18.519 -18.519 501 3HB ALA 353 1HB ALA 53 -1.128 -19.803 -19.803 502 H GLN 354 H GLN 54 -4.557 -17.767 -17.767 503 HA GLN 354 HA GLN 54 -3.094 -18.664 -18.664 504 1HB GLN 354 2HB GLN 54 -3.903 -16.054 -16.054 505 2HB GLN 354 1HB GLN 54 -4.874 -16.502 -16.502 506 1HG GLN 354 2HG GLN 54 -2.281 -17.390 -17.390 507 2HG GLN 354 1HG GLN 54 -2.061 -15.798 -15.798 508 1HE2 GLN 354 2HE2 GLN 54 -2.668 -15.132 -15.132 509 2HE2 GLN 354 1HE2 GLN 54 -1.434 -15.801 -15.801 510 H ALA 355 HN ALA 55 -4.231 -20.452 -20.452 511 HA ALA 355 HA ALA 55 -6.900 -20.114 -20.114 512 1HB ALA 355 2HB ALA 55 -6.543 -21.365 -21.365 513 2HB ALA 355 1HB ALA 55 -7.736 -22.069 -22.069 514 3HB ALA 355 3HB ALA 55 -7.871 -20.378 -20.378 515 1H GLY 325 1H GLY 25 11.006 -2.114 -2.114 516 2H GLY 325 3H GLY 25 9.869 -3.116 -3.116 517 3H GLY 325 2H GLY 25 11.450 -3.016 -3.016 518 1HA GLY 325 2HA GLY 25 11.135 -0.975 -0.975 519 2HA GLY 325 1HA GLY 25 9.536 -1.698 -1.698 520 H GLU 326 H GLU 26 9.011 0.736 0.736 521 HA GLU 326 HA GLU 26 8.517 1.634 1.634 522 1HB GLU 326 2HB GLU 26 9.426 3.188 3.188 523 2HB GLU 326 1HB GLU 26 8.542 3.992 3.992 524 1HG GLU 326 2HG GLU 26 11.109 2.407 2.407 525 2HG GLU 326 1HG GLU 26 10.962 4.164 4.164 526 H TYR 327 H TYR 27 6.713 3.520 3.520 527 HA TYR 327 HA TYR 27 4.468 2.233 2.233 528 1HB TYR 327 2HB TYR 27 4.703 3.783 3.783 529 2HB TYR 327 1HB TYR 27 3.245 4.059 4.059 530 HD1 TYR 327 HD1 TYR 27 5.277 1.475 1.475 531 HD2 TYR 327 HD2 TYR 27 1.551 2.377 2.377 532 HE1 TYR 327 HE1 TYR 27 4.334 -0.666 -0.666 533 HE2 TYR 327 HE2 TYR 27 0.606 0.235 0.235 534 HH TYR 327 HH TYR 27 2.607 -2.173 -2.173 535 H PHE 328 H PHE 28 4.306 3.165 3.165 536 HA PHE 328 HA PHE 28 4.759 6.090 6.090 537 1HB PHE 328 2HB PHE 28 4.493 3.850 3.850 538 2HB PHE 328 1HB PHE 28 4.492 5.549 5.549 539 HD1 PHE 328 HD2 PHE 28 6.444 7.013 7.013 540 HD2 PHE 328 HD1 PHE 28 6.538 2.729 2.729 541 HE1 PHE 328 HE2 PHE 28 8.919 7.056 7.056 542 HE2 PHE 328 HE1 PHE 28 9.012 2.773 2.773 543 HZ PHE 328 HZ PHE 28 10.203 4.937 4.937 544 H THR 329 H THR 29 3.115 7.231 7.231 545 HA THR 329 HA THR 29 0.374 6.124 6.124 546 HB THR 329 HB THR 29 0.557 9.043 9.043 547 HG1 THR 329 HG1 THR 29 1.789 7.285 7.285 548 1HG2 THR 329 2HG2 THR 29 -1.309 7.161 7.161 549 2HG2 THR 329 1HG2 THR 29 -0.566 7.262 7.262 550 3HG2 THR 329 3HG2 THR 29 -1.259 8.703 8.703 551 H LEU 330 H LEU 30 -0.897 6.348 6.348 552 HA LEU 330 HA LEU 30 0.115 8.113 8.113 553 1HB LEU 330 2HB LEU 30 -0.468 5.355 5.355 554 2HB LEU 330 1HB LEU 30 -1.814 6.125 6.125 555 HG LEU 330 HG LEU 30 0.417 7.462 7.462 556 1HD1 LEU 330 2HD1 LEU 30 1.429 5.174 5.174 557 2HD1 LEU 330 1HD1 LEU 30 1.163 4.662 4.662 558 3HD1 LEU 330 3HD1 LEU 30 2.191 6.054 6.054 559 1HD2 LEU 330 2HD2 LEU 30 -1.652 6.627 6.627 560 2HD2 LEU 330 1HD2 LEU 30 -0.155 6.355 6.355 561 3HD2 LEU 330 3HD2 LEU 30 -0.920 5.023 5.023 562 H GLN 331 H GLN 31 -1.098 9.942 9.942 563 HA GLN 331 HA GLN 31 -3.961 9.706 9.706 564 1HB GLN 331 2HB GLN 31 -2.162 12.122 12.122 565 2HB GLN 331 1HB GLN 31 -3.863 12.206 12.206 566 1HG GLN 331 2HG GLN 31 -2.685 10.283 10.283 567 2HG GLN 331 1HG GLN 31 -1.579 11.658 11.658 568 1HE2 GLN 331 2HE2 GLN 31 -3.807 12.805 12.805 569 2HE2 GLN 331 1HE2 GLN 31 -2.370 11.937 11.937 570 H ILE 332 H ILE 32 -5.334 9.376 9.376 571 HA ILE 332 HA ILE 32 -4.713 10.691 10.691 572 HB ILE 332 HB ILE 32 -6.397 8.244 8.244 573 1HG1 ILE 332 2HG1 ILE 32 -4.230 7.948 7.948 574 2HG1 ILE 332 1HG1 ILE 32 -3.628 8.547 8.547 575 1HG2 ILE 332 3HG2 ILE 32 -7.217 9.746 9.746 576 2HG2 ILE 332 2HG2 ILE 32 -5.702 9.380 9.380 577 3HG2 ILE 332 1HG2 ILE 32 -6.839 8.084 8.084 578 1HD1 ILE 332 1HD1 ILE 32 -4.912 6.705 6.705 579 2HD1 ILE 332 3HD1 ILE 32 -5.300 6.062 6.062 580 3HD1 ILE 332 2HD1 ILE 32 -3.623 6.125 6.125 581 H ARG 333 H ARG 33 -5.906 12.525 12.525 582 HA ARG 333 HA ARG 33 -8.378 12.936 12.936 583 1HB ARG 333 2HB ARG 33 -7.055 14.552 14.552 584 2HB ARG 333 1HB ARG 33 -8.470 15.079 15.079 585 1HG ARG 333 2HG ARG 33 -7.240 15.110 15.110 586 2HG ARG 333 1HG ARG 33 -5.867 14.282 14.282 587 1HD ARG 333 2HD ARG 33 -6.833 17.096 17.096 588 2HD ARG 333 1HD ARG 33 -5.277 16.605 16.605 589 HE ARG 333 HE ARG 33 -5.002 15.438 15.438 590 1HH1 ARG 333 2HH1 ARG 33 -5.135 18.641 18.641 591 2HH1 ARG 333 1HH1 ARG 33 -5.589 19.189 19.189 592 1HH2 ARG 333 1HH2 ARG 33 -6.270 16.008 16.008 593 2HH2 ARG 333 2HH2 ARG 33 -6.228 17.699 17.699 594 H GLY 334 H GLY 34 -9.956 11.484 11.484 595 1HA GLY 334 2HA GLY 34 -11.548 12.072 12.072 596 2HA GLY 334 1HA GLY 34 -10.414 10.833 10.833 597 H ARG 335 H ARG 35 -11.192 8.807 8.807 598 HA ARG 335 HA ARG 35 -12.173 7.637 7.637 599 1HB ARG 335 2HB ARG 35 -14.101 9.097 9.097 600 2HB ARG 335 1HB ARG 35 -14.356 8.689 8.689 601 1HG ARG 335 2HG ARG 35 -14.968 6.437 6.437 602 2HG ARG 335 1HG ARG 35 -14.413 6.614 6.614 603 1HD ARG 335 2HD ARG 35 -16.455 8.576 8.576 604 2HD ARG 335 1HD ARG 35 -17.012 6.905 6.905 605 HE ARG 335 HE ARG 35 -15.682 8.259 8.259 606 1HH1 ARG 335 2HH1 ARG 35 -16.364 5.289 5.289 607 2HH1 ARG 335 1HH1 ARG 35 -17.867 5.295 5.295 608 1HH2 ARG 335 1HH2 ARG 35 -18.383 8.701 8.701 609 2HH2 ARG 335 2HH2 ARG 35 -19.010 7.227 7.227 610 H GLU 336 H GLU 36 -13.441 7.547 7.547 611 HA GLU 336 HA GLU 36 -13.436 4.708 4.708 612 1HB GLU 336 2HB GLU 36 -13.578 6.973 6.973 613 2HB GLU 336 1HB GLU 36 -13.095 5.410 5.410 614 1HG GLU 336 2HG GLU 36 -15.361 5.109 5.109 615 2HG GLU 336 1HG GLU 36 -15.168 4.617 4.617 616 H ARG 337 H ARG 37 -11.017 7.069 7.069 617 HA ARG 337 HA ARG 37 -9.140 5.184 5.184 618 1HB ARG 337 2HB ARG 37 -8.997 8.002 8.002 619 2HB ARG 337 1HB ARG 37 -7.480 7.114 7.114 620 1HG ARG 337 2HG ARG 37 -8.219 6.472 6.472 621 2HG ARG 337 1HG ARG 37 -9.502 7.670 7.670 622 1HD ARG 337 2HD ARG 37 -6.656 8.434 8.434 623 2HD ARG 337 1HD ARG 37 -7.227 8.391 8.391 624 HE ARG 337 HE ARG 37 -8.563 10.298 10.298 625 1HH1 ARG 337 1HH2 ARG 37 -10.231 10.135 10.135 626 2HH1 ARG 337 2HH2 ARG 37 -9.447 10.865 10.865 627 1HH2 ARG 337 2HH1 ARG 37 -6.278 10.696 10.696 628 2HH2 ARG 337 1HH1 ARG 37 -7.212 11.184 11.184 629 H PHE 338 H PHE 38 -9.599 6.501 6.501 630 HA PHE 338 HA PHE 38 -7.349 5.300 5.300 631 1HB PHE 338 2HB PHE 38 -8.710 6.920 6.920 632 2HB PHE 338 1HB PHE 38 -10.115 5.859 5.859 633 HD1 PHE 338 HD2 PHE 38 -6.762 6.309 6.309 634 HD2 PHE 338 HD1 PHE 38 -10.355 3.956 3.956 635 HE1 PHE 338 HE2 PHE 38 -6.050 5.187 5.187 636 HE2 PHE 338 HE1 PHE 38 -9.642 2.832 2.832 637 HZ PHE 338 HZ PHE 38 -7.489 3.447 3.447 638 H GLU 339 H GLU 39 -10.606 4.009 4.009 639 HA GLU 339 HA GLU 39 -10.257 1.505 1.505 640 1HB GLU 339 2HB GLU 39 -11.901 2.192 2.192 641 2HB GLU 339 1HB GLU 39 -12.052 0.697 0.697 642 1HG GLU 339 2HG GLU 39 -12.300 2.427 2.427 643 2HG GLU 339 1HG GLU 39 -12.887 3.466 3.466 644 H MET 340 H MET 40 -9.482 2.583 2.583 645 HA MET 340 HA MET 40 -8.669 0.134 0.134 646 1HB MET 340 2HB MET 40 -8.100 2.992 2.992 647 2HB MET 340 1HB MET 40 -6.811 1.909 1.909 648 1HG MET 340 2HG MET 40 -8.314 0.680 0.680 649 2HG MET 340 1HG MET 40 -9.719 1.500 1.500 650 1HE MET 340 2HE MET 40 -6.222 2.358 2.358 651 2HE MET 340 1HE MET 40 -6.370 3.802 3.802 652 3HE MET 340 3HE MET 40 -6.654 3.895 3.895 653 H PHE 341 H PHE 41 -6.719 2.486 2.486 654 HA PHE 341 HA PHE 41 -4.347 0.866 0.866 655 1HB PHE 341 2HB PHE 41 -5.344 3.208 3.208 656 2HB PHE 341 1HB PHE 41 -3.870 2.366 2.366 657 HD1 PHE 341 HD2 PHE 41 -5.067 2.770 2.770 658 HD2 PHE 341 HD1 PHE 41 -2.274 4.087 4.087 659 HE1 PHE 341 HE2 PHE 41 -3.799 4.006 4.006 660 HE2 PHE 341 HE1 PHE 41 -1.004 5.323 5.323 661 HZ PHE 341 HZ PHE 41 -1.767 5.282 5.282 662 H ARG 342 H ARG 42 -7.273 0.908 0.908 663 HA ARG 342 HA ARG 42 -6.311 -0.472 -0.472 664 1HB ARG 342 2HB ARG 42 -8.830 0.417 0.417 665 2HB ARG 342 1HB ARG 42 -8.994 -1.283 -1.283 666 1HG ARG 342 2HG ARG 42 -7.456 0.242 0.242 667 2HG ARG 342 1HG ARG 42 -9.096 0.862 0.862 668 1HD ARG 342 2HD ARG 42 -9.934 -1.504 -1.504 669 2HD ARG 342 1HD ARG 42 -8.288 -1.978 -1.978 670 HE ARG 342 HE ARG 42 -8.654 -0.047 -0.047 671 1HH1 ARG 342 1HH2 ARG 42 -10.080 -3.043 -3.043 672 2HH1 ARG 342 2HH2 ARG 42 -11.305 -2.886 -2.886 673 1HH2 ARG 342 2HH1 ARG 42 -10.562 0.426 0.426 674 2HH2 ARG 342 1HH1 ARG 42 -11.578 -0.923 -0.923 675 H GLU 343 H GLU 43 -7.486 -1.593 -1.593 676 HA GLU 343 HA GLU 43 -7.459 -4.400 -4.400 677 1HB GLU 343 2HB GLU 43 -8.750 -3.559 -3.559 678 2HB GLU 343 1HB GLU 43 -7.250 -3.075 -3.075 679 1HG GLU 343 2HG GLU 43 -8.003 -5.255 -5.255 680 2HG GLU 343 1HG GLU 43 -6.484 -5.428 -5.428 681 H LEU 344 H LEU 44 -5.182 -2.299 -2.299 682 HA LEU 344 HA LEU 44 -3.165 -4.281 -4.281 683 1HB LEU 344 2HB LEU 44 -3.143 -1.268 -1.268 684 2HB LEU 344 1HB LEU 44 -1.621 -2.146 -2.146 685 HG LEU 344 HG LEU 44 -2.030 -1.743 -1.743 686 1HD1 LEU 344 1HD1 LEU 44 -2.018 -4.291 -4.291 687 2HD1 LEU 344 3HD1 LEU 44 -3.676 -4.241 -4.241 688 3HD1 LEU 344 2HD1 LEU 44 -2.340 -3.818 -3.818 689 1HD2 LEU 344 3HD2 LEU 44 -4.951 -2.143 -2.143 690 2HD2 LEU 344 2HD2 LEU 44 -4.158 -0.670 -0.670 691 3HD2 LEU 344 1HD2 LEU 44 -4.363 -2.036 -2.036 692 H ASN 345 H ASN 45 -4.192 -2.491 -2.491 693 HA ASN 345 HA ASN 45 -1.734 -3.049 -3.049 694 1HB ASN 345 2HB ASN 45 -3.881 -1.197 -1.197 695 2HB ASN 345 1HB ASN 45 -3.944 -2.210 -2.210 696 1HD2 ASN 345 2HD2 ASN 45 -1.579 0.368 0.368 697 2HD2 ASN 345 1HD2 ASN 45 -3.252 0.116 0.116 698 H GLU 346 H GLU 46 -4.896 -4.399 -4.399 699 HA GLU 346 HA GLU 46 -4.963 -6.044 -6.044 700 1HB GLU 346 2HB GLU 46 -6.964 -5.407 -5.407 701 2HB GLU 346 1HB GLU 46 -6.382 -6.577 -6.577 702 1HG GLU 346 2HG GLU 46 -8.089 -7.547 -7.547 703 2HG GLU 346 1HG GLU 46 -6.535 -8.376 -8.376 704 H ALA 347 H ALA 47 -3.923 -6.550 -6.550 705 HA ALA 347 HA ALA 47 -3.228 -9.337 -9.337 706 1HB ALA 347 1HB ALA 47 -3.791 -8.089 -8.089 707 2HB ALA 347 3HB ALA 47 -2.068 -7.704 -7.704 708 3HB ALA 347 2HB ALA 47 -2.597 -9.387 -9.387 709 H LEU 348 H LEU 48 -1.369 -6.293 -6.293 710 HA LEU 348 HA LEU 48 1.215 -7.415 -7.415 711 1HB LEU 348 2HB LEU 48 0.138 -4.745 -4.745 712 2HB LEU 348 1HB LEU 48 1.849 -5.173 -5.173 713 HG LEU 348 HG LEU 48 0.044 -5.305 -5.305 714 1HD1 LEU 348 1HD1 LEU 48 0.485 -2.972 -2.972 715 2HD1 LEU 348 3HD1 LEU 48 2.048 -3.117 -3.117 716 3HD1 LEU 348 2HD1 LEU 48 0.563 -3.117 -3.117 717 1HD2 LEU 348 3HD2 LEU 48 3.058 -5.240 -5.240 718 2HD2 LEU 348 2HD2 LEU 48 2.104 -6.656 -6.656 719 3HD2 LEU 348 1HD2 LEU 48 2.221 -5.287 -5.287 720 H GLU 349 H GLU 49 -1.009 -6.124 -6.124 721 HA GLU 349 HA GLU 49 0.598 -6.886 -6.886 722 1HB GLU 349 2HB GLU 49 -1.290 -5.318 -5.318 723 2HB GLU 349 1HB GLU 49 -2.419 -6.609 -6.609 724 1HG GLU 349 2HG GLU 49 -2.082 -7.728 -7.728 725 2HG GLU 349 1HG GLU 49 -0.509 -6.976 -6.976 726 H LEU 350 H LEU 50 -1.612 -8.651 -8.651 727 HA LEU 350 HA LEU 50 -1.931 -10.930 -10.930 728 1HB LEU 350 2HB LEU 50 -3.414 -11.525 -11.525 729 2HB LEU 350 1HB LEU 50 -2.960 -10.081 -10.081 730 HG LEU 350 HG LEU 50 -0.977 -11.592 -11.592 731 1HD1 LEU 350 2HD1 LEU 50 -2.889 -13.482 -13.482 732 2HD1 LEU 350 1HD1 LEU 50 -2.212 -13.962 -13.962 733 3HD1 LEU 350 3HD1 LEU 50 -1.142 -13.613 -13.613 734 1HD2 LEU 350 1HD2 LEU 50 -3.799 -11.293 -11.293 735 2HD2 LEU 350 3HD2 LEU 50 -2.317 -10.988 -10.988 736 3HD2 LEU 350 2HD2 LEU 50 -2.935 -12.633 -12.633 737 H LYS 351 H LYS 51 0.487 -9.893 -9.893 738 HA LYS 351 HA LYS 51 1.861 -12.375 -12.375 739 1HB LYS 351 2HB LYS 51 2.183 -9.900 -9.900 740 2HB LYS 351 1HB LYS 51 3.461 -9.870 -9.870 741 1HG LYS 351 2HG LYS 51 4.416 -11.933 -11.933 742 2HG LYS 351 1HG LYS 51 3.111 -12.034 -12.034 743 1HD LYS 351 2HD LYS 51 3.856 -9.679 -9.679 744 2HD LYS 351 1HD LYS 51 5.331 -9.998 -9.998 745 1HE LYS 351 2HE LYS 51 4.774 -12.308 -12.308 746 2HE LYS 351 1HE LYS 51 4.652 -10.897 -10.897 747 1HZ LYS 351 2HZ LYS 51 6.838 -10.306 -10.306 748 2HZ LYS 351 1HZ LYS 51 6.960 -12.000 -12.000 749 3HZ LYS 351 3HZ LYS 51 6.870 -11.119 -11.119 750 H ASP 352 H ASP 52 2.152 -9.811 -9.811 751 HA ASP 352 HA ASP 52 4.359 -10.976 -10.976 752 1HB ASP 352 2HB ASP 52 3.193 -8.603 -8.603 753 2HB ASP 352 1HB ASP 52 2.236 -9.414 -9.414 754 H ALA 353 H ALA 53 0.881 -11.489 -11.489 755 HA ALA 353 HA ALA 53 1.118 -13.309 -13.309 756 1HB ALA 353 3HB ALA 53 -0.901 -11.636 -11.636 757 2HB ALA 353 2HB ALA 53 -1.456 -13.220 -13.220 758 3HB ALA 353 1HB ALA 53 -1.104 -12.941 -12.941 759 H GLN 354 H GLN 54 2.329 -13.866 -13.866 760 HA GLN 354 HA GLN 54 0.861 -16.412 -16.412 761 1HB GLN 354 2HB GLN 54 1.655 -14.307 -14.307 762 2HB GLN 354 1HB GLN 54 2.630 -15.727 -15.727 763 1HG GLN 354 2HG GLN 54 0.049 -16.730 -16.730 764 2HG GLN 354 1HG GLN 54 -0.192 -15.253 -15.253 765 1HE2 GLN 354 2HE2 GLN 54 0.422 -17.868 -17.868 766 2HE2 GLN 354 1HE2 GLN 54 -0.811 -17.443 -17.443 767 H ALA 355 HN ALA 55 2.002 -17.944 -17.944 768 HA ALA 355 HA ALA 55 4.669 -18.632 -18.632 769 1HB ALA 355 2HB ALA 55 4.319 -17.037 -17.037 770 2HB ALA 355 1HB ALA 55 5.510 -18.338 -18.338 771 3HB ALA 355 3HB ALA 55 5.645 -17.020 -17.020 772 1H GLY 325 1H GLY 25 -14.928 15.806 15.806 773 2H GLY 325 3H GLY 25 -13.667 15.767 15.767 774 3H GLY 325 2H GLY 25 -15.184 15.116 15.116 775 1HA GLY 325 2HA GLY 25 -14.892 13.237 13.237 776 2HA GLY 325 1HA GLY 25 -13.245 13.552 13.552 777 H GLU 326 H GLU 26 -12.856 12.234 12.234 778 HA GLU 326 HA GLU 26 -12.694 14.136 14.136 779 1HB GLU 326 2HB GLU 26 -13.438 11.219 11.219 780 2HB GLU 326 1HB GLU 26 -12.734 11.921 11.921 781 1HG GLU 326 2HG GLU 26 -15.232 12.901 12.901 782 2HG GLU 326 1HG GLU 26 -15.186 12.022 12.022 783 H TYR 327 H TYR 27 -10.982 13.048 13.048 784 HA TYR 327 HA TYR 27 -8.531 12.620 12.620 785 1HB TYR 327 2HB TYR 27 -9.105 13.895 13.895 786 2HB TYR 327 1HB TYR 27 -7.575 13.025 13.025 787 HD1 TYR 327 HD1 TYR 27 -9.626 15.751 15.751 788 HD2 TYR 327 HD2 TYR 27 -5.776 13.848 13.848 789 HE1 TYR 327 HE1 TYR 27 -8.655 17.650 17.650 790 HE2 TYR 327 HE2 TYR 27 -4.806 15.746 15.746 791 HH TYR 327 HH TYR 27 -6.819 18.247 18.247 792 H PHE 328 H PHE 28 -8.219 10.440 10.440 793 HA PHE 328 HA PHE 28 -8.804 8.626 8.626 794 1HB PHE 328 2HB PHE 28 -8.212 8.160 8.160 795 2HB PHE 328 1HB PHE 28 -8.257 6.841 6.841 796 HD1 PHE 328 HD2 PHE 28 -10.375 6.779 6.779 797 HD2 PHE 328 HD1 PHE 28 -10.202 8.823 8.823 798 HE1 PHE 328 HE2 PHE 28 -12.850 6.744 6.744 799 HE2 PHE 328 HE1 PHE 28 -12.678 8.789 8.789 800 HZ PHE 328 HZ PHE 28 -14.002 7.749 7.749 801 H THR 329 H THR 29 -7.080 6.842 6.842 802 HA THR 329 HA THR 29 -4.340 7.932 7.932 803 HB THR 329 HB THR 29 -4.707 6.591 6.591 804 HG1 THR 329 HG1 THR 29 -6.021 9.020 9.020 805 1HG2 THR 329 2HG2 THR 29 -2.802 8.127 8.127 806 2HG2 THR 329 1HG2 THR 29 -3.708 9.376 9.376 807 3HG2 THR 329 3HG2 THR 29 -3.023 8.016 8.016 808 H LEU 330 H LEU 30 -2.911 6.390 6.390 809 HA LEU 330 HA LEU 30 -3.785 3.535 3.535 810 1HB LEU 330 2HB LEU 30 -3.051 5.037 5.037 811 2HB LEU 330 1HB LEU 30 -1.672 3.994 3.994 812 HG LEU 330 HG LEU 30 -3.863 2.321 2.321 813 1HD1 LEU 330 2HD1 LEU 30 -4.861 4.472 4.472 814 2HD1 LEU 330 1HD1 LEU 30 -4.398 3.364 3.364 815 3HD1 LEU 330 3HD1 LEU 30 -5.530 2.841 2.841 816 1HD2 LEU 330 2HD2 LEU 30 -1.642 1.886 1.886 817 2HD2 LEU 330 1HD2 LEU 30 -3.022 1.204 1.204 818 3HD2 LEU 330 3HD2 LEU 30 -2.272 2.692 2.692 819 H GLN 331 H GLN 31 -2.759 3.245 3.245 820 HA GLN 331 HA GLN 31 0.048 3.943 3.943 821 1HB GLN 331 2HB GLN 31 -1.837 2.254 2.254 822 2HB GLN 331 1HB GLN 31 -0.196 2.685 2.685 823 1HG GLN 331 2HG GLN 31 -1.433 5.093 5.093 824 2HG GLN 331 1HG GLN 31 -2.603 4.259 4.259 825 1HE2 GLN 331 2HE2 GLN 31 -0.714 5.939 5.939 826 2HE2 GLN 331 1HE2 GLN 31 -2.069 6.118 6.118 827 H ILE 332 H ILE 32 1.598 2.800 2.800 828 HA ILE 332 HA ILE 32 1.175 -0.140 -0.140 829 HB ILE 332 HB ILE 32 2.921 1.796 1.796 830 1HG1 ILE 332 2HG1 ILE 32 0.984 0.224 0.224 831 2HG1 ILE 332 1HG1 ILE 32 0.192 1.165 1.165 832 1HG2 ILE 332 3HG2 ILE 32 3.845 -0.558 -0.558 833 2HG2 ILE 332 2HG2 ILE 32 2.446 -1.140 -1.140 834 3HG2 ILE 332 1HG2 ILE 32 3.611 -0.067 -0.067 835 1HD1 ILE 332 1HD1 ILE 32 1.453 3.185 3.185 836 2HD1 ILE 332 3HD1 ILE 32 2.036 2.217 2.217 837 3HD1 ILE 332 2HD1 ILE 32 0.311 2.542 2.542 838 H ARG 333 H ARG 33 2.279 -1.261 -1.261 839 HA ARG 333 HA ARG 33 4.558 -0.095 -0.095 840 1HB ARG 333 2HB ARG 33 3.376 -2.887 -2.887 841 2HB ARG 333 1HB ARG 33 4.665 -2.330 -2.330 842 1HG ARG 333 2HG ARG 33 3.241 -0.685 -0.685 843 2HG ARG 333 1HG ARG 33 1.992 -0.928 -0.928 844 1HD ARG 333 2HD ARG 33 2.857 -2.861 -2.861 845 2HD ARG 333 1HD ARG 33 1.270 -2.122 -2.122 846 HE ARG 333 HE ARG 33 1.296 -3.471 -3.471 847 1HH1 ARG 333 2HH1 ARG 33 1.184 -4.596 -4.596 848 2HH1 ARG 333 1HH1 ARG 33 1.764 -6.193 -6.193 849 1HH2 ARG 333 1HH2 ARG 33 2.738 -5.446 -5.446 850 2HH2 ARG 333 2HH2 ARG 33 2.643 -6.675 -6.675 851 H GLY 334 H GLY 34 6.283 0.197 0.197 852 1HA GLY 334 2HA GLY 34 8.058 -1.901 -1.901 853 2HA GLY 334 1HA GLY 34 7.058 -1.757 -1.757 854 H ARG 335 H ARG 35 7.931 -0.457 -0.457 855 HA ARG 335 HA ARG 35 8.722 2.219 2.219 856 1HB ARG 335 2HB ARG 35 10.572 1.441 1.441 857 2HB ARG 335 1HB ARG 35 11.022 0.249 0.249 858 1HG ARG 335 2HG ARG 35 11.694 1.948 1.948 859 2HG ARG 335 1HG ARG 35 10.962 3.220 3.220 860 1HD ARG 335 2HD ARG 35 12.969 1.560 1.560 861 2HD ARG 335 1HD ARG 35 13.606 2.568 2.568 862 HE ARG 335 HE ARG 35 11.974 3.709 3.709 863 1HH1 ARG 335 1HH1 ARG 35 14.222 6.165 6.165 864 2HH1 ARG 335 2HH1 ARG 35 12.814 5.364 5.364 865 1HH2 ARG 335 1HH2 ARG 35 14.583 4.028 4.028 866 2HH2 ARG 335 2HH2 ARG 35 15.223 5.408 5.408 867 H GLU 336 H GLU 36 10.327 -0.476 -0.476 868 HA GLU 336 HA GLU 36 10.493 0.903 0.903 869 1HB GLU 336 2HB GLU 36 10.706 -1.929 -1.929 870 2HB GLU 336 1HB GLU 36 10.380 -1.666 -1.666 871 1HG GLU 336 2HG GLU 36 12.663 -1.496 -1.496 872 2HG GLU 336 1HG GLU 36 12.324 0.172 0.172 873 H ARG 337 H ARG 37 8.078 -1.502 -1.502 874 HA ARG 337 HA ARG 37 6.419 -1.403 -1.403 875 1HB ARG 337 2HB ARG 37 6.018 -2.108 -2.108 876 2HB ARG 337 1HB ARG 37 4.575 -1.833 -1.833 877 1HG ARG 337 2HG ARG 37 5.588 -3.425 -3.425 878 2HG ARG 337 1HG ARG 37 6.779 -3.847 -3.847 879 1HD ARG 337 2HD ARG 37 3.849 -3.929 -3.929 880 2HD ARG 337 1HD ARG 37 4.590 -5.274 -5.274 881 HE ARG 337 HE ARG 37 5.767 -5.844 -5.844 882 1HH1 ARG 337 1HH2 ARG 37 7.217 -3.887 -3.887 883 2HH1 ARG 337 2HH2 ARG 37 6.261 -3.181 -3.181 884 1HH2 ARG 337 2HH1 ARG 37 3.263 -4.438 -4.438 885 2HH2 ARG 337 1HH1 ARG 37 4.023 -3.495 -3.495 886 H PHE 338 H PHE 38 6.472 0.661 0.661 887 HA PHE 338 HA PHE 38 4.177 2.223 2.223 888 1HB PHE 338 2HB PHE 38 5.320 2.434 2.434 889 2HB PHE 338 1HB PHE 38 6.783 3.011 3.011 890 HD1 PHE 338 HD2 PHE 38 3.273 3.842 3.842 891 HD2 PHE 338 HD1 PHE 38 6.977 5.278 5.278 892 HE1 PHE 338 HE2 PHE 38 2.414 6.167 6.167 893 HE2 PHE 338 HE1 PHE 38 6.118 7.602 7.602 894 HZ PHE 338 HZ PHE 38 3.836 8.047 8.047 895 H GLU 339 H GLU 39 7.550 2.567 2.567 896 HA GLU 339 HA GLU 39 7.211 5.008 5.008 897 1HB GLU 339 2HB GLU 39 9.051 2.659 2.659 898 2HB GLU 339 1HB GLU 39 9.193 4.249 4.249 899 1HG GLU 339 2HG GLU 39 9.135 5.036 5.036 900 2HG GLU 339 1HG GLU 39 9.795 3.418 3.418 901 H MET 340 H MET 40 6.712 1.617 1.617 902 HA MET 340 HA MET 40 6.154 1.942 1.942 903 1HB MET 340 2HB MET 40 5.472 -0.013 -0.013 904 2HB MET 340 1HB MET 40 4.309 0.056 0.056 905 1HG MET 340 2HG MET 40 6.014 -0.390 -0.390 906 2HG MET 340 1HG MET 40 7.294 -0.178 -0.178 907 1HE MET 340 2HE MET 40 3.890 -1.780 -1.780 908 2HE MET 340 1HE MET 40 4.062 -3.389 -3.389 909 3HE MET 340 3HE MET 40 4.155 -1.959 -1.959 910 H PHE 341 H PHE 41 3.898 2.116 2.116 911 HA PHE 341 HA PHE 41 1.627 2.896 2.896 912 1HB PHE 341 2HB PHE 41 2.325 3.042 3.042 913 2HB PHE 341 1HB PHE 41 0.858 3.814 3.814 914 HD1 PHE 341 HD2 PHE 41 2.378 0.731 0.731 915 HD2 PHE 341 HD1 PHE 41 -0.771 2.373 2.373 916 HE1 PHE 341 HE2 PHE 41 1.226 -1.463 -1.463 917 HE2 PHE 341 HE1 PHE 41 -1.924 0.178 0.178 918 HZ PHE 341 HZ PHE 41 -0.925 -1.740 -1.740 919 H ARG 342 H ARG 42 4.339 4.627 4.627 920 HA ARG 342 HA ARG 42 3.228 7.263 7.263 921 1HB ARG 342 2HB ARG 42 5.783 6.068 6.068 922 2HB ARG 342 1HB ARG 42 5.997 7.367 7.367 923 1HG ARG 342 2HG ARG 42 4.182 8.111 8.111 924 2HG ARG 342 1HG ARG 42 5.797 7.696 7.696 925 1HD ARG 342 2HD ARG 42 6.735 9.237 9.237 926 2HD ARG 342 1HD ARG 42 5.084 9.753 9.753 927 HE ARG 342 HE ARG 42 5.155 10.254 10.254 928 1HH1 ARG 342 1HH2 ARG 42 6.793 11.462 11.462 929 2HH1 ARG 342 2HH2 ARG 42 7.877 12.468 12.468 930 1HH2 ARG 342 2HH1 ARG 42 6.888 11.224 11.224 931 2HH2 ARG 342 1HH1 ARG 42 7.932 12.333 12.333 932 H GLU 343 H GLU 43 4.773 5.282 5.282 933 HA GLU 343 HA GLU 43 4.836 7.388 7.388 934 1HB GLU 343 2HB GLU 43 6.265 5.383 5.383 935 2HB GLU 343 1HB GLU 43 4.828 4.373 4.373 936 1HG GLU 343 2HG GLU 43 5.789 4.872 4.872 937 2HG GLU 343 1HG GLU 43 4.197 5.615 5.615 938 H LEU 344 H LEU 44 2.632 4.623 4.623 939 HA LEU 344 HA LEU 44 0.779 5.276 5.276 940 1HB LEU 344 2HB LEU 44 0.566 3.760 3.760 941 2HB LEU 344 1HB LEU 44 -0.889 4.103 4.103 942 HG LEU 344 HG LEU 44 -0.294 2.016 2.016 943 1HD1 LEU 344 1HD1 LEU 44 -0.222 3.958 3.958 944 2HD1 LEU 344 3HD1 LEU 44 1.493 3.552 3.552 945 3HD1 LEU 344 2HD1 LEU 44 0.278 2.330 2.330 946 1HD2 LEU 344 3HD2 LEU 44 2.571 2.925 2.925 947 2HD2 LEU 344 2HD2 LEU 44 1.742 1.645 1.645 948 3HD2 LEU 344 1HD2 LEU 44 2.122 1.430 1.430 949 H ASN 345 H ASN 45 1.419 6.683 6.683 950 HA ASN 345 HA ASN 45 -1.144 8.136 8.136 951 1HB ASN 345 2HB ASN 45 0.862 7.417 7.417 952 2HB ASN 345 1HB ASN 45 0.839 9.179 9.179 953 1HD2 ASN 345 2HD2 ASN 45 -1.756 8.505 8.505 954 2HD2 ASN 345 1HD2 ASN 45 -0.066 8.623 8.623 955 H GLU 346 H GLU 46 2.128 8.595 8.595 956 HA GLU 346 HA GLU 46 2.050 11.487 11.487 957 1HB GLU 346 2HB GLU 46 4.144 10.043 10.043 958 2HB GLU 346 1HB GLU 46 3.747 9.651 9.651 959 1HG GLU 346 2HG GLU 46 5.342 11.564 11.564 960 2HG GLU 346 1HG GLU 46 3.835 12.010 12.010 961 H ALA 347 H ALA 47 1.371 8.883 8.883 962 HA ALA 347 HA ALA 47 0.783 10.735 10.735 963 1HB ALA 347 1HB ALA 47 1.458 8.192 8.192 964 2HB ALA 347 3HB ALA 47 -0.277 7.928 7.928 965 3HB ALA 347 2HB ALA 47 0.346 8.843 8.843 966 H LEU 348 H LEU 48 -1.214 8.746 8.746 967 HA LEU 348 HA LEU 48 -3.747 9.508 9.508 968 1HB LEU 348 2HB LEU 48 -2.913 8.927 8.927 969 2HB LEU 348 1HB LEU 48 -4.584 9.012 9.012 970 HG LEU 348 HG LEU 48 -2.537 7.155 7.155 971 1HD1 LEU 348 1HD1 LEU 48 -3.215 6.874 6.874 972 2HD1 LEU 348 3HD1 LEU 48 -4.679 6.186 6.186 973 3HD1 LEU 348 2HD1 LEU 48 -3.106 5.474 5.474 974 1HD2 LEU 348 3HD2 LEU 48 -5.571 7.248 7.248 975 2HD2 LEU 348 2HD2 LEU 48 -4.505 7.689 7.689 976 3HD2 LEU 348 1HD2 LEU 48 -4.580 6.017 6.017 977 H GLU 349 H GLU 49 -1.852 11.022 11.022 978 HA GLU 349 HA GLU 49 -3.638 13.219 13.219 979 1HB GLU 349 2HB GLU 49 -1.874 12.659 12.659 980 2HB GLU 349 1HB GLU 49 -0.637 13.069 13.069 981 1HG GLU 349 2HG GLU 49 -1.109 15.356 15.356 982 2HG GLU 349 1HG GLU 49 -2.740 15.091 15.091 983 H LEU 350 H LEU 50 -1.134 12.578 12.578 984 HA LEU 350 HA LEU 50 -0.872 15.290 15.290 985 1HB LEU 350 2HB LEU 50 0.790 14.361 14.361 986 2HB LEU 350 1HB LEU 50 0.374 12.815 12.815 987 HG LEU 350 HG LEU 50 -1.441 12.739 12.739 988 1HD1 LEU 350 2HD1 LEU 50 0.412 14.948 14.948 989 2HD1 LEU 350 1HD1 LEU 50 -0.083 13.827 13.827 990 3HD1 LEU 350 3HD1 LEU 50 -1.300 14.739 14.739 991 1HD2 LEU 350 1HD2 LEU 50 1.430 12.042 12.042 992 2HD2 LEU 350 3HD2 LEU 50 0.038 11.029 11.029 993 3HD2 LEU 350 2HD2 LEU 50 0.733 12.075 12.075 994 H LYS 351 H LYS 51 -3.097 12.663 12.663 995 HA LYS 351 HA LYS 51 -4.284 13.621 13.621 996 1HB LYS 351 2HB LYS 51 -4.633 11.396 11.396 997 2HB LYS 351 1HB LYS 51 -6.029 12.324 12.324 998 1HG LYS 351 2HG LYS 51 -6.772 12.620 12.620 999 2HG LYS 351 1HG LYS 51 -5.350 11.755 11.755 1000 1HD LYS 351 2HD LYS 51 -6.141 9.814 9.814 1001 2HD LYS 351 1HD LYS 51 -7.682 10.667 10.667 1002 1HE LYS 351 2HE LYS 51 -6.842 10.619 10.619 1003 2HE LYS 351 1HE LYS 51 -6.691 8.983 8.983 1004 1HZ LYS 351 2HZ LYS 51 -9.038 9.717 9.717 1005 2HZ LYS 351 1HZ LYS 51 -9.064 10.588 10.588 1006 3HZ LYS 351 3HZ LYS 51 -8.873 8.903 8.903 1007 H ASP 352 H ASP 52 -4.963 14.268 14.268 1008 HA ASP 352 HA ASP 52 -7.236 15.961 15.961 1009 1HB ASP 352 2HB ASP 52 -6.231 14.903 14.903 1010 2HB ASP 352 1HB ASP 52 -5.361 16.437 16.437 1011 H ALA 353 H ALA 53 -3.764 16.498 16.498 1012 HA ALA 353 HA ALA 53 -4.133 19.420 19.420 1013 1HB ALA 353 3HB ALA 53 -2.132 17.892 17.892 1014 2HB ALA 353 2HB ALA 53 -1.436 18.327 18.327 1015 3HB ALA 353 1HB ALA 53 -1.976 19.590 19.590 1016 H GLN 354 H GLN 54 -5.018 17.368 17.368 1017 HA GLN 354 HA GLN 54 -3.364 18.363 18.363 1018 1HB GLN 354 2HB GLN 54 -4.055 15.704 15.704 1019 2HB GLN 354 1HB GLN 54 -4.943 16.083 16.083 1020 1HG GLN 354 2HG GLN 54 -2.399 17.155 17.155 1021 2HG GLN 354 1HG GLN 54 -2.089 15.614 15.614 1022 1HE2 GLN 354 2HE2 GLN 54 -2.350 14.682 14.682 1023 2HE2 GLN 354 1HE2 GLN 54 -1.244 15.441 15.441 1024 H ALA 355 HN ALA 55 -4.532 20.068 20.068 1025 HA ALA 355 HA ALA 55 -7.056 19.569 19.569 1026 1HB ALA 355 2HB ALA 55 -7.054 20.836 20.836 1027 2HB ALA 355 1HB ALA 55 -8.165 21.472 21.472 1028 3HB ALA 355 3HB ALA 55 -8.253 19.775 19.775 Start of MODEL 9 1 1H GLY 325 2H GLY 25 13.335 1.937 1.937 2 2H GLY 325 1H GLY 25 13.267 3.151 3.151 3 3H GLY 325 3H GLY 25 14.015 1.668 1.668 4 1HA GLY 325 2HA GLY 25 12.070 1.124 1.124 5 2HA GLY 325 1HA GLY 25 11.215 2.383 2.383 6 H GLU 326 H GLU 26 11.315 -0.858 -0.858 7 HA GLU 326 HA GLU 26 10.886 -1.455 -1.455 8 1HB GLU 326 2HB GLU 26 11.539 -3.091 -3.091 9 2HB GLU 326 1HB GLU 26 10.660 -3.864 -3.864 10 1HG GLU 326 2HG GLU 26 12.580 -2.573 -2.573 11 2HG GLU 326 1HG GLU 26 13.457 -2.883 -2.883 12 H TYR 327 H TYR 27 9.094 -3.512 -3.512 13 HA TYR 327 HA TYR 27 6.679 -2.197 -2.197 14 1HB TYR 327 2HB TYR 27 7.187 -3.517 -3.517 15 2HB TYR 327 1HB TYR 27 5.620 -3.828 -3.828 16 HD1 TYR 327 HD2 TYR 27 4.228 -1.825 -1.825 17 HD2 TYR 327 HD1 TYR 27 7.624 -1.457 -1.457 18 HE1 TYR 327 HE2 TYR 27 3.436 0.413 0.413 19 HE2 TYR 327 HE1 TYR 27 6.832 0.781 0.781 20 HH TYR 327 HH TYR 27 4.428 1.940 1.940 21 H PHE 328 H PHE 28 6.216 -3.297 -3.297 22 HA PHE 328 HA PHE 28 6.623 -6.243 -6.243 23 1HB PHE 328 2HB PHE 28 6.205 -4.140 -4.140 24 2HB PHE 328 1HB PHE 28 5.951 -5.847 -5.847 25 HD1 PHE 328 HD2 PHE 28 8.435 -3.294 -3.294 26 HD2 PHE 328 HD1 PHE 28 7.806 -7.427 -7.427 27 HE1 PHE 328 HE2 PHE 28 10.882 -3.606 -3.606 28 HE2 PHE 328 HE1 PHE 28 10.253 -7.739 -7.739 29 HZ PHE 328 HZ PHE 28 11.791 -5.829 -5.829 30 H THR 329 H THR 29 4.749 -7.389 -7.389 31 HA THR 329 HA THR 29 2.104 -6.241 -6.241 32 HB THR 329 HB THR 29 2.365 -9.163 -9.163 33 HG1 THR 329 HG1 THR 29 4.128 -8.985 -8.985 34 1HG2 THR 329 2HG2 THR 29 0.504 -7.343 -7.343 35 2HG2 THR 329 1HG2 THR 29 1.411 -7.410 -7.410 36 3HG2 THR 329 3HG2 THR 29 0.694 -8.878 -8.878 37 H LEU 330 H LEU 30 0.583 -6.471 -6.471 38 HA LEU 330 HA LEU 30 1.251 -8.282 -8.282 39 1HB LEU 330 2HB LEU 30 0.800 -5.538 -5.538 40 2HB LEU 330 1HB LEU 30 -0.731 -6.241 -6.241 41 HG LEU 330 HG LEU 30 1.165 -7.770 -7.770 42 1HD1 LEU 330 1HD1 LEU 30 2.559 -5.555 -5.555 43 2HD1 LEU 330 3HD1 LEU 30 1.985 -5.048 -5.048 44 3HD1 LEU 330 2HD1 LEU 30 2.956 -6.511 -6.511 45 1HD2 LEU 330 1HD2 LEU 30 -0.541 -5.404 -5.404 46 2HD2 LEU 330 3HD2 LEU 30 -0.828 -7.115 -7.115 47 3HD2 LEU 330 2HD2 LEU 30 0.441 -6.256 -6.256 48 H GLN 331 H GLN 31 0.136 -10.106 -10.106 49 HA GLN 331 HA GLN 31 -2.623 -9.804 -9.804 50 1HB GLN 331 2HB GLN 31 -1.009 -12.321 -12.321 51 2HB GLN 331 1HB GLN 31 -2.538 -12.221 -12.221 52 1HG GLN 331 2HG GLN 31 -1.508 -10.799 -10.799 53 2HG GLN 331 1HG GLN 31 0.018 -10.816 -10.816 54 1HE2 GLN 331 2HE2 GLN 31 0.340 -13.472 -13.472 55 2HE2 GLN 331 1HE2 GLN 31 0.262 -11.777 -11.777 56 H ILE 332 H ILE 32 -4.160 -9.512 -9.512 57 HA ILE 332 HA ILE 32 -3.805 -10.881 -10.881 58 HB ILE 332 HB ILE 32 -5.482 -8.488 -8.488 59 1HG1 ILE 332 2HG1 ILE 32 -3.674 -8.107 -8.107 60 2HG1 ILE 332 1HG1 ILE 32 -2.785 -8.770 -8.770 61 1HG2 ILE 332 1HG2 ILE 32 -5.884 -10.373 -10.373 62 2HG2 ILE 332 3HG2 ILE 32 -5.316 -8.868 -8.868 63 3HG2 ILE 332 2HG2 ILE 32 -6.757 -8.869 -8.869 64 1HD1 ILE 332 3HD1 ILE 32 -3.928 -6.991 -6.991 65 2HD1 ILE 332 2HD1 ILE 32 -4.461 -6.250 -6.250 66 3HD1 ILE 332 1HD1 ILE 32 -2.739 -6.392 -6.392 67 H ARG 333 H ARG 33 -4.927 -12.767 -12.767 68 HA ARG 333 HA ARG 33 -7.242 -13.276 -13.276 69 1HB ARG 333 2HB ARG 33 -5.582 -15.044 -15.044 70 2HB ARG 333 1HB ARG 33 -6.284 -14.913 -14.913 71 1HG ARG 333 2HG ARG 33 -8.559 -15.253 -15.253 72 2HG ARG 333 1HG ARG 33 -7.507 -15.989 -15.989 73 1HD ARG 333 2HD ARG 33 -7.762 -17.872 -17.872 74 2HD ARG 333 1HD ARG 33 -6.550 -17.128 -17.128 75 HE ARG 333 HE ARG 33 -9.105 -16.153 -16.153 76 1HH1 ARG 333 1HH2 ARG 33 -8.304 -19.347 -19.347 77 2HH1 ARG 333 2HH2 ARG 33 -8.598 -19.925 -19.925 78 1HH2 ARG 333 1HH1 ARG 33 -9.007 -18.457 -18.457 79 2HH2 ARG 333 2HH1 ARG 33 -9.029 -16.757 -16.757 80 H GLY 334 H GLY 34 -8.789 -11.698 -11.698 81 1HA GLY 334 2HA GLY 34 -10.568 -12.416 -12.416 82 2HA GLY 334 1HA GLY 34 -9.498 -11.158 -11.158 83 H ARG 335 H ARG 35 -10.647 -9.298 -9.298 84 HA ARG 335 HA ARG 35 -11.357 -8.061 -8.061 85 1HB ARG 335 2HB ARG 35 -13.252 -9.784 -9.784 86 2HB ARG 335 1HB ARG 35 -13.763 -8.715 -8.715 87 1HG ARG 335 2HG ARG 35 -14.250 -6.946 -6.946 88 2HG ARG 335 1HG ARG 35 -13.227 -7.597 -7.597 89 1HD ARG 335 2HD ARG 35 -14.996 -9.635 -9.635 90 2HD ARG 335 1HD ARG 35 -16.026 -8.273 -8.273 91 HE ARG 335 HE ARG 35 -14.742 -8.678 -8.678 92 1HH1 ARG 335 1HH2 ARG 35 -14.943 -5.788 -5.788 93 2HH1 ARG 335 2HH2 ARG 35 -16.393 -5.257 -5.257 94 1HH2 ARG 335 2HH1 ARG 35 -17.371 -8.450 -8.450 95 2HH2 ARG 335 1HH1 ARG 35 -17.766 -6.764 -6.764 96 H GLU 336 H GLU 36 -12.231 -8.186 -8.186 97 HA GLU 336 HA GLU 36 -12.464 -5.282 -5.282 98 1HB GLU 336 2HB GLU 36 -13.098 -7.530 -7.530 99 2HB GLU 336 1HB GLU 36 -12.061 -6.439 -6.439 100 1HG GLU 336 2HG GLU 36 -13.562 -4.640 -4.640 101 2HG GLU 336 1HG GLU 36 -14.390 -5.363 -5.363 102 H ARG 337 H ARG 37 -9.977 -7.700 -7.700 103 HA ARG 337 HA ARG 37 -8.176 -5.882 -5.882 104 1HB ARG 337 2HB ARG 37 -7.856 -8.583 -8.583 105 2HB ARG 337 1HB ARG 37 -6.450 -7.688 -7.688 106 1HG ARG 337 2HG ARG 37 -8.137 -7.470 -7.470 107 2HG ARG 337 1HG ARG 37 -8.564 -9.067 -9.067 108 1HD ARG 337 2HD ARG 37 -5.658 -8.526 -8.526 109 2HD ARG 337 1HD ARG 37 -6.459 -8.590 -8.590 110 HE ARG 337 HE ARG 37 -5.956 -10.852 -10.852 111 1HH1 ARG 337 1HH2 ARG 37 -8.715 -11.325 -11.325 112 2HH1 ARG 337 2HH2 ARG 37 -9.167 -12.007 -12.007 113 1HH2 ARG 337 2HH1 ARG 37 -6.307 -10.911 -10.911 114 2HH2 ARG 337 1HH1 ARG 37 -7.803 -11.770 -11.770 115 H PHE 338 H PHE 38 -8.453 -7.081 -7.081 116 HA PHE 338 HA PHE 38 -6.242 -5.590 -5.590 117 1HB PHE 338 2HB PHE 38 -7.162 -7.328 -7.328 118 2HB PHE 338 1HB PHE 38 -8.775 -6.617 -6.617 119 HD1 PHE 338 HD1 PHE 38 -5.271 -5.799 -5.799 120 HD2 PHE 338 HD2 PHE 38 -9.474 -5.165 -5.165 121 HE1 PHE 338 HE1 PHE 38 -4.763 -4.429 -4.429 122 HE2 PHE 338 HE2 PHE 38 -8.965 -3.795 -3.795 123 HZ PHE 338 HZ PHE 38 -6.610 -3.427 -3.427 124 H GLU 339 H GLU 39 -9.577 -4.732 -4.732 125 HA GLU 339 HA GLU 39 -9.557 -2.228 -2.228 126 1HB GLU 339 2HB GLU 39 -11.262 -3.387 -3.387 127 2HB GLU 339 1HB GLU 39 -11.453 -1.701 -1.701 128 1HG GLU 339 2HG GLU 39 -11.247 -3.384 -3.384 129 2HG GLU 339 1HG GLU 39 -12.517 -3.980 -3.980 130 H MET 340 H MET 40 -8.953 -3.135 -3.135 131 HA MET 340 HA MET 40 -8.504 -0.623 -0.623 132 1HB MET 340 2HB MET 40 -7.253 -3.303 -3.303 133 2HB MET 340 1HB MET 40 -6.668 -1.892 -1.892 134 1HG MET 340 2HG MET 40 -8.654 -1.621 -1.621 135 2HG MET 340 1HG MET 40 -9.618 -2.393 -2.393 136 1HE MET 340 1HE MET 40 -6.349 -3.162 -3.162 137 2HE MET 340 3HE MET 40 -6.486 -4.584 -4.584 138 3HE MET 340 2HE MET 40 -6.442 -4.771 -4.771 139 H PHE 341 H PHE 41 -6.217 -2.651 -2.651 140 HA PHE 341 HA PHE 41 -4.031 -0.827 -0.827 141 1HB PHE 341 2HB PHE 41 -4.726 -3.216 -3.216 142 2HB PHE 341 1HB PHE 41 -3.311 -2.252 -2.252 143 HD1 PHE 341 HD1 PHE 41 -4.711 -2.829 -2.829 144 HD2 PHE 341 HD2 PHE 41 -1.562 -3.806 -3.806 145 HE1 PHE 341 HE1 PHE 41 -3.497 -3.977 -3.977 146 HE2 PHE 341 HE2 PHE 41 -0.338 -4.960 -4.960 147 HZ PHE 341 HZ PHE 41 -1.320 -5.046 -5.046 148 H ARG 342 H ARG 42 -6.586 -1.376 -1.376 149 HA ARG 342 HA ARG 42 -5.726 0.280 0.280 150 1HB ARG 342 2HB ARG 42 -8.065 -1.052 -1.052 151 2HB ARG 342 1HB ARG 42 -8.573 0.631 0.631 152 1HG ARG 342 2HG ARG 42 -7.626 1.111 1.111 153 2HG ARG 342 1HG ARG 42 -7.126 -0.573 -0.573 154 1HD ARG 342 2HD ARG 42 -9.148 -0.841 -0.841 155 2HD ARG 342 1HD ARG 42 -9.768 -0.867 -0.867 156 HE ARG 342 HE ARG 42 -10.460 1.446 1.446 157 1HH1 ARG 342 1HH2 ARG 42 -8.541 2.650 2.650 158 2HH1 ARG 342 2HH2 ARG 42 -9.342 2.666 2.666 159 1HH2 ARG 342 2HH1 ARG 42 -11.714 0.308 0.308 160 2HH2 ARG 342 1HH1 ARG 42 -11.136 1.337 1.337 161 H GLU 343 H GLU 43 -7.032 1.093 1.093 162 HA GLU 343 HA GLU 43 -7.346 3.926 3.926 163 1HB GLU 343 2HB GLU 43 -8.453 2.518 2.518 164 2HB GLU 343 1HB GLU 43 -6.940 2.777 2.777 165 1HG GLU 343 2HG GLU 43 -7.424 4.952 4.952 166 2HG GLU 343 1HG GLU 43 -8.003 5.224 5.224 167 H LEU 344 H LEU 44 -4.992 2.198 2.198 168 HA LEU 344 HA LEU 44 -3.273 4.439 4.439 169 1HB LEU 344 2HB LEU 44 -2.769 1.457 1.457 170 2HB LEU 344 1HB LEU 44 -1.450 2.598 2.598 171 HG LEU 344 HG LEU 44 -2.098 2.159 2.159 172 1HD1 LEU 344 3HD1 LEU 44 -2.407 4.665 4.665 173 2HD1 LEU 344 2HD1 LEU 44 -4.081 4.360 4.360 174 3HD1 LEU 344 1HD1 LEU 44 -2.791 4.200 4.200 175 1HD2 LEU 344 3HD2 LEU 44 -4.502 1.307 1.307 176 2HD2 LEU 344 2HD2 LEU 44 -4.036 1.107 1.107 177 3HD2 LEU 344 1HD2 LEU 44 -4.962 2.527 2.527 178 H ASN 345 H ASN 45 -2.697 1.668 1.668 179 HA ASN 345 HA ASN 45 -0.610 2.639 2.639 180 1HB ASN 345 2HB ASN 45 -1.460 0.414 0.414 181 2HB ASN 345 1HB ASN 45 -3.035 1.038 1.038 182 1HD2 ASN 345 2HD2 ASN 45 -1.529 0.384 0.384 183 2HD2 ASN 345 1HD2 ASN 45 -2.384 -0.398 -0.398 184 H GLU 346 H GLU 46 -4.001 3.616 3.616 185 HA GLU 346 HA GLU 46 -3.809 5.085 5.085 186 1HB GLU 346 2HB GLU 46 -5.764 4.751 4.751 187 2HB GLU 346 1HB GLU 46 -5.796 6.348 6.348 188 1HG GLU 346 2HG GLU 46 -5.962 3.707 3.707 189 2HG GLU 346 1HG GLU 46 -7.311 4.802 4.802 190 H ALA 347 H ALA 47 -3.661 6.129 6.129 191 HA ALA 347 HA ALA 47 -3.211 8.887 8.887 192 1HB ALA 347 2HB ALA 47 -2.429 7.128 7.128 193 2HB ALA 347 1HB ALA 47 -2.139 8.867 8.867 194 3HB ALA 347 3HB ALA 47 -3.787 8.247 8.247 195 H LEU 348 H LEU 48 -0.885 6.220 6.220 196 HA LEU 348 HA LEU 48 1.489 7.751 7.751 197 1HB LEU 348 2HB LEU 48 0.969 4.953 4.953 198 2HB LEU 348 1HB LEU 48 2.563 5.653 5.653 199 HG LEU 348 HG LEU 48 0.463 5.436 5.436 200 1HD1 LEU 348 3HD1 LEU 48 1.904 3.314 3.314 201 2HD1 LEU 348 2HD1 LEU 48 2.615 3.576 3.576 202 3HD1 LEU 348 1HD1 LEU 48 0.890 3.237 3.237 203 1HD2 LEU 348 2HD2 LEU 48 3.214 6.444 6.444 204 2HD2 LEU 348 1HD2 LEU 48 1.996 6.791 6.791 205 3HD2 LEU 348 3HD2 LEU 48 2.989 5.340 5.340 206 H GLU 349 H GLU 49 -0.311 6.121 6.121 207 HA GLU 349 HA GLU 49 1.284 7.121 7.121 208 1HB GLU 349 2HB GLU 49 -0.562 5.310 5.310 209 2HB GLU 349 1HB GLU 49 -1.696 6.653 6.653 210 1HG GLU 349 2HG GLU 49 -1.049 7.146 7.146 211 2HG GLU 349 1HG GLU 49 0.643 6.766 6.766 212 H LEU 350 H LEU 50 -1.195 8.593 8.593 213 HA LEU 350 HA LEU 50 -1.728 10.796 10.796 214 1HB LEU 350 2HB LEU 50 -3.353 11.222 11.222 215 2HB LEU 350 1HB LEU 50 -2.806 9.802 9.802 216 HG LEU 350 HG LEU 50 -1.107 11.335 11.335 217 1HD1 LEU 350 3HD1 LEU 50 -2.211 13.116 13.116 218 2HD1 LEU 350 2HD1 LEU 50 -2.658 13.712 13.712 219 3HD1 LEU 350 1HD1 LEU 50 -0.961 13.448 13.448 220 1HD2 LEU 350 2HD2 LEU 50 -3.706 10.689 10.689 221 2HD2 LEU 350 1HD2 LEU 50 -2.586 11.510 11.510 222 3HD2 LEU 350 3HD2 LEU 50 -3.723 12.448 12.448 223 H LYS 351 H LYS 51 0.606 10.109 10.109 224 HA LYS 351 HA LYS 51 1.631 12.750 12.750 225 1HB LYS 351 2HB LYS 51 2.144 10.671 10.671 226 2HB LYS 351 1HB LYS 51 3.300 10.243 10.243 227 1HG LYS 351 2HG LYS 51 4.576 12.231 12.231 228 2HG LYS 351 1HG LYS 51 3.313 12.940 12.940 229 1HD LYS 351 2HD LYS 51 3.735 10.684 10.684 230 2HD LYS 351 1HD LYS 51 5.336 10.861 10.861 231 1HE LYS 351 2HE LYS 51 4.052 13.271 13.271 232 2HE LYS 351 1HE LYS 51 4.745 12.051 12.051 233 1HZ LYS 351 2HZ LYS 51 6.819 12.218 12.218 234 2HZ LYS 351 1HZ LYS 51 6.139 13.496 13.496 235 3HZ LYS 351 3HZ LYS 51 6.406 13.673 13.673 236 H ASP 352 H ASP 52 2.386 10.173 10.173 237 HA ASP 352 HA ASP 52 4.547 11.621 11.621 238 1HB ASP 352 2HB ASP 52 3.835 9.036 9.036 239 2HB ASP 352 1HB ASP 52 2.991 9.571 9.571 240 H ALA 353 H ALA 53 1.072 11.574 11.574 241 HA ALA 353 HA ALA 53 1.115 12.971 12.971 242 1HB ALA 353 1HB ALA 53 -0.685 11.278 11.278 243 2HB ALA 353 3HB ALA 53 -1.375 12.801 12.801 244 3HB ALA 353 2HB ALA 53 -1.138 12.523 12.523 245 H GLN 354 H GLN 54 1.276 13.786 13.786 246 HA GLN 354 HA GLN 54 -0.153 16.128 16.128 247 1HB GLN 354 2HB GLN 54 2.550 15.232 15.232 248 2HB GLN 354 1HB GLN 54 2.091 16.912 16.912 249 1HG GLN 354 2HG GLN 54 -0.189 15.666 15.666 250 2HG GLN 354 1HG GLN 54 0.993 14.424 14.424 251 1HE2 GLN 354 2HE2 GLN 54 0.571 17.427 17.427 252 2HE2 GLN 354 1HE2 GLN 54 -0.604 16.880 16.880 253 H ALA 355 HN ALA 55 -0.220 18.071 18.071 254 HA ALA 355 HA ALA 55 2.160 18.904 18.904 255 1HB ALA 355 1HB ALA 55 -0.735 18.813 18.813 256 2HB ALA 355 3HB ALA 55 0.457 19.829 19.829 257 3HB ALA 355 2HB ALA 55 0.660 18.076 18.076 258 1H GLY 325 2H GLY 25 -14.067 -15.480 -15.480 259 2H GLY 325 1H GLY 25 -14.201 -15.115 -15.115 260 3H GLY 325 3H GLY 25 -14.879 -14.074 -14.074 261 1HA GLY 325 2HA GLY 25 -13.007 -12.897 -12.897 262 2HA GLY 325 1HA GLY 25 -12.147 -14.288 -14.288 263 H GLU 326 H GLU 26 -12.107 -12.245 -12.245 264 HA GLU 326 HA GLU 26 -11.363 -14.319 -14.319 265 1HB GLU 326 2HB GLU 26 -12.154 -11.435 -11.435 266 2HB GLU 326 1HB GLU 26 -11.112 -12.076 -12.076 267 1HG GLU 326 2HG GLU 26 -12.956 -14.060 -14.060 268 2HG GLU 326 1HG GLU 26 -13.954 -12.678 -12.678 269 H TYR 327 H TYR 27 -9.474 -12.985 -12.985 270 HA TYR 327 HA TYR 27 -7.253 -12.611 -12.611 271 1HB TYR 327 2HB TYR 27 -7.447 -14.125 -14.125 272 2HB TYR 327 1HB TYR 27 -5.940 -13.251 -13.251 273 HD1 TYR 327 HD2 TYR 27 -4.741 -13.595 -13.595 274 HD2 TYR 327 HD1 TYR 27 -7.876 -16.163 -16.163 275 HE1 TYR 327 HE2 TYR 27 -4.011 -15.361 -15.361 276 HE2 TYR 327 HE1 TYR 27 -7.148 -17.929 -17.929 277 HH TYR 327 HH TYR 27 -4.818 -18.491 -18.491 278 H PHE 328 H PHE 28 -7.017 -10.407 -10.407 279 HA PHE 328 HA PHE 28 -7.176 -8.796 -8.796 280 1HB PHE 328 2HB PHE 28 -7.113 -8.135 -8.135 281 2HB PHE 328 1HB PHE 28 -6.802 -6.894 -6.894 282 HD1 PHE 328 HD2 PHE 28 -9.311 -9.220 -9.220 283 HD2 PHE 328 HD1 PHE 28 -8.550 -6.130 -6.130 284 HE1 PHE 328 HE2 PHE 28 -11.750 -8.976 -8.976 285 HE2 PHE 328 HE1 PHE 28 -10.988 -5.887 -5.887 286 HZ PHE 328 HZ PHE 28 -12.588 -7.311 -7.311 287 H THR 329 H THR 29 -5.391 -7.053 -7.053 288 HA THR 329 HA THR 29 -2.765 -8.142 -8.142 289 HB THR 329 HB THR 29 -2.661 -6.791 -6.791 290 HG1 THR 329 HG1 THR 29 -4.429 -7.767 -7.767 291 1HG2 THR 329 2HG2 THR 29 -1.018 -8.387 -8.387 292 2HG2 THR 329 1HG2 THR 29 -1.865 -9.628 -9.628 293 3HG2 THR 329 3HG2 THR 29 -1.013 -8.331 -8.331 294 H LEU 330 H LEU 30 -1.299 -6.583 -6.583 295 HA LEU 330 HA LEU 30 -2.175 -3.731 -3.731 296 1HB LEU 330 2HB LEU 30 -1.811 -5.215 -5.215 297 2HB LEU 330 1HB LEU 30 -0.341 -4.252 -4.252 298 HG LEU 330 HG LEU 30 -2.430 -2.509 -2.509 299 1HD1 LEU 330 1HD1 LEU 30 -3.604 -4.586 -4.586 300 2HD1 LEU 330 3HD1 LEU 30 -3.181 -3.529 -3.529 301 3HD1 LEU 330 2HD1 LEU 30 -4.205 -2.928 -2.928 302 1HD2 LEU 330 1HD2 LEU 30 -0.775 -2.928 -2.928 303 2HD2 LEU 330 3HD2 LEU 30 -0.489 -1.770 -1.770 304 3HD2 LEU 330 2HD2 LEU 30 -1.851 -1.545 -1.545 305 H GLN 331 H GLN 31 -0.878 -3.405 -3.405 306 HA GLN 331 HA GLN 31 1.955 -4.114 -4.114 307 1HB GLN 331 2HB GLN 31 0.461 -2.407 -2.407 308 2HB GLN 331 1HB GLN 31 2.061 -3.121 -3.121 309 1HG GLN 331 2HG GLN 31 1.119 -5.371 -5.371 310 2HG GLN 331 1HG GLN 31 -0.482 -4.699 -4.699 311 1HE2 GLN 331 2HE2 GLN 31 -0.433 -5.431 -5.431 312 2HE2 GLN 331 1HE2 GLN 31 -0.443 -6.316 -6.316 313 H ILE 332 H ILE 32 3.293 -2.904 -2.904 314 HA ILE 332 HA ILE 32 2.757 0.024 0.024 315 HB ILE 332 HB ILE 32 4.378 -1.863 -1.863 316 1HG1 ILE 332 2HG1 ILE 32 2.349 -0.313 -0.313 317 2HG1 ILE 332 1HG1 ILE 32 1.631 -1.145 -1.145 318 1HG2 ILE 332 1HG2 ILE 32 4.686 0.943 0.943 319 2HG2 ILE 332 3HG2 ILE 32 3.953 0.713 0.713 320 3HG2 ILE 332 2HG2 ILE 32 5.484 -0.072 -0.072 321 1HD1 ILE 332 3HD1 ILE 32 2.834 -3.248 -3.248 322 2HD1 ILE 332 2HD1 ILE 32 3.146 -2.362 -2.362 323 3HD1 ILE 332 1HD1 ILE 32 1.487 -2.688 -2.688 324 H ARG 333 H ARG 33 3.979 1.210 1.210 325 HA ARG 333 HA ARG 33 6.451 0.134 0.134 326 1HB ARG 333 2HB ARG 33 4.840 1.629 1.629 327 2HB ARG 333 1HB ARG 33 5.367 2.957 2.957 328 1HG ARG 333 2HG ARG 33 7.778 2.160 2.160 329 2HG ARG 333 1HG ARG 33 6.896 1.484 1.484 330 1HD ARG 333 2HD ARG 33 7.133 3.564 3.564 331 2HD ARG 333 1HD ARG 33 5.785 3.980 3.980 332 HE ARG 333 HE ARG 33 8.196 4.246 4.246 333 1HH1 ARG 333 1HH2 ARG 33 7.642 5.396 5.396 334 2HH1 ARG 333 2HH2 ARG 33 7.807 7.073 7.073 335 1HH2 ARG 333 1HH1 ARG 33 7.968 7.709 7.709 336 2HH2 ARG 333 2HH1 ARG 33 7.925 6.519 6.519 337 H GLY 334 H GLY 34 7.833 -0.094 -0.094 338 1HA GLY 334 2HA GLY 34 9.488 2.122 2.122 339 2HA GLY 334 1HA GLY 34 8.308 1.962 1.962 340 H ARG 335 H ARG 35 9.313 0.967 0.967 341 HA ARG 335 HA ARG 35 10.189 -1.762 -1.762 342 1HB ARG 335 2HB ARG 35 12.130 -0.402 -0.402 343 2HB ARG 335 1HB ARG 35 12.452 0.147 0.147 344 1HG ARG 335 2HG ARG 35 12.978 -2.010 -2.010 345 2HG ARG 335 1HG ARG 35 12.126 -2.788 -2.788 346 1HD ARG 335 2HD ARG 35 13.974 -1.369 -1.369 347 2HD ARG 335 1HD ARG 35 14.875 -1.680 -1.680 348 HE ARG 335 HE ARG 35 13.883 -3.749 -3.749 349 1HH1 ARG 335 1HH2 ARG 35 13.811 -4.346 -4.346 350 2HH1 ARG 335 2HH2 ARG 35 15.303 -5.209 -5.209 351 1HH2 ARG 335 2HH1 ARG 35 16.539 -4.222 -4.222 352 2HH2 ARG 335 1HH1 ARG 35 16.845 -5.144 -5.144 353 H GLU 336 H GLU 36 10.753 1.263 1.263 354 HA GLU 336 HA GLU 36 10.807 -0.140 -0.140 355 1HB GLU 336 2HB GLU 36 11.378 2.503 2.503 356 2HB GLU 336 1HB GLU 36 10.198 2.626 2.626 357 1HG GLU 336 2HG GLU 36 11.614 1.576 1.576 358 2HG GLU 336 1HG GLU 36 12.607 0.844 0.844 359 H ARG 337 H ARG 37 8.393 1.500 1.500 360 HA ARG 337 HA ARG 37 6.367 1.582 1.582 361 1HB ARG 337 2HB ARG 37 6.341 1.899 1.899 362 2HB ARG 337 1HB ARG 37 4.834 1.837 1.837 363 1HG ARG 337 2HG ARG 37 6.314 3.609 3.609 364 2HG ARG 337 1HG ARG 37 6.852 3.981 3.981 365 1HD ARG 337 2HD ARG 37 3.940 3.597 3.597 366 2HD ARG 337 1HD ARG 37 4.574 4.989 4.989 367 HE ARG 337 HE ARG 37 4.335 4.788 4.788 368 1HH1 ARG 337 1HH2 ARG 37 7.131 5.046 5.046 369 2HH1 ARG 337 2HH2 ARG 37 7.471 6.719 6.719 370 1HH2 ARG 337 2HH1 ARG 37 4.411 7.349 7.349 371 2HH2 ARG 337 1HH1 ARG 37 5.930 8.024 8.024 372 H PHE 338 H PHE 38 7.024 -0.586 -0.586 373 HA PHE 338 HA PHE 38 4.842 -2.377 -2.377 374 1HB PHE 338 2HB PHE 38 5.987 -2.540 -2.540 375 2HB PHE 338 1HB PHE 38 7.545 -2.773 -2.773 376 HD1 PHE 338 HD1 PHE 38 4.133 -4.311 -4.311 377 HD2 PHE 338 HD2 PHE 38 8.336 -4.941 -4.941 378 HE1 PHE 338 HE1 PHE 38 3.764 -6.764 -6.764 379 HE2 PHE 338 HE2 PHE 38 7.966 -7.392 -7.392 380 HZ PHE 338 HZ PHE 38 5.679 -8.304 -8.304 381 H GLU 339 H GLU 39 8.028 -2.040 -2.040 382 HA GLU 339 HA GLU 39 8.018 -4.604 -4.604 383 1HB GLU 339 2HB GLU 39 9.562 -2.035 -2.035 384 2HB GLU 339 1HB GLU 39 9.724 -3.361 -3.361 385 1HG GLU 339 2HG GLU 39 9.870 -4.356 -4.356 386 2HG GLU 339 1HG GLU 39 11.070 -3.090 -3.090 387 H MET 340 H MET 40 7.188 -1.279 -1.279 388 HA MET 340 HA MET 40 6.477 -1.723 -1.723 389 1HB MET 340 2HB MET 40 5.354 0.071 0.071 390 2HB MET 340 1HB MET 40 4.599 0.018 0.018 391 1HG MET 340 2HG MET 40 6.429 0.961 0.961 392 2HG MET 340 1HG MET 40 7.568 0.332 0.332 393 1HE MET 340 1HE MET 40 4.263 1.820 1.820 394 2HE MET 340 3HE MET 40 4.423 3.486 3.486 395 3HE MET 340 2HE MET 40 4.487 2.150 2.150 396 H PHE 341 H PHE 41 4.461 -2.154 -2.154 397 HA PHE 341 HA PHE 41 2.171 -3.166 -3.166 398 1HB PHE 341 2HB PHE 41 3.122 -3.282 -3.282 399 2HB PHE 341 1HB PHE 41 1.692 -4.182 -4.182 400 HD1 PHE 341 HD1 PHE 41 2.793 -0.932 -0.932 401 HD2 PHE 341 HD2 PHE 41 0.016 -2.928 -2.928 402 HE1 PHE 341 HE1 PHE 41 1.440 1.134 1.134 403 HE2 PHE 341 HE2 PHE 41 -1.344 -0.857 -0.857 404 HZ PHE 341 HZ PHE 41 -0.630 1.175 1.175 405 H ARG 342 H ARG 42 5.029 -4.696 -4.696 406 HA ARG 342 HA ARG 42 4.248 -7.397 -7.397 407 1HB ARG 342 2HB ARG 42 6.583 -6.097 -6.097 408 2HB ARG 342 1HB ARG 42 7.003 -6.842 -6.842 409 1HG ARG 342 2HG ARG 42 6.231 -9.033 -9.033 410 2HG ARG 342 1HG ARG 42 5.843 -8.284 -8.284 411 1HD ARG 342 2HD ARG 42 7.964 -8.888 -8.888 412 2HD ARG 342 1HD ARG 42 8.423 -7.452 -7.452 413 HE ARG 342 HE ARG 42 9.006 -8.888 -8.888 414 1HH1 ARG 342 1HH2 ARG 42 7.214 -11.142 -11.142 415 2HH1 ARG 342 2HH2 ARG 42 8.158 -12.400 -12.400 416 1HH2 ARG 342 2HH1 ARG 42 10.554 -10.235 -10.235 417 2HH2 ARG 342 1HH1 ARG 42 10.047 -11.886 -11.886 418 H GLU 343 H GLU 43 5.127 -5.105 -5.105 419 HA GLU 343 HA GLU 43 5.427 -7.099 -7.099 420 1HB GLU 343 2HB GLU 43 6.380 -4.678 -4.678 421 2HB GLU 343 1HB GLU 43 4.775 -4.195 -4.195 422 1HG GLU 343 2HG GLU 43 5.134 -4.984 -4.984 423 2HG GLU 343 1HG GLU 43 5.859 -6.475 -6.475 424 H LEU 344 H LEU 44 2.962 -4.516 -4.516 425 HA LEU 344 HA LEU 44 1.078 -5.563 -5.563 426 1HB LEU 344 2HB LEU 44 0.749 -3.952 -3.952 427 2HB LEU 344 1HB LEU 44 -0.646 -4.442 -4.442 428 HG LEU 344 HG LEU 44 -0.166 -2.310 -2.310 429 1HD1 LEU 344 3HD1 LEU 44 0.023 -4.355 -4.355 430 2HD1 LEU 344 2HD1 LEU 44 1.665 -3.739 -3.739 431 3HD1 LEU 344 1HD1 LEU 44 0.288 -2.695 -2.695 432 1HD2 LEU 344 3HD2 LEU 44 2.354 -2.754 -2.754 433 2HD2 LEU 344 2HD2 LEU 44 1.814 -1.284 -1.284 434 3HD2 LEU 344 1HD2 LEU 44 2.675 -2.525 -2.525 435 H ASN 345 H ASN 45 0.805 -5.846 -5.846 436 HA ASN 345 HA ASN 45 -1.100 -7.811 -7.811 437 1HB ASN 345 2HB ASN 45 -0.100 -6.827 -6.827 438 2HB ASN 345 1HB ASN 45 1.482 -7.479 -7.479 439 1HD2 ASN 345 2HD2 ASN 45 0.408 -9.869 -9.869 440 2HD2 ASN 345 1HD2 ASN 45 1.162 -8.361 -8.361 441 H GLU 346 H GLU 46 2.186 -8.222 -8.222 442 HA GLU 346 HA GLU 46 2.195 -11.121 -11.121 443 1HB GLU 346 2HB GLU 46 3.960 -9.018 -9.018 444 2HB GLU 346 1HB GLU 46 3.982 -10.500 -10.500 445 1HG GLU 346 2HG GLU 46 4.403 -10.331 -10.331 446 2HG GLU 346 1HG GLU 46 5.667 -10.600 -10.600 447 H ALA 347 H ALA 47 1.659 -8.818 -8.818 448 HA ALA 347 HA ALA 47 1.128 -10.776 -10.776 449 1HB ALA 347 2HB ALA 47 0.187 -7.916 -7.916 450 2HB ALA 347 1HB ALA 47 -0.150 -8.885 -8.885 451 3HB ALA 347 3HB ALA 47 1.516 -8.506 -8.506 452 H LEU 348 H LEU 48 -1.088 -9.049 -9.049 453 HA LEU 348 HA LEU 48 -3.513 -10.146 -10.146 454 1HB LEU 348 2HB LEU 48 -2.743 -9.497 -9.497 455 2HB LEU 348 1HB LEU 48 -4.391 -9.734 -9.734 456 HG LEU 348 HG LEU 48 -2.539 -7.668 -7.668 457 1HD1 LEU 348 3HD1 LEU 48 -3.707 -7.653 -7.653 458 2HD1 LEU 348 2HD1 LEU 48 -4.579 -6.485 -6.485 459 3HD1 LEU 348 1HD1 LEU 48 -2.829 -6.354 -6.354 460 1HD2 LEU 348 2HD2 LEU 48 -5.302 -8.584 -8.584 461 2HD2 LEU 348 1HD2 LEU 48 -4.261 -7.652 -7.652 462 3HD2 LEU 348 3HD2 LEU 48 -5.168 -6.835 -6.835 463 H GLU 349 H GLU 49 -1.383 -11.381 -11.381 464 HA GLU 349 HA GLU 49 -2.829 -13.791 -13.791 465 1HB GLU 349 2HB GLU 49 -0.881 -12.788 -12.788 466 2HB GLU 349 1HB GLU 49 0.179 -13.576 -13.576 467 1HG GLU 349 2HG GLU 49 -0.293 -15.667 -15.667 468 2HG GLU 349 1HG GLU 49 -1.983 -15.274 -15.274 469 H LEU 350 H LEU 50 -0.625 -12.820 -12.820 470 HA LEU 350 HA LEU 50 -0.036 -15.478 -15.478 471 1HB LEU 350 2HB LEU 50 1.383 -14.354 -14.354 472 2HB LEU 350 1HB LEU 50 0.845 -12.877 -12.877 473 HG LEU 350 HG LEU 50 -1.058 -12.817 -12.817 474 1HD1 LEU 350 3HD1 LEU 50 0.104 -15.337 -15.337 475 2HD1 LEU 350 2HD1 LEU 50 0.359 -14.263 -14.263 476 3HD1 LEU 350 1HD1 LEU 50 -1.272 -14.547 -14.547 477 1HD2 LEU 350 2HD2 LEU 50 1.508 -11.819 -11.819 478 2HD2 LEU 350 1HD2 LEU 50 0.234 -11.392 -11.392 479 3HD2 LEU 350 3HD2 LEU 50 1.396 -12.655 -12.655 480 H LYS 351 H LYS 51 -2.578 -13.117 -13.117 481 HA LYS 351 HA LYS 51 -3.770 -14.336 -14.336 482 1HB LYS 351 2HB LYS 51 -4.310 -12.056 -12.056 483 2HB LYS 351 1HB LYS 51 -5.304 -12.954 -12.954 484 1HG LYS 351 2HG LYS 51 -6.726 -13.784 -13.784 485 2HG LYS 351 1HG LYS 51 -5.614 -13.255 -13.255 486 1HD LYS 351 2HD LYS 51 -6.032 -10.886 -10.886 487 2HD LYS 351 1HD LYS 51 -7.565 -11.666 -11.666 488 1HE LYS 351 2HE LYS 51 -6.543 -11.865 -11.865 489 2HE LYS 351 1HE LYS 51 -7.263 -10.343 -10.343 490 1HZ LYS 351 2HZ LYS 51 -9.214 -11.618 -11.618 491 2HZ LYS 351 1HZ LYS 51 -8.525 -13.028 -13.028 492 3HZ LYS 351 3HZ LYS 51 -8.954 -11.745 -11.745 493 H ASP 352 H ASP 52 -4.162 -14.904 -14.904 494 HA ASP 352 HA ASP 52 -6.267 -16.874 -16.874 495 1HB ASP 352 2HB ASP 52 -5.438 -15.473 -15.473 496 2HB ASP 352 1HB ASP 52 -4.477 -16.928 -16.928 497 H ALA 353 H ALA 53 -2.793 -16.910 -16.910 498 HA ALA 353 HA ALA 53 -2.661 -19.851 -19.851 499 1HB ALA 353 1HB ALA 53 -0.882 -17.964 -17.964 500 2HB ALA 353 3HB ALA 53 -0.314 -18.264 -18.264 501 3HB ALA 353 2HB ALA 53 -0.385 -19.588 -19.588 502 H GLN 354 H GLN 54 -3.202 -17.537 -17.537 503 HA GLN 354 HA GLN 54 -1.905 -18.443 -18.443 504 1HB GLN 354 2HB GLN 54 -4.627 -17.314 -17.314 505 2HB GLN 354 1HB GLN 54 -4.295 -17.987 -17.987 506 1HG GLN 354 2HG GLN 54 -2.040 -16.553 -16.553 507 2HG GLN 354 1HG GLN 54 -3.138 -15.584 -15.584 508 1HE2 GLN 354 2HE2 GLN 54 -3.269 -14.998 -14.998 509 2HE2 GLN 354 1HE2 GLN 54 -1.929 -15.552 -15.552 510 H ALA 355 HN ALA 55 -1.856 -20.347 -20.347 511 HA ALA 355 HA ALA 55 -4.110 -22.264 -22.264 512 1HB ALA 355 1HB ALA 55 -1.146 -22.776 -22.776 513 2HB ALA 355 3HB ALA 55 -2.279 -24.079 -24.079 514 3HB ALA 355 2HB ALA 55 -2.433 -23.163 -23.163 515 1H GLY 325 2H GLY 25 11.892 -1.236 -1.236 516 2H GLY 325 1H GLY 25 11.997 -2.461 -2.461 517 3H GLY 325 3H GLY 25 12.687 -0.942 -0.942 518 1HA GLY 325 2HA GLY 25 10.806 -0.506 -0.506 519 2HA GLY 325 1HA GLY 25 9.953 -1.819 -1.819 520 H GLU 326 H GLU 26 9.897 1.430 1.430 521 HA GLU 326 HA GLU 26 9.173 1.988 1.988 522 1HB GLU 326 2HB GLU 26 9.942 3.663 3.663 523 2HB GLU 326 1HB GLU 26 8.904 4.384 4.384 524 1HG GLU 326 2HG GLU 26 10.761 3.201 3.201 525 2HG GLU 326 1HG GLU 26 11.750 3.569 3.569 526 H TYR 327 H TYR 27 7.273 3.961 3.961 527 HA TYR 327 HA TYR 27 5.047 2.492 2.492 528 1HB TYR 327 2HB TYR 27 5.265 3.818 3.818 529 2HB TYR 327 1HB TYR 27 3.746 4.052 4.052 530 HD1 TYR 327 HD2 TYR 27 2.553 1.968 1.968 531 HD2 TYR 327 HD1 TYR 27 5.706 1.790 1.790 532 HE1 TYR 327 HE2 TYR 27 1.834 -0.318 -0.318 533 HE2 TYR 327 HE1 TYR 27 4.989 -0.496 -0.496 534 HH TYR 327 HH TYR 27 2.677 -1.805 -1.805 535 H PHE 328 H PHE 28 4.799 3.578 3.578 536 HA PHE 328 HA PHE 28 4.953 6.540 6.540 537 1HB PHE 328 2HB PHE 28 4.859 4.417 4.417 538 2HB PHE 328 1HB PHE 28 4.544 6.108 6.108 539 HD1 PHE 328 HD2 PHE 28 7.068 3.698 3.698 540 HD2 PHE 328 HD1 PHE 28 6.296 7.791 7.791 541 HE1 PHE 328 HE2 PHE 28 9.507 4.155 4.155 542 HE2 PHE 328 HE1 PHE 28 8.732 8.247 8.247 543 HZ PHE 328 HZ PHE 28 10.338 6.429 6.429 544 H THR 329 H THR 29 3.147 7.607 7.607 545 HA THR 329 HA THR 29 0.530 6.267 6.267 546 HB THR 329 HB THR 29 0.507 9.195 9.195 547 HG1 THR 329 HG1 THR 29 2.224 9.149 9.149 548 1HG2 THR 329 2HG2 THR 29 -1.193 7.169 7.169 549 2HG2 THR 329 1HG2 THR 29 -0.405 7.335 7.335 550 3HG2 THR 329 3HG2 THR 29 -1.232 8.715 8.715 551 H LEU 330 H LEU 30 -0.897 6.462 6.462 552 HA LEU 330 HA LEU 30 -0.097 8.284 8.284 553 1HB LEU 330 2HB LEU 30 -0.398 5.510 5.510 554 2HB LEU 330 1HB LEU 30 -1.902 6.119 6.119 555 HG LEU 330 HG LEU 30 0.089 7.725 7.725 556 1HD1 LEU 330 1HD1 LEU 30 1.432 5.543 5.543 557 2HD1 LEU 330 3HD1 LEU 30 0.999 4.994 4.994 558 3HD1 LEU 330 2HD1 LEU 30 1.936 6.473 6.473 559 1HD2 LEU 330 1HD2 LEU 30 -1.499 5.339 5.339 560 2HD2 LEU 330 3HD2 LEU 30 -1.809 7.049 7.049 561 3HD2 LEU 330 2HD2 LEU 30 -0.445 6.249 6.249 562 H GLN 331 H GLN 31 -1.404 10.024 10.024 563 HA GLN 331 HA GLN 31 -4.240 9.563 9.563 564 1HB GLN 331 2HB GLN 31 -2.745 12.177 12.177 565 2HB GLN 331 1HB GLN 31 -4.338 11.975 11.975 566 1HG GLN 331 2HG GLN 31 -3.378 10.624 10.624 567 2HG GLN 331 1HG GLN 31 -1.783 10.729 10.729 568 1HE2 GLN 331 2HE2 GLN 31 -1.828 13.388 13.388 569 2HE2 GLN 331 1HE2 GLN 31 -1.809 11.691 11.691 570 H ILE 332 H ILE 32 -5.587 9.175 9.175 571 HA ILE 332 HA ILE 32 -5.058 10.569 10.569 572 HB ILE 332 HB ILE 32 -6.665 8.082 8.082 573 1HG1 ILE 332 2HG1 ILE 32 -4.649 7.813 7.813 574 2HG1 ILE 332 1HG1 ILE 32 -3.925 8.522 8.522 575 1HG2 ILE 332 1HG2 ILE 32 -6.992 9.947 9.947 576 2HG2 ILE 332 3HG2 ILE 32 -6.269 8.486 8.486 577 3HG2 ILE 332 2HG2 ILE 32 -7.791 8.390 8.390 578 1HD1 ILE 332 3HD1 ILE 32 -5.096 6.685 6.685 579 2HD1 ILE 332 2HD1 ILE 32 -5.445 5.917 5.917 580 3HD1 ILE 332 1HD1 ILE 32 -3.773 6.154 6.154 581 H ARG 333 H ARG 33 -6.288 12.378 12.378 582 HA ARG 333 HA ARG 33 -8.753 12.748 12.748 583 1HB ARG 333 2HB ARG 33 -7.149 14.611 14.611 584 2HB ARG 333 1HB ARG 33 -7.705 14.452 14.452 585 1HG ARG 333 2HG ARG 33 -10.096 14.647 14.647 586 2HG ARG 333 1HG ARG 33 -9.197 15.433 15.433 587 1HD ARG 333 2HD ARG 33 -9.465 17.308 17.308 588 2HD ARG 333 1HD ARG 33 -8.118 16.654 16.654 589 HE ARG 333 HE ARG 33 -10.531 15.530 15.530 590 1HH1 ARG 333 1HH2 ARG 33 -9.983 18.762 18.762 591 2HH1 ARG 333 2HH2 ARG 33 -10.156 19.326 19.326 592 1HH2 ARG 333 2HH1 ARG 33 -10.281 16.142 16.142 593 2HH2 ARG 333 1HH1 ARG 33 -10.322 17.842 17.842 594 H GLY 334 H GLY 34 -10.142 11.078 11.078 595 1HA GLY 334 2HA GLY 34 -11.833 11.731 11.731 596 2HA GLY 334 1HA GLY 34 -10.649 10.566 10.566 597 H ARG 335 H ARG 35 -11.666 8.623 8.623 598 HA ARG 335 HA ARG 35 -12.487 7.306 7.306 599 1HB ARG 335 2HB ARG 35 -14.445 8.909 8.909 600 2HB ARG 335 1HB ARG 35 -14.770 7.814 7.814 601 1HG ARG 335 2HG ARG 35 -15.277 6.016 6.016 602 2HG ARG 335 1HG ARG 35 -14.414 6.727 6.727 603 1HD ARG 335 2HD ARG 35 -16.267 8.657 8.657 604 2HD ARG 335 1HD ARG 35 -17.173 7.240 7.240 605 HE ARG 335 HE ARG 35 -16.168 7.717 7.717 606 1HH1 ARG 335 1HH2 ARG 35 -16.081 4.820 4.820 607 2HH1 ARG 335 2HH2 ARG 35 -17.560 4.197 4.197 608 1HH2 ARG 335 2HH1 ARG 35 -18.816 7.319 7.319 609 2HH2 ARG 335 1HH1 ARG 35 -19.111 5.612 5.612 610 H GLU 336 H GLU 36 -13.075 7.390 7.390 611 HA GLU 336 HA GLU 36 -13.109 4.482 4.482 612 1HB GLU 336 2HB GLU 36 -13.703 6.701 6.701 613 2HB GLU 336 1HB GLU 36 -12.521 5.675 5.675 614 1HG GLU 336 2HG GLU 36 -13.926 3.795 3.795 615 2HG GLU 336 1HG GLU 36 -14.916 4.453 4.453 616 H ARG 337 H ARG 37 -10.716 7.039 7.039 617 HA ARG 337 HA ARG 37 -8.691 5.342 5.342 618 1HB ARG 337 2HB ARG 37 -8.659 8.041 8.041 619 2HB ARG 337 1HB ARG 37 -7.156 7.235 7.235 620 1HG ARG 337 2HG ARG 37 -8.648 6.944 6.944 621 2HG ARG 337 1HG ARG 37 -9.187 8.521 8.521 622 1HD ARG 337 2HD ARG 37 -6.273 8.102 8.102 623 2HD ARG 337 1HD ARG 37 -6.912 8.110 8.110 624 HE ARG 337 HE ARG 37 -6.673 10.416 10.416 625 1HH1 ARG 337 1HH2 ARG 37 -9.472 10.722 10.722 626 2HH1 ARG 337 2HH2 ARG 37 -9.826 11.380 11.380 627 1HH2 ARG 337 2HH1 ARG 37 -6.773 10.469 10.469 628 2HH2 ARG 337 1HH1 ARG 37 -8.298 11.237 11.237 629 H PHE 338 H PHE 38 -9.341 6.502 6.502 630 HA PHE 338 HA PHE 38 -7.146 5.142 5.142 631 1HB PHE 338 2HB PHE 38 -8.289 6.815 6.815 632 2HB PHE 338 1HB PHE 38 -9.844 6.009 6.009 633 HD1 PHE 338 HD1 PHE 38 -6.411 5.397 5.397 634 HD2 PHE 338 HD2 PHE 38 -10.606 4.512 4.512 635 HE1 PHE 338 HE1 PHE 38 -6.008 4.051 4.051 636 HE2 PHE 338 HE2 PHE 38 -10.203 3.168 3.168 637 HZ PHE 338 HZ PHE 38 -7.902 2.936 2.936 638 H GLU 339 H GLU 39 -10.336 4.086 4.086 639 HA GLU 339 HA GLU 39 -10.296 1.571 1.571 640 1HB GLU 339 2HB GLU 39 -11.858 2.633 2.633 641 2HB GLU 339 1HB GLU 39 -12.008 0.948 0.948 642 1HG GLU 339 2HG GLU 39 -12.150 2.704 2.704 643 2HG GLU 339 1HG GLU 39 -13.360 3.156 3.156 644 H MET 340 H MET 40 -9.493 2.526 2.526 645 HA MET 340 HA MET 40 -8.777 0.043 0.043 646 1HB MET 340 2HB MET 40 -7.665 2.818 2.818 647 2HB MET 340 1HB MET 40 -6.907 1.451 1.451 648 1HG MET 340 2HG MET 40 -8.737 1.067 1.067 649 2HG MET 340 1HG MET 40 -9.878 1.723 1.723 650 1HE MET 340 1HE MET 40 -6.582 2.744 2.744 651 2HE MET 340 3HE MET 40 -6.753 4.115 4.115 652 3HE MET 340 2HE MET 40 -6.800 4.370 4.370 653 H PHE 341 H PHE 41 -6.755 2.261 2.261 654 HA PHE 341 HA PHE 41 -4.460 0.539 0.539 655 1HB PHE 341 2HB PHE 41 -5.401 2.878 2.878 656 2HB PHE 341 1HB PHE 41 -3.963 1.971 1.971 657 HD1 PHE 341 HD1 PHE 41 -5.096 2.517 2.517 658 HD2 PHE 341 HD2 PHE 41 -2.306 3.652 3.652 659 HE1 PHE 341 HE1 PHE 41 -3.763 3.753 3.753 660 HE2 PHE 341 HE2 PHE 41 -0.967 4.889 4.889 661 HZ PHE 341 HZ PHE 41 -1.695 4.939 4.939 662 H ARG 342 H ARG 42 -7.302 0.905 0.905 663 HA ARG 342 HA ARG 42 -6.503 -0.705 -0.705 664 1HB ARG 342 2HB ARG 42 -8.846 0.521 0.521 665 2HB ARG 342 1HB ARG 42 -9.261 -1.182 -1.182 666 1HG ARG 342 2HG ARG 42 -8.467 -1.634 -1.634 667 2HG ARG 342 1HG ARG 42 -8.086 0.077 0.077 668 1HD ARG 342 2HD ARG 42 -10.200 0.215 0.215 669 2HD ARG 342 1HD ARG 42 -10.674 0.219 0.219 670 HE ARG 342 HE ARG 42 -11.243 -2.136 -2.136 671 1HH1 ARG 342 1HH2 ARG 42 -9.431 -3.239 -3.239 672 2HH1 ARG 342 2HH2 ARG 42 -10.361 -3.307 -3.307 673 1HH2 ARG 342 2HH1 ARG 42 -12.776 -1.087 -1.087 674 2HH2 ARG 342 1HH1 ARG 42 -12.258 -2.093 -2.093 675 H GLU 343 H GLU 43 -7.370 -1.552 -1.552 676 HA GLU 343 HA GLU 43 -7.657 -4.405 -4.405 677 1HB GLU 343 2HB GLU 43 -8.640 -3.041 -3.041 678 2HB GLU 343 1HB GLU 43 -7.041 -3.238 -3.238 679 1HG GLU 343 2HG GLU 43 -7.400 -5.426 -5.426 680 2HG GLU 343 1HG GLU 43 -8.096 -5.727 -5.727 681 H LEU 344 H LEU 44 -5.224 -2.589 -2.589 682 HA LEU 344 HA LEU 44 -3.328 -4.684 -4.684 683 1HB LEU 344 2HB LEU 44 -3.012 -1.674 -1.674 684 2HB LEU 344 1HB LEU 44 -1.612 -2.734 -2.734 685 HG LEU 344 HG LEU 44 -2.075 -2.310 -2.310 686 1HD1 LEU 344 3HD1 LEU 44 -2.313 -4.841 -4.841 687 2HD1 LEU 344 2HD1 LEU 44 -3.953 -4.627 -4.627 688 3HD1 LEU 344 1HD1 LEU 44 -2.572 -4.379 -4.379 689 1HD2 LEU 344 3HD2 LEU 44 -4.616 -1.595 -1.595 690 2HD2 LEU 344 2HD2 LEU 44 -4.023 -1.387 -1.387 691 3HD2 LEU 344 1HD2 LEU 44 -4.908 -2.850 -2.850 692 H ASN 345 H ASN 45 -3.046 -1.868 -1.868 693 HA ASN 345 HA ASN 45 -1.123 -2.742 -2.742 694 1HB ASN 345 2HB ASN 45 -2.121 -0.569 -0.569 695 2HB ASN 345 1HB ASN 45 -3.699 -1.279 -1.279 696 1HD2 ASN 345 2HD2 ASN 45 -2.556 -0.609 -0.609 697 2HD2 ASN 345 1HD2 ASN 45 -3.357 0.129 0.129 698 H GLU 346 H GLU 46 -4.419 -3.941 -3.941 699 HA GLU 346 HA GLU 46 -4.378 -5.386 -5.386 700 1HB GLU 346 2HB GLU 46 -6.169 -5.133 -5.133 701 2HB GLU 346 1HB GLU 46 -6.178 -6.738 -6.738 702 1HG GLU 346 2HG GLU 46 -6.594 -4.124 -4.124 703 2HG GLU 346 1HG GLU 46 -7.861 -5.276 -5.276 704 H ALA 347 H ALA 47 -3.892 -6.379 -6.379 705 HA ALA 347 HA ALA 47 -3.352 -9.115 -9.115 706 1HB ALA 347 2HB ALA 47 -2.525 -7.311 -7.311 707 2HB ALA 347 1HB ALA 47 -2.137 -9.031 -9.031 708 3HB ALA 347 3HB ALA 47 -3.820 -8.507 -8.507 709 H LEU 348 H LEU 48 -1.174 -6.297 -6.297 710 HA LEU 348 HA LEU 48 1.274 -7.702 -7.702 711 1HB LEU 348 2HB LEU 48 0.510 -4.942 -4.942 712 2HB LEU 348 1HB LEU 48 2.157 -5.560 -5.560 713 HG LEU 348 HG LEU 48 0.289 -5.459 -5.459 714 1HD1 LEU 348 3HD1 LEU 48 1.468 -3.260 -3.260 715 2HD1 LEU 348 2HD1 LEU 48 2.336 -3.466 -3.466 716 3HD1 LEU 348 1HD1 LEU 48 0.587 -3.235 -3.235 717 1HD2 LEU 348 2HD2 LEU 48 3.063 -6.279 -6.279 718 2HD2 LEU 348 1HD2 LEU 48 2.003 -6.719 -6.719 719 3HD2 LEU 348 3HD2 LEU 48 2.899 -5.202 -5.202 720 H GLU 349 H GLU 49 -0.834 -6.182 -6.182 721 HA GLU 349 HA GLU 49 0.632 -7.092 -7.092 722 1HB GLU 349 2HB GLU 49 -1.321 -5.406 -5.406 723 2HB GLU 349 1HB GLU 49 -2.378 -6.819 -6.819 724 1HG GLU 349 2HG GLU 49 -1.888 -7.295 -7.295 725 2HG GLU 349 1HG GLU 49 -0.200 -6.811 -6.811 726 H LEU 350 H LEU 50 -1.582 -8.709 -8.709 727 HA LEU 350 HA LEU 50 -2.141 -10.952 -10.952 728 1HB LEU 350 2HB LEU 50 -3.568 -11.513 -11.513 729 2HB LEU 350 1HB LEU 50 -3.058 -10.044 -10.044 730 HG LEU 350 HG LEU 50 -1.138 -11.431 -11.431 731 1HD1 LEU 350 3HD1 LEU 50 -2.293 -13.351 -13.351 732 2HD1 LEU 350 2HD1 LEU 50 -2.552 -13.923 -13.923 733 3HD1 LEU 350 1HD1 LEU 50 -0.919 -13.566 -13.566 734 1HD2 LEU 350 2HD2 LEU 50 -3.701 -10.950 -10.950 735 2HD2 LEU 350 1HD2 LEU 50 -2.432 -11.687 -11.687 736 3HD2 LEU 350 3HD2 LEU 50 -3.598 -12.705 -12.705 737 H LYS 351 H LYS 51 0.382 -10.150 -10.150 738 HA LYS 351 HA LYS 51 1.584 -12.734 -12.734 739 1HB LYS 351 2HB LYS 51 2.099 -10.614 -10.614 740 2HB LYS 351 1HB LYS 51 3.109 -10.122 -10.122 741 1HG LYS 351 2HG LYS 51 4.531 -12.029 -12.029 742 2HG LYS 351 1HG LYS 51 3.409 -12.805 -12.805 743 1HD LYS 351 2HD LYS 51 3.811 -10.514 -10.514 744 2HD LYS 351 1HD LYS 51 5.350 -10.600 -10.600 745 1HE LYS 351 2HE LYS 51 4.334 -13.072 -13.072 746 2HE LYS 351 1HE LYS 51 5.041 -11.802 -11.802 747 1HZ LYS 351 2HZ LYS 51 7.000 -11.850 -11.850 748 2HZ LYS 351 1HZ LYS 51 6.325 -13.160 -13.160 749 3HZ LYS 351 3HZ LYS 51 6.742 -13.334 -13.334 750 H ASP 352 H ASP 52 1.974 -10.109 -10.109 751 HA ASP 352 HA ASP 52 4.102 -11.436 -11.436 752 1HB ASP 352 2HB ASP 52 3.250 -8.893 -8.893 753 2HB ASP 352 1HB ASP 52 2.311 -9.470 -9.470 754 H ALA 353 H ALA 53 0.631 -11.612 -11.612 755 HA ALA 353 HA ALA 53 0.523 -12.991 -12.991 756 1HB ALA 353 1HB ALA 53 -1.272 -11.384 -11.384 757 2HB ALA 353 3HB ALA 53 -1.835 -12.931 -12.931 758 3HB ALA 353 2HB ALA 53 -1.755 -12.667 -12.667 759 H GLN 354 H GLN 54 1.033 -13.781 -13.781 760 HA GLN 354 HA GLN 54 -0.247 -16.197 -16.197 761 1HB GLN 354 2HB GLN 54 2.459 -15.147 -15.147 762 2HB GLN 354 1HB GLN 54 2.139 -16.857 -16.857 763 1HG GLN 354 2HG GLN 54 -0.134 -15.813 -15.813 764 2HG GLN 354 1HG GLN 54 0.958 -14.459 -14.459 765 1HE2 GLN 354 2HE2 GLN 54 1.077 -17.422 -17.422 766 2HE2 GLN 354 1HE2 GLN 54 -0.255 -16.986 -16.986 767 H ALA 355 HN ALA 55 -0.276 -18.151 -18.151 768 HA ALA 355 HA ALA 55 1.996 -18.846 -18.846 769 1HB ALA 355 1HB ALA 55 -0.962 -18.889 -18.889 770 2HB ALA 355 3HB ALA 55 0.176 -19.897 -19.897 771 3HB ALA 355 2HB ALA 55 0.334 -18.141 -18.141 772 1H GLY 325 2H GLY 25 -15.759 14.448 14.448 773 2H GLY 325 1H GLY 25 -15.681 14.125 14.125 774 3H GLY 325 3H GLY 25 -16.412 13.008 13.008 775 1HA GLY 325 2HA GLY 25 -14.453 11.960 11.960 776 2HA GLY 325 1HA GLY 25 -13.622 13.403 13.403 777 H GLU 326 H GLU 26 -13.699 11.365 11.365 778 HA GLU 326 HA GLU 26 -13.287 13.477 13.477 779 1HB GLU 326 2HB GLU 26 -13.904 10.548 10.548 780 2HB GLU 326 1HB GLU 26 -13.030 11.248 11.248 781 1HG GLU 326 2HG GLU 26 -14.974 13.114 13.114 782 2HG GLU 326 1HG GLU 26 -15.834 11.672 11.672 783 H TYR 327 H TYR 27 -11.471 12.259 12.259 784 HA TYR 327 HA TYR 27 -9.052 12.031 12.031 785 1HB TYR 327 2HB TYR 27 -9.588 13.529 13.529 786 2HB TYR 327 1HB TYR 27 -8.008 12.755 12.755 787 HD1 TYR 327 HD2 TYR 27 -6.621 13.176 13.176 788 HD2 TYR 327 HD1 TYR 27 -10.041 15.537 15.537 789 HE1 TYR 327 HE2 TYR 27 -5.852 14.984 14.984 790 HE2 TYR 327 HE1 TYR 27 -9.274 17.345 17.345 791 HH TYR 327 HH TYR 27 -6.878 18.055 18.055 792 H PHE 328 H PHE 28 -8.659 9.845 9.845 793 HA PHE 328 HA PHE 28 -8.965 8.224 8.224 794 1HB PHE 328 2HB PHE 28 -8.553 7.570 7.570 795 2HB PHE 328 1HB PHE 28 -8.288 6.350 6.350 796 HD1 PHE 328 HD2 PHE 28 -10.791 8.516 8.516 797 HD2 PHE 328 HD1 PHE 28 -10.127 5.473 5.473 798 HE1 PHE 328 HE2 PHE 28 -13.237 8.118 8.118 799 HE2 PHE 328 HE1 PHE 28 -12.570 5.072 5.072 800 HZ PHE 328 HZ PHE 28 -14.125 6.396 6.396 801 H THR 329 H THR 29 -7.090 6.560 6.560 802 HA THR 329 HA THR 29 -4.468 7.848 7.848 803 HB THR 329 HB THR 29 -4.623 6.528 6.528 804 HG1 THR 329 HG1 THR 29 -6.450 7.488 7.488 805 1HG2 THR 329 2HG2 THR 29 -2.883 8.179 8.179 806 2HG2 THR 329 1HG2 THR 29 -3.821 9.364 9.364 807 3HG2 THR 329 3HG2 THR 29 -2.999 8.054 8.054 808 H LEU 330 H LEU 30 -2.896 6.404 6.404 809 HA LEU 330 HA LEU 30 -3.568 3.499 3.499 810 1HB LEU 330 2HB LEU 30 -3.116 4.968 4.968 811 2HB LEU 330 1HB LEU 30 -1.588 4.136 4.136 812 HG LEU 330 HG LEU 30 -3.538 2.210 2.210 813 1HD1 LEU 330 1HD1 LEU 30 -4.855 4.125 4.125 814 2HD1 LEU 330 3HD1 LEU 30 -4.241 3.087 3.087 815 3HD1 LEU 330 2HD1 LEU 30 -5.267 2.409 2.409 816 1HD2 LEU 330 1HD2 LEU 30 -1.749 2.783 2.783 817 2HD2 LEU 330 3HD2 LEU 30 -1.491 1.625 1.625 818 3HD2 LEU 330 2HD2 LEU 30 -2.731 1.320 1.320 819 H GLN 331 H GLN 31 -2.428 3.238 3.238 820 HA GLN 331 HA GLN 31 0.357 4.129 4.129 821 1HB GLN 331 2HB GLN 31 -1.218 2.332 2.332 822 2HB GLN 331 1HB GLN 31 0.306 3.144 3.144 823 1HG GLN 331 2HG GLN 31 -0.756 5.331 5.331 824 2HG GLN 331 1HG GLN 31 -2.275 4.563 4.563 825 1HE2 GLN 331 2HE2 GLN 31 -2.614 5.290 5.290 826 2HE2 GLN 331 1HE2 GLN 31 -2.542 6.174 6.174 827 H ILE 332 H ILE 32 1.882 2.999 2.999 828 HA ILE 332 HA ILE 32 1.532 0.047 0.047 829 HB ILE 332 HB ILE 32 3.193 2.032 2.032 830 1HG1 ILE 332 2HG1 ILE 32 1.410 0.347 0.347 831 2HG1 ILE 332 1HG1 ILE 32 0.510 1.142 1.142 832 1HG2 ILE 332 1HG2 ILE 32 3.641 -0.751 -0.751 833 2HG2 ILE 332 3HG2 ILE 32 3.065 -0.561 -0.561 834 3HG2 ILE 332 2HG2 ILE 32 4.493 0.321 0.321 835 1HD1 ILE 332 3HD1 ILE 32 1.654 3.311 3.311 836 2HD1 ILE 332 2HD1 ILE 32 2.174 2.435 2.435 837 3HD1 ILE 332 1HD1 ILE 32 0.455 2.657 2.657 838 H ARG 333 H ARG 33 2.682 -1.064 -1.064 839 HA ARG 333 HA ARG 33 4.963 0.153 0.153 840 1HB ARG 333 2HB ARG 33 3.341 -1.452 -1.452 841 2HB ARG 333 1HB ARG 33 4.060 -2.736 -2.736 842 1HG ARG 333 2HG ARG 33 6.324 -1.778 -1.778 843 2HG ARG 333 1HG ARG 33 5.271 -1.158 -1.158 844 1HD ARG 333 2HD ARG 33 5.563 -3.214 -3.214 845 2HD ARG 333 1HD ARG 33 4.352 -3.724 -3.724 846 HE ARG 333 HE ARG 33 6.909 -3.829 -3.829 847 1HH1 ARG 333 1HH2 ARG 33 6.131 -5.016 -5.016 848 2HH1 ARG 333 2HH2 ARG 33 6.437 -6.679 -6.679 849 1HH2 ARG 333 2HH1 ARG 33 6.854 -6.112 -6.112 850 2HH2 ARG 333 1HH1 ARG 33 6.850 -7.300 -7.300 851 H GLY 334 H GLY 34 6.516 0.481 0.481 852 1HA GLY 334 2HA GLY 34 8.369 -1.607 -1.607 853 2HA GLY 334 1HA GLY 34 7.315 -1.542 -1.542 854 H ARG 335 H ARG 35 8.428 -0.494 -0.494 855 HA ARG 335 HA ARG 35 9.081 2.297 2.297 856 1HB ARG 335 2HB ARG 35 11.000 1.066 1.066 857 2HB ARG 335 1HB ARG 35 11.510 0.546 0.546 858 1HG ARG 335 2HG ARG 35 11.960 2.737 2.737 859 2HG ARG 335 1HG ARG 35 10.935 3.451 3.451 860 1HD ARG 335 2HD ARG 35 12.731 2.152 2.152 861 2HD ARG 335 1HD ARG 35 13.748 2.521 2.521 862 HE ARG 335 HE ARG 35 12.457 4.519 4.519 863 1HH1 ARG 335 1HH2 ARG 35 12.627 5.113 5.113 864 2HH1 ARG 335 2HH2 ARG 35 14.066 6.076 6.076 865 1HH2 ARG 335 2HH1 ARG 35 15.078 5.161 5.161 866 2HH2 ARG 335 1HH1 ARG 35 15.455 6.102 6.102 867 H GLU 336 H GLU 36 10.001 -0.682 -0.682 868 HA GLU 336 HA GLU 36 10.209 0.726 0.726 869 1HB GLU 336 2HB GLU 36 10.857 -1.874 -1.874 870 2HB GLU 336 1HB GLU 36 9.812 -2.073 -2.073 871 1HG GLU 336 2HG GLU 36 11.292 -0.934 -0.934 872 2HG GLU 336 1HG GLU 36 12.119 -0.141 -0.141 873 H ARG 337 H ARG 37 7.730 -1.072 -1.072 874 HA ARG 337 HA ARG 37 5.923 -1.272 -1.272 875 1HB ARG 337 2HB ARG 37 5.620 -1.599 -1.599 876 2HB ARG 337 1HB ARG 37 4.211 -1.626 -1.626 877 1HG ARG 337 2HG ARG 37 5.929 -3.303 -3.303 878 2HG ARG 337 1HG ARG 37 6.331 -3.643 -3.643 879 1HD ARG 337 2HD ARG 37 3.439 -3.436 -3.436 880 2HD ARG 337 1HD ARG 37 4.236 -4.785 -4.785 881 HE ARG 337 HE ARG 37 3.714 -4.606 -4.606 882 1HH1 ARG 337 1HH2 ARG 37 6.491 -4.687 -4.687 883 2HH1 ARG 337 2HH2 ARG 37 6.959 -6.335 -6.335 884 1HH2 ARG 337 2HH1 ARG 37 4.102 -7.156 -7.156 885 2HH2 ARG 337 1HH1 ARG 37 5.607 -7.733 -7.733 886 H PHE 338 H PHE 38 6.186 0.926 0.926 887 HA PHE 338 HA PHE 38 3.953 2.571 2.571 888 1HB PHE 338 2HB PHE 38 4.871 2.814 2.814 889 2HB PHE 338 1HB PHE 38 6.481 3.151 3.151 890 HD1 PHE 338 HD1 PHE 38 2.966 4.455 4.455 891 HD2 PHE 338 HD2 PHE 38 7.157 5.368 5.368 892 HE1 PHE 338 HE1 PHE 38 2.435 6.878 6.878 893 HE2 PHE 338 HE2 PHE 38 6.626 7.789 7.789 894 HZ PHE 338 HZ PHE 38 4.265 8.543 8.543 895 H GLU 339 H GLU 39 7.277 2.451 2.451 896 HA GLU 339 HA GLU 39 7.229 5.008 5.008 897 1HB GLU 339 2HB GLU 39 8.958 2.543 2.543 898 2HB GLU 339 1HB GLU 39 9.145 3.877 3.877 899 1HG GLU 339 2HG GLU 39 8.968 4.875 4.875 900 2HG GLU 339 1HG GLU 39 10.268 3.693 3.693 901 H MET 340 H MET 40 6.704 1.639 1.639 902 HA MET 340 HA MET 40 6.227 2.044 2.044 903 1HB MET 340 2HB MET 40 5.011 0.182 0.182 904 2HB MET 340 1HB MET 40 4.409 0.192 0.192 905 1HG MET 340 2HG MET 40 6.382 -0.643 -0.643 906 2HG MET 340 1HG MET 40 7.365 0.052 0.052 907 1HE MET 340 1HE MET 40 4.151 -1.633 -1.633 908 2HE MET 340 3HE MET 40 4.354 -3.289 -3.289 909 3HE MET 340 2HE MET 40 4.224 -1.956 -1.956 910 H PHE 341 H PHE 41 3.915 2.337 2.337 911 HA PHE 341 HA PHE 41 1.713 3.214 3.214 912 1HB PHE 341 2HB PHE 41 2.381 3.381 3.381 913 2HB PHE 341 1HB PHE 41 0.951 4.193 4.193 914 HD1 PHE 341 HD1 PHE 41 2.378 1.024 1.024 915 HD2 PHE 341 HD2 PHE 41 -0.745 2.828 2.828 916 HE1 PHE 341 HE1 PHE 41 1.147 -1.121 -1.121 917 HE2 PHE 341 HE2 PHE 41 -1.980 0.678 0.678 918 HZ PHE 341 HZ PHE 41 -1.034 -1.297 -1.297 919 H ARG 342 H ARG 42 4.331 4.919 4.919 920 HA ARG 342 HA ARG 42 3.400 7.569 7.569 921 1HB ARG 342 2HB ARG 42 5.739 6.413 6.413 922 2HB ARG 342 1HB ARG 42 6.259 7.194 7.194 923 1HG ARG 342 2HG ARG 42 5.262 9.324 9.324 924 2HG ARG 342 1HG ARG 42 4.779 8.539 8.539 925 1HD ARG 342 2HD ARG 42 6.790 9.281 9.281 926 2HD ARG 342 1HD ARG 42 7.426 7.881 7.881 927 HE ARG 342 HE ARG 42 8.094 9.354 9.354 928 1HH1 ARG 342 1HH2 ARG 42 6.155 11.484 11.484 929 2HH1 ARG 342 2HH2 ARG 42 6.938 12.800 12.800 930 1HH2 ARG 342 2HH1 ARG 42 9.339 10.792 10.792 931 2HH2 ARG 342 1HH1 ARG 42 8.744 12.408 12.408 932 H GLU 343 H GLU 43 4.629 5.327 5.327 933 HA GLU 343 HA GLU 43 5.009 7.340 7.340 934 1HB GLU 343 2HB GLU 43 6.099 4.981 4.981 935 2HB GLU 343 1HB GLU 43 4.586 4.404 4.404 936 1HG GLU 343 2HG GLU 43 5.101 5.223 5.223 937 2HG GLU 343 1HG GLU 43 5.668 6.754 6.754 938 H LEU 344 H LEU 44 2.678 4.608 4.608 939 HA LEU 344 HA LEU 44 0.918 5.541 5.541 940 1HB LEU 344 2HB LEU 44 0.453 3.901 3.901 941 2HB LEU 344 1HB LEU 44 -0.879 4.319 4.319 942 HG LEU 344 HG LEU 44 -0.215 2.227 2.227 943 1HD1 LEU 344 3HD1 LEU 44 0.032 4.289 4.289 944 2HD1 LEU 344 2HD1 LEU 44 1.714 3.758 3.758 945 3HD1 LEU 344 1HD1 LEU 44 0.433 2.647 2.647 946 1HD2 LEU 344 3HD2 LEU 44 2.172 2.800 2.800 947 2HD2 LEU 344 2HD2 LEU 44 1.765 1.298 1.298 948 3HD2 LEU 344 1HD2 LEU 44 2.649 2.563 2.563 949 H ASN 345 H ASN 45 0.292 5.809 5.809 950 HA ASN 345 HA ASN 45 -1.752 7.647 7.647 951 1HB ASN 345 2HB ASN 45 -0.894 6.757 6.757 952 2HB ASN 345 1HB ASN 45 0.672 7.524 7.524 953 1HD2 ASN 345 2HD2 ASN 45 -0.844 9.904 9.904 954 2HD2 ASN 345 1HD2 ASN 45 0.048 8.461 8.461 955 H GLU 346 H GLU 46 1.606 8.278 8.278 956 HA GLU 346 HA GLU 46 1.404 11.166 11.166 957 1HB GLU 346 2HB GLU 46 3.389 9.173 9.173 958 2HB GLU 346 1HB GLU 46 3.413 10.656 10.656 959 1HG GLU 346 2HG GLU 46 3.556 10.506 10.506 960 2HG GLU 346 1HG GLU 46 4.909 10.856 10.856 961 H ALA 347 H ALA 47 1.278 8.828 8.828 962 HA ALA 347 HA ALA 47 0.814 10.749 10.749 963 1HB ALA 347 2HB ALA 47 0.090 7.824 7.824 964 2HB ALA 347 1HB ALA 47 -0.271 8.763 8.763 965 3HB ALA 347 3HB ALA 47 1.400 8.546 8.546 966 H LEU 348 H LEU 48 -1.482 8.887 8.887 967 HA LEU 348 HA LEU 48 -3.873 9.831 9.831 968 1HB LEU 348 2HB LEU 48 -3.329 9.221 9.221 969 2HB LEU 348 1HB LEU 48 -4.929 9.359 9.359 970 HG LEU 348 HG LEU 48 -2.843 7.419 7.419 971 1HD1 LEU 348 3HD1 LEU 48 -4.266 7.324 7.324 972 2HD1 LEU 348 2HD1 LEU 48 -4.966 6.112 6.112 973 3HD1 LEU 348 1HD1 LEU 48 -3.240 6.080 6.080 974 1HD2 LEU 348 2HD2 LEU 48 -5.618 8.157 8.157 975 2HD2 LEU 348 1HD2 LEU 48 -4.404 7.348 7.348 976 3HD2 LEU 348 3HD2 LEU 48 -5.361 6.421 6.421 977 H GLU 349 H GLU 49 -2.079 11.188 11.188 978 HA GLU 349 HA GLU 49 -3.707 13.503 13.503 979 1HB GLU 349 2HB GLU 49 -1.841 12.623 12.623 980 2HB GLU 349 1HB GLU 49 -0.725 13.478 13.478 981 1HG GLU 349 2HG GLU 49 -1.400 15.535 15.535 982 2HG GLU 349 1HG GLU 49 -3.085 15.035 15.035 983 H LEU 350 H LEU 50 -1.209 12.685 12.685 984 HA LEU 350 HA LEU 50 -0.703 15.380 15.380 985 1HB LEU 350 2HB LEU 50 0.893 14.351 14.351 986 2HB LEU 350 1HB LEU 50 0.394 12.846 12.846 987 HG LEU 350 HG LEU 50 -1.362 12.656 12.656 988 1HD1 LEU 350 3HD1 LEU 50 -0.301 15.234 15.234 989 2HD1 LEU 350 2HD1 LEU 50 0.139 14.166 14.166 990 3HD1 LEU 350 1HD1 LEU 50 -1.554 14.354 14.354 991 1HD2 LEU 350 2HD2 LEU 50 1.240 11.788 11.788 992 2HD2 LEU 350 1HD2 LEU 50 0.104 11.308 11.308 993 3HD2 LEU 350 3HD2 LEU 50 1.236 12.628 12.628 994 H LYS 351 H LYS 51 -3.032 12.871 12.871 995 HA LYS 351 HA LYS 51 -4.080 14.021 14.021 996 1HB LYS 351 2HB LYS 51 -4.559 11.700 11.700 997 2HB LYS 351 1HB LYS 51 -5.722 12.516 12.516 998 1HG LYS 351 2HG LYS 51 -7.019 13.260 13.260 999 2HG LYS 351 1HG LYS 51 -5.755 12.807 12.807 1000 1HD LYS 351 2HD LYS 51 -6.137 10.411 10.411 1001 2HD LYS 351 1HD LYS 51 -7.746 11.090 11.090 1002 1HE LYS 351 2HE LYS 51 -6.479 11.356 11.356 1003 2HE LYS 351 1HE LYS 51 -7.150 9.792 9.792 1004 1HZ LYS 351 2HZ LYS 51 -9.236 10.941 10.941 1005 2HZ LYS 351 1HZ LYS 51 -8.580 12.393 12.393 1006 3HZ LYS 351 3HZ LYS 51 -8.829 11.087 11.087 1007 H ASP 352 H ASP 52 -4.819 14.557 14.557 1008 HA ASP 352 HA ASP 52 -7.017 16.378 16.378 1009 1HB ASP 352 2HB ASP 52 -6.307 15.030 15.030 1010 2HB ASP 352 1HB ASP 52 -5.476 16.547 16.547 1011 H ALA 353 H ALA 53 -3.558 16.637 16.637 1012 HA ALA 353 HA ALA 53 -3.630 19.579 19.579 1013 1HB ALA 353 1HB ALA 53 -1.814 17.799 17.799 1014 2HB ALA 353 3HB ALA 53 -1.118 18.140 18.140 1015 3HB ALA 353 2HB ALA 53 -1.375 19.451 19.451 1016 H GLN 354 H GLN 54 -3.769 17.230 17.230 1017 HA GLN 354 HA GLN 54 -2.323 18.235 18.235 1018 1HB GLN 354 2HB GLN 54 -4.977 16.890 16.890 1019 2HB GLN 354 1HB GLN 54 -4.563 17.611 17.611 1020 1HG GLN 354 2HG GLN 54 -2.237 16.375 16.375 1021 2HG GLN 354 1HG GLN 54 -3.291 15.319 15.319 1022 1HE2 GLN 354 2HE2 GLN 54 -3.107 14.604 14.604 1023 2HE2 GLN 354 1HE2 GLN 54 -1.892 15.306 15.306 1024 H ALA 355 HN ALA 55 -2.301 20.124 20.124 1025 HA ALA 355 HA ALA 55 -4.703 21.889 21.889 1026 1HB ALA 355 1HB ALA 55 -1.821 22.581 22.581 1027 2HB ALA 355 3HB ALA 55 -2.977 23.815 23.815 1028 3HB ALA 355 2HB ALA 55 -3.243 22.910 22.910 Start of MODEL 10 1 1H GLY 325 3H GLY 25 10.521 2.840 2.840 2 2H GLY 325 2H GLY 25 10.950 3.143 3.143 3 3H GLY 325 1H GLY 25 11.554 4.133 4.133 4 1HA GLY 325 2HA GLY 25 13.289 2.819 2.819 5 2HA GLY 325 1HA GLY 25 12.741 1.877 1.877 6 H GLU 326 H GLU 26 10.961 0.252 0.252 7 HA GLU 326 HA GLU 26 11.163 -0.767 -0.767 8 1HB GLU 326 2HB GLU 26 11.983 -2.116 -2.116 9 2HB GLU 326 1HB GLU 26 11.107 -3.100 -3.100 10 1HG GLU 326 2HG GLU 26 12.719 -2.598 -2.598 11 2HG GLU 326 1HG GLU 26 13.527 -1.416 -1.416 12 H TYR 327 H TYR 27 9.573 -2.954 -2.954 13 HA TYR 327 HA TYR 27 6.994 -1.855 -1.855 14 1HB TYR 327 2HB TYR 27 7.543 -3.657 -3.657 15 2HB TYR 327 1HB TYR 27 5.928 -3.285 -3.285 16 HD1 TYR 327 HD1 TYR 27 6.777 -0.345 -0.345 17 HD2 TYR 327 HD2 TYR 27 7.094 -2.650 -2.650 18 HE1 TYR 327 HE1 TYR 27 6.755 1.739 1.739 19 HE2 TYR 327 HE2 TYR 27 7.072 -0.563 -0.563 20 HH TYR 327 HH TYR 27 5.993 2.108 2.108 21 H PHE 328 H PHE 28 6.051 -3.025 -3.025 22 HA PHE 328 HA PHE 28 6.836 -5.904 -5.904 23 1HB PHE 328 2HB PHE 28 6.131 -3.980 -3.980 24 2HB PHE 328 1HB PHE 28 6.636 -5.659 -5.659 25 HD1 PHE 328 HD1 PHE 28 8.968 -6.338 -6.338 26 HD2 PHE 328 HD2 PHE 28 7.717 -2.232 -2.232 27 HE1 PHE 328 HE1 PHE 28 11.340 -5.613 -5.613 28 HE2 PHE 328 HE2 PHE 28 10.087 -1.510 -1.510 29 HZ PHE 328 HZ PHE 28 11.900 -3.195 -3.195 30 H THR 329 H THR 29 5.117 -7.339 -7.339 31 HA THR 329 HA THR 29 2.384 -6.143 -6.143 32 HB THR 329 HB THR 29 2.586 -9.041 -9.041 33 HG1 THR 329 HG1 THR 29 3.938 -9.118 -9.118 34 1HG2 THR 329 1HG2 THR 29 0.776 -7.278 -7.278 35 2HG2 THR 329 3HG2 THR 29 1.782 -7.109 -7.109 36 3HG2 THR 329 2HG2 THR 29 1.084 -8.676 -8.676 37 H LEU 330 H LEU 30 0.970 -6.384 -6.384 38 HA LEU 330 HA LEU 30 1.781 -8.246 -8.246 39 1HB LEU 330 2HB LEU 30 1.059 -5.456 -5.456 40 2HB LEU 330 1HB LEU 30 -0.125 -6.382 -6.382 41 HG LEU 330 HG LEU 30 2.850 -6.799 -6.799 42 1HD1 LEU 330 3HD1 LEU 30 1.158 -4.580 -4.580 43 2HD1 LEU 330 2HD1 LEU 30 2.058 -5.409 -5.409 44 3HD1 LEU 330 1HD1 LEU 30 2.915 -4.695 -4.695 45 1HD2 LEU 330 1HD2 LEU 30 0.334 -7.515 -7.515 46 2HD2 LEU 330 3HD2 LEU 30 1.664 -8.562 -8.562 47 3HD2 LEU 330 2HD2 LEU 30 1.877 -7.436 -7.436 48 H GLN 331 H GLN 31 0.615 -10.058 -10.058 49 HA GLN 331 HA GLN 31 -2.214 -9.745 -9.745 50 1HB GLN 331 2HB GLN 31 -0.793 -11.319 -11.319 51 2HB GLN 331 1HB GLN 31 -0.466 -12.213 -12.213 52 1HG GLN 331 2HG GLN 31 -2.800 -12.813 -12.813 53 2HG GLN 331 1HG GLN 31 -3.240 -11.769 -11.769 54 1HE2 GLN 331 2HE2 GLN 31 -2.911 -14.535 -14.535 55 2HE2 GLN 331 1HE2 GLN 31 -3.876 -13.250 -13.250 56 H ILE 332 H ILE 32 -3.591 -9.492 -9.492 57 HA ILE 332 HA ILE 32 -3.097 -11.087 -11.087 58 HB ILE 332 HB ILE 32 -4.801 -8.605 -8.605 59 1HG1 ILE 332 2HG1 ILE 32 -2.389 -8.513 -8.513 60 2HG1 ILE 332 1HG1 ILE 32 -2.059 -8.720 -8.720 61 1HG2 ILE 332 3HG2 ILE 32 -4.246 -10.463 -10.463 62 2HG2 ILE 332 2HG2 ILE 32 -4.340 -8.740 -8.740 63 3HG2 ILE 332 1HG2 ILE 32 -5.712 -9.559 -9.559 64 1HD1 ILE 332 3HD1 ILE 32 -4.131 -6.709 -6.709 65 2HD1 ILE 332 2HD1 ILE 32 -2.513 -6.300 -6.300 66 3HD1 ILE 332 1HD1 ILE 32 -2.789 -6.628 -6.628 67 H ARG 333 H ARG 33 -4.516 -12.705 -12.705 68 HA ARG 333 HA ARG 33 -6.892 -13.011 -13.011 69 1HB ARG 333 2HB ARG 33 -5.941 -14.859 -14.859 70 2HB ARG 333 1HB ARG 33 -7.015 -15.253 -15.253 71 1HG ARG 333 2HG ARG 33 -5.165 -14.802 -14.802 72 2HG ARG 333 1HG ARG 33 -4.092 -14.476 -14.476 73 1HD ARG 333 2HD ARG 33 -5.598 -17.060 -17.060 74 2HD ARG 333 1HD ARG 33 -4.213 -16.896 -16.896 75 HE ARG 333 HE ARG 33 -2.848 -16.368 -16.368 76 1HH1 ARG 333 1HH2 ARG 33 -5.039 -15.958 -15.958 77 2HH1 ARG 333 2HH2 ARG 33 -5.109 -17.484 -17.484 78 1HH2 ARG 333 2HH1 ARG 33 -3.320 -19.173 -19.173 79 2HH2 ARG 333 1HH1 ARG 33 -4.139 -19.305 -19.305 80 H GLY 334 H GLY 34 -8.602 -11.790 -11.790 81 1HA GLY 334 2HA GLY 34 -10.070 -12.392 -12.392 82 2HA GLY 334 1HA GLY 34 -9.024 -11.036 -11.036 83 H ARG 335 H ARG 35 -9.854 -9.071 -9.071 84 HA ARG 335 HA ARG 35 -10.984 -8.050 -8.050 85 1HB ARG 335 2HB ARG 35 -12.787 -9.605 -9.605 86 2HB ARG 335 1HB ARG 35 -13.053 -9.451 -9.451 87 1HG ARG 335 2HG ARG 35 -14.066 -7.347 -7.347 88 2HG ARG 335 1HG ARG 35 -13.333 -7.046 -7.046 89 1HD ARG 335 2HD ARG 35 -14.744 -9.180 -9.180 90 2HD ARG 335 1HD ARG 35 -15.725 -8.710 -8.710 91 HE ARG 335 HE ARG 35 -15.114 -6.664 -6.664 92 1HH1 ARG 335 1HH2 ARG 35 -17.293 -9.127 -9.127 93 2HH1 ARG 335 2HH2 ARG 35 -18.712 -8.153 -8.153 94 1HH2 ARG 335 2HH1 ARG 35 -16.952 -5.213 -5.213 95 2HH2 ARG 335 1HH1 ARG 35 -18.521 -5.939 -5.939 96 H GLU 336 H GLU 36 -11.460 -8.213 -8.213 97 HA GLU 336 HA GLU 36 -12.116 -5.350 -5.350 98 1HB GLU 336 2HB GLU 36 -11.998 -7.638 -7.638 99 2HB GLU 336 1HB GLU 36 -11.721 -6.031 -6.031 100 1HG GLU 336 2HG GLU 36 -13.844 -5.245 -5.245 101 2HG GLU 336 1HG GLU 36 -14.074 -6.634 -6.634 102 H ARG 337 H ARG 37 -9.431 -7.470 -7.470 103 HA ARG 337 HA ARG 37 -7.796 -5.375 -5.375 104 1HB ARG 337 2HB ARG 37 -7.526 -8.191 -8.191 105 2HB ARG 337 1HB ARG 37 -6.093 -7.343 -7.343 106 1HG ARG 337 2HG ARG 37 -5.549 -6.524 -6.524 107 2HG ARG 337 1HG ARG 37 -7.203 -6.669 -6.669 108 1HD ARG 337 2HD ARG 37 -5.281 -8.951 -8.951 109 2HD ARG 337 1HD ARG 37 -5.840 -8.407 -8.407 110 HE ARG 337 HE ARG 37 -8.090 -9.106 -9.106 111 1HH1 ARG 337 1HH2 ARG 37 -8.112 -9.951 -9.951 112 2HH1 ARG 337 2HH2 ARG 37 -7.736 -11.640 -11.640 113 1HH2 ARG 337 2HH1 ARG 37 -6.450 -11.493 -11.493 114 2HH2 ARG 337 1HH1 ARG 37 -6.796 -12.515 -12.515 115 H PHE 338 H PHE 38 -8.167 -6.695 -6.695 116 HA PHE 338 HA PHE 38 -6.008 -5.260 -5.260 117 1HB PHE 338 2HB PHE 38 -7.285 -7.128 -7.128 118 2HB PHE 338 1HB PHE 38 -8.650 -6.028 -6.028 119 HD1 PHE 338 HD1 PHE 38 -5.223 -6.819 -6.819 120 HD2 PHE 338 HD2 PHE 38 -8.556 -4.150 -4.150 121 HE1 PHE 338 HE1 PHE 38 -4.208 -5.917 -5.917 122 HE2 PHE 338 HE2 PHE 38 -7.541 -3.248 -3.248 123 HZ PHE 338 HZ PHE 38 -5.367 -4.131 -4.131 124 H GLU 339 H GLU 39 -9.289 -4.347 -4.347 125 HA GLU 339 HA GLU 39 -9.333 -1.881 -1.881 126 1HB GLU 339 2HB GLU 39 -10.948 -3.048 -3.048 127 2HB GLU 339 1HB GLU 39 -11.129 -1.336 -1.336 128 1HG GLU 339 2HG GLU 39 -11.280 -3.544 -3.544 129 2HG GLU 339 1HG GLU 39 -12.685 -2.875 -2.875 130 H MET 340 H MET 40 -8.583 -2.698 -2.698 131 HA MET 340 HA MET 40 -8.109 -0.106 -0.106 132 1HB MET 340 2HB MET 40 -6.654 -2.647 -2.647 133 2HB MET 340 1HB MET 40 -6.667 -1.168 -1.168 134 1HG MET 340 2HG MET 40 -9.230 -1.366 -1.366 135 2HG MET 340 1HG MET 40 -8.982 -3.011 -3.011 136 1HE MET 340 2HE MET 40 -6.752 -4.308 -4.308 137 2HE MET 340 1HE MET 40 -5.931 -2.800 -2.800 138 3HE MET 340 3HE MET 40 -6.260 -3.993 -3.993 139 H PHE 341 H PHE 41 -5.873 -2.318 -2.318 140 HA PHE 341 HA PHE 41 -3.608 -0.590 -0.590 141 1HB PHE 341 2HB PHE 41 -4.379 -2.973 -2.973 142 2HB PHE 341 1HB PHE 41 -2.885 -2.109 -2.109 143 HD1 PHE 341 HD1 PHE 41 -4.153 -2.110 -2.110 144 HD2 PHE 341 HD2 PHE 41 -1.647 -4.233 -4.233 145 HE1 PHE 341 HE1 PHE 41 -3.144 -3.352 -3.352 146 HE2 PHE 341 HE2 PHE 41 -0.627 -5.477 -5.477 147 HZ PHE 341 HZ PHE 41 -1.382 -5.043 -5.043 148 H ARG 342 H ARG 42 -6.133 -1.105 -1.105 149 HA ARG 342 HA ARG 42 -5.135 0.369 0.369 150 1HB ARG 342 2HB ARG 42 -7.802 -0.415 -0.415 151 2HB ARG 342 1HB ARG 42 -7.804 1.064 1.064 152 1HG ARG 342 2HG ARG 42 -6.199 -0.384 -0.384 153 2HG ARG 342 1HG ARG 42 -7.069 -1.717 -1.717 154 1HD ARG 342 2HD ARG 42 -8.707 -1.358 -1.358 155 2HD ARG 342 1HD ARG 42 -9.069 0.125 0.125 156 HE ARG 342 HE ARG 42 -6.981 0.246 0.246 157 1HH1 ARG 342 1HH2 ARG 42 -10.314 0.170 0.170 158 2HH1 ARG 342 2HH2 ARG 42 -10.559 1.728 1.728 159 1HH2 ARG 342 2HH1 ARG 42 -7.208 2.610 2.610 160 2HH2 ARG 342 1HH1 ARG 42 -8.800 3.111 3.111 161 H GLU 343 H GLU 43 -6.708 1.491 1.491 162 HA GLU 343 HA GLU 43 -6.744 4.284 4.284 163 1HB GLU 343 2HB GLU 43 -8.261 3.290 3.290 164 2HB GLU 343 1HB GLU 43 -6.861 3.126 3.126 165 1HG GLU 343 2HG GLU 43 -7.193 5.248 5.248 166 2HG GLU 343 1HG GLU 43 -6.789 5.778 5.778 167 H LEU 344 H LEU 44 -4.721 2.464 2.464 168 HA LEU 344 HA LEU 44 -2.990 4.494 4.494 169 1HB LEU 344 2HB LEU 44 -2.616 1.550 1.550 170 2HB LEU 344 1HB LEU 44 -1.195 2.532 2.532 171 HG LEU 344 HG LEU 44 -1.775 1.882 1.882 172 1HD1 LEU 344 3HD1 LEU 44 -1.974 4.481 4.481 173 2HD1 LEU 344 2HD1 LEU 44 -3.666 4.203 4.203 174 3HD1 LEU 344 1HD1 LEU 44 -2.396 3.804 3.804 175 1HD2 LEU 344 3HD2 LEU 44 -4.078 1.009 1.009 176 2HD2 LEU 344 2HD2 LEU 44 -3.832 1.117 1.117 177 3HD2 LEU 344 1HD2 LEU 44 -4.696 2.400 2.400 178 H ASN 345 H ASN 45 -2.306 2.284 2.284 179 HA ASN 345 HA ASN 45 -0.124 3.849 3.849 180 1HB ASN 345 2HB ASN 45 -0.098 2.403 2.403 181 2HB ASN 345 1HB ASN 45 -0.745 1.406 1.406 182 1HD2 ASN 345 2HD2 ASN 45 -3.583 0.666 0.666 183 2HD2 ASN 345 1HD2 ASN 45 -2.403 0.136 0.136 184 H GLU 346 H GLU 46 -3.567 4.218 4.218 185 HA GLU 346 HA GLU 46 -3.625 5.713 5.713 186 1HB GLU 346 2HB GLU 46 -5.669 4.876 4.876 187 2HB GLU 346 1HB GLU 46 -5.401 5.984 5.984 188 1HG GLU 346 2HG GLU 46 -5.950 7.858 7.858 189 2HG GLU 346 1HG GLU 46 -5.479 7.108 7.108 190 H ALA 347 H ALA 47 -3.265 6.791 6.791 191 HA ALA 347 HA ALA 47 -3.011 9.586 9.586 192 1HB ALA 347 3HB ALA 47 -3.697 8.819 8.819 193 2HB ALA 347 2HB ALA 47 -2.069 8.186 8.186 194 3HB ALA 347 1HB ALA 47 -2.321 9.921 9.921 195 H LEU 348 H LEU 48 -0.626 7.067 7.067 196 HA LEU 348 HA LEU 48 1.712 8.602 8.602 197 1HB LEU 348 2HB LEU 48 1.337 5.825 5.825 198 2HB LEU 348 1HB LEU 48 2.875 6.542 6.542 199 HG LEU 348 HG LEU 48 0.560 6.190 6.190 200 1HD1 LEU 348 1HD1 LEU 48 2.025 4.125 4.125 201 2HD1 LEU 348 3HD1 LEU 48 2.841 4.405 4.405 202 3HD1 LEU 348 2HD1 LEU 48 1.118 4.028 4.028 203 1HD2 LEU 348 1HD2 LEU 48 2.800 7.739 7.739 204 2HD2 LEU 348 3HD2 LEU 48 1.974 7.028 7.028 205 3HD2 LEU 348 2HD2 LEU 48 3.382 6.225 6.225 206 H GLU 349 H GLU 49 0.091 7.015 7.015 207 HA GLU 349 HA GLU 49 1.816 8.057 8.057 208 1HB GLU 349 2HB GLU 49 -0.832 6.779 6.779 209 2HB GLU 349 1HB GLU 49 -0.639 7.898 7.898 210 1HG GLU 349 2HG GLU 49 1.757 6.325 6.325 211 2HG GLU 349 1HG GLU 49 0.353 5.267 5.267 212 H LEU 350 H LEU 50 -1.023 9.390 9.390 213 HA LEU 350 HA LEU 50 -1.374 11.647 11.647 214 1HB LEU 350 2HB LEU 50 -3.080 12.056 12.056 215 2HB LEU 350 1HB LEU 50 -2.580 10.620 10.620 216 HG LEU 350 HG LEU 50 -0.935 12.142 12.142 217 1HD1 LEU 350 1HD1 LEU 50 -2.075 13.965 13.965 218 2HD1 LEU 350 3HD1 LEU 50 -2.439 14.513 14.513 219 3HD1 LEU 350 2HD1 LEU 50 -0.765 14.243 14.243 220 1HD2 LEU 350 2HD2 LEU 50 -3.922 12.558 12.558 221 2HD2 LEU 350 1HD2 LEU 50 -2.947 11.351 11.351 222 3HD2 LEU 350 3HD2 LEU 50 -2.743 13.061 13.061 223 H LYS 351 H LYS 51 0.862 10.933 10.933 224 HA LYS 351 HA LYS 51 1.831 13.576 13.576 225 1HB LYS 351 2HB LYS 51 2.325 11.455 11.455 226 2HB LYS 351 1HB LYS 51 3.527 11.087 11.087 227 1HG LYS 351 2HG LYS 51 4.852 12.931 12.931 228 2HG LYS 351 1HG LYS 51 3.512 13.797 13.797 229 1HD LYS 351 2HD LYS 51 3.522 11.778 11.778 230 2HD LYS 351 1HD LYS 51 5.176 11.556 11.556 231 1HE LYS 351 2HE LYS 51 5.912 13.526 13.526 232 2HE LYS 351 1HE LYS 51 4.351 14.324 14.324 233 1HZ LYS 351 1HZ LYS 51 4.801 12.120 12.120 234 2HZ LYS 351 3HZ LYS 51 4.993 13.754 13.754 235 3HZ LYS 351 2HZ LYS 51 3.474 13.178 13.178 236 H ASP 352 H ASP 52 2.849 11.032 11.032 237 HA ASP 352 HA ASP 52 4.964 12.609 12.609 238 1HB ASP 352 2HB ASP 52 4.329 9.963 9.963 239 2HB ASP 352 1HB ASP 52 3.705 10.479 10.479 240 H ALA 353 H ALA 53 1.553 12.617 12.617 241 HA ALA 353 HA ALA 53 1.678 13.894 13.894 242 1HB ALA 353 2HB ALA 53 -0.316 12.345 12.345 243 2HB ALA 353 1HB ALA 53 -0.985 13.800 13.800 244 3HB ALA 353 3HB ALA 53 -0.165 12.602 12.602 245 H GLN 354 H GLN 54 1.767 14.797 14.797 246 HA GLN 354 HA GLN 54 -0.021 16.930 16.930 247 1HB GLN 354 2HB GLN 54 2.787 16.458 16.458 248 2HB GLN 354 1HB GLN 54 1.990 17.996 17.996 249 1HG GLN 354 2HG GLN 54 -0.008 16.331 16.331 250 2HG GLN 354 1HG GLN 54 1.361 15.272 15.272 251 1HE2 GLN 354 2HE2 GLN 54 0.540 18.310 18.310 252 2HE2 GLN 354 1HE2 GLN 54 -0.480 17.902 17.902 253 H ALA 355 HN ALA 55 -0.409 18.322 18.322 254 HA ALA 355 HA ALA 55 1.751 20.172 20.172 255 1HB ALA 355 1HB ALA 55 1.587 17.991 17.991 256 2HB ALA 355 3HB ALA 55 0.367 18.999 18.999 257 3HB ALA 355 2HB ALA 55 2.023 19.584 19.584 258 1H GLY 325 3H GLY 25 -10.934 -14.853 -14.853 259 2H GLY 325 2H GLY 25 -11.569 -13.707 -13.707 260 3H GLY 325 1H GLY 25 -12.082 -15.324 -15.324 261 1HA GLY 325 2HA GLY 25 -13.681 -14.964 -14.964 262 2HA GLY 325 1HA GLY 25 -13.248 -13.255 -13.255 263 H GLU 326 H GLU 26 -11.309 -12.660 -12.660 264 HA GLU 326 HA GLU 26 -11.112 -14.419 -14.419 265 1HB GLU 326 2HB GLU 26 -12.138 -11.629 -11.629 266 2HB GLU 326 1HB GLU 26 -11.068 -12.000 -12.000 267 1HG GLU 326 2HG GLU 26 -12.496 -13.815 -13.815 268 2HG GLU 326 1HG GLU 26 -13.493 -13.663 -13.663 269 H TYR 327 H TYR 27 -9.409 -13.005 -13.005 270 HA TYR 327 HA TYR 27 -7.048 -12.572 -12.572 271 1HB TYR 327 2HB TYR 27 -7.196 -13.575 -13.575 272 2HB TYR 327 1HB TYR 27 -5.692 -13.197 -13.197 273 HD1 TYR 327 HD1 TYR 27 -6.833 -14.198 -14.198 274 HD2 TYR 327 HD2 TYR 27 -6.585 -15.923 -15.923 275 HE1 TYR 327 HE1 TYR 27 -6.815 -16.466 -16.466 276 HE2 TYR 327 HE2 TYR 27 -6.568 -18.191 -18.191 277 HH TYR 327 HH TYR 27 -5.765 -18.969 -18.969 278 H PHE 328 H PHE 28 -6.220 -10.545 -10.545 279 HA PHE 328 HA PHE 28 -6.851 -8.781 -8.781 280 1HB PHE 328 2HB PHE 28 -6.539 -7.940 -7.940 281 2HB PHE 328 1HB PHE 28 -6.957 -6.890 -6.890 282 HD1 PHE 328 HD1 PHE 28 -9.161 -7.085 -7.085 283 HD2 PHE 328 HD2 PHE 28 -8.160 -9.432 -9.432 284 HE1 PHE 328 HE1 PHE 28 -11.559 -7.623 -7.623 285 HE2 PHE 328 HE2 PHE 28 -10.558 -9.972 -9.972 286 HZ PHE 328 HZ PHE 28 -12.258 -9.068 -9.068 287 H THR 329 H THR 29 -5.087 -7.669 -7.669 288 HA THR 329 HA THR 29 -2.445 -8.290 -8.290 289 HB THR 329 HB THR 29 -2.314 -6.930 -6.930 290 HG1 THR 329 HG1 THR 29 -3.480 -8.306 -8.306 291 1HG2 THR 329 1HG2 THR 29 -0.674 -8.505 -8.505 292 2HG2 THR 329 3HG2 THR 29 -1.601 -9.801 -9.801 293 3HG2 THR 329 2HG2 THR 29 -0.766 -8.614 -8.614 294 H LEU 330 H LEU 30 -1.120 -6.653 -6.653 295 HA LEU 330 HA LEU 30 -2.155 -3.858 -3.858 296 1HB LEU 330 2HB LEU 30 -1.573 -5.406 -5.406 297 2HB LEU 330 1HB LEU 30 -0.465 -4.037 -4.037 298 HG LEU 330 HG LEU 30 -3.440 -3.730 -3.730 299 1HD1 LEU 330 3HD1 LEU 30 -1.897 -4.146 -4.146 300 2HD1 LEU 330 2HD1 LEU 30 -2.907 -2.700 -2.700 301 3HD1 LEU 330 1HD1 LEU 30 -3.634 -4.279 -4.279 302 1HD2 LEU 330 1HD2 LEU 30 -1.089 -1.898 -1.898 303 2HD2 LEU 330 3HD2 LEU 30 -2.289 -1.827 -1.827 304 3HD2 LEU 330 2HD2 LEU 30 -2.735 -1.371 -1.371 305 H GLN 331 H GLN 31 -0.789 -3.501 -3.501 306 HA GLN 331 HA GLN 31 2.089 -3.977 -3.977 307 1HB GLN 331 2HB GLN 31 0.849 -4.118 -4.118 308 2HB GLN 331 1HB GLN 31 0.556 -2.382 -2.382 309 1HG GLN 331 2HG GLN 31 2.906 -1.899 -1.899 310 2HG GLN 331 1HG GLN 31 3.323 -3.604 -3.604 311 1HE2 GLN 331 2HE2 GLN 31 3.445 -3.848 -3.848 312 2HE2 GLN 331 1HE2 GLN 31 4.261 -4.054 -4.054 313 H ILE 332 H ILE 32 3.247 -2.639 -2.639 314 HA ILE 332 HA ILE 32 2.541 0.263 0.263 315 HB ILE 332 HB ILE 32 4.126 -1.336 -1.336 316 1HG1 ILE 332 2HG1 ILE 32 1.524 -0.136 -0.136 317 2HG1 ILE 332 1HG1 ILE 32 1.421 -1.472 -1.472 318 1HG2 ILE 332 3HG2 ILE 32 3.429 1.545 1.545 319 2HG2 ILE 332 2HG2 ILE 32 3.369 0.889 0.889 320 3HG2 ILE 332 1HG2 ILE 32 4.868 0.813 0.813 321 1HD1 ILE 332 3HD1 ILE 32 3.273 -1.915 -1.915 322 2HD1 ILE 332 2HD1 ILE 32 1.571 -1.801 -1.801 323 3HD1 ILE 332 1HD1 ILE 32 2.097 -3.012 -3.012 324 H ARG 333 H ARG 33 4.005 1.623 1.623 325 HA ARG 333 HA ARG 33 6.571 0.492 0.492 326 1HB ARG 333 2HB ARG 33 5.487 3.286 3.286 327 2HB ARG 333 1HB ARG 33 6.738 2.460 2.460 328 1HG ARG 333 2HG ARG 33 5.066 0.765 0.765 329 2HG ARG 333 1HG ARG 33 3.821 1.652 1.652 330 1HD ARG 333 2HD ARG 33 5.488 3.153 3.153 331 2HD ARG 333 1HD ARG 33 4.234 2.077 2.077 332 HE ARG 333 HE ARG 33 2.606 3.401 3.401 333 1HH1 ARG 333 1HH2 ARG 33 4.524 4.930 4.930 334 2HH1 ARG 333 2HH2 ARG 33 4.599 6.459 6.459 335 1HH2 ARG 333 2HH1 ARG 33 3.214 5.262 5.262 336 2HH2 ARG 333 1HH1 ARG 33 3.856 6.646 6.646 337 H GLY 334 H GLY 34 8.093 0.485 0.485 338 1HA GLY 334 2HA GLY 34 9.352 2.836 2.836 339 2HA GLY 334 1HA GLY 34 8.185 2.402 2.402 340 H ARG 335 H ARG 35 8.892 1.000 1.000 341 HA ARG 335 HA ARG 35 10.213 -1.402 -1.402 342 1HB ARG 335 2HB ARG 35 12.104 -0.466 -0.466 343 2HB ARG 335 1HB ARG 35 12.171 0.906 0.906 344 1HG ARG 335 2HG ARG 35 13.051 -0.391 -0.391 345 2HG ARG 335 1HG ARG 35 12.495 -1.903 -1.903 346 1HD ARG 335 2HD ARG 35 14.115 -1.193 -1.193 347 2HD ARG 335 1HD ARG 35 14.889 -0.243 -0.243 348 HE ARG 335 HE ARG 35 14.407 -3.141 -3.141 349 1HH1 ARG 335 1HH2 ARG 35 16.621 -0.941 -0.941 350 2HH1 ARG 335 2HH2 ARG 35 17.988 -1.546 -1.546 351 1HH2 ARG 335 2HH1 ARG 35 16.119 -3.728 -3.728 352 2HH2 ARG 335 1HH1 ARG 35 17.704 -3.125 -3.125 353 H GLU 336 H GLU 36 10.303 1.637 1.637 354 HA GLU 336 HA GLU 36 10.769 0.214 0.214 355 1HB GLU 336 2HB GLU 36 10.567 3.051 3.051 356 2HB GLU 336 1HB GLU 36 10.107 2.706 2.706 357 1HG GLU 336 2HG GLU 36 12.244 1.786 1.786 358 2HG GLU 336 1HG GLU 36 12.689 1.688 1.688 359 H ARG 337 H ARG 37 8.098 2.046 2.046 360 HA ARG 337 HA ARG 37 6.227 1.655 1.655 361 1HB ARG 337 2HB ARG 37 6.197 2.715 2.715 362 2HB ARG 337 1HB ARG 37 4.789 1.682 1.682 363 1HG ARG 337 2HG ARG 37 3.970 2.981 2.981 364 2HG ARG 337 1HG ARG 37 5.555 3.664 3.664 365 1HD ARG 337 2HD ARG 37 3.882 4.272 4.272 366 2HD ARG 337 1HD ARG 37 4.129 5.349 5.349 367 HE ARG 337 HE ARG 37 6.662 4.557 4.557 368 1HH1 ARG 337 1HH2 ARG 37 6.410 7.301 7.301 369 2HH1 ARG 337 2HH2 ARG 37 6.151 8.164 8.164 370 1HH2 ARG 337 2HH1 ARG 37 5.243 5.339 5.339 371 2HH2 ARG 337 1HH1 ARG 37 5.494 7.052 7.052 372 H PHE 338 H PHE 38 7.019 -0.312 -0.312 373 HA PHE 338 HA PHE 38 4.949 -2.275 -2.275 374 1HB PHE 338 2HB PHE 38 6.459 -2.031 -2.031 375 2HB PHE 338 1HB PHE 38 7.770 -2.713 -2.713 376 HD1 PHE 338 HD1 PHE 38 4.547 -3.400 -3.400 377 HD2 PHE 338 HD2 PHE 38 7.761 -5.058 -5.058 378 HE1 PHE 338 HE1 PHE 38 3.735 -5.686 -5.686 379 HE2 PHE 338 HE2 PHE 38 6.949 -7.346 -7.346 380 HZ PHE 338 HZ PHE 38 4.936 -7.659 -7.659 381 H GLU 339 H GLU 39 8.028 -1.799 -1.799 382 HA GLU 339 HA GLU 39 8.101 -4.430 -4.430 383 1HB GLU 339 2HB GLU 39 9.538 -1.827 -1.827 384 2HB GLU 339 1HB GLU 39 9.665 -3.104 -3.104 385 1HG GLU 339 2HG GLU 39 10.209 -3.551 -3.551 386 2HG GLU 339 1HG GLU 39 11.469 -3.149 -3.149 387 H MET 340 H MET 40 7.070 -1.199 -1.199 388 HA MET 340 HA MET 40 6.314 -1.888 -1.888 389 1HB MET 340 2HB MET 40 4.926 0.050 0.050 390 2HB MET 340 1HB MET 40 4.766 0.028 0.028 391 1HG MET 340 2HG MET 40 7.323 0.286 0.286 392 2HG MET 340 1HG MET 40 7.210 0.700 0.700 393 1HE MET 340 2HE MET 40 5.010 2.312 2.312 394 2HE MET 340 1HE MET 40 4.015 1.751 1.751 395 3HE MET 340 3HE MET 40 4.306 3.481 3.481 396 H PHE 341 H PHE 41 4.388 -2.019 -2.019 397 HA PHE 341 HA PHE 41 2.025 -3.088 -3.088 398 1HB PHE 341 2HB PHE 41 3.099 -3.143 -3.143 399 2HB PHE 341 1HB PHE 41 1.573 -3.913 -3.913 400 HD1 PHE 341 HD1 PHE 41 2.516 -0.989 -0.989 401 HD2 PHE 341 HD2 PHE 41 0.468 -2.306 -2.306 402 HE1 PHE 341 HE1 PHE 41 1.375 1.197 1.197 403 HE2 PHE 341 HE2 PHE 41 -0.678 -0.113 -0.113 404 HZ PHE 341 HZ PHE 41 -0.223 1.639 1.639 405 H ARG 342 H ARG 42 4.884 -4.599 -4.599 406 HA ARG 342 HA ARG 42 4.018 -7.252 -7.252 407 1HB ARG 342 2HB ARG 42 6.609 -5.881 -5.881 408 2HB ARG 342 1HB ARG 42 6.627 -7.489 -7.489 409 1HG ARG 342 2HG ARG 42 5.302 -8.113 -8.113 410 2HG ARG 342 1HG ARG 42 6.160 -6.700 -6.700 411 1HD ARG 342 2HD ARG 42 7.942 -8.046 -8.046 412 2HD ARG 342 1HD ARG 42 8.094 -8.108 -8.108 413 HE ARG 342 HE ARG 42 6.266 -10.056 -10.056 414 1HH1 ARG 342 1HH2 ARG 42 9.564 -9.722 -9.722 415 2HH1 ARG 342 2HH2 ARG 42 9.789 -11.163 -11.163 416 1HH2 ARG 342 2HH1 ARG 42 6.397 -11.747 -11.747 417 2HH2 ARG 342 1HH1 ARG 42 7.997 -12.308 -12.308 418 H GLU 343 H GLU 43 5.133 -5.351 -5.351 419 HA GLU 343 HA GLU 43 5.119 -7.590 -7.590 420 1HB GLU 343 2HB GLU 43 6.500 -5.526 -5.526 421 2HB GLU 343 1HB GLU 43 5.012 -4.619 -4.619 422 1HG GLU 343 2HG GLU 43 5.101 -5.224 -5.224 423 2HG GLU 343 1HG GLU 43 4.857 -6.897 -6.897 424 H LEU 344 H LEU 44 2.961 -4.761 -4.761 425 HA LEU 344 HA LEU 44 1.036 -5.354 -5.354 426 1HB LEU 344 2HB LEU 44 0.875 -4.116 -4.116 427 2HB LEU 344 1HB LEU 44 -0.617 -4.479 -4.479 428 HG LEU 344 HG LEU 44 -0.205 -2.284 -2.284 429 1HD1 LEU 344 3HD1 LEU 44 -0.171 -4.094 -4.094 430 2HD1 LEU 344 2HD1 LEU 44 1.476 -3.501 -3.501 431 3HD1 LEU 344 1HD1 LEU 44 0.114 -2.390 -2.390 432 1HD2 LEU 344 3HD2 LEU 44 2.246 -2.612 -2.612 433 2HD2 LEU 344 2HD2 LEU 44 1.840 -1.250 -1.250 434 3HD2 LEU 344 1HD2 LEU 44 2.668 -2.657 -2.657 435 H ASN 345 H ASN 45 0.806 -6.415 -6.415 436 HA ASN 345 HA ASN 45 -1.337 -8.236 -8.236 437 1HB ASN 345 2HB ASN 45 -1.046 -8.949 -8.949 438 2HB ASN 345 1HB ASN 45 -0.466 -7.288 -7.288 439 1HD2 ASN 345 2HD2 ASN 45 2.598 -8.345 -8.345 440 2HD2 ASN 345 1HD2 ASN 45 1.342 -7.203 -7.203 441 H GLU 346 H GLU 46 2.081 -8.508 -8.508 442 HA GLU 346 HA GLU 46 2.336 -11.353 -11.353 443 1HB GLU 346 2HB GLU 46 4.288 -9.854 -9.854 444 2HB GLU 346 1HB GLU 46 3.800 -9.367 -9.367 445 1HG GLU 346 2HG GLU 46 4.362 -11.415 -11.415 446 2HG GLU 346 1HG GLU 46 4.113 -12.288 -12.288 447 H ALA 347 H ALA 47 1.545 -9.167 -9.167 448 HA ALA 347 HA ALA 47 1.190 -11.328 -11.328 449 1HB ALA 347 3HB ALA 47 1.648 -8.975 -8.975 450 2HB ALA 347 2HB ALA 47 0.047 -8.520 -8.520 451 3HB ALA 347 1HB ALA 47 0.208 -9.629 -9.629 452 H LEU 348 H LEU 48 -1.130 -9.332 -9.332 453 HA LEU 348 HA LEU 48 -3.536 -10.405 -10.405 454 1HB LEU 348 2HB LEU 48 -2.817 -9.816 -9.816 455 2HB LEU 348 1HB LEU 48 -4.452 -9.933 -9.933 456 HG LEU 348 HG LEU 48 -2.400 -7.980 -7.980 457 1HD1 LEU 348 1HD1 LEU 48 -3.606 -7.914 -7.914 458 2HD1 LEU 348 3HD1 LEU 48 -4.569 -6.817 -6.817 459 3HD1 LEU 348 2HD1 LEU 48 -2.832 -6.564 -6.564 460 1HD2 LEU 348 1HD2 LEU 48 -4.748 -8.851 -8.851 461 2HD2 LEU 348 3HD2 LEU 48 -4.066 -7.250 -7.250 462 3HD2 LEU 348 2HD2 LEU 48 -5.312 -7.472 -7.472 463 H GLU 349 H GLU 49 -1.512 -11.735 -11.735 464 HA GLU 349 HA GLU 49 -3.082 -14.074 -14.074 465 1HB GLU 349 2HB GLU 49 -0.392 -13.129 -13.129 466 2HB GLU 349 1HB GLU 49 -0.490 -14.880 -14.880 467 1HG GLU 349 2HG GLU 49 -2.811 -13.926 -13.926 468 2HG GLU 349 1HG GLU 49 -1.346 -13.348 -13.348 469 H LEU 350 H LEU 50 -0.497 -13.334 -13.334 470 HA LEU 350 HA LEU 50 -0.105 -15.967 -15.967 471 1HB LEU 350 2HB LEU 50 1.369 -14.904 -14.904 472 2HB LEU 350 1HB LEU 50 0.873 -13.403 -13.403 473 HG LEU 350 HG LEU 50 -1.027 -13.335 -13.335 474 1HD1 LEU 350 1HD1 LEU 50 0.231 -15.834 -15.834 475 2HD1 LEU 350 3HD1 LEU 50 0.376 -14.734 -14.734 476 3HD1 LEU 350 2HD1 LEU 50 -1.213 -15.112 -15.112 477 1HD2 LEU 350 2HD2 LEU 50 1.883 -13.105 -13.105 478 2HD2 LEU 350 1HD2 LEU 50 0.867 -11.825 -11.825 479 3HD2 LEU 350 3HD2 LEU 50 0.537 -12.469 -12.469 480 H LYS 351 H LYS 51 -2.589 -13.564 -13.564 481 HA LYS 351 HA LYS 51 -3.774 -14.723 -14.723 482 1HB LYS 351 2HB LYS 51 -4.286 -12.447 -12.447 483 2HB LYS 351 1HB LYS 51 -5.311 -13.344 -13.344 484 1HG LYS 351 2HG LYS 51 -6.804 -13.995 -13.995 485 2HG LYS 351 1HG LYS 51 -5.617 -13.761 -13.761 486 1HD LYS 351 2HD LYS 51 -5.695 -11.249 -11.249 487 2HD LYS 351 1HD LYS 51 -7.253 -11.706 -11.706 488 1HE LYS 351 2HE LYS 51 -8.220 -12.063 -12.063 489 2HE LYS 351 1HE LYS 51 -6.702 -12.572 -12.572 490 1HZ LYS 351 1HZ LYS 51 -7.233 -9.779 -9.779 491 2HZ LYS 351 3HZ LYS 51 -7.568 -10.352 -10.352 492 3HZ LYS 351 2HZ LYS 51 -5.971 -10.350 -10.350 493 H ASP 352 H ASP 52 -4.368 -15.230 -15.230 494 HA ASP 352 HA ASP 52 -6.425 -17.225 -17.225 495 1HB ASP 352 2HB ASP 52 -5.632 -15.760 -15.760 496 2HB ASP 352 1HB ASP 52 -4.869 -17.307 -17.307 497 H ALA 353 H ALA 53 -3.019 -17.263 -17.263 498 HA ALA 353 HA ALA 53 -2.909 -20.209 -20.209 499 1HB ALA 353 2HB ALA 53 -1.003 -17.998 -17.998 500 2HB ALA 353 1HB ALA 53 -0.339 -19.374 -19.374 501 3HB ALA 353 3HB ALA 53 -0.982 -19.596 -19.596 502 H GLN 354 H GLN 54 -3.428 -18.055 -18.055 503 HA GLN 354 HA GLN 54 -1.807 -18.880 -18.880 504 1HB GLN 354 2HB GLN 54 -4.658 -17.955 -17.955 505 2HB GLN 354 1HB GLN 54 -4.024 -18.514 -18.514 506 1HG GLN 354 2HG GLN 54 -1.995 -16.910 -16.910 507 2HG GLN 354 1HG GLN 54 -3.287 -16.102 -16.102 508 1HE2 GLN 354 2HE2 GLN 54 -3.041 -15.612 -15.612 509 2HE2 GLN 354 1HE2 GLN 54 -1.826 -16.370 -16.370 510 H ALA 355 HN ALA 55 -1.319 -21.030 -21.030 511 HA ALA 355 HA ALA 55 -3.489 -22.801 -22.801 512 1HB ALA 355 1HB ALA 55 -3.012 -22.896 -22.896 513 2HB ALA 355 3HB ALA 55 -1.773 -24.021 -24.021 514 3HB ALA 355 2HB ALA 55 -3.468 -24.320 -24.320 515 1H GLY 325 3H GLY 25 8.770 -2.072 -2.072 516 2H GLY 325 2H GLY 25 9.400 -2.339 -2.339 517 3H GLY 325 1H GLY 25 9.915 -3.298 -3.298 518 1HA GLY 325 2HA GLY 25 11.519 -1.883 -1.883 519 2HA GLY 325 1HA GLY 25 11.082 -0.970 -0.970 520 H GLU 326 H GLU 26 9.158 0.547 0.547 521 HA GLU 326 HA GLU 26 8.965 1.553 1.553 522 1HB GLU 326 2HB GLU 26 9.999 2.974 2.974 523 2HB GLU 326 1HB GLU 26 8.931 3.893 3.893 524 1HG GLU 326 2HG GLU 26 10.352 3.473 3.473 525 2HG GLU 326 1HG GLU 26 11.344 2.347 2.347 526 H TYR 327 H TYR 27 7.271 3.642 3.642 527 HA TYR 327 HA TYR 27 4.909 2.397 2.397 528 1HB TYR 327 2HB TYR 27 5.056 4.215 4.215 529 2HB TYR 327 1HB TYR 27 3.552 3.737 3.737 530 HD1 TYR 327 HD1 TYR 27 4.684 0.863 0.863 531 HD2 TYR 327 HD2 TYR 27 4.434 3.164 3.164 532 HE1 TYR 327 HE1 TYR 27 4.654 -1.227 -1.227 533 HE2 TYR 327 HE2 TYR 27 4.403 1.069 1.069 534 HH TYR 327 HH TYR 27 3.592 -1.658 -1.658 535 H PHE 328 H PHE 28 4.090 3.527 3.527 536 HA PHE 328 HA PHE 28 4.736 6.447 6.447 537 1HB PHE 328 2HB PHE 28 4.419 4.505 4.505 538 2HB PHE 328 1HB PHE 28 4.843 6.212 6.212 539 HD1 PHE 328 HD1 PHE 28 7.042 7.026 7.026 540 HD2 PHE 328 HD2 PHE 28 6.037 2.850 2.850 541 HE1 PHE 328 HE1 PHE 28 9.439 6.450 6.450 542 HE2 PHE 328 HE2 PHE 28 8.431 2.276 2.276 543 HZ PHE 328 HZ PHE 28 10.133 4.075 4.075 544 H THR 329 H THR 29 2.991 7.790 7.790 545 HA THR 329 HA THR 29 0.337 6.443 6.443 546 HB THR 329 HB THR 29 0.279 9.339 9.339 547 HG1 THR 329 HG1 THR 29 1.435 9.500 9.500 548 1HG2 THR 329 1HG2 THR 29 -1.427 7.407 7.407 549 2HG2 THR 329 3HG2 THR 29 -0.549 7.317 7.317 550 3HG2 THR 329 2HG2 THR 29 -1.346 8.818 8.818 551 H LEU 330 H LEU 30 -0.918 6.662 6.662 552 HA LEU 330 HA LEU 30 0.077 8.524 8.524 553 1HB LEU 330 2HB LEU 30 -0.487 5.702 5.702 554 2HB LEU 330 1HB LEU 30 -1.600 6.544 6.544 555 HG LEU 330 HG LEU 30 1.370 7.104 7.104 556 1HD1 LEU 330 3HD1 LEU 30 -0.125 4.806 4.806 557 2HD1 LEU 330 2HD1 LEU 30 0.888 5.634 5.634 558 3HD1 LEU 330 1HD1 LEU 30 1.604 4.986 4.986 559 1HD2 LEU 330 1HD2 LEU 30 -0.987 7.713 7.713 560 2HD2 LEU 330 3HD2 LEU 30 0.213 8.825 8.825 561 3HD2 LEU 330 2HD2 LEU 30 0.653 7.723 7.723 562 H GLN 331 H GLN 31 -1.280 10.251 10.251 563 HA GLN 331 HA GLN 31 -4.165 9.814 9.814 564 1HB GLN 331 2HB GLN 31 -2.928 11.505 11.505 565 2HB GLN 331 1HB GLN 31 -2.598 12.407 12.407 566 1HG GLN 331 2HG GLN 31 -4.945 12.804 12.804 567 2HG GLN 331 1HG GLN 31 -5.392 11.703 11.703 568 1HE2 GLN 331 2HE2 GLN 31 -5.504 14.489 14.489 569 2HE2 GLN 331 1HE2 GLN 31 -6.327 13.157 13.157 570 H ILE 332 H ILE 32 -5.326 9.485 9.485 571 HA ILE 332 HA ILE 32 -4.598 11.073 11.073 572 HB ILE 332 HB ILE 32 -6.199 8.501 8.501 573 1HG1 ILE 332 2HG1 ILE 32 -3.594 8.548 8.548 574 2HG1 ILE 332 1HG1 ILE 32 -3.493 8.759 8.759 575 1HG2 ILE 332 3HG2 ILE 32 -5.484 10.387 10.387 576 2HG2 ILE 332 2HG2 ILE 32 -5.432 8.664 8.664 577 3HG2 ILE 332 1HG2 ILE 32 -6.930 9.399 9.399 578 1HD1 ILE 332 3HD1 ILE 32 -5.358 6.645 6.645 579 2HD1 ILE 332 2HD1 ILE 32 -3.655 6.327 6.327 580 3HD1 ILE 332 1HD1 ILE 32 -4.187 6.630 6.630 581 H ARG 333 H ARG 33 -6.052 12.611 12.611 582 HA ARG 333 HA ARG 33 -8.621 12.767 12.767 583 1HB ARG 333 2HB ARG 33 -7.523 14.690 14.690 584 2HB ARG 333 1HB ARG 33 -8.787 15.002 15.002 585 1HG ARG 333 2HG ARG 33 -7.137 14.650 14.650 586 2HG ARG 333 1HG ARG 33 -5.878 14.404 14.404 587 1HD ARG 333 2HD ARG 33 -7.531 16.890 16.890 588 2HD ARG 333 1HD ARG 33 -6.283 16.801 16.801 589 HE ARG 333 HE ARG 33 -4.647 16.378 16.378 590 1HH1 ARG 333 1HH2 ARG 33 -6.558 15.850 15.850 591 2HH1 ARG 333 2HH2 ARG 33 -6.624 17.375 17.375 592 1HH2 ARG 333 2HH1 ARG 33 -5.240 19.149 19.149 593 2HH2 ARG 333 1HH1 ARG 33 -5.875 19.243 19.243 594 H GLY 334 H GLY 34 -10.164 11.452 11.452 595 1HA GLY 334 2HA GLY 34 -11.421 12.015 12.015 596 2HA GLY 334 1HA GLY 34 -10.258 10.733 10.733 597 H ARG 335 H ARG 35 -10.983 8.693 8.693 598 HA ARG 335 HA ARG 35 -12.310 7.584 7.584 599 1HB ARG 335 2HB ARG 35 -14.196 9.025 9.025 600 2HB ARG 335 1HB ARG 35 -14.246 8.877 8.877 601 1HG ARG 335 2HG ARG 35 -15.143 6.709 6.709 602 2HG ARG 335 1HG ARG 35 -14.590 6.441 6.441 603 1HD ARG 335 2HD ARG 35 -16.200 8.482 8.482 604 2HD ARG 335 1HD ARG 35 -16.976 7.962 7.962 605 HE ARG 335 HE ARG 35 -16.500 5.944 5.944 606 1HH1 ARG 335 1HH2 ARG 35 -18.702 8.280 8.280 607 2HH1 ARG 335 2HH2 ARG 35 -20.075 7.225 7.225 608 1HH2 ARG 335 2HH1 ARG 35 -18.222 4.388 4.388 609 2HH2 ARG 335 1HH1 ARG 35 -19.804 5.022 5.022 610 H GLU 336 H GLU 36 -12.395 7.749 7.749 611 HA GLU 336 HA GLU 36 -12.865 4.859 4.859 612 1HB GLU 336 2HB GLU 36 -12.642 7.168 7.168 613 2HB GLU 336 1HB GLU 36 -12.183 5.591 5.591 614 1HG GLU 336 2HG GLU 36 -14.326 4.661 4.661 615 2HG GLU 336 1HG GLU 36 -14.775 6.023 6.023 616 H ARG 337 H ARG 37 -10.187 7.126 7.126 617 HA ARG 337 HA ARG 37 -8.317 5.139 5.139 618 1HB ARG 337 2HB ARG 37 -8.282 7.958 7.958 619 2HB ARG 337 1HB ARG 37 -6.884 7.183 7.183 620 1HG ARG 337 2HG ARG 37 -6.045 6.424 6.424 621 2HG ARG 337 1HG ARG 37 -7.621 6.506 6.506 622 1HD ARG 337 2HD ARG 37 -5.934 8.877 8.877 623 2HD ARG 337 1HD ARG 37 -6.187 8.331 8.331 624 HE ARG 337 HE ARG 37 -8.716 8.849 8.849 625 1HH1 ARG 337 1HH2 ARG 37 -8.442 9.713 9.713 626 2HH1 ARG 337 2HH2 ARG 37 -8.177 11.421 11.421 627 1HH2 ARG 337 2HH1 ARG 37 -7.284 11.333 11.333 628 2HH2 ARG 337 1HH1 ARG 37 -7.517 12.337 12.337 629 H PHE 338 H PHE 38 -9.132 6.418 6.418 630 HA PHE 338 HA PHE 38 -7.060 5.091 5.091 631 1HB PHE 338 2HB PHE 38 -8.558 6.875 6.875 632 2HB PHE 338 1HB PHE 38 -9.873 5.700 5.700 633 HD1 PHE 338 HD1 PHE 38 -6.647 6.664 6.664 634 HD2 PHE 338 HD2 PHE 38 -9.869 3.825 3.825 635 HE1 PHE 338 HE1 PHE 38 -5.838 5.807 5.807 636 HE2 PHE 338 HE2 PHE 38 -9.059 2.966 2.966 637 HZ PHE 338 HZ PHE 38 -7.044 3.958 3.958 638 H GLU 339 H GLU 39 -10.144 3.991 3.991 639 HA GLU 339 HA GLU 39 -10.216 1.513 1.513 640 1HB GLU 339 2HB GLU 39 -11.638 2.593 2.593 641 2HB GLU 339 1HB GLU 39 -11.771 0.878 0.878 642 1HG GLU 339 2HG GLU 39 -12.318 3.082 3.082 643 2HG GLU 339 1HG GLU 39 -13.576 2.338 2.338 644 H MET 340 H MET 40 -9.154 2.395 2.395 645 HA MET 340 HA MET 40 -8.411 -0.180 -0.180 646 1HB MET 340 2HB MET 40 -7.012 2.454 2.454 647 2HB MET 340 1HB MET 40 -6.853 0.980 0.980 648 1HG MET 340 2HG MET 40 -9.407 1.072 1.072 649 2HG MET 340 1HG MET 40 -9.295 2.723 2.723 650 1HE MET 340 2HE MET 40 -7.076 4.189 4.189 651 2HE MET 340 1HE MET 40 -6.091 2.755 2.755 652 3HE MET 340 3HE MET 40 -6.367 3.907 3.907 653 H PHE 341 H PHE 41 -6.515 2.216 2.216 654 HA PHE 341 HA PHE 41 -4.146 0.599 0.599 655 1HB PHE 341 2HB PHE 41 -5.201 2.921 2.921 656 2HB PHE 341 1HB PHE 41 -3.681 2.125 2.125 657 HD1 PHE 341 HD1 PHE 41 -4.615 2.140 2.140 658 HD2 PHE 341 HD2 PHE 41 -2.568 4.347 4.347 659 HE1 PHE 341 HE1 PHE 41 -3.460 3.475 3.475 660 HE2 PHE 341 HE2 PHE 41 -1.408 5.681 5.681 661 HZ PHE 341 HZ PHE 41 -1.855 5.245 5.245 662 H ARG 342 H ARG 42 -7.003 0.952 0.952 663 HA ARG 342 HA ARG 42 -6.166 -0.495 -0.495 664 1HB ARG 342 2HB ARG 42 -8.738 0.153 0.153 665 2HB ARG 342 1HB ARG 42 -8.772 -1.330 -1.330 666 1HG ARG 342 2HG ARG 42 -7.439 0.198 0.198 667 2HG ARG 342 1HG ARG 42 -8.291 1.484 1.484 668 1HD ARG 342 2HD ARG 42 -10.066 1.021 1.021 669 2HD ARG 342 1HD ARG 42 -10.242 -0.471 -0.471 670 HE ARG 342 HE ARG 42 -8.404 -0.496 -0.496 671 1HH1 ARG 342 1HH2 ARG 42 -11.701 -0.620 -0.620 672 2HH1 ARG 342 2HH2 ARG 42 -11.934 -2.196 -2.196 673 1HH2 ARG 342 2HH1 ARG 42 -8.543 -2.871 -2.871 674 2HH2 ARG 342 1HH1 ARG 42 -10.147 -3.472 -3.472 675 H GLU 343 H GLU 43 -7.243 -1.679 -1.679 676 HA GLU 343 HA GLU 43 -7.247 -4.475 -4.475 677 1HB GLU 343 2HB GLU 43 -8.605 -3.573 -3.573 678 2HB GLU 343 1HB GLU 43 -7.102 -3.323 -3.323 679 1HG GLU 343 2HG GLU 43 -7.221 -5.458 -5.458 680 2HG GLU 343 1HG GLU 43 -6.989 -5.969 -5.969 681 H LEU 344 H LEU 44 -5.086 -2.517 -2.517 682 HA LEU 344 HA LEU 44 -3.152 -4.430 -4.430 683 1HB LEU 344 2HB LEU 44 -3.023 -1.470 -1.470 684 2HB LEU 344 1HB LEU 44 -1.510 -2.356 -2.356 685 HG LEU 344 HG LEU 44 -1.865 -1.746 -1.746 686 1HD1 LEU 344 3HD1 LEU 44 -1.932 -4.350 -4.350 687 2HD1 LEU 344 2HD1 LEU 44 -3.573 -4.193 -4.193 688 3HD1 LEU 344 1HD1 LEU 44 -2.202 -3.708 -3.708 689 1HD2 LEU 344 3HD2 LEU 44 -4.356 -1.063 -1.063 690 2HD2 LEU 344 2HD2 LEU 44 -3.868 -1.129 -1.129 691 3HD2 LEU 344 1HD2 LEU 44 -4.730 -2.489 -2.489 692 H ASN 345 H ASN 45 -2.914 -2.190 -2.190 693 HA ASN 345 HA ASN 45 -0.785 -3.640 -3.640 694 1HB ASN 345 2HB ASN 45 -1.067 -2.219 -2.219 695 2HB ASN 345 1HB ASN 45 -1.608 -1.245 -1.245 696 1HD2 ASN 345 2HD2 ASN 45 -4.699 -0.690 -0.690 697 2HD2 ASN 345 1HD2 ASN 45 -3.427 -0.083 -0.083 698 H GLU 346 H GLU 46 -4.209 -4.219 -4.219 699 HA GLU 346 HA GLU 46 -4.462 -5.737 -5.737 700 1HB GLU 346 2HB GLU 46 -6.414 -5.008 -5.008 701 2HB GLU 346 1HB GLU 46 -5.932 -6.083 -6.083 702 1HG GLU 346 2HG GLU 46 -6.499 -8.002 -8.002 703 2HG GLU 346 1HG GLU 46 -6.261 -7.235 -7.235 704 H ALA 347 H ALA 47 -3.679 -6.765 -6.765 705 HA ALA 347 HA ALA 47 -3.341 -9.539 -9.539 706 1HB ALA 347 3HB ALA 47 -3.812 -8.778 -8.778 707 2HB ALA 347 2HB ALA 47 -2.207 -8.050 -8.050 708 3HB ALA 347 1HB ALA 47 -2.376 -9.800 -9.800 709 H LEU 348 H LEU 48 -1.015 -6.880 -6.880 710 HA LEU 348 HA LEU 48 1.387 -8.252 -8.252 711 1HB LEU 348 2HB LEU 48 0.682 -5.521 -5.521 712 2HB LEU 348 1HB LEU 48 2.314 -6.137 -6.137 713 HG LEU 348 HG LEU 48 0.266 -5.917 -5.917 714 1HD1 LEU 348 1HD1 LEU 48 1.471 -3.782 -3.782 715 2HD1 LEU 348 3HD1 LEU 48 2.447 -3.998 -3.998 716 3HD1 LEU 348 2HD1 LEU 48 0.712 -3.719 -3.719 717 1HD2 LEU 348 1HD2 LEU 48 2.606 -7.325 -7.325 718 2HD2 LEU 348 3HD2 LEU 48 1.928 -6.667 -6.667 719 3HD2 LEU 348 2HD2 LEU 48 3.179 -5.777 -5.777 720 H GLU 349 H GLU 49 -0.630 -6.785 -6.785 721 HA GLU 349 HA GLU 49 0.917 -7.745 -7.745 722 1HB GLU 349 2HB GLU 49 -1.764 -6.609 -6.609 723 2HB GLU 349 1HB GLU 49 -1.680 -7.743 -7.743 724 1HG GLU 349 2HG GLU 49 0.651 -6.043 -6.043 725 2HG GLU 349 1HG GLU 49 -0.808 -5.053 -5.053 726 H LEU 350 H LEU 50 -1.666 -9.237 -9.237 727 HA LEU 350 HA LEU 50 -2.077 -11.530 -11.530 728 1HB LEU 350 2HB LEU 50 -3.551 -12.054 -12.054 729 2HB LEU 350 1HB LEU 50 -3.040 -10.585 -10.585 730 HG LEU 350 HG LEU 50 -1.147 -12.002 -12.002 731 1HD1 LEU 350 1HD1 LEU 50 -2.419 -13.931 -13.931 732 2HD1 LEU 350 3HD1 LEU 50 -2.560 -14.466 -14.466 733 3HD1 LEU 350 2HD1 LEU 50 -0.972 -14.124 -14.124 734 1HD2 LEU 350 2HD2 LEU 50 -4.061 -12.531 -12.531 735 2HD2 LEU 350 1HD2 LEU 50 -3.019 -11.297 -11.297 736 3HD2 LEU 350 3HD2 LEU 50 -2.721 -13.001 -13.001 737 H LYS 351 H LYS 51 0.420 -10.691 -10.691 738 HA LYS 351 HA LYS 51 1.588 -13.281 -13.281 739 1HB LYS 351 2HB LYS 51 2.111 -11.123 -11.123 740 2HB LYS 351 1HB LYS 51 3.132 -10.679 -10.679 741 1HG LYS 351 2HG LYS 51 4.628 -12.438 -12.438 742 2HG LYS 351 1HG LYS 51 3.446 -13.379 -13.379 743 1HD LYS 351 2HD LYS 51 3.531 -11.346 -11.346 744 2HD LYS 351 1HD LYS 51 5.086 -11.028 -11.028 745 1HE LYS 351 2HE LYS 51 6.053 -12.938 -12.938 746 2HE LYS 351 1HE LYS 51 4.534 -13.835 -13.835 747 1HZ LYS 351 1HZ LYS 51 5.080 -11.585 -11.585 748 2HZ LYS 351 3HZ LYS 51 5.408 -13.202 -13.202 749 3HZ LYS 351 2HZ LYS 51 3.812 -12.714 -12.714 750 H ASP 352 H ASP 52 2.187 -10.680 -10.680 751 HA ASP 352 HA ASP 52 4.240 -12.149 -12.149 752 1HB ASP 352 2HB ASP 52 3.453 -9.543 -9.543 753 2HB ASP 352 1HB ASP 52 2.683 -10.096 -10.096 754 H ALA 353 H ALA 53 0.836 -12.367 -12.367 755 HA ALA 353 HA ALA 53 0.708 -13.636 -13.636 756 1HB ALA 353 2HB ALA 53 -1.182 -12.172 -12.172 757 2HB ALA 353 1HB ALA 53 -1.857 -13.666 -13.666 758 3HB ALA 353 3HB ALA 53 -1.214 -12.439 -12.439 759 H GLN 354 H GLN 54 1.246 -14.511 -14.511 760 HA GLN 354 HA GLN 54 -0.389 -16.731 -16.731 761 1HB GLN 354 2HB GLN 54 2.465 -16.086 -16.086 762 2HB GLN 354 1HB GLN 54 1.822 -17.682 -17.682 763 1HG GLN 354 2HG GLN 54 -0.200 -16.199 -16.199 764 2HG GLN 354 1HG GLN 54 1.096 -15.019 -15.019 765 1HE2 GLN 354 2HE2 GLN 54 0.844 -18.054 -18.054 766 2HE2 GLN 354 1HE2 GLN 54 -0.371 -17.719 -17.719 767 H ALA 355 HN ALA 55 -0.885 -18.164 -18.164 768 HA ALA 355 HA ALA 55 1.274 -19.891 -19.891 769 1HB ALA 355 1HB ALA 55 0.800 -17.739 -17.739 770 2HB ALA 355 3HB ALA 55 -0.449 -18.818 -18.818 771 3HB ALA 355 2HB ALA 55 1.244 -19.310 -19.310 772 1H GLY 325 3H GLY 25 -12.618 14.338 14.338 773 2H GLY 325 2H GLY 25 -13.049 13.158 13.158 774 3H GLY 325 1H GLY 25 -13.643 14.743 14.743 775 1HA GLY 325 2HA GLY 25 -15.385 14.288 14.288 776 2HA GLY 325 1HA GLY 25 -14.852 12.607 12.607 777 H GLU 326 H GLU 26 -13.062 12.126 12.126 778 HA GLU 326 HA GLU 26 -13.271 13.890 13.890 779 1HB GLU 326 2HB GLU 26 -14.094 11.042 11.042 780 2HB GLU 326 1HB GLU 26 -13.220 11.474 11.474 781 1HG GLU 326 2HG GLU 26 -14.833 13.194 13.194 782 2HG GLU 326 1HG GLU 26 -15.636 12.988 12.988 783 H TYR 327 H TYR 27 -11.684 12.553 12.553 784 HA TYR 327 HA TYR 27 -9.104 12.284 12.284 785 1HB TYR 327 2HB TYR 27 -9.653 13.271 13.271 786 2HB TYR 327 1HB TYR 27 -8.039 12.981 12.981 787 HD1 TYR 327 HD1 TYR 27 -8.889 13.918 13.918 788 HD2 TYR 327 HD2 TYR 27 -9.218 15.651 15.651 789 HE1 TYR 327 HE1 TYR 27 -8.883 16.184 16.184 790 HE2 TYR 327 HE2 TYR 27 -9.213 17.917 17.917 791 HH TYR 327 HH TYR 27 -8.131 18.747 18.747 792 H PHE 328 H PHE 28 -8.159 10.309 10.309 793 HA PHE 328 HA PHE 28 -8.963 8.500 8.500 794 1HB PHE 328 2HB PHE 28 -8.248 7.696 7.696 795 2HB PHE 328 1HB PHE 28 -8.756 6.612 6.612 796 HD1 PHE 328 HD1 PHE 28 -11.088 6.671 6.671 797 HD2 PHE 328 HD2 PHE 28 -9.825 9.079 9.079 798 HE1 PHE 328 HE1 PHE 28 -13.458 7.070 7.070 799 HE2 PHE 328 HE2 PHE 28 -12.194 9.479 9.479 800 HZ PHE 328 HZ PHE 28 -14.011 8.475 8.475 801 H THR 329 H THR 29 -7.259 7.489 7.489 802 HA THR 329 HA THR 29 -4.529 8.282 8.282 803 HB THR 329 HB THR 29 -4.684 6.945 6.945 804 HG1 THR 329 HG1 THR 29 -6.055 8.265 8.265 805 1HG2 THR 329 1HG2 THR 29 -2.937 8.564 8.564 806 2HG2 THR 329 3HG2 THR 29 -3.980 9.826 9.826 807 3HG2 THR 329 2HG2 THR 29 -3.228 8.652 8.652 808 H LEU 330 H LEU 30 -3.074 6.742 6.742 809 HA LEU 330 HA LEU 30 -3.929 3.884 3.884 810 1HB LEU 330 2HB LEU 30 -3.190 5.433 5.433 811 2HB LEU 330 1HB LEU 30 -2.007 4.147 4.147 812 HG LEU 330 HG LEU 30 -4.982 3.627 3.627 813 1HD1 LEU 330 3HD1 LEU 30 -3.227 4.119 4.119 814 2HD1 LEU 330 2HD1 LEU 30 -4.131 2.606 2.606 815 3HD1 LEU 330 1HD1 LEU 30 -4.988 4.136 4.136 816 1HD2 LEU 330 1HD2 LEU 30 -2.465 1.975 1.975 817 2HD2 LEU 330 3HD2 LEU 30 -3.802 1.817 1.817 818 3HD2 LEU 330 2HD2 LEU 30 -4.012 1.323 1.323 819 H GLN 331 H GLN 31 -2.767 3.573 3.573 820 HA GLN 331 HA GLN 31 0.082 4.247 4.247 821 1HB GLN 331 2HB GLN 31 -1.404 4.339 4.339 822 2HB GLN 331 1HB GLN 31 -1.615 2.593 2.593 823 1HG GLN 331 2HG GLN 31 0.729 2.209 2.209 824 2HG GLN 331 1HG GLN 31 1.088 3.930 3.930 825 1HE2 GLN 331 2HE2 GLN 31 0.768 4.174 4.174 826 2HE2 GLN 331 1HE2 GLN 31 1.744 4.426 4.426 827 H ILE 332 H ILE 32 1.474 2.986 2.986 828 HA ILE 332 HA ILE 32 0.946 0.046 0.046 829 HB ILE 332 HB ILE 32 2.669 1.735 1.735 830 1HG1 ILE 332 2HG1 ILE 32 0.253 0.380 0.380 831 2HG1 ILE 332 1HG1 ILE 32 -0.070 1.707 1.707 832 1HG2 ILE 332 3HG2 ILE 32 2.105 -1.181 -1.181 833 2HG2 ILE 332 2HG2 ILE 32 2.207 -0.530 -0.530 834 3HG2 ILE 332 1HG2 ILE 32 3.575 -0.367 -0.367 835 1HD1 ILE 332 3HD1 ILE 32 2.013 2.264 2.264 836 2HD1 ILE 332 2HD1 ILE 32 0.387 2.048 2.048 837 3HD1 ILE 332 1HD1 ILE 32 0.695 3.287 3.287 838 H ARG 333 H ARG 33 2.361 -1.230 -1.230 839 HA ARG 333 HA ARG 33 4.726 0.044 0.044 840 1HB ARG 333 2HB ARG 33 3.763 -2.810 -2.810 841 2HB ARG 333 1HB ARG 33 4.852 -1.918 -1.918 842 1HG ARG 333 2HG ARG 33 3.019 -0.323 -0.323 843 2HG ARG 333 1HG ARG 33 1.933 -1.270 -1.270 844 1HD ARG 333 2HD ARG 33 3.437 -2.688 -2.688 845 2HD ARG 333 1HD ARG 33 2.058 -1.691 -1.691 846 HE ARG 333 HE ARG 33 0.688 -3.104 -3.104 847 1HH1 ARG 333 1HH2 ARG 33 2.881 -4.514 -4.514 848 2HH1 ARG 333 2HH2 ARG 33 2.948 -6.037 -6.037 849 1HH2 ARG 333 2HH1 ARG 33 1.149 -4.929 -4.929 850 2HH2 ARG 333 1HH1 ARG 33 1.970 -6.271 -6.271 851 H GLY 334 H GLY 34 6.446 0.141 0.141 852 1HA GLY 334 2HA GLY 34 7.940 -2.121 -2.121 853 2HA GLY 334 1HA GLY 34 6.908 -1.759 -1.759 854 H ARG 335 H ARG 35 7.717 -0.326 -0.326 855 HA ARG 335 HA ARG 35 8.849 2.158 2.158 856 1HB ARG 335 2HB ARG 35 10.649 1.329 1.329 857 2HB ARG 335 1HB ARG 35 10.918 -0.038 -0.038 858 1HG ARG 335 2HG ARG 35 11.932 1.300 1.300 859 2HG ARG 335 1HG ARG 35 11.200 2.780 2.780 860 1HD ARG 335 2HD ARG 35 12.605 2.180 2.180 861 2HD ARG 335 1HD ARG 35 13.588 1.281 1.281 862 HE ARG 335 HE ARG 35 12.985 4.143 4.143 863 1HH1 ARG 335 1HH2 ARG 35 15.150 2.080 2.080 864 2HH1 ARG 335 2HH2 ARG 35 16.576 2.768 2.768 865 1HH2 ARG 335 2HH1 ARG 35 14.829 4.835 4.835 866 2HH2 ARG 335 1HH1 ARG 35 16.394 4.330 4.330 867 H GLU 336 H GLU 36 9.348 -0.865 -0.865 868 HA GLU 336 HA GLU 36 10.016 0.590 0.590 869 1HB GLU 336 2HB GLU 36 9.877 -2.256 -2.256 870 2HB GLU 336 1HB GLU 36 9.596 -1.935 -1.935 871 1HG GLU 336 2HG GLU 36 11.721 -0.895 -0.895 872 2HG GLU 336 1HG GLU 36 11.958 -0.772 -0.772 873 H ARG 337 H ARG 37 7.304 -1.415 -1.415 874 HA ARG 337 HA ARG 37 5.679 -1.126 -1.126 875 1HB ARG 337 2HB ARG 37 5.398 -2.202 -2.202 876 2HB ARG 337 1HB ARG 37 3.971 -1.242 -1.242 877 1HG ARG 337 2HG ARG 37 3.426 -2.566 -2.566 878 2HG ARG 337 1HG ARG 37 5.075 -3.164 -3.164 879 1HD ARG 337 2HD ARG 37 3.159 -3.882 -3.882 880 2HD ARG 337 1HD ARG 37 3.642 -4.934 -4.934 881 HE ARG 337 HE ARG 37 5.963 -3.999 -3.999 882 1HH1 ARG 337 1HH2 ARG 37 5.964 -6.751 -6.751 883 2HH1 ARG 337 2HH2 ARG 37 5.578 -7.629 -7.629 884 1HH2 ARG 337 2HH1 ARG 37 4.300 -4.867 -4.867 885 2HH2 ARG 337 1HH1 ARG 37 4.640 -6.562 -6.562 886 H PHE 338 H PHE 38 6.023 0.872 0.872 887 HA PHE 338 HA PHE 38 3.879 2.680 2.680 888 1HB PHE 338 2HB PHE 38 5.143 2.551 2.551 889 2HB PHE 338 1HB PHE 38 6.515 3.314 3.314 890 HD1 PHE 338 HD1 PHE 38 3.085 3.800 3.800 891 HD2 PHE 338 HD2 PHE 38 6.435 5.655 5.655 892 HE1 PHE 338 HE1 PHE 38 2.079 6.032 6.032 893 HE2 PHE 338 HE2 PHE 38 5.428 7.887 7.887 894 HZ PHE 338 HZ PHE 38 3.250 8.076 8.076 895 H GLU 339 H GLU 39 7.155 2.442 2.442 896 HA GLU 339 HA GLU 39 7.201 5.066 5.066 897 1HB GLU 339 2HB GLU 39 8.832 2.555 2.555 898 2HB GLU 339 1HB GLU 39 9.025 3.844 3.844 899 1HG GLU 339 2HG GLU 39 9.187 4.308 4.308 900 2HG GLU 339 1HG GLU 39 10.600 3.990 3.990 901 H MET 340 H MET 40 6.488 1.784 1.784 902 HA MET 340 HA MET 40 6.014 2.432 2.432 903 1HB MET 340 2HB MET 40 4.533 0.410 0.410 904 2HB MET 340 1HB MET 40 4.579 0.425 0.425 905 1HG MET 340 2HG MET 40 7.137 0.323 0.323 906 2HG MET 340 1HG MET 40 6.850 -0.100 -0.100 907 1HE MET 340 2HE MET 40 4.677 -1.843 -1.843 908 2HE MET 340 1HE MET 40 3.821 -1.335 -1.335 909 3HE MET 340 3HE MET 40 4.182 -3.046 -3.046 910 H PHE 341 H PHE 41 3.770 2.498 2.498 911 HA PHE 341 HA PHE 41 1.499 3.388 3.388 912 1HB PHE 341 2HB PHE 41 2.209 3.509 3.509 913 2HB PHE 341 1HB PHE 41 0.704 4.186 4.186 914 HD1 PHE 341 HD1 PHE 41 2.046 1.325 1.325 915 HD2 PHE 341 HD2 PHE 41 -0.484 2.513 2.513 916 HE1 PHE 341 HE1 PHE 41 1.025 -0.927 -0.927 917 HE2 PHE 341 HE2 PHE 41 -1.508 0.256 0.256 918 HZ PHE 341 HZ PHE 41 -0.754 -1.464 -1.464 919 H ARG 342 H ARG 42 4.062 5.082 5.082 920 HA ARG 342 HA ARG 42 3.059 7.699 7.699 921 1HB ARG 342 2HB ARG 42 5.716 6.451 6.451 922 2HB ARG 342 1HB ARG 42 5.732 8.067 8.067 923 1HG ARG 342 2HG ARG 42 4.101 8.579 8.579 924 2HG ARG 342 1HG ARG 42 4.960 7.211 7.211 925 1HD ARG 342 2HD ARG 42 6.594 8.665 8.665 926 2HD ARG 342 1HD ARG 42 6.975 8.749 8.749 927 HE ARG 342 HE ARG 42 4.880 10.574 10.574 928 1HH1 ARG 342 1HH2 ARG 42 8.213 10.438 10.438 929 2HH1 ARG 342 2HH2 ARG 42 8.462 11.894 11.894 930 1HH2 ARG 342 2HH1 ARG 42 5.114 12.273 12.273 931 2HH2 ARG 342 1HH1 ARG 42 6.707 12.932 12.932 932 H GLU 343 H GLU 43 4.573 5.814 5.814 933 HA GLU 343 HA GLU 43 4.664 8.047 8.047 934 1HB GLU 343 2HB GLU 43 6.180 6.053 6.053 935 2HB GLU 343 1HB GLU 43 4.783 5.077 5.077 936 1HG GLU 343 2HG GLU 43 5.120 5.693 5.693 937 2HG GLU 343 1HG GLU 43 4.712 7.347 7.347 938 H LEU 344 H LEU 44 2.636 5.105 5.105 939 HA LEU 344 HA LEU 44 0.910 5.577 5.577 940 1HB LEU 344 2HB LEU 44 0.538 4.313 4.313 941 2HB LEU 344 1HB LEU 44 -0.889 4.611 4.611 942 HG LEU 344 HG LEU 44 -0.325 2.457 2.457 943 1HD1 LEU 344 3HD1 LEU 44 -0.147 4.269 4.269 944 2HD1 LEU 344 2HD1 LEU 44 1.548 3.784 3.784 945 3HD1 LEU 344 1HD1 LEU 44 0.289 2.591 2.591 946 1HD2 LEU 344 3HD2 LEU 44 1.997 2.870 2.870 947 2HD2 LEU 344 2HD2 LEU 44 1.725 1.483 1.483 948 3HD2 LEU 344 1HD2 LEU 44 2.587 2.897 2.897 949 H ASN 345 H ASN 45 0.205 6.627 6.627 950 HA ASN 345 HA ASN 45 -1.960 8.316 8.316 951 1HB ASN 345 2HB ASN 45 -1.991 9.080 9.080 952 2HB ASN 345 1HB ASN 45 -1.352 7.443 7.443 953 1HD2 ASN 345 2HD2 ASN 45 1.489 8.631 8.631 954 2HD2 ASN 345 1HD2 ASN 45 0.298 7.432 7.432 955 H GLU 346 H GLU 46 1.474 8.791 8.791 956 HA GLU 346 HA GLU 46 1.542 11.645 11.645 957 1HB GLU 346 2HB GLU 46 3.584 10.264 10.264 958 2HB GLU 346 1HB GLU 46 3.327 9.757 9.757 959 1HG GLU 346 2HG GLU 46 3.874 11.837 11.837 960 2HG GLU 346 1HG GLU 46 3.396 12.688 12.688 961 H ALA 347 H ALA 47 1.216 9.415 9.415 962 HA ALA 347 HA ALA 47 0.963 11.546 11.546 963 1HB ALA 347 3HB ALA 47 1.637 9.221 9.221 964 2HB ALA 347 2HB ALA 47 0.006 8.676 8.676 965 3HB ALA 347 1HB ALA 47 0.268 9.788 9.788 966 H LEU 348 H LEU 48 -1.435 9.428 9.428 967 HA LEU 348 HA LEU 48 -3.777 10.354 10.354 968 1HB LEU 348 2HB LEU 48 -3.371 9.803 9.803 969 2HB LEU 348 1HB LEU 48 -4.922 9.824 9.824 970 HG LEU 348 HG LEU 48 -2.646 8.001 8.001 971 1HD1 LEU 348 1HD1 LEU 48 -4.127 7.852 7.852 972 2HD1 LEU 348 3HD1 LEU 48 -4.911 6.708 6.708 973 3HD1 LEU 348 2HD1 LEU 48 -3.192 6.551 6.551 974 1HD2 LEU 348 1HD2 LEU 48 -4.898 8.731 8.731 975 2HD2 LEU 348 3HD2 LEU 48 -4.092 7.175 7.175 976 3HD2 LEU 348 2HD2 LEU 48 -5.485 7.318 7.318 977 H GLU 349 H GLU 49 -2.164 11.796 11.796 978 HA GLU 349 HA GLU 49 -3.902 14.041 14.041 979 1HB GLU 349 2HB GLU 49 -1.268 13.249 13.249 980 2HB GLU 349 1HB GLU 49 -1.441 14.992 14.992 981 1HG GLU 349 2HG GLU 49 -3.858 13.901 13.901 982 2HG GLU 349 1HG GLU 49 -2.465 13.413 13.413 983 H LEU 350 H LEU 50 -1.021 13.461 13.461 984 HA LEU 350 HA LEU 50 -0.670 16.118 16.118 985 1HB LEU 350 2HB LEU 50 1.007 15.153 15.153 986 2HB LEU 350 1HB LEU 50 0.522 13.621 13.621 987 HG LEU 350 HG LEU 50 -1.171 13.445 13.445 988 1HD1 LEU 350 1HD1 LEU 50 0.010 16.010 16.010 989 2HD1 LEU 350 3HD1 LEU 50 0.375 14.917 14.917 990 3HD1 LEU 350 2HD1 LEU 50 -1.300 15.201 15.201 991 1HD2 LEU 350 2HD2 LEU 50 1.823 13.367 13.367 992 2HD2 LEU 350 1HD2 LEU 50 0.797 12.033 12.033 993 3HD2 LEU 350 3HD2 LEU 50 0.637 12.676 12.676 994 H LYS 351 H LYS 51 -2.926 13.578 13.578 995 HA LYS 351 HA LYS 51 -3.891 14.675 14.675 996 1HB LYS 351 2HB LYS 51 -4.386 12.366 12.366 997 2HB LYS 351 1HB LYS 51 -5.598 13.190 13.190 998 1HG LYS 351 2HG LYS 51 -6.907 13.757 13.757 999 2HG LYS 351 1HG LYS 51 -5.558 13.597 13.597 1000 1HD LYS 351 2HD LYS 51 -5.579 11.085 11.085 1001 2HD LYS 351 1HD LYS 51 -7.230 11.444 11.444 1002 1HE LYS 351 2HE LYS 51 -7.970 11.749 11.749 1003 2HE LYS 351 1HE LYS 51 -6.410 12.350 12.350 1004 1HZ LYS 351 1HZ LYS 51 -6.868 9.529 9.529 1005 2HZ LYS 351 3HZ LYS 51 -7.051 10.084 10.084 1006 3HZ LYS 351 2HZ LYS 51 -5.535 10.176 10.176 1007 H ASP 352 H ASP 52 -4.925 15.131 15.131 1008 HA ASP 352 HA ASP 52 -7.034 16.998 16.998 1009 1HB ASP 352 2HB ASP 52 -6.416 15.578 15.578 1010 2HB ASP 352 1HB ASP 52 -5.797 17.167 17.167 1011 H ALA 353 H ALA 53 -3.633 17.235 17.235 1012 HA ALA 353 HA ALA 53 -3.742 20.182 20.182 1013 1HB ALA 353 2HB ALA 53 -1.758 18.083 18.083 1014 2HB ALA 353 1HB ALA 53 -1.076 19.499 19.499 1015 3HB ALA 353 3HB ALA 53 -1.920 19.677 19.677 1016 H GLN 354 H GLN 54 -3.849 18.008 18.008 1017 HA GLN 354 HA GLN 54 -2.029 18.932 18.932 1018 1HB GLN 354 2HB GLN 54 -4.814 17.823 17.823 1019 2HB GLN 354 1HB GLN 54 -4.042 18.434 18.434 1020 1HG GLN 354 2HG GLN 54 -2.004 16.975 16.975 1021 2HG GLN 354 1HG GLN 54 -3.316 16.080 16.080 1022 1HE2 GLN 354 2HE2 GLN 54 -2.602 15.515 15.515 1023 2HE2 GLN 354 1HE2 GLN 54 -1.547 16.370 16.370 1024 H ALA 355 HN ALA 55 -1.639 21.103 21.103 1025 HA ALA 355 HA ALA 55 -3.788 22.744 22.744 1026 1HB ALA 355 1HB ALA 55 -3.632 22.862 22.862 1027 2HB ALA 355 3HB ALA 55 -2.406 24.062 24.062 1028 3HB ALA 355 2HB ALA 55 -4.061 24.258 24.258 Start of MODEL 11 1 1H GLY 325 3H GLY 25 13.740 -0.202 -0.202 2 2H GLY 325 2H GLY 25 14.513 1.211 1.211 3 3H GLY 325 1H GLY 25 13.975 1.095 1.095 4 1HA GLY 325 2HA GLY 25 11.760 1.328 1.328 5 2HA GLY 325 1HA GLY 25 12.574 2.440 2.440 6 H GLU 326 H GLU 26 10.845 -0.578 -0.578 7 HA GLU 326 HA GLU 26 10.623 -0.604 -0.604 8 1HB GLU 326 2HB GLU 26 11.359 -2.924 -2.924 9 2HB GLU 326 1HB GLU 26 10.702 -3.156 -3.156 10 1HG GLU 326 2HG GLU 26 12.585 -1.458 -1.458 11 2HG GLU 326 1HG GLU 26 13.329 -1.955 -1.955 12 H TYR 327 H TYR 27 8.914 -2.716 -2.716 13 HA TYR 327 HA TYR 27 6.521 -1.744 -1.744 14 1HB TYR 327 2HB TYR 27 7.030 -2.705 -2.705 15 2HB TYR 327 1HB TYR 27 5.718 -3.609 -3.609 16 HD1 TYR 327 HD2 TYR 27 4.215 -1.887 -1.887 17 HD2 TYR 327 HD1 TYR 27 6.294 -0.905 -0.905 18 HE1 TYR 327 HE2 TYR 27 2.686 0.034 0.034 19 HE2 TYR 327 HE1 TYR 27 4.765 1.016 1.016 20 HH TYR 327 HH TYR 27 2.950 2.076 2.076 21 H PHE 328 H PHE 28 6.118 -2.902 -2.902 22 HA PHE 328 HA PHE 28 6.722 -5.826 -5.826 23 1HB PHE 328 2HB PHE 28 6.390 -3.803 -3.803 24 2HB PHE 328 1HB PHE 28 6.316 -5.536 -5.536 25 HD1 PHE 328 HD2 PHE 28 8.456 -2.815 -2.815 26 HD2 PHE 328 HD1 PHE 28 8.290 -6.887 -6.887 27 HE1 PHE 328 HE2 PHE 28 10.933 -2.920 -2.920 28 HE2 PHE 328 HE1 PHE 28 10.768 -6.993 -6.993 29 HZ PHE 328 HZ PHE 28 12.089 -5.010 -5.010 30 H THR 329 H THR 29 5.087 -7.238 -7.238 31 HA THR 329 HA THR 29 2.298 -6.190 -6.190 32 HB THR 329 HB THR 29 2.714 -9.102 -9.102 33 HG1 THR 329 HG1 THR 29 4.445 -8.783 -8.783 34 1HG2 THR 329 2HG2 THR 29 0.687 -7.482 -7.482 35 2HG2 THR 329 1HG2 THR 29 1.488 -7.460 -7.460 36 3HG2 THR 329 3HG2 THR 29 0.952 -8.989 -8.989 37 H LEU 330 H LEU 30 0.954 -6.400 -6.400 38 HA LEU 330 HA LEU 30 1.919 -8.103 -8.103 39 1HB LEU 330 2HB LEU 30 1.070 -5.361 -5.361 40 2HB LEU 330 1HB LEU 30 -0.123 -6.281 -6.281 41 HG LEU 330 HG LEU 30 2.853 -6.535 -6.535 42 1HD1 LEU 330 2HD1 LEU 30 0.833 -4.615 -4.615 43 2HD1 LEU 330 1HD1 LEU 30 2.261 -5.109 -5.109 44 3HD1 LEU 330 3HD1 LEU 30 2.445 -4.265 -4.265 45 1HD2 LEU 330 3HD2 LEU 30 0.393 -7.204 -7.204 46 2HD2 LEU 330 2HD2 LEU 30 1.433 -8.366 -8.366 47 3HD2 LEU 330 1HD2 LEU 30 2.060 -7.424 -7.424 48 H GLN 331 H GLN 31 0.858 -10.004 -10.004 49 HA GLN 331 HA GLN 31 -1.986 -9.880 -9.880 50 1HB GLN 331 2HB GLN 31 0.068 -12.083 -12.083 51 2HB GLN 331 1HB GLN 31 -1.639 -12.450 -12.450 52 1HG GLN 331 2HG GLN 31 -1.580 -10.803 -10.803 53 2HG GLN 331 1HG GLN 31 0.176 -10.960 -10.960 54 1HE2 GLN 331 2HE2 GLN 31 0.201 -14.352 -14.352 55 2HE2 GLN 331 1HE2 GLN 31 1.086 -13.188 -13.188 56 H ILE 332 H ILE 32 -3.527 -9.873 -9.873 57 HA ILE 332 HA ILE 32 -2.967 -11.312 -11.312 58 HB ILE 332 HB ILE 32 -4.505 -8.722 -8.722 59 1HG1 ILE 332 2HG1 ILE 32 -2.183 -8.749 -8.749 60 2HG1 ILE 332 1HG1 ILE 32 -1.754 -9.110 -9.110 61 1HG2 ILE 332 2HG2 ILE 32 -3.938 -10.489 -10.489 62 2HG2 ILE 332 1HG2 ILE 32 -4.366 -8.787 -8.787 63 3HG2 ILE 332 3HG2 ILE 32 -5.500 -9.907 -9.907 64 1HD1 ILE 332 2HD1 ILE 32 -3.548 -6.786 -6.786 65 2HD1 ILE 332 1HD1 ILE 32 -1.792 -6.626 -6.626 66 3HD1 ILE 332 3HD1 ILE 32 -2.664 -7.066 -7.066 67 H ARG 333 H ARG 33 -4.449 -12.877 -12.877 68 HA ARG 333 HA ARG 33 -6.787 -13.152 -13.152 69 1HB ARG 333 2HB ARG 33 -5.262 -14.840 -14.840 70 2HB ARG 333 1HB ARG 33 -6.983 -14.972 -14.972 71 1HG ARG 333 2HG ARG 33 -7.129 -15.069 -15.069 72 2HG ARG 333 1HG ARG 33 -5.505 -15.728 -15.728 73 1HD ARG 333 2HD ARG 33 -8.073 -16.772 -16.772 74 2HD ARG 333 1HD ARG 33 -7.031 -17.590 -17.590 75 HE ARG 333 HE ARG 33 -5.440 -17.999 -17.999 76 1HH1 ARG 333 1HH2 ARG 33 -5.117 -16.088 -16.088 77 2HH1 ARG 333 2HH2 ARG 33 -6.235 -16.404 -16.404 78 1HH2 ARG 333 2HH1 ARG 33 -8.246 -18.489 -18.489 79 2HH2 ARG 333 1HH1 ARG 33 -8.009 -17.763 -17.763 80 H GLY 334 H GLY 34 -8.910 -12.707 -12.707 81 1HA GLY 334 2HA GLY 34 -10.440 -12.560 -12.560 82 2HA GLY 334 1HA GLY 34 -9.280 -11.345 -11.345 83 H ARG 335 H ARG 35 -10.307 -9.421 -9.421 84 HA ARG 335 HA ARG 35 -10.785 -8.215 -8.215 85 1HB ARG 335 2HB ARG 35 -12.730 -9.947 -9.947 86 2HB ARG 335 1HB ARG 35 -13.415 -8.818 -8.818 87 1HG ARG 335 2HG ARG 35 -14.212 -7.607 -7.607 88 2HG ARG 335 1HG ARG 35 -12.547 -7.233 -7.233 89 1HD ARG 335 2HD ARG 35 -13.126 -8.264 -8.264 90 2HD ARG 335 1HD ARG 35 -12.731 -9.719 -9.719 91 HE ARG 335 HE ARG 35 -15.118 -10.097 -10.097 92 1HH1 ARG 335 2HH1 ARG 35 -17.077 -8.526 -8.526 93 2HH1 ARG 335 1HH1 ARG 35 -17.406 -7.902 -7.902 94 1HH2 ARG 335 1HH2 ARG 35 -14.323 -8.819 -8.819 95 2HH2 ARG 335 2HH2 ARG 35 -15.847 -8.064 -8.064 96 H GLU 336 H GLU 36 -12.175 -8.341 -8.341 97 HA GLU 336 HA GLU 36 -12.513 -5.483 -5.483 98 1HB GLU 336 2HB GLU 36 -13.344 -7.616 -7.616 99 2HB GLU 336 1HB GLU 36 -12.045 -6.978 -6.978 100 1HG GLU 336 2HG GLU 36 -13.321 -4.673 -4.673 101 2HG GLU 336 1HG GLU 36 -14.675 -5.802 -5.802 102 H ARG 337 H ARG 37 -9.948 -7.728 -7.728 103 HA ARG 337 HA ARG 37 -8.326 -5.708 -5.708 104 1HB ARG 337 2HB ARG 37 -7.975 -8.525 -8.525 105 2HB ARG 337 1HB ARG 37 -6.500 -7.563 -7.563 106 1HG ARG 337 2HG ARG 37 -7.260 -6.850 -6.850 107 2HG ARG 337 1HG ARG 37 -8.537 -8.060 -8.060 108 1HD ARG 337 2HD ARG 37 -5.586 -8.672 -8.672 109 2HD ARG 337 1HD ARG 37 -6.486 -8.885 -8.885 110 HE ARG 337 HE ARG 37 -7.837 -10.271 -10.271 111 1HH1 ARG 337 1HH2 ARG 37 -7.127 -11.364 -11.364 112 2HH1 ARG 337 2HH2 ARG 37 -6.015 -12.626 -12.626 113 1HH2 ARG 337 2HH1 ARG 37 -5.473 -11.464 -11.464 114 2HH2 ARG 337 1HH1 ARG 37 -5.082 -12.685 -12.685 115 H PHE 338 H PHE 38 -8.496 -7.022 -7.022 116 HA PHE 338 HA PHE 38 -6.229 -5.636 -5.636 117 1HB PHE 338 2HB PHE 38 -7.495 -7.460 -7.460 118 2HB PHE 338 1HB PHE 38 -8.796 -6.302 -6.302 119 HD1 PHE 338 HD1 PHE 38 -8.470 -4.367 -4.367 120 HD2 PHE 338 HD2 PHE 38 -5.370 -7.282 -7.282 121 HE1 PHE 338 HE1 PHE 38 -7.268 -3.492 -3.492 122 HE2 PHE 338 HE2 PHE 38 -4.168 -6.405 -6.405 123 HZ PHE 338 HZ PHE 38 -5.117 -4.509 -4.509 124 H GLU 339 H GLU 39 -9.532 -4.649 -4.649 125 HA GLU 339 HA GLU 39 -9.390 -2.152 -2.152 126 1HB GLU 339 2HB GLU 39 -11.225 -3.333 -3.333 127 2HB GLU 339 1HB GLU 39 -11.331 -1.608 -1.608 128 1HG GLU 339 2HG GLU 39 -11.203 -3.541 -3.541 129 2HG GLU 339 1HG GLU 39 -12.710 -3.372 -3.372 130 H MET 340 H MET 40 -8.789 -3.146 -3.146 131 HA MET 340 HA MET 40 -8.409 -0.594 -0.594 132 1HB MET 340 2HB MET 40 -7.491 -3.356 -3.356 133 2HB MET 340 1HB MET 40 -6.656 -2.029 -2.029 134 1HG MET 340 2HG MET 40 -8.681 -1.230 -1.230 135 2HG MET 340 1HG MET 40 -9.671 -2.261 -2.261 136 1HE MET 340 3HE MET 40 -6.477 -2.513 -2.513 137 2HE MET 340 2HE MET 40 -6.589 -3.976 -3.976 138 3HE MET 340 1HE MET 40 -6.412 -4.102 -4.102 139 H PHE 341 H PHE 41 -5.979 -2.783 -2.783 140 HA PHE 341 HA PHE 41 -3.802 -0.981 -0.981 141 1HB PHE 341 2HB PHE 41 -4.370 -3.388 -3.388 142 2HB PHE 341 1HB PHE 41 -2.867 -2.505 -2.505 143 HD1 PHE 341 HD2 PHE 41 -2.697 -1.730 -1.730 144 HD2 PHE 341 HD1 PHE 41 -3.498 -5.438 -5.438 145 HE1 PHE 341 HE2 PHE 41 -1.900 -2.979 -2.979 146 HE2 PHE 341 HE1 PHE 41 -2.687 -6.690 -6.690 147 HZ PHE 341 HZ PHE 41 -1.889 -5.466 -5.466 148 H ARG 342 H ARG 42 -6.178 -1.571 -1.571 149 HA ARG 342 HA ARG 42 -5.058 -0.099 -0.099 150 1HB ARG 342 2HB ARG 42 -7.605 -1.223 -1.223 151 2HB ARG 342 1HB ARG 42 -7.873 0.444 0.444 152 1HG ARG 342 2HG ARG 42 -6.020 -1.343 -1.343 153 2HG ARG 342 1HG ARG 42 -7.762 -1.411 -1.411 154 1HD ARG 342 2HD ARG 42 -7.135 1.328 1.328 155 2HD ARG 342 1HD ARG 42 -5.857 0.580 0.580 156 HE ARG 342 HE ARG 42 -8.732 0.061 0.061 157 1HH1 ARG 342 1HH2 ARG 42 -6.152 2.047 2.047 158 2HH1 ARG 342 2HH2 ARG 42 -6.186 1.695 1.695 159 1HH2 ARG 342 2HH1 ARG 42 -8.524 -0.846 -0.846 160 2HH2 ARG 342 1HH1 ARG 42 -7.528 0.057 0.057 161 H GLU 343 H GLU 43 -6.926 0.997 0.997 162 HA GLU 343 HA GLU 43 -7.055 3.759 3.759 163 1HB GLU 343 2HB GLU 43 -8.485 2.723 2.723 164 2HB GLU 343 1HB GLU 43 -7.059 2.670 2.670 165 1HG GLU 343 2HG GLU 43 -8.015 4.707 4.707 166 2HG GLU 343 1HG GLU 43 -6.868 5.222 5.222 167 H LEU 344 H LEU 44 -4.785 1.931 1.931 168 HA LEU 344 HA LEU 44 -3.141 4.164 4.164 169 1HB LEU 344 2HB LEU 44 -2.730 1.191 1.191 170 2HB LEU 344 1HB LEU 44 -1.325 2.226 2.226 171 HG LEU 344 HG LEU 44 -1.938 1.762 1.762 172 1HD1 LEU 344 1HD1 LEU 44 -2.055 4.316 4.316 173 2HD1 LEU 344 3HD1 LEU 44 -3.734 4.136 4.136 174 3HD1 LEU 344 2HD1 LEU 44 -2.431 3.830 3.830 175 1HD2 LEU 344 1HD2 LEU 44 -4.358 1.025 1.025 176 2HD2 LEU 344 3HD2 LEU 44 -3.983 1.013 1.013 177 3HD2 LEU 344 2HD2 LEU 44 -4.797 2.404 2.404 178 H ASN 345 H ASN 45 -3.379 2.258 2.258 179 HA ASN 345 HA ASN 45 -0.853 3.283 3.283 180 1HB ASN 345 2HB ASN 45 -2.757 1.191 1.191 181 2HB ASN 345 1HB ASN 45 -2.406 2.173 2.173 182 1HD2 ASN 345 2HD2 ASN 45 0.399 -0.374 -0.374 183 2HD2 ASN 345 1HD2 ASN 45 -1.159 -0.296 -0.296 184 H GLU 346 H GLU 46 -4.163 4.189 4.189 185 HA GLU 346 HA GLU 46 -4.246 5.791 5.791 186 1HB GLU 346 2HB GLU 46 -6.225 4.906 4.906 187 2HB GLU 346 1HB GLU 46 -5.923 6.322 6.322 188 1HG GLU 346 2HG GLU 46 -6.246 7.808 7.808 189 2HG GLU 346 1HG GLU 46 -6.402 6.433 6.433 190 H ALA 347 H ALA 47 -3.669 6.513 6.513 191 HA ALA 347 HA ALA 47 -3.180 9.334 9.334 192 1HB ALA 347 3HB ALA 47 -2.890 7.464 7.464 193 2HB ALA 347 2HB ALA 47 -2.043 9.012 9.012 194 3HB ALA 347 1HB ALA 47 -3.799 8.971 8.971 195 H LEU 348 H LEU 48 -1.066 6.529 6.529 196 HA LEU 348 HA LEU 48 1.411 7.859 7.859 197 1HB LEU 348 2HB LEU 48 0.608 5.081 5.081 198 2HB LEU 348 1HB LEU 48 2.286 5.630 5.630 199 HG LEU 348 HG LEU 48 0.458 5.647 5.647 200 1HD1 LEU 348 2HD1 LEU 48 1.398 3.402 3.402 201 2HD1 LEU 348 1HD1 LEU 48 2.877 3.905 3.905 202 3HD1 LEU 348 3HD1 LEU 48 1.399 3.643 3.643 203 1HD2 LEU 348 3HD2 LEU 48 2.862 7.039 7.039 204 2HD2 LEU 348 2HD2 LEU 48 2.035 6.934 6.934 205 3HD2 LEU 348 1HD2 LEU 48 3.283 5.759 5.759 206 H GLU 349 H GLU 49 -0.372 6.346 6.346 207 HA GLU 349 HA GLU 49 1.407 7.201 7.201 208 1HB GLU 349 2HB GLU 49 -0.383 5.511 5.511 209 2HB GLU 349 1HB GLU 49 -1.596 6.780 6.780 210 1HG GLU 349 2HG GLU 49 -0.796 7.923 7.923 211 2HG GLU 349 1HG GLU 49 0.602 6.853 6.853 212 H LEU 350 H LEU 50 -1.220 8.848 8.848 213 HA LEU 350 HA LEU 50 -1.413 11.054 11.054 214 1HB LEU 350 2HB LEU 50 -3.099 11.618 11.618 215 2HB LEU 350 1HB LEU 50 -2.690 10.207 10.207 216 HG LEU 350 HG LEU 50 -0.994 11.659 11.659 217 1HD1 LEU 350 2HD1 LEU 50 -2.061 13.520 13.520 218 2HD1 LEU 350 1HD1 LEU 50 -2.068 14.169 14.169 219 3HD1 LEU 350 3HD1 LEU 50 -0.562 13.600 13.600 220 1HD2 LEU 350 3HD2 LEU 50 -3.949 12.306 12.306 221 2HD2 LEU 350 2HD2 LEU 50 -3.068 11.165 11.165 222 3HD2 LEU 350 1HD2 LEU 50 -2.799 12.899 12.899 223 H LYS 351 H LYS 51 0.739 10.244 10.244 224 HA LYS 351 HA LYS 51 1.940 12.831 12.831 225 1HB LYS 351 2HB LYS 51 2.166 10.790 10.790 226 2HB LYS 351 1HB LYS 51 3.382 10.215 10.215 227 1HG LYS 351 2HG LYS 51 4.904 11.807 11.807 228 2HG LYS 351 1HG LYS 51 3.666 13.038 13.038 229 1HD LYS 351 2HD LYS 51 4.686 12.416 12.416 230 2HD LYS 351 1HD LYS 51 2.999 11.904 11.904 231 1HE LYS 351 2HE LYS 51 3.896 9.915 9.915 232 2HE LYS 351 1HE LYS 51 4.158 9.693 9.693 233 1HZ LYS 351 3HZ LYS 51 6.360 10.856 10.856 234 2HZ LYS 351 2HZ LYS 51 6.092 10.588 10.588 235 3HZ LYS 351 1HZ LYS 51 6.217 9.272 9.272 236 H ASP 352 H ASP 52 2.623 10.068 10.068 237 HA ASP 352 HA ASP 52 5.040 10.978 10.978 238 1HB ASP 352 2HB ASP 52 3.692 8.735 8.735 239 2HB ASP 352 1HB ASP 52 2.960 9.613 9.613 240 H ALA 353 H ALA 53 1.656 11.745 11.745 241 HA ALA 353 HA ALA 53 2.399 13.491 13.491 242 1HB ALA 353 2HB ALA 53 -0.220 13.034 13.034 243 2HB ALA 353 1HB ALA 53 -0.038 14.095 14.095 244 3HB ALA 353 3HB ALA 53 0.259 12.364 12.364 245 H GLN 354 H GLN 54 0.104 14.684 14.684 246 HA GLN 354 HA GLN 54 0.043 16.800 16.800 247 1HB GLN 354 2HB GLN 54 2.532 15.393 15.393 248 2HB GLN 354 1HB GLN 54 2.297 17.070 17.070 249 1HG GLN 354 2HG GLN 54 -0.178 15.638 15.638 250 2HG GLN 354 1HG GLN 54 1.107 14.759 14.759 251 1HE2 GLN 354 2HE2 GLN 54 1.548 17.226 17.226 252 2HE2 GLN 354 1HE2 GLN 54 2.142 15.790 15.790 253 H ALA 355 HN ALA 55 1.249 16.672 16.672 254 HA ALA 355 HA ALA 55 2.343 19.393 19.393 255 1HB ALA 355 2HB ALA 55 4.024 16.977 16.977 256 2HB ALA 355 1HB ALA 55 4.365 18.543 18.543 257 3HB ALA 355 3HB ALA 55 4.433 18.359 18.359 258 1H GLY 325 3H GLY 25 -14.174 -12.813 -12.813 259 2H GLY 325 2H GLY 25 -14.972 -14.087 -14.087 260 3H GLY 325 1H GLY 25 -14.621 -12.650 -12.650 261 1HA GLY 325 2HA GLY 25 -12.373 -13.101 -13.101 262 2HA GLY 325 1HA GLY 25 -13.125 -14.676 -14.676 263 H GLU 326 H GLU 26 -11.253 -12.725 -12.725 264 HA GLU 326 HA GLU 26 -10.689 -15.192 -15.192 265 1HB GLU 326 2HB GLU 26 -11.475 -12.478 -12.478 266 2HB GLU 326 1HB GLU 26 -10.626 -13.673 -13.673 267 1HG GLU 326 2HG GLU 26 -12.519 -15.293 -15.293 268 2HG GLU 326 1HG GLU 26 -13.399 -13.797 -13.797 269 H TYR 327 H TYR 27 -8.824 -14.210 -14.210 270 HA TYR 327 HA TYR 27 -6.679 -13.338 -13.338 271 1HB TYR 327 2HB TYR 27 -6.820 -15.110 -15.110 272 2HB TYR 327 1HB TYR 27 -5.548 -13.904 -13.904 273 HD1 TYR 327 HD2 TYR 27 -4.350 -13.398 -13.398 274 HD2 TYR 327 HD1 TYR 27 -6.058 -17.103 -17.103 275 HE1 TYR 327 HE2 TYR 27 -2.916 -14.640 -14.640 276 HE2 TYR 327 HE1 TYR 27 -4.624 -18.345 -18.345 277 HH TYR 327 HH TYR 27 -2.970 -18.201 -18.201 278 H PHE 328 H PHE 28 -6.401 -11.153 -11.153 279 HA PHE 328 HA PHE 28 -6.830 -9.628 -9.628 280 1HB PHE 328 2HB PHE 28 -6.885 -8.849 -8.849 281 2HB PHE 328 1HB PHE 28 -6.743 -7.636 -7.636 282 HD1 PHE 328 HD2 PHE 28 -8.881 -10.377 -10.377 283 HD2 PHE 328 HD1 PHE 28 -8.614 -7.023 -7.023 284 HE1 PHE 328 HE2 PHE 28 -11.331 -10.480 -10.480 285 HE2 PHE 328 HE1 PHE 28 -11.064 -7.125 -7.125 286 HZ PHE 328 HZ PHE 28 -12.422 -8.854 -8.854 287 H THR 329 H THR 29 -5.246 -7.873 -7.873 288 HA THR 329 HA THR 29 -2.526 -8.576 -8.576 289 HB THR 329 HB THR 29 -2.531 -7.105 -7.105 290 HG1 THR 329 HG1 THR 29 -4.316 -8.190 -8.190 291 1HG2 THR 329 2HG2 THR 29 -0.750 -8.575 -8.575 292 2HG2 THR 329 1HG2 THR 29 -1.518 -9.897 -9.897 293 3HG2 THR 329 3HG2 THR 29 -0.799 -8.550 -8.550 294 H LEU 330 H LEU 30 -1.237 -6.874 -6.874 295 HA LEU 330 HA LEU 30 -2.460 -4.147 -4.147 296 1HB LEU 330 2HB LEU 30 -1.808 -5.720 -5.720 297 2HB LEU 330 1HB LEU 30 -0.633 -4.406 -4.406 298 HG LEU 330 HG LEU 30 -3.621 -3.984 -3.984 299 1HD1 LEU 330 2HD1 LEU 30 -1.789 -3.954 -3.954 300 2HD1 LEU 330 1HD1 LEU 30 -3.281 -3.013 -3.013 301 3HD1 LEU 330 3HD1 LEU 30 -3.342 -4.770 -4.770 302 1HD2 LEU 330 2HD2 LEU 30 -2.172 -2.235 -2.235 303 2HD2 LEU 330 1HD2 LEU 30 -3.003 -1.634 -1.634 304 3HD2 LEU 330 3HD2 LEU 30 -1.303 -2.097 -2.097 305 H GLN 331 H GLN 31 -1.157 -3.883 -3.883 306 HA GLN 331 HA GLN 31 1.724 -4.147 -4.147 307 1HB GLN 331 2HB GLN 31 -0.197 -2.875 -2.875 308 2HB GLN 331 1HB GLN 31 1.549 -2.741 -2.741 309 1HG GLN 331 2HG GLN 31 1.599 -5.305 -5.305 310 2HG GLN 331 1HG GLN 31 -0.145 -5.240 -5.240 311 1HE2 GLN 331 2HE2 GLN 31 0.135 -4.379 -4.379 312 2HE2 GLN 331 1HE2 GLN 31 -0.903 -4.377 -4.377 313 H ILE 332 H ILE 32 3.083 -2.753 -2.753 314 HA ILE 332 HA ILE 32 2.281 0.120 0.120 315 HB ILE 332 HB ILE 32 3.694 -1.508 -1.508 316 1HG1 ILE 332 2HG1 ILE 32 1.185 -0.175 -0.175 317 2HG1 ILE 332 1HG1 ILE 32 0.973 -1.370 -1.370 318 1HG2 ILE 332 2HG2 ILE 32 2.943 1.410 1.410 319 2HG2 ILE 332 1HG2 ILE 32 3.245 0.652 0.652 320 3HG2 ILE 332 3HG2 ILE 32 4.527 0.720 0.720 321 1HD1 ILE 332 2HD1 ILE 32 2.529 -1.996 -1.996 322 2HD1 ILE 332 1HD1 ILE 32 0.782 -2.219 -2.219 323 3HD1 ILE 332 3HD1 ILE 32 1.840 -3.124 -3.124 324 H ARG 333 H ARG 33 3.811 1.426 1.426 325 HA ARG 333 HA ARG 33 6.333 0.250 0.250 326 1HB ARG 333 2HB ARG 33 4.723 2.561 2.561 327 2HB ARG 333 1HB ARG 33 6.394 3.052 3.052 328 1HG ARG 333 2HG ARG 33 6.859 0.862 0.862 329 2HG ARG 333 1HG ARG 33 5.268 1.283 1.283 330 1HD ARG 333 2HD ARG 33 7.739 3.032 3.032 331 2HD ARG 333 1HD ARG 33 6.889 2.430 2.430 332 HE ARG 333 HE ARG 33 5.134 4.035 4.035 333 1HH1 ARG 333 1HH2 ARG 33 4.482 4.567 4.567 334 2HH1 ARG 333 2HH2 ARG 33 5.466 5.886 5.886 335 1HH2 ARG 333 2HH1 ARG 33 7.804 5.529 5.529 336 2HH2 ARG 333 1HH1 ARG 33 7.349 6.429 6.429 337 H GLY 334 H GLY 34 8.342 0.603 0.603 338 1HA GLY 334 2HA GLY 34 9.655 2.363 2.363 339 2HA GLY 334 1HA GLY 34 8.376 2.124 2.124 340 H ARG 335 H ARG 35 9.274 0.971 0.971 341 HA ARG 335 HA ARG 35 9.956 -1.769 -1.769 342 1HB ARG 335 2HB ARG 35 11.963 -0.560 -0.560 343 2HB ARG 335 1HB ARG 35 12.440 -0.136 -0.136 344 1HG ARG 335 2HG ARG 35 13.400 -2.168 -2.168 345 2HG ARG 335 1HG ARG 35 11.779 -2.863 -2.863 346 1HD ARG 335 2HD ARG 35 12.574 -3.918 -3.918 347 2HD ARG 335 1HD ARG 35 12.171 -2.389 -2.389 348 HE ARG 335 HE ARG 35 14.529 -1.784 -1.784 349 1HH1 ARG 335 2HH1 ARG 35 16.372 -2.525 -2.525 350 2HH1 ARG 335 1HH1 ARG 35 16.835 -4.173 -4.173 351 1HH2 ARG 335 1HH2 ARG 35 13.986 -4.955 -4.955 352 2HH2 ARG 335 2HH2 ARG 35 15.485 -5.548 -5.548 353 H GLU 336 H GLU 36 10.958 1.150 1.150 354 HA GLU 336 HA GLU 36 11.115 -0.211 -0.211 355 1HB GLU 336 2HB GLU 36 11.868 2.259 2.259 356 2HB GLU 336 1HB GLU 36 10.428 2.665 2.665 357 1HG GLU 336 2HG GLU 36 11.656 0.902 0.902 358 2HG GLU 336 1HG GLU 36 13.050 1.667 1.667 359 H ARG 337 H ARG 37 8.566 1.664 1.664 360 HA ARG 337 HA ARG 37 6.694 1.529 1.529 361 1HB ARG 337 2HB ARG 37 6.614 2.279 2.279 362 2HB ARG 337 1HB ARG 37 5.081 1.756 1.756 363 1HG ARG 337 2HG ARG 37 5.521 3.374 3.374 364 2HG ARG 337 1HG ARG 37 6.868 4.005 4.005 365 1HD ARG 337 2HD ARG 37 4.029 3.842 3.842 366 2HD ARG 337 1HD ARG 37 4.706 5.283 5.283 367 HE ARG 337 HE ARG 37 6.440 4.413 4.413 368 1HH1 ARG 337 1HH2 ARG 37 5.499 7.240 7.240 369 2HH1 ARG 337 2HH2 ARG 37 4.523 7.519 7.519 370 1HH2 ARG 337 2HH1 ARG 37 4.264 4.158 4.158 371 2HH2 ARG 337 1HH1 ARG 37 3.827 5.774 5.774 372 H PHE 338 H PHE 38 7.273 -0.511 -0.511 373 HA PHE 338 HA PHE 38 5.077 -2.302 -2.302 374 1HB PHE 338 2HB PHE 38 6.588 -2.214 -2.214 375 2HB PHE 338 1HB PHE 38 7.838 -3.000 -3.000 376 HD1 PHE 338 HD1 PHE 38 7.561 -5.319 -5.319 377 HD2 PHE 338 HD2 PHE 38 4.609 -3.419 -3.419 378 HE1 PHE 338 HE1 PHE 38 6.539 -7.527 -7.527 379 HE2 PHE 338 HE2 PHE 38 3.586 -5.628 -5.628 380 HZ PHE 338 HZ PHE 38 4.552 -7.682 -7.682 381 H GLU 339 H GLU 39 8.215 -2.051 -2.051 382 HA GLU 339 HA GLU 39 8.074 -4.637 -4.637 383 1HB GLU 339 2HB GLU 39 9.763 -2.168 -2.168 384 2HB GLU 339 1HB GLU 39 9.800 -3.407 -3.407 385 1HG GLU 339 2HG GLU 39 10.062 -4.281 -4.281 386 2HG GLU 339 1HG GLU 39 11.455 -3.519 -3.519 387 H MET 340 H MET 40 7.213 -1.307 -1.307 388 HA MET 340 HA MET 40 6.538 -1.743 -1.743 389 1HB MET 340 2HB MET 40 5.732 0.220 0.220 390 2HB MET 340 1HB MET 40 4.729 0.122 0.122 391 1HG MET 340 2HG MET 40 6.565 0.650 0.650 392 2HG MET 340 1HG MET 40 7.736 0.398 0.398 393 1HE MET 340 3HE MET 40 4.364 1.969 1.969 394 2HE MET 340 2HE MET 40 4.463 3.586 3.586 395 3HE MET 340 1HE MET 40 4.478 2.179 2.179 396 H PHE 341 H PHE 41 4.386 -1.772 -1.772 397 HA PHE 341 HA PHE 41 2.099 -2.757 -2.757 398 1HB PHE 341 2HB PHE 41 2.919 -2.891 -2.891 399 2HB PHE 341 1HB PHE 41 1.372 -3.509 -3.509 400 HD1 PHE 341 HD2 PHE 41 0.814 -1.469 -1.469 401 HD2 PHE 341 HD1 PHE 41 2.236 -1.025 -1.025 402 HE1 PHE 341 HE2 PHE 41 -0.119 0.823 0.823 403 HE2 PHE 341 HE1 PHE 41 1.301 1.269 1.269 404 HZ PHE 341 HZ PHE 41 0.125 2.195 2.195 405 H ARG 342 H ARG 42 4.826 -4.379 -4.379 406 HA ARG 342 HA ARG 42 3.816 -7.013 -7.013 407 1HB ARG 342 2HB ARG 42 6.360 -5.758 -5.758 408 2HB ARG 342 1HB ARG 42 6.559 -7.076 -7.076 409 1HG ARG 342 2HG ARG 42 5.023 -7.522 -7.522 410 2HG ARG 342 1HG ARG 42 6.786 -7.602 -7.602 411 1HD ARG 342 2HD ARG 42 5.984 -9.083 -9.083 412 2HD ARG 342 1HD ARG 42 4.871 -9.554 -9.554 413 HE ARG 342 HE ARG 42 7.825 -9.622 -9.622 414 1HH1 ARG 342 1HH2 ARG 42 5.231 -11.535 -11.535 415 2HH1 ARG 342 2HH2 ARG 42 5.482 -12.766 -12.766 416 1HH2 ARG 342 2HH1 ARG 42 7.922 -10.989 -10.989 417 2HH2 ARG 342 1HH1 ARG 42 7.005 -12.457 -12.457 418 H GLU 343 H GLU 43 5.336 -5.189 -5.189 419 HA GLU 343 HA GLU 43 5.349 -7.336 -7.336 420 1HB GLU 343 2HB GLU 43 6.633 -5.183 -5.183 421 2HB GLU 343 1HB GLU 43 5.107 -4.369 -4.369 422 1HG GLU 343 2HG GLU 43 5.887 -4.868 -4.868 423 2HG GLU 343 1HG GLU 43 4.834 -6.243 -6.243 424 H LEU 344 H LEU 44 2.980 -4.767 -4.767 425 HA LEU 344 HA LEU 44 1.138 -5.476 -5.476 426 1HB LEU 344 2HB LEU 44 0.949 -3.972 -3.972 427 2HB LEU 344 1HB LEU 44 -0.543 -4.451 -4.451 428 HG LEU 344 HG LEU 44 -0.160 -2.321 -2.321 429 1HD1 LEU 344 1HD1 LEU 44 -0.139 -4.347 -4.347 430 2HD1 LEU 344 3HD1 LEU 44 1.481 -3.734 -3.734 431 3HD1 LEU 344 2HD1 LEU 44 0.083 -2.682 -2.682 432 1HD2 LEU 344 1HD2 LEU 44 2.408 -2.685 -2.685 433 2HD2 LEU 344 3HD2 LEU 44 1.850 -1.282 -1.282 434 3HD2 LEU 344 2HD2 LEU 44 2.645 -2.616 -2.616 435 H ASN 345 H ASN 45 1.849 -6.878 -6.878 436 HA ASN 345 HA ASN 45 -0.612 -8.499 -8.499 437 1HB ASN 345 2HB ASN 45 1.465 -7.790 -7.790 438 2HB ASN 345 1HB ASN 45 1.216 -9.536 -9.536 439 1HD2 ASN 345 2HD2 ASN 45 -1.572 -7.159 -7.159 440 2HD2 ASN 345 1HD2 ASN 45 -0.094 -6.552 -6.552 441 H GLU 346 H GLU 46 2.583 -8.660 -8.660 442 HA GLU 346 HA GLU 46 2.837 -11.551 -11.551 443 1HB GLU 346 2HB GLU 46 4.693 -9.739 -9.739 444 2HB GLU 346 1HB GLU 46 4.196 -9.687 -9.687 445 1HG GLU 346 2HG GLU 46 4.638 -12.064 -12.064 446 2HG GLU 346 1HG GLU 46 4.996 -12.217 -12.217 447 H ALA 347 H ALA 47 1.848 -9.081 -9.081 448 HA ALA 347 HA ALA 47 1.230 -11.039 -11.039 449 1HB ALA 347 3HB ALA 47 0.784 -8.097 -8.097 450 2HB ALA 347 2HB ALA 47 -0.140 -8.945 -8.945 451 3HB ALA 347 1HB ALA 47 1.623 -8.944 -8.944 452 H LEU 348 H LEU 48 -0.776 -9.064 -9.064 453 HA LEU 348 HA LEU 48 -3.305 -10.030 -10.030 454 1HB LEU 348 2HB LEU 48 -2.220 -9.212 -9.212 455 2HB LEU 348 1HB LEU 48 -3.914 -9.639 -9.639 456 HG LEU 348 HG LEU 48 -2.431 -7.485 -7.485 457 1HD1 LEU 348 2HD1 LEU 48 -3.092 -7.236 -7.236 458 2HD1 LEU 348 1HD1 LEU 48 -4.684 -6.921 -6.921 459 3HD1 LEU 348 3HD1 LEU 48 -3.313 -5.905 -5.905 460 1HD2 LEU 348 3HD2 LEU 48 -4.828 -8.917 -8.917 461 2HD2 LEU 348 2HD2 LEU 48 -4.199 -7.508 -7.508 462 3HD2 LEU 348 1HD2 LEU 48 -5.300 -7.297 -7.297 463 H GLU 349 H GLU 49 -1.117 -11.376 -11.376 464 HA GLU 349 HA GLU 49 -2.724 -13.655 -13.655 465 1HB GLU 349 2HB GLU 49 -0.805 -12.932 -12.932 466 2HB GLU 349 1HB GLU 49 0.299 -13.399 -13.399 467 1HG GLU 349 2HG GLU 49 -0.351 -15.713 -15.713 468 2HG GLU 349 1HG GLU 49 -1.660 -15.314 -15.314 469 H LEU 350 H LEU 50 -0.377 -12.996 -12.996 470 HA LEU 350 HA LEU 50 -0.117 -15.683 -15.683 471 1HB LEU 350 2HB LEU 50 1.342 -14.694 -14.694 472 2HB LEU 350 1HB LEU 50 0.898 -13.148 -13.148 473 HG LEU 350 HG LEU 50 -1.018 -13.058 -13.058 474 1HD1 LEU 350 2HD1 LEU 50 0.165 -15.668 -15.668 475 2HD1 LEU 350 1HD1 LEU 50 -0.059 -14.641 -14.641 476 3HD1 LEU 350 3HD1 LEU 50 -1.435 -15.037 -15.037 477 1HD2 LEU 350 3HD2 LEU 50 1.861 -13.129 -13.129 478 2HD2 LEU 350 2HD2 LEU 50 0.943 -11.720 -11.720 479 3HD2 LEU 350 1HD2 LEU 50 0.538 -12.515 -12.515 480 H LYS 351 H LYS 51 -2.529 -13.180 -13.180 481 HA LYS 351 HA LYS 51 -3.904 -14.411 -14.411 482 1HB LYS 351 2HB LYS 51 -4.183 -12.020 -12.020 483 2HB LYS 351 1HB LYS 51 -5.216 -12.740 -12.740 484 1HG LYS 351 2HG LYS 51 -6.902 -13.184 -13.184 485 2HG LYS 351 1HG LYS 51 -5.787 -13.560 -13.560 486 1HD LYS 351 2HD LYS 51 -7.008 -11.490 -11.490 487 2HD LYS 351 1HD LYS 51 -5.297 -11.137 -11.137 488 1HE LYS 351 2HE LYS 51 -6.136 -9.534 -9.534 489 2HE LYS 351 1HE LYS 51 -6.194 -10.881 -10.881 490 1HZ LYS 351 3HZ LYS 51 -8.492 -11.307 -11.307 491 2HZ LYS 351 2HZ LYS 51 -8.390 -9.753 -9.753 492 3HZ LYS 351 1HZ LYS 51 -8.317 -9.952 -9.952 493 H ASP 352 H ASP 52 -4.210 -14.682 -14.682 494 HA ASP 352 HA ASP 52 -6.536 -16.292 -16.292 495 1HB ASP 352 2HB ASP 52 -5.039 -15.283 -15.283 496 2HB ASP 352 1HB ASP 52 -4.211 -16.837 -16.837 497 H ALA 353 H ALA 53 -3.175 -17.121 -17.121 498 HA ALA 353 HA ALA 53 -3.782 -19.996 -19.996 499 1HB ALA 353 2HB ALA 53 -1.293 -18.398 -18.398 500 2HB ALA 353 1HB ALA 53 -1.395 -20.154 -20.154 501 3HB ALA 353 3HB ALA 53 -1.576 -19.373 -19.373 502 H GLN 354 H GLN 54 -1.797 -18.542 -18.542 503 HA GLN 354 HA GLN 54 -1.955 -18.853 -18.853 504 1HB GLN 354 2HB GLN 54 -4.438 -17.467 -17.467 505 2HB GLN 354 1HB GLN 54 -4.349 -17.972 -17.972 506 1HG GLN 354 2HG GLN 54 -1.844 -16.791 -16.791 507 2HG GLN 354 1HG GLN 54 -3.126 -15.700 -15.700 508 1HE2 GLN 354 2HE2 GLN 54 -4.134 -14.859 -14.859 509 2HE2 GLN 354 1HE2 GLN 54 -4.493 -14.739 -14.739 510 H ALA 355 HN ALA 55 -2.837 -21.164 -21.164 511 HA ALA 355 HA ALA 55 -4.102 -22.691 -22.691 512 1HB ALA 355 2HB ALA 55 -5.544 -22.052 -22.052 513 2HB ALA 355 1HB ALA 55 -5.916 -23.507 -23.507 514 3HB ALA 355 3HB ALA 55 -6.143 -21.916 -21.916 515 1H GLY 325 3H GLY 25 11.982 1.010 1.010 516 2H GLY 325 2H GLY 25 12.777 -0.343 -0.343 517 3H GLY 325 1H GLY 25 12.441 -0.270 -0.270 518 1HA GLY 325 2HA GLY 25 10.189 -0.644 -0.644 519 2HA GLY 325 1HA GLY 25 10.937 -1.710 -1.710 520 H GLU 326 H GLU 26 9.064 1.201 1.201 521 HA GLU 326 HA GLU 26 8.491 1.180 1.180 522 1HB GLU 326 2HB GLU 26 9.274 3.562 3.562 523 2HB GLU 326 1HB GLU 26 8.417 3.734 3.734 524 1HG GLU 326 2HG GLU 26 10.311 2.163 2.163 525 2HG GLU 326 1HG GLU 26 11.195 2.709 2.709 526 H TYR 327 H TYR 27 6.623 3.178 3.178 527 HA TYR 327 HA TYR 27 4.482 2.069 2.069 528 1HB TYR 327 2HB TYR 27 4.617 3.044 3.044 529 2HB TYR 327 1HB TYR 27 3.345 3.865 3.865 530 HD1 TYR 327 HD2 TYR 27 2.154 2.054 2.054 531 HD2 TYR 327 HD1 TYR 27 3.858 1.198 1.198 532 HE1 TYR 327 HE2 TYR 27 0.726 0.035 0.035 533 HE2 TYR 327 HE1 TYR 27 2.430 -0.821 -0.821 534 HH TYR 327 HH TYR 27 0.774 -1.988 -1.988 535 H PHE 328 H PHE 28 4.234 3.215 3.215 536 HA PHE 328 HA PHE 28 4.647 6.167 6.167 537 1HB PHE 328 2HB PHE 28 4.695 4.138 4.138 538 2HB PHE 328 1HB PHE 28 4.551 5.865 5.865 539 HD1 PHE 328 HD2 PHE 28 6.693 3.278 3.278 540 HD2 PHE 328 HD1 PHE 28 6.420 7.336 7.336 541 HE1 PHE 328 HE2 PHE 28 9.141 3.544 3.544 542 HE2 PHE 328 HE1 PHE 28 8.867 7.602 7.602 543 HZ PHE 328 HZ PHE 28 10.228 5.706 5.706 544 H THR 329 H THR 29 3.070 7.485 7.485 545 HA THR 329 HA THR 29 0.344 6.253 6.253 546 HB THR 329 HB THR 29 0.465 9.181 9.181 547 HG1 THR 329 HG1 THR 29 2.132 9.022 9.022 548 1HG2 THR 329 2HG2 THR 29 -1.431 7.375 7.375 549 2HG2 THR 329 1HG2 THR 29 -0.742 7.369 7.369 550 3HG2 THR 329 3HG2 THR 29 -1.372 8.868 8.868 551 H LEU 330 H LEU 30 -0.870 6.457 6.457 552 HA LEU 330 HA LEU 30 0.275 8.137 8.137 553 1HB LEU 330 2HB LEU 30 -0.366 5.358 5.358 554 2HB LEU 330 1HB LEU 30 -1.538 6.152 6.152 555 HG LEU 330 HG LEU 30 1.446 6.619 6.619 556 1HD1 LEU 330 2HD1 LEU 30 -0.347 4.600 4.600 557 2HD1 LEU 330 1HD1 LEU 30 1.141 5.166 5.166 558 3HD1 LEU 330 3HD1 LEU 30 1.205 4.329 4.329 559 1HD2 LEU 330 3HD2 LEU 30 -0.876 7.168 7.168 560 2HD2 LEU 330 2HD2 LEU 30 -0.015 8.379 8.379 561 3HD2 LEU 330 1HD2 LEU 30 0.819 7.515 7.515 562 H GLN 331 H GLN 31 -1.016 9.943 9.943 563 HA GLN 331 HA GLN 31 -3.908 9.688 9.688 564 1HB GLN 331 2HB GLN 31 -1.988 12.015 12.015 565 2HB GLN 331 1HB GLN 31 -3.733 12.268 12.268 566 1HG GLN 331 2HG GLN 31 -3.800 10.654 10.654 567 2HG GLN 331 1HG GLN 31 -2.058 10.914 10.914 568 1HE2 GLN 331 2HE2 GLN 31 -2.360 14.289 14.289 569 2HE2 GLN 331 1HE2 GLN 31 -1.313 13.171 13.171 570 H ILE 332 H ILE 32 -5.273 9.626 9.626 571 HA ILE 332 HA ILE 32 -4.468 11.039 11.039 572 HB ILE 332 HB ILE 32 -5.876 8.357 8.357 573 1HG1 ILE 332 2HG1 ILE 32 -3.362 8.505 8.505 574 2HG1 ILE 332 1HG1 ILE 32 -3.156 8.930 8.930 575 1HG2 ILE 332 2HG2 ILE 32 -5.123 10.151 10.151 576 2HG2 ILE 332 1HG2 ILE 32 -5.422 8.425 8.425 577 3HG2 ILE 332 3HG2 ILE 32 -6.707 9.475 9.475 578 1HD1 ILE 332 2HD1 ILE 32 -4.706 6.479 6.479 579 2HD1 ILE 332 1HD1 ILE 32 -2.960 6.436 6.436 580 3HD1 ILE 332 3HD1 ILE 32 -4.027 6.851 6.851 581 H ARG 333 H ARG 33 -5.991 12.513 12.513 582 HA ARG 333 HA ARG 33 -8.523 12.631 12.631 583 1HB ARG 333 2HB ARG 33 -6.916 14.423 14.423 584 2HB ARG 333 1HB ARG 33 -8.585 14.447 14.447 585 1HG ARG 333 2HG ARG 33 -9.057 14.513 14.513 586 2HG ARG 333 1HG ARG 33 -7.469 15.282 15.282 587 1HD ARG 333 2HD ARG 33 -9.941 16.156 16.156 588 2HD ARG 333 1HD ARG 33 -9.100 17.037 17.037 589 HE ARG 333 HE ARG 33 -7.343 17.560 17.560 590 1HH1 ARG 333 1HH2 ARG 33 -6.683 15.681 15.681 591 2HH1 ARG 333 2HH2 ARG 33 -7.664 15.929 15.929 592 1HH2 ARG 333 2HH1 ARG 33 -10.012 17.870 17.870 593 2HH2 ARG 333 1HH1 ARG 33 -9.548 17.172 17.172 594 H GLY 334 H GLY 34 -10.532 12.055 12.055 595 1HA GLY 334 2HA GLY 34 -11.850 11.854 11.854 596 2HA GLY 334 1HA GLY 34 -10.569 10.728 10.728 597 H ARG 335 H ARG 35 -11.465 8.724 8.724 598 HA ARG 335 HA ARG 35 -12.146 7.459 7.459 599 1HB ARG 335 2HB ARG 35 -14.158 9.070 9.070 600 2HB ARG 335 1HB ARG 35 -14.627 7.915 7.915 601 1HG ARG 335 2HG ARG 35 -15.582 6.675 6.675 602 2HG ARG 335 1HG ARG 35 -13.961 6.347 6.347 603 1HD ARG 335 2HD ARG 35 -14.768 7.341 7.341 604 2HD ARG 335 1HD ARG 35 -14.369 8.827 8.827 605 HE ARG 335 HE ARG 35 -16.725 9.073 9.073 606 1HH1 ARG 335 2HH1 ARG 35 -18.561 7.361 7.361 607 2HH1 ARG 335 1HH1 ARG 35 -19.028 6.692 6.692 608 1HH2 ARG 335 1HH2 ARG 35 -16.188 7.804 7.804 609 2HH2 ARG 335 2HH2 ARG 35 -17.685 6.946 6.946 610 H GLU 336 H GLU 36 -13.159 7.513 7.513 611 HA GLU 336 HA GLU 36 -13.296 4.645 4.645 612 1HB GLU 336 2HB GLU 36 -14.054 6.729 6.729 613 2HB GLU 336 1HB GLU 36 -12.604 6.175 6.175 614 1HG GLU 336 2HG GLU 36 -13.816 3.794 3.794 615 2HG GLU 336 1HG GLU 36 -15.217 4.836 4.836 616 H ARG 337 H ARG 37 -10.753 7.038 7.038 617 HA ARG 337 HA ARG 37 -8.873 5.130 5.130 618 1HB ARG 337 2HB ARG 37 -8.807 7.952 7.952 619 2HB ARG 337 1HB ARG 37 -7.272 7.086 7.086 620 1HG ARG 337 2HG ARG 37 -7.684 6.345 6.345 621 2HG ARG 337 1HG ARG 37 -9.034 7.479 7.479 622 1HD ARG 337 2HD ARG 37 -6.202 8.276 8.276 623 2HD ARG 337 1HD ARG 37 -6.871 8.415 8.415 624 HE ARG 337 HE ARG 37 -8.618 9.718 9.718 625 1HH1 ARG 337 1HH2 ARG 37 -7.670 10.858 10.858 626 2HH1 ARG 337 2HH2 ARG 37 -6.695 12.191 12.191 627 1HH2 ARG 337 2HH1 ARG 37 -6.440 11.059 11.059 628 2HH2 ARG 337 1HH1 ARG 37 -6.000 12.305 12.305 629 H PHE 338 H PHE 38 -9.470 6.427 6.427 630 HA PHE 338 HA PHE 38 -7.269 5.169 5.169 631 1HB PHE 338 2HB PHE 38 -8.779 6.901 6.901 632 2HB PHE 338 1HB PHE 38 -10.027 5.661 5.661 633 HD1 PHE 338 HD1 PHE 38 -9.750 3.747 3.747 634 HD2 PHE 338 HD2 PHE 38 -6.800 6.860 6.860 635 HE1 PHE 338 HE1 PHE 38 -8.731 2.948 2.948 636 HE2 PHE 338 HE2 PHE 38 -5.782 6.061 6.061 637 HZ PHE 338 HZ PHE 38 -6.748 4.105 4.105 638 H GLU 339 H GLU 39 -10.408 3.975 3.975 639 HA GLU 339 HA GLU 39 -10.258 1.468 1.468 640 1HB GLU 339 2HB GLU 39 -11.939 2.541 2.541 641 2HB GLU 339 1HB GLU 39 -11.973 0.815 0.815 642 1HG GLU 339 2HG GLU 39 -12.250 2.741 2.741 643 2HG GLU 339 1HG GLU 39 -13.639 2.498 2.498 644 H MET 340 H MET 40 -9.385 2.542 2.542 645 HA MET 340 HA MET 40 -8.699 0.020 0.020 646 1HB MET 340 2HB MET 40 -7.896 2.851 2.851 647 2HB MET 340 1HB MET 40 -6.887 1.583 1.583 648 1HG MET 340 2HG MET 40 -8.712 0.666 0.666 649 2HG MET 340 1HG MET 40 -9.893 1.608 1.608 650 1HE MET 340 3HE MET 40 -6.523 2.089 2.089 651 2HE MET 340 2HE MET 40 -6.619 3.540 3.540 652 3HE MET 340 1HE MET 40 -6.634 3.683 3.683 653 H PHE 341 H PHE 41 -6.560 2.411 2.411 654 HA PHE 341 HA PHE 41 -4.270 0.705 0.705 655 1HB PHE 341 2HB PHE 41 -5.087 3.075 3.075 656 2HB PHE 341 1HB PHE 41 -3.542 2.254 2.254 657 HD1 PHE 341 HD2 PHE 41 -2.984 1.552 1.552 658 HD2 PHE 341 HD1 PHE 41 -4.405 5.177 5.177 659 HE1 PHE 341 HE2 PHE 41 -2.054 2.862 2.862 660 HE2 PHE 341 HE1 PHE 41 -3.471 6.487 6.487 661 HZ PHE 341 HZ PHE 41 -2.299 5.332 5.332 662 H ARG 342 H ARG 42 -6.999 1.108 1.108 663 HA ARG 342 HA ARG 42 -5.994 -0.296 -0.296 664 1HB ARG 342 2HB ARG 42 -8.536 0.637 0.637 665 2HB ARG 342 1HB ARG 42 -8.728 -1.045 -1.045 666 1HG ARG 342 2HG ARG 42 -7.196 0.880 0.880 667 2HG ARG 342 1HG ARG 42 -8.958 0.830 0.830 668 1HD ARG 342 2HD ARG 42 -8.138 -1.860 -1.860 669 2HD ARG 342 1HD ARG 42 -7.038 -1.019 -1.019 670 HE ARG 342 HE ARG 42 -9.997 -0.704 -0.704 671 1HH1 ARG 342 1HH2 ARG 42 -7.403 -2.516 -2.516 672 2HH1 ARG 342 2HH2 ARG 42 -7.660 -2.179 -2.179 673 1HH2 ARG 342 2HH1 ARG 42 -10.107 0.209 0.209 674 2HH2 ARG 342 1HH1 ARG 42 -9.192 -0.634 -0.634 675 H GLU 343 H GLU 43 -7.488 -1.512 -1.512 676 HA GLU 343 HA GLU 43 -7.497 -4.279 -4.279 677 1HB GLU 343 2HB GLU 43 -8.762 -3.304 -3.304 678 2HB GLU 343 1HB GLU 43 -7.222 -3.182 -3.182 679 1HG GLU 343 2HG GLU 43 -8.021 -5.258 -5.258 680 2HG GLU 343 1HG GLU 43 -6.971 -5.710 -5.710 681 H LEU 344 H LEU 44 -5.133 -2.268 -2.268 682 HA LEU 344 HA LEU 44 -3.273 -4.378 -4.378 683 1HB LEU 344 2HB LEU 44 -3.130 -1.385 -1.385 684 2HB LEU 344 1HB LEU 44 -1.616 -2.278 -2.278 685 HG LEU 344 HG LEU 44 -1.899 -1.961 -1.961 686 1HD1 LEU 344 1HD1 LEU 44 -1.985 -4.485 -4.485 687 2HD1 LEU 344 3HD1 LEU 44 -3.607 -4.416 -4.416 688 3HD1 LEU 344 2HD1 LEU 44 -2.208 -4.061 -4.061 689 1HD2 LEU 344 1HD2 LEU 44 -4.472 -1.270 -1.270 690 2HD2 LEU 344 3HD2 LEU 44 -3.843 -1.378 -1.378 691 3HD2 LEU 344 2HD2 LEU 44 -4.719 -2.740 -2.740 692 H ASN 345 H ASN 45 -4.005 -2.538 -2.538 693 HA ASN 345 HA ASN 45 -1.530 -3.371 -3.371 694 1HB ASN 345 2HB ASN 45 -3.625 -1.410 -1.410 695 2HB ASN 345 1HB ASN 45 -3.367 -2.380 -2.380 696 1HD2 ASN 345 2HD2 ASN 45 -0.595 0.351 0.351 697 2HD2 ASN 345 1HD2 ASN 45 -2.063 0.180 0.180 698 H GLU 346 H GLU 46 -4.722 -4.515 -4.515 699 HA GLU 346 HA GLU 46 -4.957 -6.132 -6.132 700 1HB GLU 346 2HB GLU 46 -6.823 -5.359 -5.359 701 2HB GLU 346 1HB GLU 46 -6.325 -6.744 -6.744 702 1HG GLU 346 2HG GLU 46 -6.757 -8.260 -8.260 703 2HG GLU 346 1HG GLU 46 -7.128 -6.902 -6.902 704 H ALA 347 H ALA 47 -3.987 -6.781 -6.781 705 HA ALA 347 HA ALA 47 -3.366 -9.567 -9.567 706 1HB ALA 347 3HB ALA 47 -2.929 -7.659 -7.659 707 2HB ALA 347 2HB ALA 47 -2.036 -9.178 -9.178 708 3HB ALA 347 1HB ALA 47 -3.799 -9.194 -9.194 709 H LEU 348 H LEU 48 -1.381 -6.615 -6.615 710 HA LEU 348 HA LEU 48 1.157 -7.786 -7.786 711 1HB LEU 348 2HB LEU 48 0.074 -5.069 -5.069 712 2HB LEU 348 1HB LEU 48 1.768 -5.512 -5.512 713 HG LEU 348 HG LEU 48 0.282 -5.627 -5.627 714 1HD1 LEU 348 2HD1 LEU 48 0.945 -3.336 -3.336 715 2HD1 LEU 348 1HD1 LEU 48 2.539 -3.746 -3.746 716 3HD1 LEU 348 3HD1 LEU 48 1.173 -3.564 -3.564 717 1HD2 LEU 348 3HD2 LEU 48 2.688 -6.854 -6.854 718 2HD2 LEU 348 2HD2 LEU 48 2.043 -6.828 -6.828 719 3HD2 LEU 348 1HD2 LEU 48 3.146 -5.559 -5.559 720 H GLU 349 H GLU 49 -1.029 -6.405 -6.405 721 HA GLU 349 HA GLU 49 0.567 -7.140 -7.140 722 1HB GLU 349 2HB GLU 49 -1.361 -5.582 -5.582 723 2HB GLU 349 1HB GLU 49 -2.459 -6.928 -6.928 724 1HG GLU 349 2HG GLU 49 -1.809 -8.032 -8.032 725 2HG GLU 349 1HG GLU 49 -0.501 -6.878 -6.878 726 H LEU 350 H LEU 50 -1.763 -8.931 -8.931 727 HA LEU 350 HA LEU 50 -2.026 -11.178 -11.178 728 1HB LEU 350 2HB LEU 50 -3.478 -11.837 -11.837 729 2HB LEU 350 1HB LEU 50 -3.035 -10.406 -10.406 730 HG LEU 350 HG LEU 50 -1.114 -11.757 -11.757 731 1HD1 LEU 350 2HD1 LEU 50 -2.296 -13.698 -13.698 732 2HD1 LEU 350 1HD1 LEU 50 -2.065 -14.339 -14.339 733 3HD1 LEU 350 3HD1 LEU 50 -0.693 -13.680 -13.680 734 1HD2 LEU 350 3HD2 LEU 50 -3.990 -12.607 -12.607 735 2HD2 LEU 350 2HD2 LEU 50 -3.080 -11.393 -11.393 736 3HD2 LEU 350 1HD2 LEU 50 -2.661 -13.099 -13.099 737 H LYS 351 H LYS 51 0.387 -10.241 -10.241 738 HA LYS 351 HA LYS 51 1.768 -12.754 -12.754 739 1HB LYS 351 2HB LYS 51 2.049 -10.688 -10.688 740 2HB LYS 351 1HB LYS 51 3.076 -10.038 -10.038 741 1HG LYS 351 2HG LYS 51 4.768 -11.517 -11.517 742 2HG LYS 351 1HG LYS 51 3.658 -12.828 -12.828 743 1HD LYS 351 2HD LYS 51 4.884 -12.122 -12.122 744 2HD LYS 351 1HD LYS 51 3.174 -11.721 -11.721 745 1HE LYS 351 2HE LYS 51 4.009 -9.671 -9.671 746 2HE LYS 351 1HE LYS 51 4.061 -9.448 -9.448 747 1HZ LYS 351 3HZ LYS 51 6.363 -10.467 -10.467 748 2HZ LYS 351 2HZ LYS 51 6.265 -10.197 -10.197 749 3HZ LYS 351 1HZ LYS 51 6.184 -8.889 -8.889 750 H ASP 352 H ASP 52 2.065 -9.937 -9.937 751 HA ASP 352 HA ASP 52 4.390 -10.712 -10.712 752 1HB ASP 352 2HB ASP 52 2.883 -8.560 -8.560 753 2HB ASP 352 1HB ASP 52 2.057 -9.483 -9.483 754 H ALA 353 H ALA 53 1.034 -11.765 -11.765 755 HA ALA 353 HA ALA 53 1.647 -13.408 -13.408 756 1HB ALA 353 2HB ALA 53 -0.844 -13.111 -13.111 757 2HB ALA 353 1HB ALA 53 -0.740 -14.171 -14.171 758 3HB ALA 353 3HB ALA 53 -0.564 -12.427 -12.427 759 H GLN 354 H GLN 54 -0.334 -14.718 -14.718 760 HA GLN 354 HA GLN 54 -0.172 -16.851 -16.851 761 1HB GLN 354 2HB GLN 54 2.314 -15.319 -15.319 762 2HB GLN 354 1HB GLN 54 2.221 -17.012 -17.012 763 1HG GLN 354 2HG GLN 54 -0.278 -15.777 -15.777 764 2HG GLN 354 1HG GLN 54 1.009 -14.748 -14.748 765 1HE2 GLN 354 2HE2 GLN 54 2.014 -17.062 -17.062 766 2HE2 GLN 354 1HE2 GLN 54 2.372 -15.605 -15.605 767 H ALA 355 HN ALA 55 0.711 -16.657 -16.657 768 HA ALA 355 HA ALA 55 1.976 -19.298 -19.298 769 1HB ALA 355 2HB ALA 55 3.413 -16.783 -16.783 770 2HB ALA 355 1HB ALA 55 3.779 -18.336 -18.336 771 3HB ALA 355 3HB ALA 55 4.019 -18.115 -18.115 772 1H GLY 325 3H GLY 25 -15.918 11.827 11.827 773 2H GLY 325 2H GLY 25 -16.704 13.040 13.040 774 3H GLY 325 1H GLY 25 -16.164 11.628 11.628 775 1HA GLY 325 2HA GLY 25 -13.953 12.235 12.235 776 2HA GLY 325 1HA GLY 25 -14.776 13.760 13.760 777 H GLU 326 H GLU 26 -13.036 11.912 11.912 778 HA GLU 326 HA GLU 26 -12.805 14.400 14.400 779 1HB GLU 326 2HB GLU 26 -13.532 11.636 11.636 780 2HB GLU 326 1HB GLU 26 -12.874 12.878 12.878 781 1HG GLU 326 2HG GLU 26 -14.764 14.379 14.379 782 2HG GLU 326 1HG GLU 26 -15.506 12.829 12.829 783 H TYR 327 H TYR 27 -11.088 13.524 13.524 784 HA TYR 327 HA TYR 27 -8.698 12.798 12.798 785 1HB TYR 327 2HB TYR 27 -9.201 14.551 14.551 786 2HB TYR 327 1HB TYR 27 -7.886 13.428 13.428 787 HD1 TYR 327 HD2 TYR 27 -6.398 13.007 13.007 788 HD2 TYR 327 HD1 TYR 27 -8.466 16.593 16.593 789 HE1 TYR 327 HE2 TYR 27 -4.880 14.344 14.344 790 HE2 TYR 327 HE1 TYR 27 -6.948 17.928 17.928 791 HH TYR 327 HH TYR 27 -5.146 17.895 17.895 792 H PHE 328 H PHE 28 -8.296 10.638 10.638 793 HA PHE 328 HA PHE 28 -8.903 9.081 9.081 794 1HB PHE 328 2HB PHE 28 -8.570 8.313 8.313 795 2HB PHE 328 1HB PHE 28 -8.492 7.105 7.105 796 HD1 PHE 328 HD2 PHE 28 -10.643 9.704 9.704 797 HD2 PHE 328 HD1 PHE 28 -10.460 6.369 6.369 798 HE1 PHE 328 HE2 PHE 28 -13.120 9.648 9.648 799 HE2 PHE 328 HE1 PHE 28 -12.938 6.313 6.313 800 HZ PHE 328 HZ PHE 28 -14.267 7.953 7.953 801 H THR 329 H THR 29 -7.267 7.401 7.401 802 HA THR 329 HA THR 29 -4.500 8.316 8.316 803 HB THR 329 HB THR 29 -4.824 6.872 6.872 804 HG1 THR 329 HG1 THR 29 -6.613 7.971 7.971 805 1HG2 THR 329 2HG2 THR 29 -2.880 8.328 8.328 806 2HG2 THR 329 1HG2 THR 29 -3.745 9.643 9.643 807 3HG2 THR 329 3HG2 THR 29 -3.133 8.290 8.290 808 H LEU 330 H LEU 30 -3.096 6.741 6.741 809 HA LEU 330 HA LEU 30 -4.083 3.918 3.918 810 1HB LEU 330 2HB LEU 30 -3.289 5.505 5.505 811 2HB LEU 330 1HB LEU 30 -2.054 4.268 4.268 812 HG LEU 330 HG LEU 30 -5.018 3.654 3.654 813 1HD1 LEU 330 2HD1 LEU 30 -2.965 3.728 3.728 814 2HD1 LEU 330 1HD1 LEU 30 -4.391 2.695 2.695 815 3HD1 LEU 330 3HD1 LEU 30 -4.576 4.445 4.445 816 1HD2 LEU 330 3HD2 LEU 30 -2.529 1.939 1.939 817 2HD2 LEU 330 2HD2 LEU 30 -3.570 2.017 2.017 818 3HD2 LEU 330 1HD2 LEU 30 -4.190 1.350 1.350 819 H GLN 331 H GLN 31 -3.005 3.671 3.671 820 HA GLN 331 HA GLN 31 -0.148 4.164 4.164 821 1HB GLN 331 2HB GLN 31 -2.199 2.775 2.775 822 2HB GLN 331 1HB GLN 31 -0.483 2.734 2.734 823 1HG GLN 331 2HG GLN 31 -0.549 5.301 5.301 824 2HG GLN 331 1HG GLN 31 -2.304 5.133 5.133 825 1HE2 GLN 331 2HE2 GLN 31 -2.341 4.262 4.262 826 2HE2 GLN 331 1HE2 GLN 31 -3.228 4.201 4.201 827 H ILE 332 H ILE 32 1.405 2.858 2.858 828 HA ILE 332 HA ILE 32 0.805 -0.059 -0.059 829 HB ILE 332 HB ILE 32 2.339 1.651 1.651 830 1HG1 ILE 332 2HG1 ILE 32 0.007 0.165 0.165 831 2HG1 ILE 332 1HG1 ILE 32 -0.416 1.348 1.348 832 1HG2 ILE 332 2HG2 ILE 32 1.753 -1.308 -1.308 833 2HG2 ILE 332 1HG2 ILE 32 2.170 -0.535 -0.535 834 3HG2 ILE 332 3HG2 ILE 32 3.317 -0.518 -0.518 835 1HD1 ILE 332 2HD1 ILE 32 1.370 2.067 2.067 836 2HD1 ILE 332 1HD1 ILE 32 -0.386 2.176 2.176 837 3HD1 ILE 332 3HD1 ILE 32 0.483 3.150 3.150 838 H ARG 333 H ARG 33 2.289 -1.262 -1.262 839 HA ARG 333 HA ARG 33 4.626 0.050 0.050 840 1HB ARG 333 2HB ARG 33 3.104 -2.359 -2.359 841 2HB ARG 333 1HB ARG 33 4.823 -2.743 -2.743 842 1HG ARG 333 2HG ARG 33 4.980 -0.532 -0.532 843 2HG ARG 333 1HG ARG 33 3.361 -1.063 -1.063 844 1HD ARG 333 2HD ARG 33 5.937 -2.641 -2.641 845 2HD ARG 333 1HD ARG 33 4.903 -2.102 -2.102 846 HE ARG 333 HE ARG 33 3.312 -3.820 -3.820 847 1HH1 ARG 333 1HH2 ARG 33 2.984 -4.379 -4.379 848 2HH1 ARG 333 2HH2 ARG 33 4.102 -5.632 -5.632 849 1HH2 ARG 333 2HH1 ARG 33 6.115 -5.141 -5.141 850 2HH2 ARG 333 1HH1 ARG 33 5.875 -6.062 -6.062 851 H GLY 334 H GLY 34 6.742 -0.163 -0.163 852 1HA GLY 334 2HA GLY 34 8.317 -1.829 -1.829 853 2HA GLY 334 1HA GLY 34 7.170 -1.680 -1.680 854 H ARG 335 H ARG 35 8.179 -0.480 -0.480 855 HA ARG 335 HA ARG 35 8.650 2.301 2.301 856 1HB ARG 335 2HB ARG 35 10.595 1.214 1.214 857 2HB ARG 335 1HB ARG 35 11.271 0.832 0.832 858 1HG ARG 335 2HG ARG 35 12.104 2.926 2.926 859 2HG ARG 335 1HG ARG 35 10.446 3.511 3.511 860 1HD ARG 335 2HD ARG 35 10.967 4.607 4.607 861 2HD ARG 335 1HD ARG 35 10.580 3.052 3.052 862 HE ARG 335 HE ARG 35 12.966 2.599 2.599 863 1HH1 ARG 335 2HH1 ARG 35 14.916 3.458 3.458 864 2HH1 ARG 335 1HH1 ARG 35 15.242 5.131 5.131 865 1HH2 ARG 335 1HH2 ARG 35 12.168 5.729 5.729 866 2HH2 ARG 335 2HH2 ARG 35 13.687 6.416 6.416 867 H GLU 336 H GLU 36 10.041 -0.539 -0.539 868 HA GLU 336 HA GLU 36 10.379 0.830 0.830 869 1HB GLU 336 2HB GLU 36 11.178 -1.594 -1.594 870 2HB GLU 336 1HB GLU 36 9.872 -2.083 -2.083 871 1HG GLU 336 2HG GLU 36 11.167 -0.240 -0.240 872 2HG GLU 336 1HG GLU 36 12.515 -0.929 -0.929 873 H ARG 337 H ARG 37 7.792 -1.222 -1.222 874 HA ARG 337 HA ARG 37 6.163 -1.187 -1.187 875 1HB ARG 337 2HB ARG 37 5.827 -1.958 -1.958 876 2HB ARG 337 1HB ARG 37 4.346 -1.516 -1.516 877 1HG ARG 337 2HG ARG 37 5.070 -3.089 -3.089 878 2HG ARG 337 1HG ARG 37 6.344 -3.653 -3.653 879 1HD ARG 337 2HD ARG 37 3.404 -3.656 -3.656 880 2HD ARG 337 1HD ARG 37 4.245 -5.053 -5.053 881 HE ARG 337 HE ARG 37 5.682 -4.084 -4.084 882 1HH1 ARG 337 1HH2 ARG 37 4.974 -6.963 -6.963 883 2HH1 ARG 337 2HH2 ARG 37 3.871 -7.309 -7.309 884 1HH2 ARG 337 2HH1 ARG 37 3.310 -3.972 -3.972 885 2HH2 ARG 337 1HH1 ARG 37 2.925 -5.615 -5.615 886 H PHE 338 H PHE 38 6.306 0.880 0.880 887 HA PHE 338 HA PHE 38 4.049 2.513 2.513 888 1HB PHE 338 2HB PHE 38 5.318 2.527 2.527 889 2HB PHE 338 1HB PHE 38 6.617 3.393 3.393 890 HD1 PHE 338 HD1 PHE 38 6.283 5.689 5.689 891 HD2 PHE 338 HD2 PHE 38 3.200 3.608 3.608 892 HE1 PHE 338 HE1 PHE 38 5.083 7.831 7.831 893 HE2 PHE 338 HE2 PHE 38 2.001 5.749 5.749 894 HZ PHE 338 HZ PHE 38 2.941 7.860 7.860 895 H GLU 339 H GLU 39 7.349 2.487 2.487 896 HA GLU 339 HA GLU 39 7.195 5.060 5.060 897 1HB GLU 339 2HB GLU 39 9.052 2.699 2.699 898 2HB GLU 339 1HB GLU 39 9.156 3.936 3.936 899 1HG GLU 339 2HG GLU 39 9.043 4.820 4.820 900 2HG GLU 339 1HG GLU 39 10.559 4.155 4.155 901 H MET 340 H MET 40 6.625 1.691 1.691 902 HA MET 340 HA MET 40 6.232 2.094 2.094 903 1HB MET 340 2HB MET 40 5.326 0.081 0.081 904 2HB MET 340 1HB MET 40 4.479 0.121 0.121 905 1HG MET 340 2HG MET 40 6.482 -0.295 -0.295 906 2HG MET 340 1HG MET 40 7.494 0.031 0.031 907 1HE MET 340 3HE MET 40 4.298 -1.745 -1.745 908 2HE MET 340 2HE MET 40 4.421 -3.354 -3.354 909 3HE MET 340 1HE MET 40 4.231 -1.950 -1.950 910 H PHE 341 H PHE 41 3.782 1.983 1.983 911 HA PHE 341 HA PHE 41 1.606 2.825 2.825 912 1HB PHE 341 2HB PHE 41 2.089 3.001 3.001 913 2HB PHE 341 1HB PHE 41 0.581 3.524 3.524 914 HD1 PHE 341 HD2 PHE 41 0.390 1.459 1.459 915 HD2 PHE 341 HD1 PHE 41 1.384 1.090 1.090 916 HE1 PHE 341 HE2 PHE 41 -0.399 -0.889 -0.889 917 HE2 PHE 341 HE1 PHE 41 0.593 -1.258 -1.258 918 HZ PHE 341 HZ PHE 41 -0.295 -2.250 -2.250 919 H ARG 342 H ARG 42 4.045 4.617 4.617 920 HA ARG 342 HA ARG 42 2.880 7.194 7.194 921 1HB ARG 342 2HB ARG 42 5.448 6.088 6.088 922 2HB ARG 342 1HB ARG 42 5.683 7.429 7.429 923 1HG ARG 342 2HG ARG 42 3.850 7.742 7.742 924 2HG ARG 342 1HG ARG 42 5.593 7.938 7.938 925 1HD ARG 342 2HD ARG 42 4.940 9.385 9.385 926 2HD ARG 342 1HD ARG 42 3.670 9.772 9.772 927 HE ARG 342 HE ARG 42 6.550 10.027 10.027 928 1HH1 ARG 342 1HH2 ARG 42 3.963 11.781 11.781 929 2HH1 ARG 342 2HH2 ARG 42 4.001 13.019 13.019 930 1HH2 ARG 342 2HH1 ARG 42 6.344 11.387 11.387 931 2HH2 ARG 342 1HH1 ARG 42 5.350 12.795 12.795 932 H GLU 343 H GLU 43 4.765 5.436 5.436 933 HA GLU 343 HA GLU 43 4.865 7.592 7.592 934 1HB GLU 343 2HB GLU 43 6.303 5.526 5.526 935 2HB GLU 343 1HB GLU 43 4.882 4.618 4.618 936 1HG GLU 343 2HG GLU 43 5.861 5.181 5.181 937 2HG GLU 343 1HG GLU 43 4.691 6.483 6.483 938 H LEU 344 H LEU 44 2.589 4.895 4.895 939 HA LEU 344 HA LEU 44 0.949 5.486 5.486 940 1HB LEU 344 2HB LEU 44 0.582 3.951 3.951 941 2HB LEU 344 1HB LEU 44 -0.851 4.355 4.355 942 HG LEU 344 HG LEU 44 -0.280 2.267 2.267 943 1HD1 LEU 344 1HD1 LEU 44 -0.188 4.281 4.281 944 2HD1 LEU 344 3HD1 LEU 44 1.504 3.803 3.803 945 3HD1 LEU 344 2HD1 LEU 44 0.231 2.646 2.646 946 1HD2 LEU 344 1HD2 LEU 44 2.154 2.713 2.713 947 2HD2 LEU 344 3HD2 LEU 44 1.754 1.306 1.306 948 3HD2 LEU 344 2HD2 LEU 44 2.581 2.684 2.684 949 H ASN 345 H ASN 45 1.228 6.923 6.923 950 HA ASN 345 HA ASN 45 -1.324 8.378 8.378 951 1HB ASN 345 2HB ASN 45 0.577 7.808 7.808 952 2HB ASN 345 1HB ASN 45 0.217 9.534 9.534 953 1HD2 ASN 345 2HD2 ASN 45 -2.583 6.971 6.971 954 2HD2 ASN 345 1HD2 ASN 45 -1.019 6.457 6.457 955 H GLU 346 H GLU 46 1.969 8.750 8.750 956 HA GLU 346 HA GLU 46 2.035 11.653 11.653 957 1HB GLU 346 2HB GLU 46 4.023 9.964 9.964 958 2HB GLU 346 1HB GLU 46 3.723 9.885 9.885 959 1HG GLU 346 2HG GLU 46 4.037 12.290 12.290 960 2HG GLU 346 1HG GLU 46 4.198 12.455 12.455 961 H ALA 347 H ALA 47 1.488 9.123 9.123 962 HA ALA 347 HA ALA 47 0.974 11.037 11.037 963 1HB ALA 347 3HB ALA 47 0.645 8.073 8.073 964 2HB ALA 347 2HB ALA 47 -0.156 8.874 8.874 965 3HB ALA 347 1HB ALA 47 1.599 8.959 8.959 966 H LEU 348 H LEU 48 -1.132 8.941 8.941 967 HA LEU 348 HA LEU 48 -3.621 9.752 9.752 968 1HB LEU 348 2HB LEU 48 -2.789 9.015 9.015 969 2HB LEU 348 1HB LEU 48 -4.468 9.320 9.320 970 HG LEU 348 HG LEU 48 -2.670 7.263 7.263 971 1HD1 LEU 348 2HD1 LEU 48 -3.641 6.991 6.991 972 2HD1 LEU 348 1HD1 LEU 48 -5.110 6.572 6.572 973 3HD1 LEU 348 3HD1 LEU 48 -3.633 5.640 5.640 974 1HD2 LEU 348 3HD2 LEU 48 -5.078 8.534 8.534 975 2HD2 LEU 348 2HD2 LEU 48 -4.236 7.187 7.187 976 3HD2 LEU 348 1HD2 LEU 48 -5.484 6.875 6.875 977 H GLU 349 H GLU 49 -1.802 11.220 11.220 978 HA GLU 349 HA GLU 49 -3.601 13.396 13.396 979 1HB GLU 349 2HB GLU 49 -1.802 12.795 12.795 980 2HB GLU 349 1HB GLU 49 -0.595 13.333 13.333 981 1HG GLU 349 2HG GLU 49 -1.406 15.602 15.602 982 2HG GLU 349 1HG GLU 49 -2.801 15.118 15.118 983 H LEU 350 H LEU 50 -0.960 12.899 12.899 984 HA LEU 350 HA LEU 50 -0.766 15.605 15.605 985 1HB LEU 350 2HB LEU 50 0.894 14.719 14.719 986 2HB LEU 350 1HB LEU 50 0.481 13.145 13.145 987 HG LEU 350 HG LEU 50 -1.247 12.942 12.942 988 1HD1 LEU 350 2HD1 LEU 50 -0.163 15.616 15.616 989 2HD1 LEU 350 1HD1 LEU 50 -0.163 14.585 14.585 990 3HD1 LEU 350 3HD1 LEU 50 -1.666 14.889 14.889 991 1HD2 LEU 350 3HD2 LEU 50 1.708 13.179 13.179 992 2HD2 LEU 350 2HD2 LEU 50 0.817 11.718 11.718 993 3HD2 LEU 350 1HD2 LEU 50 0.535 12.503 12.503 994 H LYS 351 H LYS 51 -2.948 12.961 12.961 995 HA LYS 351 HA LYS 51 -4.150 14.114 14.114 996 1HB LYS 351 2HB LYS 51 -4.369 11.706 11.706 997 2HB LYS 351 1HB LYS 51 -5.576 12.350 12.350 998 1HG LYS 351 2HG LYS 51 -7.115 12.693 12.693 999 2HG LYS 351 1HG LYS 51 -5.888 13.141 13.141 1000 1HD LYS 351 2HD LYS 51 -6.910 11.002 11.002 1001 2HD LYS 351 1HD LYS 51 -5.221 10.755 10.755 1002 1HE LYS 351 2HE LYS 51 -6.109 9.097 9.097 1003 2HE LYS 351 1HE LYS 51 -6.379 10.433 10.433 1004 1HZ LYS 351 3HZ LYS 51 -8.580 10.718 10.718 1005 2HZ LYS 351 2HZ LYS 51 -8.305 9.181 9.181 1006 3HZ LYS 351 1HZ LYS 51 -8.432 9.368 9.368 1007 H ASP 352 H ASP 52 -4.853 14.359 14.359 1008 HA ASP 352 HA ASP 52 -7.280 15.811 15.811 1009 1HB ASP 352 2HB ASP 52 -5.940 14.893 14.893 1010 2HB ASP 352 1HB ASP 52 -5.209 16.498 16.498 1011 H ALA 353 H ALA 53 -3.925 16.855 16.855 1012 HA ALA 353 HA ALA 53 -4.696 19.688 19.688 1013 1HB ALA 353 2HB ALA 53 -2.052 18.250 18.250 1014 2HB ALA 353 1HB ALA 53 -2.247 19.996 19.996 1015 3HB ALA 353 3HB ALA 53 -2.555 19.203 19.203 1016 H GLN 354 H GLN 54 -2.353 18.376 18.376 1017 HA GLN 354 HA GLN 54 -2.256 18.698 18.698 1018 1HB GLN 354 2HB GLN 54 -4.712 17.113 17.113 1019 2HB GLN 354 1HB GLN 54 -4.483 17.658 17.658 1020 1HG GLN 354 2HG GLN 54 -1.971 16.690 16.690 1021 2HG GLN 354 1HG GLN 54 -3.181 15.493 15.493 1022 1HE2 GLN 354 2HE2 GLN 54 -3.856 14.506 14.506 1023 2HE2 GLN 354 1HE2 GLN 54 -4.351 14.399 14.399 1024 H ALA 355 HN ALA 55 -3.480 20.930 20.930 1025 HA ALA 355 HA ALA 55 -4.597 22.375 22.375 1026 1HB ALA 355 2HB ALA 55 -6.266 21.602 21.602 1027 2HB ALA 355 1HB ALA 55 -6.620 23.071 23.071 1028 3HB ALA 355 3HB ALA 55 -6.679 21.501 21.501 Start of MODEL 12 1 1H GLY 325 1H GLY 25 10.421 2.117 2.117 2 2H GLY 325 3H GLY 25 11.561 2.667 2.667 3 3H GLY 325 2H GLY 25 11.509 3.350 3.350 4 1HA GLY 325 2HA GLY 25 13.240 1.946 1.946 5 2HA GLY 325 1HA GLY 25 12.641 0.805 0.805 6 H GLU 326 H GLU 26 10.852 -0.595 -0.595 7 HA GLU 326 HA GLU 26 10.381 -0.761 -0.761 8 1HB GLU 326 2HB GLU 26 11.128 -3.003 -3.003 9 2HB GLU 326 1HB GLU 26 10.444 -3.282 -3.282 10 1HG GLU 326 2HG GLU 26 12.304 -2.044 -2.044 11 2HG GLU 326 1HG GLU 26 12.985 -1.726 -1.726 12 H TYR 327 H TYR 27 8.602 -2.813 -2.813 13 HA TYR 327 HA TYR 27 6.354 -1.744 -1.744 14 1HB TYR 327 2HB TYR 27 6.397 -3.384 -3.384 15 2HB TYR 327 1HB TYR 27 4.923 -2.959 -2.959 16 HD1 TYR 327 HD2 TYR 27 7.919 -1.505 -1.505 17 HD2 TYR 327 HD1 TYR 27 3.926 -0.824 -0.824 18 HE1 TYR 327 HE2 TYR 27 7.898 0.711 0.711 19 HE2 TYR 327 HE1 TYR 27 3.906 1.392 1.392 20 HH TYR 327 HH TYR 27 5.733 3.095 3.095 21 H PHE 328 H PHE 28 5.766 -2.938 -2.938 22 HA PHE 328 HA PHE 28 6.446 -5.848 -5.848 23 1HB PHE 328 2HB PHE 28 6.124 -3.811 -3.811 24 2HB PHE 328 1HB PHE 28 6.008 -5.538 -5.538 25 HD1 PHE 328 HD2 PHE 28 8.224 -2.852 -2.852 26 HD2 PHE 328 HD1 PHE 28 7.941 -6.970 -6.970 27 HE1 PHE 328 HE2 PHE 28 10.698 -3.022 -3.022 28 HE2 PHE 328 HE1 PHE 28 10.416 -7.141 -7.141 29 HZ PHE 328 HZ PHE 28 11.793 -5.167 -5.167 30 H THR 329 H THR 29 4.800 -7.343 -7.343 31 HA THR 329 HA THR 29 2.029 -6.255 -6.255 32 HB THR 329 HB THR 29 2.229 -9.136 -9.136 33 HG1 THR 329 HG1 THR 29 4.114 -9.144 -9.144 34 1HG2 THR 329 2HG2 THR 29 0.440 -7.527 -7.527 35 2HG2 THR 329 1HG2 THR 29 1.545 -7.192 -7.192 36 3HG2 THR 329 3HG2 THR 29 0.927 -8.825 -8.825 37 H LEU 330 H LEU 30 0.698 -6.423 -6.423 38 HA LEU 330 HA LEU 30 1.591 -8.196 -8.196 39 1HB LEU 330 2HB LEU 30 1.083 -5.440 -5.440 40 2HB LEU 330 1HB LEU 30 -0.355 -6.169 -6.169 41 HG LEU 330 HG LEU 30 2.325 -7.187 -7.187 42 1HD1 LEU 330 1HD1 LEU 30 1.921 -4.481 -4.481 43 2HD1 LEU 330 3HD1 LEU 30 1.250 -4.971 -4.971 44 3HD1 LEU 330 2HD1 LEU 30 2.922 -5.364 -5.364 45 1HD2 LEU 330 2HD2 LEU 30 -0.467 -6.999 -6.999 46 2HD2 LEU 330 1HD2 LEU 30 0.674 -8.343 -8.343 47 3HD2 LEU 330 3HD2 LEU 30 0.835 -6.979 -6.979 48 H GLN 331 H GLN 31 0.423 -10.035 -10.035 49 HA GLN 331 HA GLN 31 -2.439 -9.745 -9.745 50 1HB GLN 331 2HB GLN 31 -1.116 -11.328 -11.328 51 2HB GLN 331 1HB GLN 31 -0.642 -12.185 -12.185 52 1HG GLN 331 2HG GLN 31 -3.023 -12.695 -12.695 53 2HG GLN 331 1HG GLN 31 -3.468 -11.879 -11.879 54 1HE2 GLN 331 2HE2 GLN 31 -1.544 -14.495 -14.495 55 2HE2 GLN 331 1HE2 GLN 31 -1.376 -12.817 -12.817 56 H ILE 332 H ILE 32 -3.721 -9.465 -9.465 57 HA ILE 332 HA ILE 32 -3.073 -10.996 -10.996 58 HB ILE 332 HB ILE 32 -4.889 -8.593 -8.593 59 1HG1 ILE 332 2HG1 ILE 32 -2.509 -8.266 -8.266 60 2HG1 ILE 332 1HG1 ILE 32 -2.097 -8.694 -8.694 61 1HG2 ILE 332 2HG2 ILE 32 -5.284 -10.308 -10.308 62 2HG2 ILE 332 1HG2 ILE 32 -3.793 -9.654 -9.654 63 3HG2 ILE 332 3HG2 ILE 32 -5.180 -8.598 -8.598 64 1HD1 ILE 332 2HD1 ILE 32 -4.195 -6.605 -6.605 65 2HD1 ILE 332 1HD1 ILE 32 -2.501 -6.161 -6.161 66 3HD1 ILE 332 3HD1 ILE 32 -3.059 -6.776 -6.776 67 H ARG 333 H ARG 33 -4.488 -12.543 -12.543 68 HA ARG 333 HA ARG 33 -6.762 -13.226 -13.226 69 1HB ARG 333 2HB ARG 33 -6.186 -14.604 -14.604 70 2HB ARG 333 1HB ARG 33 -6.781 -15.288 -15.288 71 1HG ARG 333 2HG ARG 33 -4.527 -14.758 -14.758 72 2HG ARG 333 1HG ARG 33 -3.968 -14.345 -14.345 73 1HD ARG 333 2HD ARG 33 -4.904 -16.697 -16.697 74 2HD ARG 333 1HD ARG 33 -4.810 -17.025 -17.025 75 HE ARG 333 HE ARG 33 -2.324 -16.214 -16.214 76 1HH1 ARG 333 2HH1 ARG 33 -2.127 -16.024 -16.024 77 2HH1 ARG 333 1HH1 ARG 33 -1.748 -17.630 -17.630 78 1HH2 ARG 333 1HH2 ARG 33 -2.766 -19.126 -19.126 79 2HH2 ARG 333 2HH2 ARG 33 -2.108 -19.386 -19.386 80 H GLY 334 H GLY 34 -8.847 -12.641 -12.641 81 1HA GLY 334 2HA GLY 34 -10.474 -12.571 -12.571 82 2HA GLY 334 1HA GLY 34 -9.389 -11.288 -11.288 83 H ARG 335 H ARG 35 -10.332 -9.358 -9.358 84 HA ARG 335 HA ARG 35 -10.875 -8.320 -8.320 85 1HB ARG 335 2HB ARG 35 -12.757 -9.897 -9.897 86 2HB ARG 335 1HB ARG 35 -13.358 -9.261 -9.261 87 1HG ARG 335 2HG ARG 35 -13.877 -7.145 -7.145 88 2HG ARG 335 1HG ARG 35 -12.923 -7.482 -7.482 89 1HD ARG 335 2HD ARG 35 -14.718 -9.580 -9.580 90 2HD ARG 335 1HD ARG 35 -15.691 -8.233 -8.233 91 HE ARG 335 HE ARG 35 -14.097 -7.769 -7.769 92 1HH1 ARG 335 2HH1 ARG 35 -16.380 -6.022 -6.022 93 2HH1 ARG 335 1HH1 ARG 35 -17.658 -6.538 -6.538 94 1HH2 ARG 335 1HH2 ARG 35 -16.059 -9.467 -9.467 95 2HH2 ARG 335 2HH2 ARG 35 -17.476 -8.489 -8.489 96 H GLU 336 H GLU 36 -11.965 -8.292 -8.292 97 HA GLU 336 HA GLU 36 -12.435 -5.412 -5.412 98 1HB GLU 336 2HB GLU 36 -12.538 -7.602 -7.602 99 2HB GLU 336 1HB GLU 36 -12.335 -5.951 -5.951 100 1HG GLU 336 2HG GLU 36 -14.324 -5.274 -5.274 101 2HG GLU 336 1HG GLU 36 -14.562 -6.969 -6.969 102 H ARG 337 H ARG 37 -9.826 -7.584 -7.584 103 HA ARG 337 HA ARG 37 -8.251 -5.493 -5.493 104 1HB ARG 337 2HB ARG 37 -7.832 -8.335 -8.335 105 2HB ARG 337 1HB ARG 37 -6.382 -7.334 -7.334 106 1HG ARG 337 2HG ARG 37 -7.096 -6.604 -6.604 107 2HG ARG 337 1HG ARG 37 -8.475 -7.696 -7.696 108 1HD ARG 337 2HD ARG 37 -5.575 -8.567 -8.567 109 2HD ARG 337 1HD ARG 37 -6.560 -8.697 -8.697 110 HE ARG 337 HE ARG 37 -7.122 -10.186 -10.186 111 1HH1 ARG 337 1HH2 ARG 37 -8.386 -9.404 -9.404 112 2HH1 ARG 337 2HH2 ARG 37 -8.696 -11.037 -11.037 113 1HH2 ARG 337 2HH1 ARG 37 -7.059 -12.442 -12.442 114 2HH2 ARG 337 1HH1 ARG 37 -7.944 -12.757 -12.757 115 H PHE 338 H PHE 38 -8.576 -6.766 -6.766 116 HA PHE 338 HA PHE 38 -6.252 -5.452 -5.452 117 1HB PHE 338 2HB PHE 38 -7.347 -7.257 -7.257 118 2HB PHE 338 1HB PHE 38 -8.840 -6.323 -6.323 119 HD1 PHE 338 HD1 PHE 38 -5.208 -6.133 -6.133 120 HD2 PHE 338 HD2 PHE 38 -9.214 -4.893 -4.893 121 HE1 PHE 338 HE1 PHE 38 -4.387 -5.025 -5.025 122 HE2 PHE 338 HE2 PHE 38 -8.392 -3.784 -3.784 123 HZ PHE 338 HZ PHE 38 -5.979 -3.851 -3.851 124 H GLU 339 H GLU 39 -9.573 -4.466 -4.466 125 HA GLU 339 HA GLU 39 -9.358 -1.960 -1.960 126 1HB GLU 339 2HB GLU 39 -11.299 -2.904 -2.904 127 2HB GLU 339 1HB GLU 39 -11.453 -1.378 -1.378 128 1HG GLU 339 2HG GLU 39 -11.146 -3.029 -3.029 129 2HG GLU 339 1HG GLU 39 -11.877 -4.159 -4.159 130 H MET 340 H MET 40 -8.877 -3.026 -3.026 131 HA MET 340 HA MET 40 -8.615 -0.527 -0.527 132 1HB MET 340 2HB MET 40 -7.728 -3.278 -3.278 133 2HB MET 340 1HB MET 40 -6.701 -2.044 -2.044 134 1HG MET 340 2HG MET 40 -8.504 -1.119 -1.119 135 2HG MET 340 1HG MET 40 -9.710 -1.955 -1.955 136 1HE MET 340 2HE MET 40 -6.456 -2.582 -2.582 137 2HE MET 340 1HE MET 40 -6.630 -3.811 -3.811 138 3HE MET 340 3HE MET 40 -6.532 -4.283 -4.283 139 H PHE 341 H PHE 41 -6.098 -2.491 -2.491 140 HA PHE 341 HA PHE 41 -4.020 -0.567 -0.567 141 1HB PHE 341 2HB PHE 41 -4.426 -2.911 -2.911 142 2HB PHE 341 1HB PHE 41 -2.968 -1.946 -1.946 143 HD1 PHE 341 HD2 PHE 41 -4.267 -1.909 -1.909 144 HD2 PHE 341 HD1 PHE 41 -2.124 -4.434 -4.434 145 HE1 PHE 341 HE2 PHE 41 -3.420 -3.256 -3.256 146 HE2 PHE 341 HE1 PHE 41 -1.280 -5.779 -5.779 147 HZ PHE 341 HZ PHE 41 -1.929 -5.193 -5.193 148 H ARG 342 H ARG 42 -6.210 -1.344 -1.344 149 HA ARG 342 HA ARG 42 -5.293 0.292 0.292 150 1HB ARG 342 2HB ARG 42 -7.678 -1.048 -1.048 151 2HB ARG 342 1HB ARG 42 -8.178 0.640 0.640 152 1HG ARG 342 2HG ARG 42 -6.683 0.694 0.694 153 2HG ARG 342 1HG ARG 42 -6.782 -1.066 -1.066 154 1HD ARG 342 2HD ARG 42 -9.057 -1.094 -1.094 155 2HD ARG 342 1HD ARG 42 -9.315 0.515 0.515 156 HE ARG 342 HE ARG 42 -7.669 0.779 0.779 157 1HH1 ARG 342 1HH2 ARG 42 -10.206 2.318 2.318 158 2HH1 ARG 342 2HH2 ARG 42 -11.221 1.758 1.758 159 1HH2 ARG 342 2HH1 ARG 42 -9.256 -1.013 -1.013 160 2HH2 ARG 342 1HH1 ARG 42 -10.684 -0.128 -0.128 161 H GLU 343 H GLU 43 -6.915 1.208 1.208 162 HA GLU 343 HA GLU 43 -7.177 4.019 4.019 163 1HB GLU 343 2HB GLU 43 -8.667 3.036 3.036 164 2HB GLU 343 1HB GLU 43 -7.278 2.671 2.671 165 1HG GLU 343 2HG GLU 43 -7.111 4.812 4.812 166 2HG GLU 343 1HG GLU 43 -7.395 5.478 5.478 167 H LEU 344 H LEU 44 -4.922 2.106 2.106 168 HA LEU 344 HA LEU 44 -3.295 4.269 4.269 169 1HB LEU 344 2HB LEU 44 -2.832 1.338 1.338 170 2HB LEU 344 1HB LEU 44 -1.440 2.369 2.369 171 HG LEU 344 HG LEU 44 -2.035 1.620 1.620 172 1HD1 LEU 344 2HD1 LEU 44 -2.154 4.265 4.265 173 2HD1 LEU 344 1HD1 LEU 44 -3.781 4.018 4.018 174 3HD1 LEU 344 3HD1 LEU 44 -2.379 3.588 3.588 175 1HD2 LEU 344 1HD2 LEU 44 -4.487 1.063 1.063 176 2HD2 LEU 344 3HD2 LEU 44 -4.096 0.870 0.870 177 3HD2 LEU 344 2HD2 LEU 44 -4.882 2.348 2.348 178 H ASN 345 H ASN 45 -2.575 2.053 2.053 179 HA ASN 345 HA ASN 45 -0.496 3.651 3.651 180 1HB ASN 345 2HB ASN 45 -0.938 2.359 2.359 181 2HB ASN 345 1HB ASN 45 -0.753 1.335 1.335 182 1HD2 ASN 345 2HD2 ASN 45 -3.831 0.225 0.225 183 2HD2 ASN 345 1HD2 ASN 45 -2.182 0.321 0.321 184 H GLU 346 H GLU 46 -3.930 4.059 4.059 185 HA GLU 346 HA GLU 46 -4.190 5.554 5.554 186 1HB GLU 346 2HB GLU 46 -5.863 4.799 4.799 187 2HB GLU 346 1HB GLU 46 -5.956 6.556 6.556 188 1HG GLU 346 2HG GLU 46 -6.164 6.052 6.052 189 2HG GLU 346 1HG GLU 46 -6.739 4.487 4.487 190 H ALA 347 H ALA 47 -3.616 6.615 6.615 191 HA ALA 347 HA ALA 47 -3.385 9.423 9.423 192 1HB ALA 347 2HB ALA 47 -2.694 7.793 7.793 193 2HB ALA 347 1HB ALA 47 -2.204 9.484 9.484 194 3HB ALA 347 3HB ALA 47 -3.913 9.056 9.056 195 H LEU 348 H LEU 48 -0.960 6.876 6.876 196 HA LEU 348 HA LEU 48 1.355 8.464 8.464 197 1HB LEU 348 2HB LEU 48 0.949 5.622 5.622 198 2HB LEU 348 1HB LEU 48 2.508 6.387 6.387 199 HG LEU 348 HG LEU 48 0.366 6.122 6.122 200 1HD1 LEU 348 3HD1 LEU 48 2.044 4.078 4.078 201 2HD1 LEU 348 2HD1 LEU 48 2.548 4.385 4.385 202 3HD1 LEU 348 1HD1 LEU 48 0.878 3.938 3.938 203 1HD2 LEU 348 3HD2 LEU 48 2.773 7.578 7.578 204 2HD2 LEU 348 2HD2 LEU 48 1.815 7.277 7.277 205 3HD2 LEU 348 1HD2 LEU 48 3.134 6.189 6.189 206 H GLU 349 H GLU 49 -0.481 6.789 6.789 207 HA GLU 349 HA GLU 49 1.105 7.692 7.692 208 1HB GLU 349 2HB GLU 49 -1.720 6.709 6.709 209 2HB GLU 349 1HB GLU 49 -1.212 7.412 7.412 210 1HG GLU 349 2HG GLU 49 0.774 5.831 5.831 211 2HG GLU 349 1HG GLU 49 -0.020 5.020 5.020 212 H LEU 350 H LEU 50 -1.512 9.178 9.178 213 HA LEU 350 HA LEU 50 -1.978 11.347 11.347 214 1HB LEU 350 2HB LEU 50 -3.552 11.910 11.910 215 2HB LEU 350 1HB LEU 50 -3.094 10.436 10.436 216 HG LEU 350 HG LEU 50 -1.235 11.946 11.946 217 1HD1 LEU 350 3HD1 LEU 50 -2.696 13.772 13.772 218 2HD1 LEU 350 2HD1 LEU 50 -2.892 14.230 14.230 219 3HD1 LEU 350 1HD1 LEU 50 -1.280 14.076 14.076 220 1HD2 LEU 350 3HD2 LEU 50 -4.125 11.685 11.685 221 2HD2 LEU 350 2HD2 LEU 50 -2.719 11.192 11.192 222 3HD2 LEU 350 1HD2 LEU 50 -3.212 12.885 12.885 223 H LYS 351 H LYS 51 0.435 10.682 10.682 224 HA LYS 351 HA LYS 51 1.468 13.344 13.344 225 1HB LYS 351 2HB LYS 51 2.029 11.315 11.315 226 2HB LYS 351 1HB LYS 51 3.121 10.822 10.822 227 1HG LYS 351 2HG LYS 51 4.435 12.807 12.807 228 2HG LYS 351 1HG LYS 51 3.231 13.570 13.570 229 1HD LYS 351 2HD LYS 51 5.262 12.621 12.621 230 2HD LYS 351 1HD LYS 51 3.698 12.063 12.063 231 1HE LYS 351 2HE LYS 51 3.943 9.943 9.943 232 2HE LYS 351 1HE LYS 51 5.095 10.504 10.504 233 1HZ LYS 351 1HZ LYS 51 5.764 10.614 10.614 234 2HZ LYS 351 3HZ LYS 51 5.957 9.171 9.171 235 3HZ LYS 351 2HZ LYS 51 6.807 10.563 10.563 236 H ASP 352 H ASP 52 2.156 10.686 10.686 237 HA ASP 352 HA ASP 52 4.344 11.909 11.909 238 1HB ASP 352 2HB ASP 52 3.267 9.482 9.482 239 2HB ASP 352 1HB ASP 52 2.393 10.227 10.227 240 H ALA 353 H ALA 53 0.828 12.157 12.157 241 HA ALA 353 HA ALA 53 1.086 13.844 13.844 242 1HB ALA 353 3HB ALA 53 -0.987 12.416 12.416 243 2HB ALA 353 2HB ALA 53 -1.430 14.100 14.100 244 3HB ALA 353 1HB ALA 53 -1.148 13.530 13.530 245 H GLN 354 H GLN 54 1.373 14.347 14.347 246 HA GLN 354 HA GLN 54 0.427 17.074 17.074 247 1HB GLN 354 2HB GLN 54 1.963 15.198 15.198 248 2HB GLN 354 1HB GLN 54 2.296 16.907 16.907 249 1HG GLN 354 2HG GLN 54 -0.500 16.718 16.718 250 2HG GLN 354 1HG GLN 54 -0.034 15.375 15.375 251 1HE2 GLN 354 2HE2 GLN 54 1.637 17.730 17.730 252 2HE2 GLN 354 1HE2 GLN 54 2.093 16.362 16.362 253 H ALA 355 HN ALA 55 1.654 19.012 19.012 254 HA ALA 355 HA ALA 55 4.292 18.696 18.696 255 1HB ALA 355 2HB ALA 55 2.353 19.829 19.829 256 2HB ALA 355 1HB ALA 55 2.532 21.153 21.153 257 3HB ALA 355 3HB ALA 55 3.866 20.732 20.732 258 1H GLY 325 1H GLY 25 -11.474 -13.809 -13.809 259 2H GLY 325 3H GLY 25 -12.741 -13.219 -13.219 260 3H GLY 325 2H GLY 25 -12.577 -14.891 -14.891 261 1HA GLY 325 2HA GLY 25 -14.198 -14.493 -14.493 262 2HA GLY 325 1HA GLY 25 -13.660 -12.833 -12.833 263 H GLU 326 H GLU 26 -11.741 -12.492 -12.492 264 HA GLU 326 HA GLU 26 -10.995 -14.846 -14.846 265 1HB GLU 326 2HB GLU 26 -11.796 -12.079 -12.079 266 2HB GLU 326 1HB GLU 26 -10.956 -13.240 -13.240 267 1HG GLU 326 2HG GLU 26 -12.777 -14.860 -14.860 268 2HG GLU 326 1HG GLU 26 -13.614 -13.729 -13.729 269 H TYR 327 H TYR 27 -9.112 -13.705 -13.705 270 HA TYR 327 HA TYR 27 -7.081 -12.800 -12.800 271 1HB TYR 327 2HB TYR 27 -6.803 -14.050 -14.050 272 2HB TYR 327 1HB TYR 27 -5.441 -13.479 -13.479 273 HD1 TYR 327 HD2 TYR 27 -8.341 -15.827 -15.827 274 HD2 TYR 327 HD1 TYR 27 -4.538 -14.804 -14.804 275 HE1 TYR 327 HE2 TYR 27 -8.336 -17.962 -17.962 276 HE2 TYR 327 HE1 TYR 27 -4.532 -16.939 -16.939 277 HH TYR 327 HH TYR 27 -6.363 -18.568 -18.568 278 H PHE 328 H PHE 28 -6.597 -10.668 -10.668 279 HA PHE 328 HA PHE 28 -7.132 -9.125 -9.125 280 1HB PHE 328 2HB PHE 28 -7.128 -8.376 -8.376 281 2HB PHE 328 1HB PHE 28 -6.957 -7.144 -7.144 282 HD1 PHE 328 HD2 PHE 28 -9.177 -9.779 -9.779 283 HD2 PHE 328 HD1 PHE 28 -8.799 -6.528 -6.528 284 HE1 PHE 328 HE2 PHE 28 -11.628 -9.813 -9.813 285 HE2 PHE 328 HE1 PHE 28 -11.249 -6.562 -6.562 286 HZ PHE 328 HZ PHE 28 -12.664 -8.204 -8.204 287 H THR 329 H THR 29 -5.448 -7.976 -7.976 288 HA THR 329 HA THR 29 -2.747 -8.480 -8.480 289 HB THR 329 HB THR 29 -2.712 -7.037 -7.037 290 HG1 THR 329 HG1 THR 29 -4.550 -7.843 -7.843 291 1HG2 THR 329 2HG2 THR 29 -1.010 -8.631 -8.631 292 2HG2 THR 329 1HG2 THR 29 -2.058 -9.944 -9.944 293 3HG2 THR 329 3HG2 THR 29 -1.332 -8.857 -8.857 294 H LEU 330 H LEU 30 -1.458 -6.822 -6.822 295 HA LEU 330 HA LEU 30 -2.586 -4.054 -4.054 296 1HB LEU 330 2HB LEU 30 -2.170 -5.593 -5.593 297 2HB LEU 330 1HB LEU 30 -0.772 -4.519 -4.519 298 HG LEU 330 HG LEU 30 -3.507 -3.393 -3.393 299 1HD1 LEU 330 1HD1 LEU 30 -3.046 -4.877 -4.877 300 2HD1 LEU 330 3HD1 LEU 30 -2.514 -3.282 -3.282 301 3HD1 LEU 330 2HD1 LEU 30 -4.156 -3.509 -3.509 302 1HD2 LEU 330 2HD2 LEU 30 -0.798 -2.447 -2.447 303 2HD2 LEU 330 1HD2 LEU 30 -1.893 -1.746 -1.746 304 3HD2 LEU 330 3HD2 LEU 30 -2.217 -1.543 -1.543 305 H GLN 331 H GLN 31 -1.245 -3.748 -3.748 306 HA GLN 331 HA GLN 31 1.640 -4.091 -4.091 307 1HB GLN 331 2HB GLN 31 0.458 -4.327 -4.327 308 2HB GLN 331 1HB GLN 31 -0.002 -2.626 -2.626 309 1HG GLN 331 2HG GLN 31 2.379 -1.979 -1.979 310 2HG GLN 331 1HG GLN 31 2.841 -3.680 -3.680 311 1HE2 GLN 331 2HE2 GLN 31 1.256 -3.913 -3.913 312 2HE2 GLN 331 1HE2 GLN 31 0.975 -4.660 -4.660 313 H ILE 332 H ILE 32 2.732 -2.714 -2.714 314 HA ILE 332 HA ILE 32 1.915 0.161 0.161 315 HB ILE 332 HB ILE 32 3.642 -1.372 -1.372 316 1HG1 ILE 332 2HG1 ILE 32 1.105 -0.285 -0.285 317 2HG1 ILE 332 1HG1 ILE 32 0.871 -1.465 -1.465 318 1HG2 ILE 332 2HG2 ILE 32 3.944 1.187 1.187 319 2HG2 ILE 332 1HG2 ILE 32 2.365 1.327 1.327 320 3HG2 ILE 332 3HG2 ILE 32 3.714 0.598 0.598 321 1HD1 ILE 332 2HD1 ILE 32 2.809 -2.103 -2.103 322 2HD1 ILE 332 1HD1 ILE 32 1.083 -2.259 -2.259 323 3HD1 ILE 332 3HD1 ILE 32 1.825 -3.194 -3.194 324 H ARG 333 H ARG 33 3.338 1.670 1.670 325 HA ARG 333 HA ARG 33 5.790 0.692 0.692 326 1HB ARG 333 2HB ARG 33 5.051 3.598 3.598 327 2HB ARG 333 1HB ARG 33 5.821 2.728 2.728 328 1HG ARG 333 2HG ARG 33 3.649 1.475 1.475 329 2HG ARG 333 1HG ARG 33 2.917 2.580 2.580 330 1HD ARG 333 2HD ARG 33 3.913 4.452 4.452 331 2HD ARG 333 1HD ARG 33 3.999 3.176 3.176 332 HE ARG 333 HE ARG 33 1.455 2.885 2.885 333 1HH1 ARG 333 2HH1 ARG 33 0.984 5.155 5.155 334 2HH1 ARG 333 1HH1 ARG 33 0.640 6.449 6.449 335 1HH2 ARG 333 1HH2 ARG 33 2.002 4.834 4.834 336 2HH2 ARG 333 2HH2 ARG 33 1.214 6.267 6.267 337 H GLY 334 H GLY 34 7.791 0.828 0.828 338 1HA GLY 334 2HA GLY 34 9.235 2.586 2.586 339 2HA GLY 334 1HA GLY 34 8.045 2.317 2.317 340 H ARG 335 H ARG 35 8.911 1.018 1.018 341 HA ARG 335 HA ARG 35 9.629 -1.679 -1.679 342 1HB ARG 335 2HB ARG 35 11.584 -0.784 -0.784 343 2HB ARG 335 1HB ARG 35 12.010 0.191 0.191 344 1HG ARG 335 2HG ARG 35 12.529 -1.722 -1.722 345 2HG ARG 335 1HG ARG 35 11.722 -2.810 -2.810 346 1HD ARG 335 2HD ARG 35 13.596 -1.561 -1.561 347 2HD ARG 335 1HD ARG 35 14.453 -1.736 -1.736 348 HE ARG 335 HE ARG 35 13.069 -4.134 -4.134 349 1HH1 ARG 335 2HH1 ARG 35 15.166 -4.208 -4.208 350 2HH1 ARG 335 1HH1 ARG 35 16.562 -4.739 -4.739 351 1HH2 ARG 335 1HH2 ARG 35 15.209 -4.019 -4.019 352 2HH2 ARG 335 2HH2 ARG 35 16.585 -4.631 -4.631 353 H GLU 336 H GLU 36 10.399 1.199 1.199 354 HA GLU 336 HA GLU 36 10.737 -0.357 -0.357 355 1HB GLU 336 2HB GLU 36 10.745 2.536 2.536 356 2HB GLU 336 1HB GLU 36 10.408 2.128 2.128 357 1HG GLU 336 2HG GLU 36 12.480 0.721 0.721 358 2HG GLU 336 1HG GLU 36 12.841 1.298 1.298 359 H ARG 337 H ARG 37 8.135 1.502 1.502 360 HA ARG 337 HA ARG 37 6.352 1.333 1.333 361 1HB ARG 337 2HB ARG 37 6.148 2.174 2.174 362 2HB ARG 337 1HB ARG 37 4.648 1.666 1.666 363 1HG ARG 337 2HG ARG 37 5.125 3.238 3.238 364 2HG ARG 337 1HG ARG 37 6.558 3.794 3.794 365 1HD ARG 337 2HD ARG 37 3.748 3.902 3.902 366 2HD ARG 337 1HD ARG 37 4.548 5.261 5.261 367 HE ARG 337 HE ARG 37 5.496 4.012 4.012 368 1HH1 ARG 337 1HH2 ARG 37 6.387 6.166 6.166 369 2HH1 ARG 337 2HH2 ARG 37 6.719 7.493 7.493 370 1HH2 ARG 337 2HH1 ARG 37 5.444 5.911 5.911 371 2HH2 ARG 337 1HH1 ARG 37 6.186 7.348 7.348 372 H PHE 338 H PHE 38 7.002 -0.696 -0.696 373 HA PHE 338 HA PHE 38 4.747 -2.476 -2.476 374 1HB PHE 338 2HB PHE 38 6.045 -2.442 -2.442 375 2HB PHE 338 1HB PHE 38 7.494 -2.950 -2.950 376 HD1 PHE 338 HD1 PHE 38 3.961 -3.987 -3.987 377 HD2 PHE 338 HD2 PHE 38 7.970 -5.234 -5.234 378 HE1 PHE 338 HE1 PHE 38 3.279 -6.358 -6.358 379 HE2 PHE 338 HE2 PHE 38 7.288 -7.606 -7.606 380 HZ PHE 338 HZ PHE 38 4.941 -8.166 -8.166 381 H GLU 339 H GLU 39 7.932 -2.245 -2.245 382 HA GLU 339 HA GLU 39 7.758 -4.857 -4.857 383 1HB GLU 339 2HB GLU 39 9.540 -2.452 -2.452 384 2HB GLU 339 1HB GLU 39 9.706 -3.996 -3.996 385 1HG GLU 339 2HG GLU 39 9.667 -4.887 -4.887 386 2HG GLU 339 1HG GLU 39 10.361 -3.287 -3.287 387 H MET 340 H MET 40 7.058 -1.497 -1.497 388 HA MET 340 HA MET 40 6.554 -1.793 -1.793 389 1HB MET 340 2HB MET 40 5.779 0.091 0.091 390 2HB MET 340 1HB MET 40 4.604 -0.022 -0.022 391 1HG MET 340 2HG MET 40 6.205 0.609 0.609 392 2HG MET 340 1HG MET 40 7.556 0.315 0.315 393 1HE MET 340 2HE MET 40 4.197 1.735 1.735 394 2HE MET 340 1HE MET 40 4.327 3.468 3.468 395 3HE MET 340 3HE MET 40 4.416 2.337 2.337 396 H PHE 341 H PHE 41 4.256 -2.082 -2.082 397 HA PHE 341 HA PHE 41 2.072 -3.018 -3.018 398 1HB PHE 341 2HB PHE 41 2.682 -3.321 -3.321 399 2HB PHE 341 1HB PHE 41 1.178 -3.865 -3.865 400 HD1 PHE 341 HD2 PHE 41 2.239 -1.096 -1.096 401 HD2 PHE 341 HD1 PHE 41 0.499 -2.103 -2.103 402 HE1 PHE 341 HE2 PHE 41 1.317 1.198 1.198 403 HE2 PHE 341 HE1 PHE 41 -0.419 0.191 0.191 404 HZ PHE 341 HZ PHE 41 -0.012 1.841 1.841 405 H ARG 342 H ARG 42 4.561 -4.693 -4.693 406 HA ARG 342 HA ARG 42 3.730 -7.317 -7.317 407 1HB ARG 342 2HB ARG 42 6.126 -6.077 -6.077 408 2HB ARG 342 1HB ARG 42 6.554 -7.054 -7.054 409 1HG ARG 342 2HG ARG 42 5.257 -8.959 -8.959 410 2HG ARG 342 1HG ARG 42 5.418 -7.962 -7.962 411 1HD ARG 342 2HD ARG 42 7.725 -8.192 -8.192 412 2HD ARG 342 1HD ARG 42 7.855 -8.471 -8.471 413 HE ARG 342 HE ARG 42 6.416 -10.646 -10.646 414 1HH1 ARG 342 1HH2 ARG 42 8.812 -10.932 -10.932 415 2HH1 ARG 342 2HH2 ARG 42 9.970 -11.654 -11.654 416 1HH2 ARG 342 2HH1 ARG 42 8.224 -10.838 -10.838 417 2HH2 ARG 342 1HH1 ARG 42 9.638 -11.600 -11.600 418 H GLU 343 H GLU 43 4.986 -5.265 -5.265 419 HA GLU 343 HA GLU 43 5.210 -7.430 -7.430 420 1HB GLU 343 2HB GLU 43 6.583 -5.408 -5.408 421 2HB GLU 343 1HB GLU 43 5.128 -4.417 -4.417 422 1HG GLU 343 2HG GLU 43 4.771 -4.988 -4.988 423 2HG GLU 343 1HG GLU 43 5.180 -6.680 -6.680 424 H LEU 344 H LEU 44 2.869 -4.834 -4.834 425 HA LEU 344 HA LEU 44 1.069 -5.368 -5.368 426 1HB LEU 344 2HB LEU 44 0.781 -4.182 -4.182 427 2HB LEU 344 1HB LEU 44 -0.671 -4.551 -4.551 428 HG LEU 344 HG LEU 44 -0.194 -2.303 -2.303 429 1HD1 LEU 344 2HD1 LEU 44 -0.212 -4.167 -4.167 430 2HD1 LEU 344 1HD1 LEU 44 1.358 -3.422 -3.422 431 3HD1 LEU 344 3HD1 LEU 44 -0.103 -2.435 -2.435 432 1HD2 LEU 344 1HD2 LEU 44 2.365 -2.893 -2.893 433 2HD2 LEU 344 3HD2 LEU 44 1.867 -1.368 -1.368 434 3HD2 LEU 344 2HD2 LEU 44 2.583 -2.632 -2.632 435 H ASN 345 H ASN 45 0.674 -6.418 -6.418 436 HA ASN 345 HA ASN 45 -1.333 -8.348 -8.348 437 1HB ASN 345 2HB ASN 45 -0.631 -9.340 -9.340 438 2HB ASN 345 1HB ASN 45 -0.862 -7.596 -7.596 439 1HD2 ASN 345 2HD2 ASN 45 2.426 -8.427 -8.427 440 2HD2 ASN 345 1HD2 ASN 45 0.817 -8.879 -8.879 441 H GLU 346 H GLU 46 2.027 -8.398 -8.398 442 HA GLU 346 HA GLU 46 2.467 -11.245 -11.245 443 1HB GLU 346 2HB GLU 46 3.985 -8.947 -8.947 444 2HB GLU 346 1HB GLU 46 4.005 -9.960 -9.960 445 1HG GLU 346 2HG GLU 46 4.450 -11.888 -11.888 446 2HG GLU 346 1HG GLU 46 5.063 -10.544 -10.544 447 H ALA 347 H ALA 47 1.539 -9.022 -9.022 448 HA ALA 347 HA ALA 47 1.282 -11.136 -11.136 449 1HB ALA 347 2HB ALA 47 0.430 -8.252 -8.252 450 2HB ALA 347 1HB ALA 47 -0.133 -9.283 -9.283 451 3HB ALA 347 3HB ALA 47 1.593 -9.011 -9.011 452 H LEU 348 H LEU 48 -1.087 -9.313 -9.313 453 HA LEU 348 HA LEU 48 -3.446 -10.506 -10.506 454 1HB LEU 348 2HB LEU 48 -2.784 -9.769 -9.769 455 2HB LEU 348 1HB LEU 48 -4.407 -10.028 -10.028 456 HG LEU 348 HG LEU 48 -2.500 -7.979 -7.979 457 1HD1 LEU 348 3HD1 LEU 48 -3.930 -7.923 -7.923 458 2HD1 LEU 348 2HD1 LEU 48 -4.618 -6.727 -6.727 459 3HD1 LEU 348 1HD1 LEU 48 -2.898 -6.681 -6.681 460 1HD2 LEU 348 3HD2 LEU 48 -4.944 -9.064 -9.064 461 2HD2 LEU 348 2HD2 LEU 48 -4.150 -7.615 -7.615 462 3HD2 LEU 348 1HD2 LEU 48 -5.353 -7.482 -7.482 463 H GLU 349 H GLU 49 -1.303 -11.662 -11.662 464 HA GLU 349 HA GLU 49 -2.761 -14.051 -14.051 465 1HB GLU 349 2HB GLU 49 0.081 -13.166 -13.166 466 2HB GLU 349 1HB GLU 49 -0.338 -14.858 -14.858 467 1HG GLU 349 2HG GLU 49 -2.214 -14.050 -14.050 468 2HG GLU 349 1HG GLU 49 -1.524 -12.432 -12.432 469 H LEU 350 H LEU 50 -0.349 -13.238 -13.238 470 HA LEU 350 HA LEU 50 0.153 -15.894 -15.894 471 1HB LEU 350 2HB LEU 50 1.511 -14.844 -14.844 472 2HB LEU 350 1HB LEU 50 1.080 -13.361 -13.361 473 HG LEU 350 HG LEU 50 -0.989 -13.375 -13.375 474 1HD1 LEU 350 3HD1 LEU 50 0.558 -15.626 -15.626 475 2HD1 LEU 350 2HD1 LEU 50 0.528 -14.403 -14.403 476 3HD1 LEU 350 1HD1 LEU 50 -0.982 -15.034 -15.034 477 1HD2 LEU 350 3HD2 LEU 50 1.831 -12.511 -12.511 478 2HD2 LEU 350 2HD2 LEU 50 0.355 -11.547 -11.547 479 3HD2 LEU 350 1HD2 LEU 50 0.784 -12.443 -12.443 480 H LYS 351 H LYS 51 -2.455 -13.620 -13.620 481 HA LYS 351 HA LYS 51 -3.640 -14.905 -14.905 482 1HB LYS 351 2HB LYS 51 -4.236 -12.612 -12.612 483 2HB LYS 351 1HB LYS 51 -5.176 -13.496 -13.496 484 1HG LYS 351 2HG LYS 51 -6.606 -14.440 -14.440 485 2HG LYS 351 1HG LYS 51 -5.541 -13.923 -13.923 486 1HD LYS 351 2HD LYS 51 -7.620 -12.495 -12.495 487 2HD LYS 351 1HD LYS 51 -6.090 -11.617 -11.617 488 1HE LYS 351 2HE LYS 51 -6.141 -11.269 -11.269 489 2HE LYS 351 1HE LYS 51 -7.208 -12.645 -12.645 490 1HZ LYS 351 1HZ LYS 51 -8.140 -10.335 -10.335 491 2HZ LYS 351 3HZ LYS 51 -8.171 -10.280 -10.280 492 3HZ LYS 351 2HZ LYS 51 -9.051 -11.475 -11.475 493 H ASP 352 H ASP 52 -4.002 -15.371 -15.371 494 HA ASP 352 HA ASP 52 -6.110 -17.289 -17.289 495 1HB ASP 352 2HB ASP 52 -4.908 -16.065 -16.065 496 2HB ASP 352 1HB ASP 52 -3.954 -17.549 -17.549 497 H ALA 353 H ALA 53 -2.590 -17.618 -17.618 498 HA ALA 353 HA ALA 53 -2.690 -20.531 -20.531 499 1HB ALA 353 3HB ALA 53 -0.680 -18.640 -18.640 500 2HB ALA 353 2HB ALA 53 -0.351 -19.294 -19.294 501 3HB ALA 353 1HB ALA 53 -0.436 -20.374 -20.374 502 H GLN 354 H GLN 54 -3.326 -18.009 -18.009 503 HA GLN 354 HA GLN 54 -2.532 -19.339 -19.339 504 1HB GLN 354 2HB GLN 54 -4.100 -16.944 -16.944 505 2HB GLN 354 1HB GLN 54 -4.568 -17.695 -17.695 506 1HG GLN 354 2HG GLN 54 -1.777 -17.726 -17.726 507 2HG GLN 354 1HG GLN 54 -2.181 -16.156 -16.156 508 1HE2 GLN 354 2HE2 GLN 54 -4.238 -15.358 -15.358 509 2HE2 GLN 354 1HE2 GLN 54 -4.509 -15.449 -15.449 510 H ALA 355 HN ALA 55 -3.856 -20.524 -20.524 511 HA ALA 355 HA ALA 55 -6.329 -21.647 -21.647 512 1HB ALA 355 2HB ALA 55 -4.346 -23.202 -23.202 513 2HB ALA 355 1HB ALA 55 -4.686 -22.961 -22.961 514 3HB ALA 355 3HB ALA 55 -5.897 -23.705 -23.705 515 1H GLY 325 1H GLY 25 9.270 -1.442 -1.442 516 2H GLY 325 3H GLY 25 10.537 -1.913 -1.913 517 3H GLY 325 2H GLY 25 10.388 -2.612 -2.612 518 1HA GLY 325 2HA GLY 25 11.996 -1.110 -1.110 519 2HA GLY 325 1HA GLY 25 11.439 0.003 0.003 520 H GLU 326 H GLU 26 9.510 1.282 1.282 521 HA GLU 326 HA GLU 26 8.782 1.401 1.401 522 1HB GLU 326 2HB GLU 26 9.541 3.700 3.700 523 2HB GLU 326 1HB GLU 26 8.709 3.924 3.924 524 1HG GLU 326 2HG GLU 26 10.551 2.800 2.800 525 2HG GLU 326 1HG GLU 26 11.382 2.535 2.535 526 H TYR 327 H TYR 27 6.878 3.347 3.347 527 HA TYR 327 HA TYR 27 4.846 2.148 2.148 528 1HB TYR 327 2HB TYR 27 4.571 3.770 3.770 529 2HB TYR 327 1HB TYR 27 3.206 3.256 3.256 530 HD1 TYR 327 HD2 TYR 27 6.136 1.987 1.987 531 HD2 TYR 327 HD1 TYR 27 2.331 1.059 1.059 532 HE1 TYR 327 HE2 TYR 27 6.166 -0.233 -0.233 533 HE2 TYR 327 HE1 TYR 27 2.361 -1.161 -1.161 534 HH TYR 327 HH TYR 27 4.213 -2.748 -2.748 535 H PHE 328 H PHE 28 4.329 3.317 3.317 536 HA PHE 328 HA PHE 28 4.833 6.261 6.261 537 1HB PHE 328 2HB PHE 28 4.828 4.219 4.219 538 2HB PHE 328 1HB PHE 28 4.633 5.937 5.937 539 HD1 PHE 328 HD2 PHE 28 6.898 3.388 3.388 540 HD2 PHE 328 HD1 PHE 28 6.460 7.488 7.488 541 HE1 PHE 328 HE2 PHE 28 9.347 3.712 3.712 542 HE2 PHE 328 HE1 PHE 28 8.910 7.812 7.812 543 HZ PHE 328 HZ PHE 28 10.354 5.924 5.924 544 H THR 329 H THR 29 3.138 7.661 7.661 545 HA THR 329 HA THR 29 0.444 6.418 6.418 546 HB THR 329 HB THR 29 0.419 9.304 9.304 547 HG1 THR 329 HG1 THR 29 2.243 9.443 9.443 548 1HG2 THR 329 2HG2 THR 29 -1.288 7.549 7.549 549 2HG2 THR 329 1HG2 THR 29 -0.246 7.295 7.295 550 3HG2 THR 329 3HG2 THR 29 -0.979 8.874 8.874 551 H LEU 330 H LEU 30 -0.800 6.573 6.573 552 HA LEU 330 HA LEU 30 0.227 8.315 8.315 553 1HB LEU 330 2HB LEU 30 -0.122 5.542 5.542 554 2HB LEU 330 1HB LEU 30 -1.542 6.159 6.159 555 HG LEU 330 HG LEU 30 1.149 7.294 7.294 556 1HD1 LEU 330 1HD1 LEU 30 0.816 4.573 4.573 557 2HD1 LEU 330 3HD1 LEU 30 0.263 5.015 5.015 558 3HD1 LEU 330 2HD1 LEU 30 1.887 5.458 5.458 559 1HD2 LEU 330 2HD2 LEU 30 -1.558 6.994 6.994 560 2HD2 LEU 330 1HD2 LEU 30 -0.493 8.400 8.400 561 3HD2 LEU 330 3HD2 LEU 30 -0.159 7.069 7.069 562 H GLN 331 H GLN 31 -1.124 10.071 10.071 563 HA GLN 331 HA GLN 31 -4.015 9.661 9.661 564 1HB GLN 331 2HB GLN 31 -2.844 11.346 11.346 565 2HB GLN 331 1HB GLN 31 -2.393 12.222 12.222 566 1HG GLN 331 2HG GLN 31 -4.779 12.539 12.539 567 2HG GLN 331 1HG GLN 31 -5.229 11.673 11.673 568 1HE2 GLN 331 2HE2 GLN 31 -3.649 14.407 14.407 569 2HE2 GLN 331 1HE2 GLN 31 -3.356 12.746 12.746 570 H ILE 332 H ILE 32 -5.111 9.285 9.285 571 HA ILE 332 HA ILE 32 -4.322 10.842 10.842 572 HB ILE 332 HB ILE 32 -6.023 8.337 8.337 573 1HG1 ILE 332 2HG1 ILE 32 -3.498 8.157 8.157 574 2HG1 ILE 332 1HG1 ILE 32 -3.252 8.596 8.596 575 1HG2 ILE 332 2HG2 ILE 32 -6.366 10.028 10.028 576 2HG2 ILE 332 1HG2 ILE 32 -4.786 9.480 9.480 577 3HG2 ILE 332 3HG2 ILE 32 -6.116 8.331 8.331 578 1HD1 ILE 332 2HD1 ILE 32 -5.173 6.389 6.389 579 2HD1 ILE 332 1HD1 ILE 32 -3.443 6.052 6.052 580 3HD1 ILE 332 3HD1 ILE 32 -4.187 6.621 6.621 581 H ARG 333 H ARG 33 -5.772 12.301 12.301 582 HA ARG 333 HA ARG 33 -8.212 12.836 12.836 583 1HB ARG 333 2HB ARG 33 -7.505 14.264 14.264 584 2HB ARG 333 1HB ARG 33 -8.285 14.896 14.896 585 1HG ARG 333 2HG ARG 33 -6.105 14.506 14.506 586 2HG ARG 333 1HG ARG 33 -5.370 14.150 14.150 587 1HD ARG 333 2HD ARG 33 -6.409 16.438 16.438 588 2HD ARG 333 1HD ARG 33 -6.485 16.752 16.752 589 HE ARG 333 HE ARG 33 -3.935 16.116 16.116 590 1HH1 ARG 333 2HH1 ARG 33 -3.487 15.948 15.948 591 2HH1 ARG 333 1HH1 ARG 33 -3.164 17.577 17.577 592 1HH2 ARG 333 1HH2 ARG 33 -4.519 18.990 18.990 593 2HH2 ARG 333 2HH2 ARG 33 -3.748 19.299 19.299 594 H GLY 334 H GLY 34 -10.217 12.134 12.134 595 1HA GLY 334 2HA GLY 34 -11.690 11.992 11.992 596 2HA GLY 334 1HA GLY 34 -10.497 10.786 10.786 597 H ARG 335 H ARG 35 -11.335 8.788 8.788 598 HA ARG 335 HA ARG 35 -12.022 7.694 7.694 599 1HB ARG 335 2HB ARG 35 -13.996 9.151 9.151 600 2HB ARG 335 1HB ARG 35 -14.422 8.499 8.499 601 1HG ARG 335 2HG ARG 35 -14.909 6.353 6.353 602 2HG ARG 335 1HG ARG 35 -14.093 6.712 6.712 603 1HD ARG 335 2HD ARG 35 -15.996 8.713 8.713 604 2HD ARG 335 1HD ARG 35 -16.841 7.321 7.321 605 HE ARG 335 HE ARG 35 -15.423 6.921 6.921 606 1HH1 ARG 335 2HH1 ARG 35 -17.506 5.043 5.043 607 2HH1 ARG 335 1HH1 ARG 35 -18.897 5.470 5.470 608 1HH2 ARG 335 1HH2 ARG 35 -17.570 8.490 8.490 609 2HH2 ARG 335 2HH2 ARG 35 -18.933 7.424 7.424 610 H GLU 336 H GLU 36 -12.827 7.619 7.619 611 HA GLU 336 HA GLU 36 -13.124 4.718 4.718 612 1HB GLU 336 2HB GLU 36 -13.171 6.915 6.915 613 2HB GLU 336 1HB GLU 36 -12.818 5.285 5.285 614 1HG GLU 336 2HG GLU 36 -14.872 4.476 4.476 615 2HG GLU 336 1HG GLU 36 -15.250 6.151 6.151 616 H ARG 337 H ARG 37 -10.561 7.041 7.041 617 HA ARG 337 HA ARG 37 -8.760 5.061 5.061 618 1HB ARG 337 2HB ARG 37 -8.586 7.913 7.913 619 2HB ARG 337 1HB ARG 37 -7.074 7.002 7.002 620 1HG ARG 337 2HG ARG 37 -7.546 6.266 6.266 621 2HG ARG 337 1HG ARG 37 -8.990 7.278 7.278 622 1HD ARG 337 2HD ARG 37 -6.189 8.317 8.317 623 2HD ARG 337 1HD ARG 37 -7.002 8.388 8.388 624 HE ARG 337 HE ARG 37 -7.945 9.834 9.834 625 1HH1 ARG 337 1HH2 ARG 37 -8.852 8.972 8.972 626 2HH1 ARG 337 2HH2 ARG 37 -9.206 10.581 10.581 627 1HH2 ARG 337 2HH1 ARG 37 -7.927 12.090 12.090 628 2HH2 ARG 337 1HH1 ARG 37 -8.683 12.346 12.346 629 H PHE 338 H PHE 38 -9.418 6.311 6.311 630 HA PHE 338 HA PHE 38 -7.129 5.122 5.122 631 1HB PHE 338 2HB PHE 38 -8.429 6.850 6.850 632 2HB PHE 338 1HB PHE 38 -9.867 5.830 5.830 633 HD1 PHE 338 HD1 PHE 38 -6.317 5.847 5.847 634 HD2 PHE 338 HD2 PHE 38 -10.310 4.371 4.371 635 HE1 PHE 338 HE1 PHE 38 -5.613 4.774 4.774 636 HE2 PHE 338 HE2 PHE 38 -9.606 3.298 3.298 637 HZ PHE 338 HZ PHE 38 -7.258 3.500 3.500 638 H GLU 339 H GLU 39 -10.305 3.939 3.939 639 HA GLU 339 HA GLU 39 -10.069 1.436 1.436 640 1HB GLU 339 2HB GLU 39 -11.882 2.288 2.288 641 2HB GLU 339 1HB GLU 39 -12.018 0.747 0.747 642 1HG GLU 339 2HG GLU 39 -11.990 2.402 2.402 643 2HG GLU 339 1HG GLU 39 -12.704 3.487 3.487 644 H MET 340 H MET 40 -9.410 2.561 2.561 645 HA MET 340 HA MET 40 -8.890 0.086 0.086 646 1HB MET 340 2HB MET 40 -8.141 2.904 2.904 647 2HB MET 340 1HB MET 40 -6.961 1.752 1.752 648 1HG MET 340 2HG MET 40 -8.560 0.715 0.715 649 2HG MET 340 1HG MET 40 -9.915 1.453 1.453 650 1HE MET 340 2HE MET 40 -6.577 2.333 2.333 651 2HE MET 340 1HE MET 40 -6.728 3.510 3.510 652 3HE MET 340 3HE MET 40 -6.807 4.036 4.036 653 H PHE 341 H PHE 41 -6.604 2.230 2.230 654 HA PHE 341 HA PHE 41 -4.403 0.385 0.385 655 1HB PHE 341 2HB PHE 41 -5.019 2.690 2.690 656 2HB PHE 341 1HB PHE 41 -3.505 1.789 1.789 657 HD1 PHE 341 HD2 PHE 41 -4.600 1.734 1.734 658 HD2 PHE 341 HD1 PHE 41 -2.848 4.377 4.377 659 HE1 PHE 341 HE2 PHE 41 -3.709 3.151 3.151 660 HE2 PHE 341 HE1 PHE 41 -1.955 5.788 5.788 661 HZ PHE 341 HZ PHE 41 -2.387 5.180 5.180 662 H ARG 342 H ARG 42 -6.870 1.054 1.054 663 HA ARG 342 HA ARG 42 -6.019 -0.553 -0.553 664 1HB ARG 342 2HB ARG 42 -8.434 0.634 0.634 665 2HB ARG 342 1HB ARG 42 -8.830 -1.083 -1.083 666 1HG ARG 342 2HG ARG 42 -7.518 -1.063 -1.063 667 2HG ARG 342 1HG ARG 42 -7.715 0.688 0.688 668 1HD ARG 342 2HD ARG 42 -10.017 0.579 0.579 669 2HD ARG 342 1HD ARG 42 -10.123 -1.036 -1.036 670 HE ARG 342 HE ARG 42 -8.661 -1.223 -1.223 671 1HH1 ARG 342 1HH2 ARG 42 -11.042 -2.912 -2.912 672 2HH1 ARG 342 2HH2 ARG 42 -12.198 -2.423 -2.423 673 1HH2 ARG 342 2HH1 ARG 42 -10.477 0.460 0.460 674 2HH2 ARG 342 1HH1 ARG 42 -11.878 -0.514 -0.514 675 H GLU 343 H GLU 43 -7.278 -1.568 -1.568 676 HA GLU 343 HA GLU 43 -7.450 -4.388 -4.388 677 1HB GLU 343 2HB GLU 43 -8.841 -3.496 -3.496 678 2HB GLU 343 1HB GLU 43 -7.390 -3.048 -3.048 679 1HG GLU 343 2HG GLU 43 -7.035 -5.169 -5.169 680 2HG GLU 343 1HG GLU 43 -7.412 -5.854 -5.854 681 H LEU 344 H LEU 44 -5.152 -2.337 -2.337 682 HA LEU 344 HA LEU 44 -3.324 -4.378 -4.378 683 1HB LEU 344 2HB LEU 44 -3.092 -1.424 -1.424 684 2HB LEU 344 1HB LEU 44 -1.616 -2.364 -2.364 685 HG LEU 344 HG LEU 44 -2.075 -1.633 -1.633 686 1HD1 LEU 344 2HD1 LEU 44 -2.058 -4.285 -4.285 687 2HD1 LEU 344 1HD1 LEU 44 -3.633 -4.145 -4.145 688 3HD1 LEU 344 3HD1 LEU 44 -2.179 -3.614 -3.614 689 1HD2 LEU 344 1HD2 LEU 44 -4.647 -1.250 -1.250 690 2HD2 LEU 344 3HD2 LEU 44 -4.127 -1.023 -1.023 691 3HD2 LEU 344 2HD2 LEU 44 -4.856 -2.553 -2.553 692 H ASN 345 H ASN 45 -2.945 -2.112 -2.112 693 HA ASN 345 HA ASN 45 -0.905 -3.596 -3.596 694 1HB ASN 345 2HB ASN 45 -1.621 -2.350 -2.350 695 2HB ASN 345 1HB ASN 45 -1.379 -1.305 -1.305 696 1HD2 ASN 345 2HD2 ASN 45 -4.674 -0.417 -0.417 697 2HD2 ASN 345 1HD2 ASN 45 -3.063 -0.401 -0.401 698 H GLU 346 H GLU 46 -4.257 -4.262 -4.262 699 HA GLU 346 HA GLU 46 -4.653 -5.756 -5.756 700 1HB GLU 346 2HB GLU 46 -6.199 -5.063 -5.063 701 2HB GLU 346 1HB GLU 46 -6.201 -6.825 -6.825 702 1HG GLU 346 2HG GLU 46 -6.633 -6.366 -6.366 703 2HG GLU 346 1HG GLU 46 -7.262 -4.835 -4.835 704 H ALA 347 H ALA 47 -3.751 -6.720 -6.720 705 HA ALA 347 HA ALA 47 -3.450 -9.513 -9.513 706 1HB ALA 347 2HB ALA 47 -2.676 -7.812 -7.812 707 2HB ALA 347 1HB ALA 47 -2.101 -9.474 -9.474 708 3HB ALA 347 3HB ALA 47 -3.831 -9.142 -9.142 709 H LEU 348 H LEU 48 -1.133 -6.823 -6.823 710 HA LEU 348 HA LEU 48 1.255 -8.262 -8.262 711 1HB LEU 348 2HB LEU 48 0.573 -5.462 -5.462 712 2HB LEU 348 1HB LEU 48 2.202 -6.124 -6.124 713 HG LEU 348 HG LEU 48 0.266 -5.981 -5.981 714 1HD1 LEU 348 3HD1 LEU 48 1.722 -3.857 -3.857 715 2HD1 LEU 348 2HD1 LEU 48 2.385 -4.128 -4.128 716 3HD1 LEU 348 1HD1 LEU 48 0.669 -3.770 -3.770 717 1HD2 LEU 348 3HD2 LEU 48 2.742 -7.286 -7.286 718 2HD2 LEU 348 2HD2 LEU 48 1.887 -7.079 -7.079 719 3HD2 LEU 348 1HD2 LEU 48 3.089 -5.892 -5.892 720 H GLU 349 H GLU 49 -0.880 -6.721 -6.721 721 HA GLU 349 HA GLU 49 0.602 -7.533 -7.533 722 1HB GLU 349 2HB GLU 49 -2.255 -6.753 -6.753 723 2HB GLU 349 1HB GLU 49 -1.819 -7.444 -7.444 724 1HG GLU 349 2HG GLU 49 0.037 -5.723 -5.723 725 2HG GLU 349 1HG GLU 49 -0.675 -4.957 -4.957 726 H LEU 350 H LEU 50 -1.815 -9.172 -9.172 727 HA LEU 350 HA LEU 50 -2.264 -11.395 -11.395 728 1HB LEU 350 2HB LEU 50 -3.629 -12.092 -12.092 729 2HB LEU 350 1HB LEU 50 -3.230 -10.573 -10.573 730 HG LEU 350 HG LEU 50 -1.148 -11.920 -11.920 731 1HD1 LEU 350 3HD1 LEU 50 -2.675 -13.920 -13.920 732 2HD1 LEU 350 2HD1 LEU 50 -2.627 -14.317 -14.317 733 3HD1 LEU 350 1HD1 LEU 50 -1.126 -14.091 -14.091 734 1HD2 LEU 350 3HD2 LEU 50 -3.979 -11.825 -11.825 735 2HD2 LEU 350 2HD2 LEU 50 -2.520 -11.236 -11.236 736 3HD2 LEU 350 1HD2 LEU 50 -2.915 -12.954 -12.954 737 H LYS 351 H LYS 51 0.314 -10.596 -10.596 738 HA LYS 351 HA LYS 51 1.520 -13.190 -13.190 739 1HB LYS 351 2HB LYS 51 2.082 -11.114 -11.114 740 2HB LYS 351 1HB LYS 51 3.026 -10.564 -10.564 741 1HG LYS 351 2HG LYS 51 4.483 -12.454 -12.454 742 2HG LYS 351 1HG LYS 51 3.419 -13.288 -13.288 743 1HD LYS 351 2HD LYS 51 5.471 -12.198 -12.198 744 2HD LYS 351 1HD LYS 51 3.927 -11.736 -11.736 745 1HE LYS 351 2HE LYS 51 3.963 -9.610 -9.610 746 2HE LYS 351 1HE LYS 51 5.044 -10.107 -10.107 747 1HZ LYS 351 1HZ LYS 51 5.956 -10.159 -10.159 748 2HZ LYS 351 3HZ LYS 51 5.980 -8.709 -8.709 749 3HZ LYS 351 2HZ LYS 51 6.877 -10.045 -10.045 750 H ASP 352 H ASP 52 1.867 -10.509 -10.509 751 HA ASP 352 HA ASP 52 4.004 -11.619 -11.619 752 1HB ASP 352 2HB ASP 52 2.768 -9.260 -9.260 753 2HB ASP 352 1HB ASP 52 1.841 -10.061 -10.061 754 H ALA 353 H ALA 53 0.493 -12.087 -12.087 755 HA ALA 353 HA ALA 53 0.629 -13.750 -13.750 756 1HB ALA 353 3HB ALA 53 -1.402 -12.446 -12.446 757 2HB ALA 353 2HB ALA 53 -1.713 -14.152 -14.152 758 3HB ALA 353 1HB ALA 53 -1.626 -13.572 -13.572 759 H GLN 354 H GLN 54 1.249 -14.227 -14.227 760 HA GLN 354 HA GLN 54 0.485 -17.005 -17.005 761 1HB GLN 354 2HB GLN 54 2.005 -15.057 -15.057 762 2HB GLN 354 1HB GLN 54 2.497 -16.740 -16.740 763 1HG GLN 354 2HG GLN 54 -0.288 -16.857 -16.857 764 2HG GLN 354 1HG GLN 54 0.070 -15.407 -15.407 765 1HE2 GLN 354 2HE2 GLN 54 2.157 -17.426 -17.426 766 2HE2 GLN 354 1HE2 GLN 54 2.414 -16.080 -16.080 767 H ALA 355 HN ALA 55 1.840 -18.856 -18.856 768 HA ALA 355 HA ALA 55 4.321 -18.385 -18.385 769 1HB ALA 355 2HB ALA 55 2.359 -19.644 -19.644 770 2HB ALA 355 1HB ALA 55 2.712 -20.945 -20.945 771 3HB ALA 355 3HB ALA 55 3.925 -20.455 -20.455 772 1H GLY 325 1H GLY 25 -12.907 13.057 13.057 773 2H GLY 325 3H GLY 25 -14.049 12.389 12.389 774 3H GLY 325 2H GLY 25 -14.008 14.068 14.068 775 1HA GLY 325 2HA GLY 25 -15.725 13.577 13.577 776 2HA GLY 325 1HA GLY 25 -15.116 11.951 11.951 777 H GLU 326 H GLU 26 -13.300 11.723 11.723 778 HA GLU 326 HA GLU 26 -12.848 14.115 14.115 779 1HB GLU 326 2HB GLU 26 -13.550 11.300 11.300 780 2HB GLU 326 1HB GLU 26 -12.876 12.508 12.508 781 1HG GLU 326 2HG GLU 26 -14.760 14.015 14.015 782 2HG GLU 326 1HG GLU 26 -15.432 12.830 12.830 783 H TYR 327 H TYR 27 -11.042 13.097 13.097 784 HA TYR 327 HA TYR 27 -8.795 12.327 12.327 785 1HB TYR 327 2HB TYR 27 -8.836 13.595 13.595 786 2HB TYR 327 1HB TYR 27 -7.362 13.113 13.113 787 HD1 TYR 327 HD2 TYR 27 -10.392 15.270 15.270 788 HD2 TYR 327 HD1 TYR 27 -6.396 14.493 14.493 789 HE1 TYR 327 HE2 TYR 27 -10.413 17.401 17.401 790 HE2 TYR 327 HE1 TYR 27 -6.418 16.624 16.624 791 HH TYR 327 HH TYR 27 -8.274 18.131 18.131 792 H PHE 328 H PHE 28 -8.175 10.232 10.232 793 HA PHE 328 HA PHE 28 -8.822 8.655 8.655 794 1HB PHE 328 2HB PHE 28 -8.512 7.908 7.908 795 2HB PHE 328 1HB PHE 28 -8.371 6.689 6.689 796 HD1 PHE 328 HD2 PHE 28 -10.631 9.173 9.173 797 HD2 PHE 328 HD1 PHE 28 -10.288 5.959 5.959 798 HE1 PHE 328 HE2 PHE 28 -13.103 9.049 9.049 799 HE2 PHE 328 HE1 PHE 28 -12.759 5.834 5.834 800 HZ PHE 328 HZ PHE 28 -14.167 7.379 7.379 801 H THR 329 H THR 29 -7.163 7.601 7.601 802 HA THR 329 HA THR 29 -4.411 8.304 8.304 803 HB THR 329 HB THR 29 -4.538 6.877 6.877 804 HG1 THR 329 HG1 THR 29 -6.457 7.599 7.599 805 1HG2 THR 329 2HG2 THR 29 -2.824 8.552 8.552 806 2HG2 THR 329 1HG2 THR 29 -3.980 9.808 9.808 807 3HG2 THR 329 3HG2 THR 29 -3.303 8.754 8.754 808 H LEU 330 H LEU 30 -3.013 6.760 6.760 809 HA LEU 330 HA LEU 30 -3.913 3.912 3.912 810 1HB LEU 330 2HB LEU 30 -3.430 5.431 5.431 811 2HB LEU 330 1HB LEU 30 -1.970 4.461 4.461 812 HG LEU 330 HG LEU 30 -4.638 3.137 3.137 813 1HD1 LEU 330 1HD1 LEU 30 -4.171 4.604 4.604 814 2HD1 LEU 330 3HD1 LEU 30 -3.490 3.039 3.039 815 3HD1 LEU 330 2HD1 LEU 30 -5.176 3.156 3.156 816 1HD2 LEU 330 2HD2 LEU 30 -1.816 2.400 2.400 817 2HD2 LEU 330 1HD2 LEU 30 -2.951 1.609 1.609 818 3HD2 LEU 330 3HD2 LEU 30 -3.109 1.391 1.391 819 H GLN 331 H GLN 31 -2.724 3.634 3.634 820 HA GLN 331 HA GLN 31 0.147 4.203 4.203 821 1HB GLN 331 2HB GLN 31 -1.227 4.382 4.382 822 2HB GLN 331 1HB GLN 31 -1.580 2.656 2.656 823 1HG GLN 331 2HG GLN 31 0.831 2.151 2.151 824 2HG GLN 331 1HG GLN 31 1.181 3.878 3.878 825 1HE2 GLN 331 2HE2 GLN 31 -0.704 4.003 4.003 826 2HE2 GLN 331 1HE2 GLN 31 -0.897 4.735 4.735 827 H ILE 332 H ILE 32 1.428 2.897 2.897 828 HA ILE 332 HA ILE 32 0.796 -0.021 -0.021 829 HB ILE 332 HB ILE 32 2.592 1.616 1.616 830 1HG1 ILE 332 2HG1 ILE 32 0.226 0.365 0.365 831 2HG1 ILE 332 1HG1 ILE 32 -0.197 1.528 1.528 832 1HG2 ILE 332 2HG2 ILE 32 3.029 -0.915 -0.915 833 2HG2 ILE 332 1HG2 ILE 32 1.536 -1.161 -1.161 834 3HG2 ILE 332 3HG2 ILE 32 2.903 -0.346 -0.346 835 1HD1 ILE 332 2HD1 ILE 32 1.880 2.288 2.288 836 2HD1 ILE 332 1HD1 ILE 32 0.180 2.337 2.337 837 3HD1 ILE 332 3HD1 ILE 32 0.751 3.315 3.315 838 H ARG 333 H ARG 33 2.242 -1.452 -1.452 839 HA ARG 333 HA ARG 33 4.498 -0.322 -0.322 840 1HB ARG 333 2HB ARG 33 3.955 -3.268 -3.268 841 2HB ARG 333 1HB ARG 33 4.575 -2.359 -2.359 842 1HG ARG 333 2HG ARG 33 2.319 -1.226 -1.226 843 2HG ARG 333 1HG ARG 33 1.738 -2.377 -2.377 844 1HD ARG 333 2HD ARG 33 2.736 -4.177 -4.177 845 2HD ARG 333 1HD ARG 33 2.636 -2.892 -2.892 846 HE ARG 333 HE ARG 33 0.140 -2.772 -2.772 847 1HH1 ARG 333 2HH1 ARG 33 -0.038 -5.069 -5.069 848 2HH1 ARG 333 1HH1 ARG 33 -0.393 -6.383 -6.383 849 1HH2 ARG 333 1HH2 ARG 33 0.624 -4.682 -4.682 850 2HH2 ARG 333 2HH2 ARG 33 -0.017 -6.162 -6.162 851 H GLY 334 H GLY 34 6.577 -0.321 -0.321 852 1HA GLY 334 2HA GLY 34 8.248 -1.975 -1.975 853 2HA GLY 334 1HA GLY 34 7.163 -1.784 -1.784 854 H ARG 335 H ARG 35 8.082 -0.433 -0.433 855 HA ARG 335 HA ARG 35 8.580 2.307 2.307 856 1HB ARG 335 2HB ARG 35 10.480 1.542 1.542 857 2HB ARG 335 1HB ARG 35 11.085 0.593 0.593 858 1HG ARG 335 2HG ARG 35 11.588 2.533 2.533 859 2HG ARG 335 1HG ARG 35 10.620 3.569 3.569 860 1HD ARG 335 2HD ARG 35 12.427 2.450 2.450 861 2HD ARG 335 1HD ARG 35 13.398 2.678 2.678 862 HE ARG 335 HE ARG 35 11.772 4.980 4.980 863 1HH1 ARG 335 2HH1 ARG 35 14.040 5.194 5.194 864 2HH1 ARG 335 1HH1 ARG 35 15.314 5.818 5.818 865 1HH2 ARG 335 1HH2 ARG 35 13.746 5.009 5.009 866 2HH2 ARG 335 2HH2 ARG 35 15.149 5.713 5.713 867 H GLU 336 H GLU 36 9.702 -0.516 -0.516 868 HA GLU 336 HA GLU 36 10.147 1.059 1.059 869 1HB GLU 336 2HB GLU 36 10.277 -1.828 -1.828 870 2HB GLU 336 1HB GLU 36 10.054 -1.442 -1.442 871 1HG GLU 336 2HG GLU 36 12.023 0.096 0.096 872 2HG GLU 336 1HG GLU 36 12.286 -0.455 -0.455 873 H ARG 337 H ARG 37 7.558 -0.985 -0.985 874 HA ARG 337 HA ARG 37 5.962 -0.917 -0.917 875 1HB ARG 337 2HB ARG 37 5.580 -1.782 -1.782 876 2HB ARG 337 1HB ARG 37 4.118 -1.360 -1.360 877 1HG ARG 337 2HG ARG 37 4.840 -2.891 -2.891 878 2HG ARG 337 1HG ARG 37 6.226 -3.367 -3.367 879 1HD ARG 337 2HD ARG 37 3.341 -3.647 -3.647 880 2HD ARG 337 1HD ARG 37 4.292 -4.953 -4.953 881 HE ARG 337 HE ARG 37 4.928 -3.644 -3.644 882 1HH1 ARG 337 1HH2 ARG 37 6.167 -5.736 -5.736 883 2HH1 ARG 337 2HH2 ARG 37 6.492 -7.038 -7.038 884 1HH2 ARG 337 2HH1 ARG 37 4.872 -5.540 -5.540 885 2HH2 ARG 337 1HH1 ARG 37 5.758 -6.928 -6.928 886 H PHE 338 H PHE 38 6.262 1.146 1.146 887 HA PHE 338 HA PHE 38 3.924 2.747 2.747 888 1HB PHE 338 2HB PHE 38 5.025 2.830 2.830 889 2HB PHE 338 1HB PHE 38 6.510 3.428 3.428 890 HD1 PHE 338 HD1 PHE 38 2.867 4.244 4.244 891 HD2 PHE 338 HD2 PHE 38 6.856 5.739 5.739 892 HE1 PHE 338 HE1 PHE 38 2.022 6.567 6.567 893 HE2 PHE 338 HE2 PHE 38 6.008 8.063 8.063 894 HZ PHE 338 HZ PHE 38 3.592 8.478 8.478 895 H GLU 339 H GLU 39 7.227 2.773 2.773 896 HA GLU 339 HA GLU 39 6.974 5.361 5.361 897 1HB GLU 339 2HB GLU 39 8.951 3.085 3.085 898 2HB GLU 339 1HB GLU 39 9.078 4.641 4.641 899 1HG GLU 339 2HG GLU 39 8.776 5.520 5.520 900 2HG GLU 339 1HG GLU 39 9.544 3.967 3.967 901 H MET 340 H MET 40 6.566 1.960 1.960 902 HA MET 340 HA MET 40 6.289 2.226 2.226 903 1HB MET 340 2HB MET 40 5.446 0.293 0.293 904 2HB MET 340 1HB MET 40 4.385 0.336 0.336 905 1HG MET 340 2HG MET 40 6.154 -0.195 -0.195 906 2HG MET 340 1HG MET 40 7.387 0.185 0.185 907 1HE MET 340 2HE MET 40 4.131 -1.449 -1.449 908 2HE MET 340 1HE MET 40 4.346 -3.169 -3.169 909 3HE MET 340 3HE MET 40 4.249 -2.028 -2.028 910 H PHE 341 H PHE 41 3.750 2.385 2.385 911 HA PHE 341 HA PHE 41 1.665 3.175 3.175 912 1HB PHE 341 2HB PHE 41 1.992 3.519 3.519 913 2HB PHE 341 1HB PHE 41 0.527 3.969 3.969 914 HD1 PHE 341 HD2 PHE 41 1.928 1.269 1.269 915 HD2 PHE 341 HD1 PHE 41 -0.219 2.166 2.166 916 HE1 PHE 341 HE2 PHE 41 1.138 -1.078 -1.078 917 HE2 PHE 341 HE1 PHE 41 -1.006 -0.179 -0.179 918 HZ PHE 341 HZ PHE 41 -0.329 -1.802 -1.802 919 H ARG 342 H ARG 42 3.860 5.022 5.022 920 HA ARG 342 HA ARG 42 2.899 7.600 7.600 921 1HB ARG 342 2HB ARG 42 5.303 6.488 6.488 922 2HB ARG 342 1HB ARG 42 5.779 7.508 7.508 923 1HG ARG 342 2HG ARG 42 4.260 9.307 9.307 924 2HG ARG 342 1HG ARG 42 4.373 8.305 8.305 925 1HD ARG 342 2HD ARG 42 6.644 8.696 8.696 926 2HD ARG 342 1HD ARG 42 6.898 8.996 8.996 927 HE ARG 342 HE ARG 42 5.221 11.059 11.059 928 1HH1 ARG 342 1HH2 ARG 42 7.738 11.507 11.507 929 2HH1 ARG 342 2HH2 ARG 42 8.750 12.304 12.304 930 1HH2 ARG 342 2HH1 ARG 42 6.821 11.370 11.370 931 2HH2 ARG 342 1HH1 ARG 42 8.231 12.226 12.226 932 H GLU 343 H GLU 43 4.484 5.598 5.598 933 HA GLU 343 HA GLU 43 4.732 7.758 7.758 934 1HB GLU 343 2HB GLU 43 6.244 5.823 5.823 935 2HB GLU 343 1HB GLU 43 4.868 4.745 4.745 936 1HG GLU 343 2HG GLU 43 4.674 5.282 5.282 937 2HG GLU 343 1HG GLU 43 4.939 6.998 6.998 938 H LEU 344 H LEU 44 2.507 5.027 5.027 939 HA LEU 344 HA LEU 44 0.860 5.436 5.436 940 1HB LEU 344 2HB LEU 44 0.442 4.225 4.225 941 2HB LEU 344 1HB LEU 44 -0.970 4.528 4.528 942 HG LEU 344 HG LEU 44 -0.373 2.321 2.321 943 1HD1 LEU 344 2HD1 LEU 44 -0.295 4.173 4.173 944 2HD1 LEU 344 1HD1 LEU 44 1.343 3.535 3.535 945 3HD1 LEU 344 3HD1 LEU 44 -0.042 2.455 2.455 946 1HD2 LEU 344 1HD2 LEU 44 2.086 2.977 2.977 947 2HD2 LEU 344 3HD2 LEU 44 1.691 1.442 1.442 948 3HD2 LEU 344 2HD2 LEU 44 2.459 2.729 2.729 949 H ASN 345 H ASN 45 0.117 6.484 6.484 950 HA ASN 345 HA ASN 45 -1.958 8.274 8.274 951 1HB ASN 345 2HB ASN 45 -1.502 9.358 9.358 952 2HB ASN 345 1HB ASN 45 -1.663 7.606 7.606 953 1HD2 ASN 345 2HD2 ASN 45 1.421 8.573 8.573 954 2HD2 ASN 345 1HD2 ASN 45 -0.232 8.928 8.928 955 H GLU 346 H GLU 46 1.435 8.531 8.531 956 HA GLU 346 HA GLU 46 1.683 11.401 11.401 957 1HB GLU 346 2HB GLU 46 3.392 9.202 9.202 958 2HB GLU 346 1HB GLU 46 3.473 10.225 10.225 959 1HG GLU 346 2HG GLU 46 3.641 12.164 12.164 960 2HG GLU 346 1HG GLU 46 4.247 10.854 10.854 961 H ALA 347 H ALA 47 1.119 9.112 9.112 962 HA ALA 347 HA ALA 47 0.896 11.199 11.199 963 1HB ALA 347 2HB ALA 47 0.227 8.264 8.264 964 2HB ALA 347 1HB ALA 47 -0.284 9.253 9.253 965 3HB ALA 347 3HB ALA 47 1.431 9.095 9.095 966 H LEU 348 H LEU 48 -1.501 9.240 9.240 967 HA LEU 348 HA LEU 48 -3.844 10.273 10.273 968 1HB LEU 348 2HB LEU 48 -3.379 9.579 9.579 969 2HB LEU 348 1HB LEU 48 -4.955 9.733 9.733 970 HG LEU 348 HG LEU 48 -2.827 7.811 7.811 971 1HD1 LEU 348 3HD1 LEU 48 -4.495 7.663 7.663 972 2HD1 LEU 348 2HD1 LEU 48 -4.989 6.425 6.425 973 3HD1 LEU 348 1HD1 LEU 48 -3.318 6.491 6.491 974 1HD2 LEU 348 3HD2 LEU 48 -5.264 8.741 8.741 975 2HD2 LEU 348 2HD2 LEU 48 -4.290 7.386 7.386 976 3HD2 LEU 348 1HD2 LEU 48 -5.588 7.111 7.111 977 H GLU 349 H GLU 49 -2.013 11.566 11.566 978 HA GLU 349 HA GLU 49 -3.661 13.858 13.858 979 1HB GLU 349 2HB GLU 49 -0.812 13.153 13.153 980 2HB GLU 349 1HB GLU 49 -1.358 14.816 14.816 981 1HG GLU 349 2HG GLU 49 -3.302 13.886 13.886 982 2HG GLU 349 1HG GLU 49 -2.497 12.316 12.316 983 H LEU 350 H LEU 50 -0.992 13.211 13.211 984 HA LEU 350 HA LEU 50 -0.589 15.890 15.890 985 1HB LEU 350 2HB LEU 50 0.943 14.923 14.923 986 2HB LEU 350 1HB LEU 50 0.547 13.420 13.420 987 HG LEU 350 HG LEU 50 -1.397 13.297 13.297 988 1HD1 LEU 350 3HD1 LEU 50 0.096 15.618 15.618 989 2HD1 LEU 350 2HD1 LEU 50 0.226 14.375 14.375 990 3HD1 LEU 350 1HD1 LEU 50 -1.361 14.938 14.938 991 1HD2 LEU 350 3HD2 LEU 50 1.489 12.585 12.585 992 2HD2 LEU 350 2HD2 LEU 50 0.068 11.543 11.543 993 3HD2 LEU 350 1HD2 LEU 50 0.559 12.458 12.458 994 H LYS 351 H LYS 51 -2.994 13.455 13.455 995 HA LYS 351 HA LYS 51 -4.062 14.664 14.664 996 1HB LYS 351 2HB LYS 51 -4.587 12.333 12.333 997 2HB LYS 351 1HB LYS 51 -5.684 13.144 13.144 998 1HG LYS 351 2HG LYS 51 -7.026 13.999 13.999 999 2HG LYS 351 1HG LYS 51 -5.820 13.554 13.554 1000 1HD LYS 351 2HD LYS 51 -7.823 11.992 11.992 1001 2HD LYS 351 1HD LYS 51 -6.246 11.215 11.215 1002 1HE LYS 351 2HE LYS 51 -6.472 10.860 10.860 1003 2HE LYS 351 1HE LYS 51 -7.642 12.165 12.165 1004 1HZ LYS 351 1HZ LYS 51 -8.292 9.806 9.806 1005 2HZ LYS 351 3HZ LYS 51 -8.462 9.744 9.744 1006 3HZ LYS 351 2HZ LYS 51 -9.342 10.886 10.886 1007 H ASP 352 H ASP 52 -4.747 15.106 15.106 1008 HA ASP 352 HA ASP 52 -6.962 16.880 16.880 1009 1HB ASP 352 2HB ASP 52 -5.856 15.735 15.735 1010 2HB ASP 352 1HB ASP 52 -5.008 17.279 17.279 1011 H ALA 353 H ALA 53 -3.460 17.432 17.432 1012 HA ALA 353 HA ALA 53 -3.735 20.333 20.333 1013 1HB ALA 353 3HB ALA 53 -1.647 18.572 18.572 1014 2HB ALA 353 2HB ALA 53 -1.226 19.248 19.248 1015 3HB ALA 353 1HB ALA 53 -1.497 20.318 20.318 1016 H GLN 354 H GLN 54 -4.015 17.773 17.773 1017 HA GLN 354 HA GLN 54 -3.098 19.170 19.170 1018 1HB GLN 354 2HB GLN 54 -4.527 16.657 16.657 1019 2HB GLN 354 1HB GLN 54 -4.941 17.384 17.384 1020 1HG GLN 354 2HG GLN 54 -2.188 17.662 17.662 1021 2HG GLN 354 1HG GLN 54 -2.449 16.089 16.089 1022 1HE2 GLN 354 2HE2 GLN 54 -4.241 14.939 14.939 1023 2HE2 GLN 354 1HE2 GLN 54 -4.661 15.124 15.124 1024 H ALA 355 HN ALA 55 -4.370 20.253 20.253 1025 HA ALA 355 HA ALA 55 -7.011 21.206 21.206 1026 1HB ALA 355 2HB ALA 55 -5.072 22.873 22.873 1027 2HB ALA 355 1HB ALA 55 -5.315 22.631 22.631 1028 3HB ALA 355 3HB ALA 55 -6.617 23.291 23.291 Start of MODEL 13 1 1H GLY 325 2H GLY 25 15.180 -1.184 -1.184 2 2H GLY 325 1H GLY 25 15.647 0.441 0.441 3 3H GLY 325 3H GLY 25 14.931 -0.376 -0.376 4 1HA GLY 325 2HA GLY 25 12.874 0.026 0.026 5 2HA GLY 325 1HA GLY 25 13.628 1.206 1.206 6 H GLU 326 H GLU 26 11.438 -1.153 -1.153 7 HA GLU 326 HA GLU 26 11.843 -1.592 -1.592 8 1HB GLU 326 2HB GLU 26 12.278 -3.775 -3.775 9 2HB GLU 326 1HB GLU 26 11.611 -4.167 -4.167 10 1HG GLU 326 2HG GLU 26 13.665 -2.549 -2.549 11 2HG GLU 326 1HG GLU 26 14.340 -3.271 -3.271 12 H TYR 327 H TYR 27 10.056 -3.577 -3.577 13 HA TYR 327 HA TYR 27 7.537 -2.397 -2.397 14 1HB TYR 327 2HB TYR 27 8.298 -3.908 -3.908 15 2HB TYR 327 1HB TYR 27 6.632 -4.013 -4.013 16 HD1 TYR 327 HD1 TYR 27 5.447 -1.760 -1.760 17 HD2 TYR 327 HD2 TYR 27 8.979 -2.072 -2.072 18 HE1 TYR 327 HE1 TYR 27 4.972 0.469 0.469 19 HE2 TYR 327 HE2 TYR 27 8.504 0.157 0.157 20 HH TYR 327 HH TYR 27 6.990 1.798 1.798 21 H PHE 328 H PHE 28 6.693 -3.449 -3.449 22 HA PHE 328 HA PHE 28 7.076 -6.413 -6.413 23 1HB PHE 328 2HB PHE 28 6.560 -4.358 -4.358 24 2HB PHE 328 1HB PHE 28 6.532 -6.100 -6.100 25 HD1 PHE 328 HD2 PHE 28 8.613 -7.463 -7.463 26 HD2 PHE 328 HD1 PHE 28 8.611 -3.172 -3.172 27 HE1 PHE 328 HE2 PHE 28 11.084 -7.472 -7.472 28 HE2 PHE 328 HE1 PHE 28 11.081 -3.181 -3.181 29 HZ PHE 328 HZ PHE 28 12.317 -5.331 -5.331 30 H THR 329 H THR 29 5.167 -7.580 -7.580 31 HA THR 329 HA THR 29 2.578 -6.250 -6.250 32 HB THR 329 HB THR 29 2.703 -9.183 -9.183 33 HG1 THR 329 HG1 THR 29 4.481 -9.121 -9.121 34 1HG2 THR 329 1HG2 THR 29 0.942 -7.297 -7.297 35 2HG2 THR 329 3HG2 THR 29 1.882 -7.388 -7.388 36 3HG2 THR 329 2HG2 THR 29 1.092 -8.832 -8.832 37 H LEU 330 H LEU 30 1.050 -6.355 -6.355 38 HA LEU 330 HA LEU 30 1.578 -8.211 -8.211 39 1HB LEU 330 2HB LEU 30 1.168 -5.430 -5.430 40 2HB LEU 330 1HB LEU 30 -0.346 -6.119 -6.119 41 HG LEU 330 HG LEU 30 1.741 -7.553 -7.553 42 1HD1 LEU 330 3HD1 LEU 30 2.225 -4.605 -4.605 43 2HD1 LEU 330 2HD1 LEU 30 2.618 -5.404 -5.404 44 3HD1 LEU 330 1HD1 LEU 30 3.392 -5.927 -5.927 45 1HD2 LEU 330 2HD2 LEU 30 -0.530 -7.027 -7.027 46 2HD2 LEU 330 1HD2 LEU 30 0.738 -6.585 -6.585 47 3HD2 LEU 330 3HD2 LEU 30 -0.049 -5.339 -5.339 48 H GLN 331 H GLN 31 0.418 -9.978 -9.978 49 HA GLN 331 HA GLN 31 -2.328 -9.544 -9.544 50 1HB GLN 331 2HB GLN 31 -0.457 -11.284 -11.284 51 2HB GLN 331 1HB GLN 31 -1.221 -12.278 -12.278 52 1HG GLN 331 2HG GLN 31 -3.383 -12.048 -12.048 53 2HG GLN 331 1HG GLN 31 -2.749 -10.854 -10.854 54 1HE2 GLN 331 2HE2 GLN 31 -1.672 -14.796 -14.796 55 2HE2 GLN 331 1HE2 GLN 31 -2.058 -14.251 -14.251 56 H ILE 332 H ILE 32 -3.927 -9.406 -9.406 57 HA ILE 332 HA ILE 32 -3.641 -10.993 -10.993 58 HB ILE 332 HB ILE 32 -5.138 -8.387 -8.387 59 1HG1 ILE 332 2HG1 ILE 32 -2.976 -8.342 -8.342 60 2HG1 ILE 332 1HG1 ILE 32 -2.379 -8.846 -8.846 61 1HG2 ILE 332 1HG2 ILE 32 -5.532 -10.374 -10.374 62 2HG2 ILE 332 3HG2 ILE 32 -4.508 -9.193 -9.193 63 3HG2 ILE 332 2HG2 ILE 32 -6.051 -8.694 -8.694 64 1HD1 ILE 332 2HD1 ILE 32 -3.492 -6.871 -6.871 65 2HD1 ILE 332 1HD1 ILE 32 -4.004 -6.351 -6.351 66 3HD1 ILE 332 3HD1 ILE 32 -2.288 -6.404 -6.404 67 H ARG 333 H ARG 33 -5.074 -12.635 -12.635 68 HA ARG 333 HA ARG 33 -7.384 -12.737 -12.737 69 1HB ARG 333 2HB ARG 33 -5.975 -14.748 -14.748 70 2HB ARG 333 1HB ARG 33 -6.710 -14.632 -14.632 71 1HG ARG 333 2HG ARG 33 -8.963 -14.791 -14.791 72 2HG ARG 333 1HG ARG 33 -8.158 -15.064 -15.064 73 1HD ARG 333 2HD ARG 33 -7.664 -17.215 -17.215 74 2HD ARG 333 1HD ARG 33 -7.166 -16.798 -16.798 75 HE ARG 333 HE ARG 33 -10.005 -17.260 -17.260 76 1HH1 ARG 333 1HH2 ARG 33 -9.293 -15.661 -15.661 77 2HH1 ARG 333 2HH2 ARG 33 -9.434 -16.900 -16.900 78 1HH2 ARG 333 2HH1 ARG 33 -9.395 -19.499 -19.499 79 2HH2 ARG 333 1HH1 ARG 33 -9.493 -19.073 -19.073 80 H GLY 334 H GLY 34 -8.703 -11.000 -11.000 81 1HA GLY 334 2HA GLY 34 -10.600 -11.604 -11.604 82 2HA GLY 334 1HA GLY 34 -9.394 -10.510 -10.510 83 H ARG 335 H ARG 35 -10.956 -8.806 -8.806 84 HA ARG 335 HA ARG 35 -11.214 -7.266 -7.266 85 1HB ARG 335 2HB ARG 35 -13.268 -8.865 -8.865 86 2HB ARG 335 1HB ARG 35 -13.747 -7.726 -7.726 87 1HG ARG 335 2HG ARG 35 -13.997 -5.955 -5.955 88 2HG ARG 335 1HG ARG 35 -12.946 -6.702 -6.702 89 1HD ARG 335 2HD ARG 35 -14.741 -8.553 -8.553 90 2HD ARG 335 1HD ARG 35 -15.792 -7.419 -7.419 91 HE ARG 335 HE ARG 35 -14.976 -7.226 -7.226 92 1HH1 ARG 335 1HH2 ARG 35 -14.128 -4.706 -4.706 93 2HH1 ARG 335 2HH2 ARG 35 -15.472 -3.671 -3.671 94 1HH2 ARG 335 2HH1 ARG 35 -17.478 -6.236 -6.236 95 2HH2 ARG 335 1HH1 ARG 35 -17.369 -4.536 -4.536 96 H GLU 336 H GLU 36 -12.157 -7.509 -7.509 97 HA GLU 336 HA GLU 36 -12.280 -4.626 -4.626 98 1HB GLU 336 2HB GLU 36 -12.208 -6.960 -6.960 99 2HB GLU 336 1HB GLU 36 -12.196 -5.291 -5.291 100 1HG GLU 336 2HG GLU 36 -14.287 -6.306 -6.306 101 2HG GLU 336 1HG GLU 36 -14.493 -6.421 -6.421 102 H ARG 337 H ARG 37 -9.903 -7.130 -7.130 103 HA ARG 337 HA ARG 37 -8.008 -5.307 -5.307 104 1HB ARG 337 2HB ARG 37 -8.002 -8.120 -8.120 105 2HB ARG 337 1HB ARG 37 -6.433 -7.315 -7.315 106 1HG ARG 337 2HG ARG 37 -6.720 -6.610 -6.610 107 2HG ARG 337 1HG ARG 37 -8.254 -7.480 -7.480 108 1HD ARG 337 2HD ARG 37 -5.464 -8.579 -8.579 109 2HD ARG 337 1HD ARG 37 -6.788 -9.073 -9.073 110 HE ARG 337 HE ARG 37 -6.651 -9.721 -9.721 111 1HH1 ARG 337 2HH1 ARG 37 -9.203 -9.744 -9.744 112 2HH1 ARG 337 1HH1 ARG 37 -9.346 -11.453 -11.453 113 1HH2 ARG 337 1HH2 ARG 37 -6.184 -12.162 -12.162 114 2HH2 ARG 337 2HH2 ARG 37 -7.639 -12.822 -12.822 115 H PHE 338 H PHE 38 -8.350 -6.636 -6.636 116 HA PHE 338 HA PHE 38 -6.087 -5.340 -5.340 117 1HB PHE 338 2HB PHE 38 -7.210 -7.021 -7.021 118 2HB PHE 338 1HB PHE 38 -8.742 -6.153 -6.153 119 HD1 PHE 338 HD2 PHE 38 -5.370 -6.191 -6.191 120 HD2 PHE 338 HD1 PHE 38 -9.179 -4.209 -4.209 121 HE1 PHE 338 HE2 PHE 38 -4.781 -4.938 -4.938 122 HE2 PHE 338 HE1 PHE 38 -8.590 -2.956 -2.956 123 HZ PHE 338 HZ PHE 38 -6.390 -3.321 -3.321 124 H GLU 339 H GLU 39 -9.399 -4.193 -4.193 125 HA GLU 339 HA GLU 39 -9.079 -1.705 -1.705 126 1HB GLU 339 2HB GLU 39 -11.030 -2.863 -2.863 127 2HB GLU 339 1HB GLU 39 -10.939 -1.101 -1.101 128 1HG GLU 339 2HG GLU 39 -10.872 -2.238 -2.238 129 2HG GLU 339 1HG GLU 39 -12.330 -2.692 -2.692 130 H MET 340 H MET 40 -8.383 -2.773 -2.773 131 HA MET 340 HA MET 40 -7.888 -0.252 -0.252 132 1HB MET 340 2HB MET 40 -6.960 -3.042 -3.042 133 2HB MET 340 1HB MET 40 -6.153 -1.718 -1.718 134 1HG MET 340 2HG MET 40 -8.641 -0.957 -0.957 135 2HG MET 340 1HG MET 40 -8.984 -2.666 -2.666 136 1HE MET 340 3HE MET 40 -6.871 -4.364 -4.364 137 2HE MET 340 2HE MET 40 -5.621 -3.122 -3.122 138 3HE MET 340 1HE MET 40 -5.927 -3.999 -3.999 139 H PHE 341 H PHE 41 -5.833 -2.392 -2.392 140 HA PHE 341 HA PHE 41 -3.472 -0.749 -0.749 141 1HB PHE 341 2HB PHE 41 -4.295 -3.147 -3.147 142 2HB PHE 341 1HB PHE 41 -2.819 -2.293 -2.293 143 HD1 PHE 341 HD2 PHE 41 -4.185 -2.457 -2.457 144 HD2 PHE 341 HD1 PHE 41 -1.284 -4.093 -4.093 145 HE1 PHE 341 HE2 PHE 41 -3.082 -3.613 -3.613 146 HE2 PHE 341 HE1 PHE 41 -0.179 -5.256 -5.256 147 HZ PHE 341 HZ PHE 41 -1.091 -5.013 -5.013 148 H ARG 342 H ARG 42 -6.104 -1.048 -1.048 149 HA ARG 342 HA ARG 42 -5.041 0.383 0.383 150 1HB ARG 342 2HB ARG 42 -7.707 -0.419 -0.419 151 2HB ARG 342 1HB ARG 42 -7.714 1.088 1.088 152 1HG ARG 342 2HG ARG 42 -6.355 -1.449 -1.449 153 2HG ARG 342 1HG ARG 42 -7.988 -0.978 -0.978 154 1HD ARG 342 2HD ARG 42 -7.252 0.683 0.683 155 2HD ARG 342 1HD ARG 42 -5.917 1.118 1.118 156 HE ARG 342 HE ARG 42 -5.116 -1.316 -1.316 157 1HH1 ARG 342 2HH1 ARG 42 -6.094 -1.592 -1.592 158 2HH1 ARG 342 1HH1 ARG 42 -5.354 -0.415 -0.415 159 1HH2 ARG 342 1HH2 ARG 42 -4.255 1.578 1.578 160 2HH2 ARG 342 2HH2 ARG 42 -4.311 1.379 1.379 161 H GLU 343 H GLU 43 -6.669 1.503 1.503 162 HA GLU 343 HA GLU 43 -6.576 4.304 4.304 163 1HB GLU 343 2HB GLU 43 -8.251 3.344 3.344 164 2HB GLU 343 1HB GLU 43 -6.936 3.174 3.174 165 1HG GLU 343 2HG GLU 43 -6.572 5.532 5.532 166 2HG GLU 343 1HG GLU 43 -7.581 5.810 5.810 167 H LEU 344 H LEU 44 -4.786 2.343 2.343 168 HA LEU 344 HA LEU 44 -3.023 4.285 4.285 169 1HB LEU 344 2HB LEU 44 -2.854 1.335 1.335 170 2HB LEU 344 1HB LEU 44 -1.333 2.174 2.174 171 HG LEU 344 HG LEU 44 -1.958 1.608 1.608 172 1HD1 LEU 344 3HD1 LEU 44 -1.893 4.231 4.231 173 2HD1 LEU 344 2HD1 LEU 44 -3.550 4.124 4.124 174 3HD1 LEU 344 1HD1 LEU 44 -2.213 3.619 3.619 175 1HD2 LEU 344 1HD2 LEU 44 -4.769 2.043 2.043 176 2HD2 LEU 344 3HD2 LEU 44 -4.063 0.603 0.603 177 3HD2 LEU 344 2HD2 LEU 44 -4.424 2.014 2.014 178 H ASN 345 H ASN 45 -2.296 2.087 2.087 179 HA ASN 345 HA ASN 45 -0.001 3.577 3.577 180 1HB ASN 345 2HB ASN 45 0.030 2.132 2.132 181 2HB ASN 345 1HB ASN 45 -0.519 1.154 1.154 182 1HD2 ASN 345 2HD2 ASN 45 -2.883 0.500 0.500 183 2HD2 ASN 345 1HD2 ASN 45 -1.235 0.221 0.221 184 H GLU 346 H GLU 46 -3.398 4.084 4.084 185 HA GLU 346 HA GLU 46 -3.247 5.488 5.488 186 1HB GLU 346 2HB GLU 46 -5.406 4.774 4.774 187 2HB GLU 346 1HB GLU 46 -5.208 5.673 5.673 188 1HG GLU 346 2HG GLU 46 -5.861 7.621 7.621 189 2HG GLU 346 1HG GLU 46 -4.876 7.342 7.342 190 H ALA 347 H ALA 47 -3.312 6.703 6.703 191 HA ALA 347 HA ALA 47 -2.848 9.453 9.453 192 1HB ALA 347 1HB ALA 47 -3.032 7.897 7.897 193 2HB ALA 347 3HB ALA 47 -1.833 9.187 9.187 194 3HB ALA 347 2HB ALA 47 -3.506 9.567 9.567 195 H LEU 348 H LEU 48 -0.685 6.779 6.779 196 HA LEU 348 HA LEU 48 1.721 8.267 8.267 197 1HB LEU 348 2HB LEU 48 1.238 5.461 5.461 198 2HB LEU 348 1HB LEU 48 2.837 6.120 6.120 199 HG LEU 348 HG LEU 48 0.600 6.005 6.005 200 1HD1 LEU 348 2HD1 LEU 48 1.865 3.804 3.804 201 2HD1 LEU 348 1HD1 LEU 48 2.917 4.208 4.208 202 3HD1 LEU 348 3HD1 LEU 48 1.204 3.892 3.892 203 1HD2 LEU 348 1HD2 LEU 48 2.733 7.598 7.598 204 2HD2 LEU 348 3HD2 LEU 48 2.160 6.791 6.791 205 3HD2 LEU 348 2HD2 LEU 48 3.523 6.126 6.126 206 H GLU 349 H GLU 49 0.244 6.730 6.730 207 HA GLU 349 HA GLU 49 2.204 7.709 7.709 208 1HB GLU 349 2HB GLU 49 0.728 5.882 5.882 209 2HB GLU 349 1HB GLU 49 -0.693 6.904 6.904 210 1HG GLU 349 2HG GLU 49 -0.080 8.314 8.314 211 2HG GLU 349 1HG GLU 49 1.518 7.577 7.577 212 H LEU 350 H LEU 50 -0.578 9.169 9.169 213 HA LEU 350 HA LEU 50 -0.850 11.335 11.335 214 1HB LEU 350 2HB LEU 50 -2.717 11.654 11.654 215 2HB LEU 350 1HB LEU 50 -2.197 10.380 10.380 216 HG LEU 350 HG LEU 50 -0.803 12.126 12.126 217 1HD1 LEU 350 2HD1 LEU 50 -1.789 13.657 13.657 218 2HD1 LEU 350 1HD1 LEU 50 -2.248 14.413 14.413 219 3HD1 LEU 350 3HD1 LEU 50 -0.557 14.066 14.066 220 1HD2 LEU 350 2HD2 LEU 50 -3.318 11.349 11.349 221 2HD2 LEU 350 1HD2 LEU 50 -2.571 12.633 12.633 222 3HD2 LEU 350 3HD2 LEU 50 -3.646 13.039 13.039 223 H LYS 351 H LYS 51 1.217 10.596 10.596 224 HA LYS 351 HA LYS 51 2.177 13.270 13.270 225 1HB LYS 351 2HB LYS 51 2.478 11.234 11.234 226 2HB LYS 351 1HB LYS 51 3.748 10.726 10.726 227 1HG LYS 351 2HG LYS 51 4.628 13.185 13.185 228 2HG LYS 351 1HG LYS 51 3.678 13.106 13.106 229 1HD LYS 351 2HD LYS 51 5.773 11.071 11.071 230 2HD LYS 351 1HD LYS 51 6.040 12.382 12.382 231 1HE LYS 351 2HE LYS 51 4.360 11.498 11.498 232 2HE LYS 351 1HE LYS 51 3.871 10.289 10.289 233 1HZ LYS 351 2HZ LYS 51 6.312 9.564 9.564 234 2HZ LYS 351 1HZ LYS 51 6.353 10.427 10.427 235 3HZ LYS 351 3HZ LYS 51 5.278 9.129 9.129 236 H ASP 352 H ASP 52 3.325 10.576 10.576 237 HA ASP 352 HA ASP 52 5.662 11.844 11.844 238 1HB ASP 352 2HB ASP 52 4.860 9.375 9.375 239 2HB ASP 352 1HB ASP 52 3.994 9.964 9.964 240 H ALA 353 H ALA 53 2.268 12.045 12.045 241 HA ALA 353 HA ALA 53 2.896 13.591 13.591 242 1HB ALA 353 1HB ALA 53 0.885 12.070 12.070 243 2HB ALA 353 3HB ALA 53 0.206 13.253 13.253 244 3HB ALA 353 2HB ALA 53 0.512 13.701 13.701 245 H GLN 354 H GLN 54 2.272 14.224 14.224 246 HA GLN 354 HA GLN 54 1.314 16.926 16.926 247 1HB GLN 354 2HB GLN 54 2.288 15.127 15.127 248 2HB GLN 354 1HB GLN 54 2.787 16.799 16.799 249 1HG GLN 354 2HG GLN 54 0.111 16.939 16.939 250 2HG GLN 354 1HG GLN 54 0.162 15.624 15.624 251 1HE2 GLN 354 2HE2 GLN 54 1.712 17.966 17.966 252 2HE2 GLN 354 1HE2 GLN 54 2.225 16.546 16.546 253 H ALA 355 HN ALA 55 2.681 18.849 18.849 254 HA ALA 355 HA ALA 55 5.533 18.814 18.814 255 1HB ALA 355 1HB ALA 55 3.969 19.176 19.176 256 2HB ALA 355 3HB ALA 55 5.358 20.235 20.235 257 3HB ALA 355 2HB ALA 55 5.573 18.484 18.484 258 1H GLY 325 2H GLY 25 -15.318 -11.186 -11.186 259 2H GLY 325 1H GLY 25 -15.915 -11.966 -11.966 260 3H GLY 325 3H GLY 25 -15.306 -10.387 -10.387 261 1HA GLY 325 2HA GLY 25 -13.216 -11.068 -11.068 262 2HA GLY 325 1HA GLY 25 -13.913 -12.663 -12.663 263 H GLU 326 H GLU 26 -11.561 -11.302 -11.302 264 HA GLU 326 HA GLU 26 -11.562 -13.456 -13.456 265 1HB GLU 326 2HB GLU 26 -12.116 -10.603 -10.603 266 2HB GLU 326 1HB GLU 26 -11.223 -11.651 -11.651 267 1HG GLU 326 2HG GLU 26 -13.269 -13.304 -13.304 268 2HG GLU 326 1HG GLU 26 -14.078 -11.740 -11.740 269 H TYR 327 H TYR 27 -9.598 -12.662 -12.662 270 HA TYR 327 HA TYR 27 -7.317 -12.241 -12.241 271 1HB TYR 327 2HB TYR 27 -7.660 -13.506 -13.506 272 2HB TYR 327 1HB TYR 27 -6.075 -12.866 -12.866 273 HD1 TYR 327 HD1 TYR 27 -5.130 -13.561 -13.561 274 HD2 TYR 327 HD2 TYR 27 -8.298 -15.640 -15.640 275 HE1 TYR 327 HE1 TYR 27 -4.693 -15.574 -15.574 276 HE2 TYR 327 HE2 TYR 27 -7.858 -17.653 -17.653 277 HH TYR 327 HH TYR 27 -6.459 -18.604 -18.604 278 H PHE 328 H PHE 28 -6.613 -10.168 -10.168 279 HA PHE 328 HA PHE 28 -6.829 -8.425 -8.425 280 1HB PHE 328 2HB PHE 28 -6.748 -7.734 -7.734 281 2HB PHE 328 1HB PHE 28 -6.636 -6.533 -6.533 282 HD1 PHE 328 HD2 PHE 28 -8.529 -6.396 -6.396 283 HD2 PHE 328 HD1 PHE 28 -8.844 -8.597 -8.597 284 HE1 PHE 328 HE2 PHE 28 -11.000 -6.385 -6.385 285 HE2 PHE 328 HE1 PHE 28 -11.315 -8.584 -8.584 286 HZ PHE 328 HZ PHE 28 -12.393 -7.478 -7.478 287 H THR 329 H THR 29 -4.993 -6.846 -6.846 288 HA THR 329 HA THR 29 -2.451 -7.971 -7.971 289 HB THR 329 HB THR 29 -2.152 -6.556 -6.556 290 HG1 THR 329 HG1 THR 29 -3.899 -7.441 -7.441 291 1HG2 THR 329 1HG2 THR 29 -0.646 -8.242 -8.242 292 2HG2 THR 329 3HG2 THR 29 -1.498 -9.437 -9.437 293 3HG2 THR 329 2HG2 THR 29 -0.558 -8.168 -8.168 294 H LEU 330 H LEU 30 -1.013 -6.475 -6.475 295 HA LEU 330 HA LEU 30 -1.805 -3.598 -3.598 296 1HB LEU 330 2HB LEU 30 -1.542 -5.206 -5.206 297 2HB LEU 330 1HB LEU 30 -0.088 -4.209 -4.209 298 HG LEU 330 HG LEU 30 -2.307 -2.559 -2.559 299 1HD1 LEU 330 3HD1 LEU 30 -2.737 -4.493 -4.493 300 2HD1 LEU 330 2HD1 LEU 30 -3.344 -2.845 -2.845 301 3HD1 LEU 330 1HD1 LEU 30 -3.899 -3.859 -3.859 302 1HD2 LEU 330 2HD2 LEU 30 -0.135 -1.923 -1.923 303 2HD2 LEU 330 1HD2 LEU 30 -1.550 -1.288 -1.288 304 3HD2 LEU 330 3HD2 LEU 30 -0.705 -2.698 -2.698 305 H GLN 331 H GLN 31 -0.416 -3.441 -3.441 306 HA GLN 331 HA GLN 31 2.408 -4.115 -4.115 307 1HB GLN 331 2HB GLN 31 0.770 -3.846 -3.846 308 2HB GLN 331 1HB GLN 31 1.528 -2.253 -2.253 309 1HG GLN 331 2HG GLN 31 3.727 -3.206 -3.206 310 2HG GLN 331 1HG GLN 31 3.108 -4.829 -4.829 311 1HE2 GLN 331 2HE2 GLN 31 2.394 -3.183 -3.183 312 2HE2 GLN 331 1HE2 GLN 31 2.546 -2.153 -2.153 313 H ILE 332 H ILE 32 3.790 -2.857 -2.857 314 HA ILE 332 HA ILE 32 3.275 0.090 0.090 315 HB ILE 332 HB ILE 32 4.637 -1.618 -1.618 316 1HG1 ILE 332 2HG1 ILE 32 2.259 -0.179 -0.179 317 2HG1 ILE 332 1HG1 ILE 32 1.893 -1.241 -1.241 318 1HG2 ILE 332 1HG2 ILE 32 4.928 1.101 1.101 319 2HG2 ILE 332 3HG2 ILE 32 3.736 1.057 1.057 320 3HG2 ILE 332 2HG2 ILE 32 5.316 0.306 0.306 321 1HD1 ILE 332 2HD1 ILE 32 2.991 -3.120 -3.120 322 2HD1 ILE 332 1HD1 ILE 32 3.251 -2.051 -2.051 323 3HD1 ILE 332 3HD1 ILE 32 1.611 -2.472 -2.472 324 H ARG 333 H ARG 33 4.812 1.224 1.224 325 HA ARG 333 HA ARG 33 7.303 -0.100 -0.100 326 1HB ARG 333 2HB ARG 33 5.973 1.466 1.466 327 2HB ARG 333 1HB ARG 33 6.491 2.785 2.785 328 1HG ARG 333 2HG ARG 33 8.870 2.124 2.124 329 2HG ARG 333 1HG ARG 33 8.285 0.935 0.935 330 1HD ARG 333 2HD ARG 33 7.876 2.511 2.511 331 2HD ARG 333 1HD ARG 33 7.154 3.615 3.615 332 HE ARG 333 HE ARG 33 10.095 3.373 3.373 333 1HH1 ARG 333 1HH2 ARG 33 8.969 4.554 4.554 334 2HH1 ARG 333 2HH2 ARG 33 9.045 6.247 6.247 335 1HH2 ARG 333 2HH1 ARG 33 9.474 5.776 5.776 336 2HH2 ARG 333 1HH1 ARG 33 9.334 6.938 6.938 337 H GLY 334 H GLY 34 8.359 -0.362 -0.362 338 1HA GLY 334 2HA GLY 34 10.097 1.765 1.765 339 2HA GLY 334 1HA GLY 34 8.764 1.695 1.695 340 H ARG 335 H ARG 35 10.123 0.966 0.966 341 HA ARG 335 HA ARG 35 10.590 -1.934 -1.934 342 1HB ARG 335 2HB ARG 35 12.695 -0.658 -0.658 343 2HB ARG 335 1HB ARG 35 12.936 -0.217 -0.217 344 1HG ARG 335 2HG ARG 35 13.245 -2.439 -2.439 345 2HG ARG 335 1HG ARG 35 12.413 -3.085 -3.085 346 1HD ARG 335 2HD ARG 35 14.337 -2.056 -2.056 347 2HD ARG 335 1HD ARG 35 15.189 -1.908 -1.908 348 HE ARG 335 HE ARG 35 14.726 -4.381 -4.381 349 1HH1 ARG 335 1HH2 ARG 35 13.698 -5.750 -5.750 350 2HH1 ARG 335 2HH2 ARG 35 14.915 -5.944 -5.944 351 1HH2 ARG 335 2HH1 ARG 35 16.928 -3.402 -3.402 352 2HH2 ARG 335 1HH1 ARG 35 16.743 -4.614 -4.614 353 H GLU 336 H GLU 36 11.117 1.120 1.120 354 HA GLU 336 HA GLU 36 11.014 -0.160 -0.160 355 1HB GLU 336 2HB GLU 36 10.837 2.707 2.707 356 2HB GLU 336 1HB GLU 36 10.631 2.274 2.274 357 1HG GLU 336 2HG GLU 36 13.026 1.379 1.379 358 2HG GLU 336 1HG GLU 36 13.006 2.900 2.900 359 H ARG 337 H ARG 37 8.684 1.796 1.796 360 HA ARG 337 HA ARG 37 6.545 1.587 1.587 361 1HB ARG 337 2HB ARG 37 6.846 2.360 2.360 362 2HB ARG 337 1HB ARG 37 5.245 1.763 1.763 363 1HG ARG 337 2HG ARG 37 5.196 3.372 3.372 364 2HG ARG 337 1HG ARG 37 6.762 4.000 4.000 365 1HD ARG 337 2HD ARG 37 4.093 4.222 4.222 366 2HD ARG 337 1HD ARG 37 5.273 5.487 5.487 367 HE ARG 337 HE ARG 37 5.609 3.428 3.428 368 1HH1 ARG 337 2HH1 ARG 37 7.875 5.181 5.181 369 2HH1 ARG 337 1HH1 ARG 37 8.102 6.347 6.347 370 1HH2 ARG 337 1HH2 ARG 37 5.188 5.496 5.496 371 2HH2 ARG 337 2HH2 ARG 37 6.580 6.528 6.528 372 H PHE 338 H PHE 38 7.356 -0.394 -0.394 373 HA PHE 338 HA PHE 38 5.185 -2.225 -2.225 374 1HB PHE 338 2HB PHE 38 6.589 -2.282 -2.282 375 2HB PHE 338 1HB PHE 38 8.033 -2.576 -2.576 376 HD1 PHE 338 HD2 PHE 38 4.899 -4.053 -4.053 377 HD2 PHE 338 HD1 PHE 38 8.523 -4.770 -4.770 378 HE1 PHE 338 HE2 PHE 38 4.508 -6.497 -6.497 379 HE2 PHE 338 HE1 PHE 38 8.134 -7.214 -7.214 380 HZ PHE 338 HZ PHE 38 6.126 -8.077 -8.077 381 H GLU 339 H GLU 39 8.309 -2.134 -2.134 382 HA GLU 339 HA GLU 39 8.011 -4.699 -4.699 383 1HB GLU 339 2HB GLU 39 9.771 -2.325 -2.325 384 2HB GLU 339 1HB GLU 39 9.578 -3.332 -3.332 385 1HG GLU 339 2HG GLU 39 9.965 -4.916 -4.916 386 2HG GLU 339 1HG GLU 39 11.321 -3.834 -3.834 387 H MET 340 H MET 40 7.016 -1.410 -1.410 388 HA MET 340 HA MET 40 6.187 -1.868 -1.868 389 1HB MET 340 2HB MET 40 5.410 0.064 0.064 390 2HB MET 340 1HB MET 40 4.421 -0.021 -0.021 391 1HG MET 340 2HG MET 40 6.785 0.102 0.102 392 2HG MET 340 1HG MET 40 7.263 0.863 0.863 393 1HE MET 340 3HE MET 40 5.278 2.505 2.505 394 2HE MET 340 2HE MET 40 3.932 1.671 1.671 395 3HE MET 340 1HE MET 40 4.114 3.411 3.411 396 H PHE 341 H PHE 41 4.515 -2.297 -2.297 397 HA PHE 341 HA PHE 41 2.034 -3.198 -3.198 398 1HB PHE 341 2HB PHE 41 3.147 -3.165 -3.165 399 2HB PHE 341 1HB PHE 41 1.657 -4.035 -4.035 400 HD1 PHE 341 HD2 PHE 41 2.651 -1.013 -1.013 401 HD2 PHE 341 HD1 PHE 41 0.249 -2.565 -2.565 402 HE1 PHE 341 HE2 PHE 41 1.386 1.115 1.115 403 HE2 PHE 341 HE1 PHE 41 -1.020 -0.437 -0.437 404 HZ PHE 341 HZ PHE 41 -0.451 1.404 1.404 405 H ARG 342 H ARG 42 5.019 -4.679 -4.679 406 HA ARG 342 HA ARG 42 4.091 -7.375 -7.375 407 1HB ARG 342 2HB ARG 42 6.673 -5.988 -5.988 408 2HB ARG 342 1HB ARG 42 6.692 -7.581 -7.581 409 1HG ARG 342 2HG ARG 42 5.628 -7.062 -7.062 410 2HG ARG 342 1HG ARG 42 7.272 -7.605 -7.605 411 1HD ARG 342 2HD ARG 42 6.605 -9.719 -9.719 412 2HD ARG 342 1HD ARG 42 5.121 -9.158 -9.158 413 HE ARG 342 HE ARG 42 4.611 -8.690 -8.690 414 1HH1 ARG 342 2HH1 ARG 42 5.916 -10.516 -10.516 415 2HH1 ARG 342 1HH1 ARG 42 5.237 -12.075 -12.075 416 1HH2 ARG 342 1HH2 ARG 42 3.680 -11.079 -11.079 417 2HH2 ARG 342 2HH2 ARG 42 3.966 -12.394 -12.394 418 H GLU 343 H GLU 43 5.205 -5.437 -5.437 419 HA GLU 343 HA GLU 43 5.065 -7.687 -7.687 420 1HB GLU 343 2HB GLU 43 6.591 -5.704 -5.704 421 2HB GLU 343 1HB GLU 43 5.161 -4.722 -4.722 422 1HG GLU 343 2HG GLU 43 4.616 -5.982 -5.982 423 2HG GLU 343 1HG GLU 43 5.778 -7.246 -7.246 424 H LEU 344 H LEU 44 3.126 -4.730 -4.730 425 HA LEU 344 HA LEU 44 1.133 -5.139 -5.139 426 1HB LEU 344 2HB LEU 44 1.210 -3.857 -3.857 427 2HB LEU 344 1HB LEU 44 -0.383 -4.189 -4.189 428 HG LEU 344 HG LEU 44 0.049 -2.026 -2.026 429 1HD1 LEU 344 3HD1 LEU 44 -0.175 -3.956 -3.956 430 2HD1 LEU 344 2HD1 LEU 44 1.393 -3.298 -3.298 431 3HD1 LEU 344 1HD1 LEU 44 -0.023 -2.251 -2.251 432 1HD2 LEU 344 1HD2 LEU 44 2.898 -2.975 -2.975 433 2HD2 LEU 344 3HD2 LEU 44 2.261 -1.624 -1.624 434 3HD2 LEU 344 2HD2 LEU 44 2.356 -1.509 -1.509 435 H ASN 345 H ASN 45 0.942 -6.226 -6.226 436 HA ASN 345 HA ASN 45 -1.347 -7.901 -7.901 437 1HB ASN 345 2HB ASN 45 -1.018 -8.660 -8.660 438 2HB ASN 345 1HB ASN 45 -0.552 -6.962 -6.962 439 1HD2 ASN 345 2HD2 ASN 45 2.169 -8.806 -8.806 440 2HD2 ASN 345 1HD2 ASN 45 0.525 -8.504 -8.504 441 H GLU 346 H GLU 46 2.018 -8.355 -8.355 442 HA GLU 346 HA GLU 46 2.103 -11.229 -11.229 443 1HB GLU 346 2HB GLU 46 4.191 -10.033 -10.033 444 2HB GLU 346 1HB GLU 46 3.753 -9.281 -9.281 445 1HG GLU 346 2HG GLU 46 4.379 -11.101 -11.101 446 2HG GLU 346 1HG GLU 46 3.605 -12.211 -12.211 447 H ALA 347 H ALA 47 1.692 -9.090 -9.090 448 HA ALA 347 HA ALA 47 1.154 -11.246 -11.246 449 1HB ALA 347 1HB ALA 47 1.130 -8.323 -8.323 450 2HB ALA 347 3HB ALA 47 -0.172 -9.020 -9.020 451 3HB ALA 347 2HB ALA 47 1.502 -9.464 -9.464 452 H LEU 348 H LEU 48 -0.925 -9.207 -9.207 453 HA LEU 348 HA LEU 48 -3.440 -10.002 -10.002 454 1HB LEU 348 2HB LEU 48 -2.622 -9.289 -9.289 455 2HB LEU 348 1HB LEU 48 -4.298 -9.504 -9.504 456 HG LEU 348 HG LEU 48 -2.393 -7.568 -7.568 457 1HD1 LEU 348 2HD1 LEU 48 -3.326 -7.322 -7.322 458 2HD1 LEU 348 1HD1 LEU 48 -4.570 -6.483 -6.483 459 3HD1 LEU 348 3HD1 LEU 48 -2.887 -5.971 -5.971 460 1HD2 LEU 348 1HD2 LEU 48 -4.636 -8.572 -8.572 461 2HD2 LEU 348 3HD2 LEU 48 -4.225 -6.870 -6.870 462 3HD2 LEU 348 2HD2 LEU 48 -5.379 -7.353 -7.353 463 H GLU 349 H GLU 49 -1.530 -11.460 -11.460 464 HA GLU 349 HA GLU 49 -3.333 -13.646 -13.646 465 1HB GLU 349 2HB GLU 49 -1.657 -13.104 -13.104 466 2HB GLU 349 1HB GLU 49 -0.355 -13.382 -13.382 467 1HG GLU 349 2HG GLU 49 -0.828 -15.729 -15.729 468 2HG GLU 349 1HG GLU 49 -2.346 -15.526 -15.526 469 H LEU 350 H LEU 50 -0.819 -13.031 -13.031 470 HA LEU 350 HA LEU 50 -0.480 -15.754 -15.754 471 1HB LEU 350 2HB LEU 50 1.161 -14.779 -14.779 472 2HB LEU 350 1HB LEU 50 0.610 -13.207 -13.207 473 HG LEU 350 HG LEU 50 -1.064 -13.223 -13.223 474 1HD1 LEU 350 2HD1 LEU 50 0.049 -15.884 -15.884 475 2HD1 LEU 350 1HD1 LEU 50 0.257 -14.974 -14.974 476 3HD1 LEU 350 3HD1 LEU 50 -1.351 -15.180 -15.180 477 1HD2 LEU 350 2HD2 LEU 50 1.421 -12.276 -12.276 478 2HD2 LEU 350 1HD2 LEU 50 0.478 -12.253 -12.253 479 3HD2 LEU 350 3HD2 LEU 50 1.677 -13.520 -13.520 480 H LYS 351 H LYS 51 -2.841 -13.265 -13.265 481 HA LYS 351 HA LYS 51 -4.019 -14.412 -14.412 482 1HB LYS 351 2HB LYS 51 -4.375 -12.041 -12.041 483 2HB LYS 351 1HB LYS 51 -5.456 -12.763 -12.763 484 1HG LYS 351 2HG LYS 51 -6.545 -13.902 -13.902 485 2HG LYS 351 1HG LYS 51 -5.788 -12.563 -12.563 486 1HD LYS 351 2HD LYS 51 -7.614 -12.250 -12.250 487 2HD LYS 351 1HD LYS 51 -8.117 -12.036 -12.036 488 1HE LYS 351 2HE LYS 51 -6.580 -10.192 -10.192 489 2HE LYS 351 1HE LYS 51 -5.863 -10.475 -10.475 490 1HZ LYS 351 2HZ LYS 51 -8.239 -10.132 -10.132 491 2HZ LYS 351 1HZ LYS 51 -8.532 -9.409 -9.409 492 3HZ LYS 351 3HZ LYS 51 -7.353 -8.763 -8.763 493 H ASP 352 H ASP 52 -4.749 -14.646 -14.646 494 HA ASP 352 HA ASP 52 -7.022 -16.345 -16.345 495 1HB ASP 352 2HB ASP 52 -6.047 -15.119 -15.119 496 2HB ASP 352 1HB ASP 52 -5.046 -16.559 -16.559 497 H ALA 353 H ALA 53 -3.570 -17.016 -17.016 498 HA ALA 353 HA ALA 53 -3.974 -19.921 -19.921 499 1HB ALA 353 1HB ALA 53 -1.913 -18.734 -18.734 500 2HB ALA 353 3HB ALA 53 -1.467 -18.420 -18.420 501 3HB ALA 353 2HB ALA 53 -1.579 -20.080 -20.080 502 H GLN 354 H GLN 54 -3.801 -17.457 -17.457 503 HA GLN 354 HA GLN 54 -3.009 -19.100 -19.100 504 1HB GLN 354 2HB GLN 54 -4.046 -16.413 -16.413 505 2HB GLN 354 1HB GLN 54 -4.767 -17.168 -17.168 506 1HG GLN 354 2HG GLN 54 -2.087 -17.889 -17.889 507 2HG GLN 354 1HG GLN 54 -2.033 -16.227 -16.227 508 1HE2 GLN 354 2HE2 GLN 54 -4.130 -15.239 -15.239 509 2HE2 GLN 354 1HE2 GLN 54 -4.397 -15.230 -15.230 510 H ALA 355 HN ALA 55 -4.605 -19.611 -19.611 511 HA ALA 355 HA ALA 55 -7.391 -19.972 -19.972 512 1HB ALA 355 1HB ALA 55 -5.548 -22.156 -22.156 513 2HB ALA 355 3HB ALA 55 -7.030 -22.632 -22.632 514 3HB ALA 355 2HB ALA 55 -7.114 -21.688 -21.688 515 1H GLY 325 2H GLY 25 13.211 2.012 2.012 516 2H GLY 325 1H GLY 25 13.777 0.414 0.414 517 3H GLY 325 3H GLY 25 13.193 1.210 1.210 518 1HA GLY 325 2HA GLY 25 11.089 0.690 0.690 519 2HA GLY 325 1HA GLY 25 11.756 -0.454 -0.454 520 H GLU 326 H GLU 26 9.448 1.781 1.781 521 HA GLU 326 HA GLU 26 9.437 2.228 2.228 522 1HB GLU 326 2HB GLU 26 10.048 4.438 4.438 523 2HB GLU 326 1HB GLU 26 9.149 4.794 4.794 524 1HG GLU 326 2HG GLU 26 11.160 3.268 3.268 525 2HG GLU 326 1HG GLU 26 11.992 4.033 4.033 526 H TYR 327 H TYR 27 7.502 4.106 4.106 527 HA TYR 327 HA TYR 27 5.214 2.831 2.831 528 1HB TYR 327 2HB TYR 27 5.550 4.358 4.358 529 2HB TYR 327 1HB TYR 27 3.975 4.382 4.382 530 HD1 TYR 327 HD1 TYR 27 2.998 2.079 2.079 531 HD2 TYR 327 HD2 TYR 27 6.144 2.543 2.543 532 HE1 TYR 327 HE1 TYR 27 2.511 -0.181 -0.181 533 HE2 TYR 327 HE2 TYR 27 5.657 0.281 0.281 534 HH TYR 327 HH TYR 27 4.219 -1.438 -1.438 535 H PHE 328 H PHE 28 4.538 3.866 3.866 536 HA PHE 328 HA PHE 28 4.820 6.842 6.842 537 1HB PHE 328 2HB PHE 28 4.700 4.777 4.777 538 2HB PHE 328 1HB PHE 28 4.624 6.516 6.516 539 HD1 PHE 328 HD2 PHE 28 6.540 7.975 7.975 540 HD2 PHE 328 HD1 PHE 28 6.775 3.692 3.692 541 HE1 PHE 328 HE2 PHE 28 9.015 8.104 8.104 542 HE2 PHE 328 HE1 PHE 28 9.249 3.821 3.821 543 HZ PHE 328 HZ PHE 28 10.369 6.026 6.026 544 H THR 329 H THR 29 3.016 7.941 7.941 545 HA THR 329 HA THR 29 0.438 6.465 6.465 546 HB THR 329 HB THR 29 0.301 9.394 9.394 547 HG1 THR 329 HG1 THR 29 1.963 9.442 9.442 548 1HG2 THR 329 1HG2 THR 29 -1.367 7.352 7.352 549 2HG2 THR 329 3HG2 THR 29 -0.601 7.480 7.480 550 3HG2 THR 329 2HG2 THR 29 -1.438 8.871 8.871 551 H LEU 330 H LEU 30 -0.923 6.561 6.561 552 HA LEU 330 HA LEU 30 -0.144 8.381 8.381 553 1HB LEU 330 2HB LEU 30 -0.427 5.585 5.585 554 2HB LEU 330 1HB LEU 30 -1.882 6.187 6.187 555 HG LEU 330 HG LEU 30 0.317 7.711 7.711 556 1HD1 LEU 330 3HD1 LEU 30 0.824 4.772 4.772 557 2HD1 LEU 330 2HD1 LEU 30 1.401 5.586 5.586 558 3HD1 LEU 330 1HD1 LEU 30 1.954 6.119 6.119 559 1HD2 LEU 330 2HD2 LEU 30 -1.824 7.148 7.148 560 2HD2 LEU 330 1HD2 LEU 30 -0.408 6.776 6.776 561 3HD2 LEU 330 3HD2 LEU 30 -1.271 5.481 5.481 562 H GLN 331 H GLN 31 -1.510 10.075 10.075 563 HA GLN 331 HA GLN 31 -4.357 9.543 9.543 564 1HB GLN 331 2HB GLN 31 -2.684 11.430 11.430 565 2HB GLN 331 1HB GLN 31 -3.410 12.337 12.337 566 1HG GLN 331 2HG GLN 31 -5.627 11.960 11.960 567 2HG GLN 331 1HG GLN 31 -5.043 10.785 10.785 568 1HE2 GLN 331 2HE2 GLN 31 -4.260 14.770 14.770 569 2HE2 GLN 331 1HE2 GLN 31 -4.410 14.233 14.233 570 H ILE 332 H ILE 32 -5.729 9.337 9.337 571 HA ILE 332 HA ILE 32 -5.146 10.915 10.915 572 HB ILE 332 HB ILE 32 -6.559 8.240 8.240 573 1HG1 ILE 332 2HG1 ILE 32 -4.165 8.308 8.308 574 2HG1 ILE 332 1HG1 ILE 32 -3.806 8.845 8.845 575 1HG2 ILE 332 1HG2 ILE 32 -6.777 10.219 10.219 576 2HG2 ILE 332 3HG2 ILE 32 -5.624 9.063 9.063 577 3HG2 ILE 332 2HG2 ILE 32 -7.227 8.523 8.523 578 1HD1 ILE 332 2HD1 ILE 32 -4.947 6.816 6.816 579 2HD1 ILE 332 1HD1 ILE 32 -5.205 6.268 6.268 580 3HD1 ILE 332 3HD1 ILE 32 -3.566 6.414 6.414 581 H ARG 333 H ARG 33 -6.638 12.489 12.489 582 HA ARG 333 HA ARG 33 -9.157 12.461 12.461 583 1HB ARG 333 2HB ARG 33 -7.789 14.547 14.547 584 2HB ARG 333 1HB ARG 33 -8.304 14.417 14.417 585 1HG ARG 333 2HG ARG 33 -10.684 14.443 14.443 586 2HG ARG 333 1HG ARG 33 -10.104 14.733 14.733 587 1HD ARG 333 2HD ARG 33 -9.667 16.915 16.915 588 2HD ARG 333 1HD ARG 33 -8.930 16.552 16.552 589 HE ARG 333 HE ARG 33 -11.872 16.858 16.858 590 1HH1 ARG 333 1HH2 ARG 33 -10.742 15.322 15.322 591 2HH1 ARG 333 2HH2 ARG 33 -10.785 16.563 16.563 592 1HH2 ARG 333 2HH1 ARG 33 -11.194 19.139 19.139 593 2HH2 ARG 333 1HH1 ARG 33 -11.041 18.724 18.724 594 H GLY 334 H GLY 34 -10.264 10.651 10.651 595 1HA GLY 334 2HA GLY 34 -11.965 11.209 11.209 596 2HA GLY 334 1HA GLY 34 -10.640 10.196 10.196 597 H ARG 335 H ARG 35 -12.063 8.407 8.407 598 HA ARG 335 HA ARG 35 -12.551 6.813 6.813 599 1HB ARG 335 2HB ARG 35 -14.626 8.313 8.313 600 2HB ARG 335 1HB ARG 35 -14.876 7.156 7.156 601 1HG ARG 335 2HG ARG 35 -15.226 5.368 5.368 602 2HG ARG 335 1HG ARG 35 -14.392 6.169 6.169 603 1HD ARG 335 2HD ARG 35 -16.283 7.918 7.918 604 2HD ARG 335 1HD ARG 35 -17.148 6.740 6.740 605 HE ARG 335 HE ARG 35 -16.714 6.563 6.563 606 1HH1 ARG 335 1HH2 ARG 35 -15.728 4.091 4.091 607 2HH1 ARG 335 2HH2 ARG 35 -16.959 2.993 2.993 608 1HH2 ARG 335 2HH1 ARG 35 -18.916 5.466 5.466 609 2HH2 ARG 335 1HH1 ARG 35 -18.766 3.772 3.772 610 H GLU 336 H GLU 36 -13.059 7.046 7.046 611 HA GLU 336 HA GLU 36 -13.001 4.175 4.175 612 1HB GLU 336 2HB GLU 36 -12.763 6.546 6.546 613 2HB GLU 336 1HB GLU 36 -12.575 4.893 4.893 614 1HG GLU 336 2HG GLU 36 -14.975 5.766 5.766 615 2HG GLU 336 1HG GLU 36 -14.935 5.872 5.872 616 H ARG 337 H ARG 37 -10.621 6.785 6.785 617 HA ARG 337 HA ARG 37 -8.504 5.066 5.066 618 1HB ARG 337 2HB ARG 37 -8.765 7.864 7.864 619 2HB ARG 337 1HB ARG 37 -7.182 7.137 7.137 620 1HG ARG 337 2HG ARG 37 -7.110 6.446 6.446 621 2HG ARG 337 1HG ARG 37 -8.653 7.260 7.260 622 1HD ARG 337 2HD ARG 37 -5.966 8.461 8.461 623 2HD ARG 337 1HD ARG 37 -7.122 8.908 8.908 624 HE ARG 337 HE ARG 37 -7.470 9.547 9.547 625 1HH1 ARG 337 2HH1 ARG 37 -9.721 9.451 9.451 626 2HH1 ARG 337 1HH1 ARG 37 -9.911 11.152 11.152 627 1HH2 ARG 337 1HH2 ARG 37 -6.992 12.010 12.010 628 2HH2 ARG 337 2HH2 ARG 37 -8.366 12.601 12.601 629 H PHE 338 H PHE 38 -9.335 6.356 6.356 630 HA PHE 338 HA PHE 38 -7.192 5.163 5.163 631 1HB PHE 338 2HB PHE 38 -8.571 6.768 6.768 632 2HB PHE 338 1HB PHE 38 -10.028 5.822 5.822 633 HD1 PHE 338 HD2 PHE 38 -6.901 6.015 6.015 634 HD2 PHE 338 HD1 PHE 38 -10.553 3.851 3.851 635 HE1 PHE 338 HE2 PHE 38 -6.540 4.774 4.774 636 HE2 PHE 338 HE1 PHE 38 -10.193 2.609 2.609 637 HZ PHE 338 HZ PHE 38 -8.186 3.071 3.071 638 H GLU 339 H GLU 39 -10.330 3.856 3.856 639 HA GLU 339 HA GLU 39 -10.082 1.361 1.361 640 1HB GLU 339 2HB GLU 39 -11.802 2.460 2.460 641 2HB GLU 339 1HB GLU 39 -11.640 0.704 0.704 642 1HG GLU 339 2HG GLU 39 -12.029 1.843 1.843 643 2HG GLU 339 1HG GLU 39 -13.371 2.196 2.196 644 H MET 340 H MET 40 -9.032 2.495 2.495 645 HA MET 340 HA MET 40 -8.237 -0.003 -0.003 646 1HB MET 340 2HB MET 40 -7.406 2.854 2.854 647 2HB MET 340 1HB MET 40 -6.428 1.580 1.580 648 1HG MET 340 2HG MET 40 -8.797 0.686 0.686 649 2HG MET 340 1HG MET 40 -9.248 2.380 2.380 650 1HE MET 340 3HE MET 40 -7.210 4.212 4.212 651 2HE MET 340 2HE MET 40 -5.887 3.081 3.081 652 3HE MET 340 1HE MET 40 -6.043 3.885 3.885 653 H PHE 341 H PHE 41 -6.546 2.296 2.296 654 HA PHE 341 HA PHE 41 -4.097 0.732 0.732 655 1HB PHE 341 2HB PHE 41 -5.175 3.101 3.101 656 2HB PHE 341 1HB PHE 41 -3.711 2.285 2.285 657 HD1 PHE 341 HD2 PHE 41 -4.665 2.444 2.444 658 HD2 PHE 341 HD1 PHE 41 -2.240 4.173 4.173 659 HE1 PHE 341 HE2 PHE 41 -3.354 3.661 3.661 660 HE2 PHE 341 HE1 PHE 41 -0.924 5.388 5.388 661 HZ PHE 341 HZ PHE 41 -1.481 5.134 5.134 662 H ARG 342 H ARG 42 -7.095 0.820 0.820 663 HA ARG 342 HA ARG 42 -6.211 -0.514 -0.514 664 1HB ARG 342 2HB ARG 42 -8.770 0.154 0.154 665 2HB ARG 342 1HB ARG 42 -8.819 -1.357 -1.357 666 1HG ARG 342 2HG ARG 42 -7.714 1.235 1.235 667 2HG ARG 342 1HG ARG 42 -9.370 0.686 0.686 668 1HD ARG 342 2HD ARG 42 -8.738 -0.955 -0.955 669 2HD ARG 342 1HD ARG 42 -7.253 -1.310 -1.310 670 HE ARG 342 HE ARG 42 -6.716 1.151 1.151 671 1HH1 ARG 342 2HH1 ARG 42 -8.029 1.358 1.358 672 2HH1 ARG 342 1HH1 ARG 42 -7.373 0.211 0.211 673 1HH2 ARG 342 1HH2 ARG 42 -5.836 -1.702 -1.702 674 2HH2 ARG 342 2HH2 ARG 42 -6.129 -1.521 -1.521 675 H GLU 343 H GLU 43 -7.327 -1.697 -1.697 676 HA GLU 343 HA GLU 43 -7.222 -4.498 -4.498 677 1HB GLU 343 2HB GLU 43 -8.712 -3.621 -3.621 678 2HB GLU 343 1HB GLU 43 -7.262 -3.362 -3.362 679 1HG GLU 343 2HG GLU 43 -6.760 -5.693 -5.693 680 2HG GLU 343 1HG GLU 43 -7.926 -6.048 -6.048 681 H LEU 344 H LEU 44 -5.238 -2.418 -2.418 682 HA LEU 344 HA LEU 44 -3.260 -4.249 -4.249 683 1HB LEU 344 2HB LEU 44 -3.317 -1.299 -1.299 684 2HB LEU 344 1HB LEU 44 -1.726 -2.045 -2.045 685 HG LEU 344 HG LEU 44 -2.058 -1.515 -1.515 686 1HD1 LEU 344 3HD1 LEU 44 -1.940 -4.129 -4.129 687 2HD1 LEU 344 2HD1 LEU 44 -3.507 -4.105 -4.105 688 3HD1 LEU 344 1HD1 LEU 44 -2.071 -3.529 -3.529 689 1HD2 LEU 344 1HD2 LEU 44 -4.962 -2.100 -2.100 690 2HD2 LEU 344 3HD2 LEU 44 -4.228 -0.609 -0.609 691 3HD2 LEU 344 2HD2 LEU 44 -4.358 -2.014 -2.014 692 H ASN 345 H ASN 45 -3.053 -2.055 -2.055 693 HA ASN 345 HA ASN 45 -0.792 -3.428 -3.428 694 1HB ASN 345 2HB ASN 45 -1.100 -2.017 -2.017 695 2HB ASN 345 1HB ASN 45 -1.497 -1.048 -1.048 696 1HD2 ASN 345 2HD2 ASN 45 -4.265 -0.543 -0.543 697 2HD2 ASN 345 1HD2 ASN 45 -2.607 -0.181 -0.181 698 H GLU 346 H GLU 46 -4.168 -4.134 -4.134 699 HA GLU 346 HA GLU 46 -4.281 -5.548 -5.548 700 1HB GLU 346 2HB GLU 46 -6.357 -4.917 -4.917 701 2HB GLU 346 1HB GLU 46 -5.933 -5.773 -5.773 702 1HG GLU 346 2HG GLU 46 -6.596 -7.772 -7.772 703 2HG GLU 346 1HG GLU 46 -5.832 -7.471 -7.471 704 H ALA 347 H ALA 47 -3.869 -6.696 -6.696 705 HA ALA 347 HA ALA 47 -3.396 -9.427 -9.427 706 1HB ALA 347 1HB ALA 47 -3.352 -7.838 -7.838 707 2HB ALA 347 3HB ALA 47 -2.078 -9.058 -9.058 708 3HB ALA 347 2HB ALA 47 -3.764 -9.538 -9.538 709 H LEU 348 H LEU 48 -1.273 -6.634 -6.634 710 HA LEU 348 HA LEU 48 1.219 -8.002 -8.002 711 1HB LEU 348 2HB LEU 48 0.452 -5.236 -5.236 712 2HB LEU 348 1HB LEU 48 2.116 -5.814 -5.814 713 HG LEU 348 HG LEU 48 0.233 -5.813 -5.813 714 1HD1 LEU 348 2HD1 LEU 48 1.184 -3.547 -3.547 715 2HD1 LEU 348 1HD1 LEU 48 2.449 -3.874 -3.874 716 3HD1 LEU 348 3HD1 LEU 48 0.780 -3.661 -3.661 717 1HD2 LEU 348 1HD2 LEU 48 2.444 -7.272 -7.272 718 2HD2 LEU 348 3HD2 LEU 48 2.067 -6.485 -6.485 719 3HD2 LEU 348 2HD2 LEU 48 3.224 -5.748 -5.748 720 H GLU 349 H GLU 49 -0.680 -6.572 -6.572 721 HA GLU 349 HA GLU 49 1.086 -7.454 -7.454 722 1HB GLU 349 2HB GLU 49 -0.566 -5.736 -5.736 723 2HB GLU 349 1HB GLU 49 -1.883 -6.829 -6.829 724 1HG GLU 349 2HG GLU 49 -1.454 -8.233 -8.233 725 2HG GLU 349 1HG GLU 49 0.073 -7.417 -7.417 726 H LEU 350 H LEU 50 -1.442 -9.024 -9.024 727 HA LEU 350 HA LEU 50 -1.827 -11.256 -11.256 728 1HB LEU 350 2HB LEU 50 -3.464 -11.691 -11.691 729 2HB LEU 350 1HB LEU 50 -2.884 -10.359 -10.359 730 HG LEU 350 HG LEU 50 -1.227 -11.974 -11.974 731 1HD1 LEU 350 2HD1 LEU 50 -2.389 -13.659 -13.659 732 2HD1 LEU 350 1HD1 LEU 50 -2.586 -14.391 -14.391 733 3HD1 LEU 350 3HD1 LEU 50 -0.979 -13.953 -13.953 734 1HD2 LEU 350 2HD2 LEU 50 -3.713 -11.368 -11.368 735 2HD2 LEU 350 1HD2 LEU 50 -2.766 -12.579 -12.579 736 3HD2 LEU 350 3HD2 LEU 50 -3.972 -13.083 -13.083 737 H LYS 351 H LYS 51 0.564 -10.412 -10.412 738 HA LYS 351 HA LYS 51 1.694 -13.047 -13.047 739 1HB LYS 351 2HB LYS 51 2.090 -11.010 -11.010 740 2HB LYS 351 1HB LYS 51 3.163 -10.406 -10.406 741 1HG LYS 351 2HG LYS 51 4.234 -12.812 -12.812 742 2HG LYS 351 1HG LYS 51 3.502 -12.788 -12.788 743 1HD LYS 351 2HD LYS 51 5.342 -10.639 -10.639 744 2HD LYS 351 1HD LYS 51 5.836 -11.920 -11.920 745 1HE LYS 351 2HE LYS 51 4.324 -11.115 -11.115 746 2HE LYS 351 1HE LYS 51 3.619 -9.942 -9.942 747 1HZ LYS 351 2HZ LYS 51 6.015 -9.092 -9.092 748 2HZ LYS 351 1HZ LYS 51 6.294 -9.940 -9.940 749 3HZ LYS 351 3HZ LYS 51 5.139 -8.699 -8.699 750 H ASP 352 H ASP 52 2.440 -10.305 -10.305 751 HA ASP 352 HA ASP 52 4.696 -11.472 -11.472 752 1HB ASP 352 2HB ASP 52 3.761 -9.046 -9.046 753 2HB ASP 352 1HB ASP 52 2.736 -9.674 -9.674 754 H ALA 353 H ALA 53 1.235 -11.867 -11.867 755 HA ALA 353 HA ALA 53 1.595 -13.370 -13.370 756 1HB ALA 353 1HB ALA 53 -0.437 -11.947 -11.947 757 2HB ALA 353 3HB ALA 53 -0.895 -13.157 -13.157 758 3HB ALA 353 2HB ALA 53 -0.804 -13.596 -13.596 759 H GLN 354 H GLN 54 1.435 -14.031 -14.031 760 HA GLN 354 HA GLN 54 0.598 -16.769 -16.769 761 1HB GLN 354 2HB GLN 54 1.681 -14.956 -14.956 762 2HB GLN 354 1HB GLN 54 2.374 -16.571 -16.571 763 1HG GLN 354 2HG GLN 54 -0.315 -17.073 -17.073 764 2HG GLN 354 1HG GLN 54 -0.346 -15.658 -15.658 765 1HE2 GLN 354 2HE2 GLN 54 1.733 -17.586 -17.586 766 2HE2 GLN 354 1HE2 GLN 54 2.022 -16.202 -16.202 767 H ALA 355 HN ALA 55 2.167 -18.613 -18.613 768 HA ALA 355 HA ALA 55 4.951 -18.426 -18.426 769 1HB ALA 355 1HB ALA 55 3.077 -18.898 -18.898 770 2HB ALA 355 3HB ALA 55 4.541 -19.880 -19.880 771 3HB ALA 355 2HB ALA 55 4.661 -18.121 -18.121 772 1H GLY 325 2H GLY 25 -17.098 10.464 10.464 773 2H GLY 325 1H GLY 25 -17.547 11.207 11.207 774 3H GLY 325 3H GLY 25 -16.843 9.665 9.665 775 1HA GLY 325 2HA GLY 25 -14.782 10.462 10.462 776 2HA GLY 325 1HA GLY 25 -15.520 12.016 12.016 777 H GLU 326 H GLU 26 -13.357 10.765 10.765 778 HA GLU 326 HA GLU 26 -13.729 12.916 12.916 779 1HB GLU 326 2HB GLU 26 -14.238 10.035 10.035 780 2HB GLU 326 1HB GLU 26 -13.557 11.123 11.123 781 1HG GLU 326 2HG GLU 26 -15.574 12.671 12.671 782 2HG GLU 326 1HG GLU 26 -16.279 11.067 11.067 783 H TYR 327 H TYR 27 -11.970 12.226 12.226 784 HA TYR 327 HA TYR 27 -9.446 11.914 11.914 785 1HB TYR 327 2HB TYR 27 -10.197 13.168 13.168 786 2HB TYR 327 1HB TYR 27 -8.540 12.602 12.602 787 HD1 TYR 327 HD1 TYR 27 -7.329 13.338 13.338 788 HD2 TYR 327 HD2 TYR 27 -10.834 15.265 15.265 789 HE1 TYR 327 HE1 TYR 27 -6.808 15.366 15.366 790 HE2 TYR 327 HE2 TYR 27 -10.313 17.293 17.293 791 HH TYR 327 HH TYR 27 -8.777 18.308 18.308 792 H PHE 328 H PHE 28 -8.624 9.877 9.877 793 HA PHE 328 HA PHE 28 -9.085 8.125 8.125 794 1HB PHE 328 2HB PHE 28 -8.554 7.440 7.440 795 2HB PHE 328 1HB PHE 28 -8.559 6.246 6.246 796 HD1 PHE 328 HD2 PHE 28 -10.658 6.013 6.013 797 HD2 PHE 328 HD1 PHE 28 -10.579 8.192 8.192 798 HE1 PHE 328 HE2 PHE 28 -13.131 5.875 5.875 799 HE2 PHE 328 HE1 PHE 28 -13.051 8.055 8.055 800 HZ PHE 328 HZ PHE 28 -14.327 6.897 6.897 801 H THR 329 H THR 29 -7.214 6.613 6.613 802 HA THR 329 HA THR 29 -4.609 7.899 7.899 803 HB THR 329 HB THR 29 -4.695 6.513 6.513 804 HG1 THR 329 HG1 THR 29 -6.504 7.440 7.440 805 1HG2 THR 329 1HG2 THR 29 -2.978 8.184 8.184 806 2HG2 THR 329 3HG2 THR 29 -3.942 9.374 9.374 807 3HG2 THR 329 2HG2 THR 29 -3.115 8.090 8.090 808 H LEU 330 H LEU 30 -3.052 6.501 6.501 809 HA LEU 330 HA LEU 30 -3.666 3.580 3.580 810 1HB LEU 330 2HB LEU 30 -3.207 5.161 5.161 811 2HB LEU 330 1HB LEU 30 -1.706 4.270 4.270 812 HG LEU 330 HG LEU 30 -3.861 2.463 2.463 813 1HD1 LEU 330 3HD1 LEU 30 -4.205 4.322 4.322 814 2HD1 LEU 330 2HD1 LEU 30 -4.645 2.625 2.625 815 3HD1 LEU 330 1HD1 LEU 30 -5.431 3.605 3.605 816 1HD2 LEU 330 2HD2 LEU 30 -1.555 1.964 1.964 817 2HD2 LEU 330 1HD2 LEU 30 -2.808 1.254 1.254 818 3HD2 LEU 330 3HD2 LEU 30 -1.975 2.720 2.720 819 H GLN 331 H GLN 31 -2.531 3.452 3.452 820 HA GLN 331 HA GLN 31 0.269 4.283 4.283 821 1HB GLN 331 2HB GLN 31 -1.631 3.941 3.941 822 2HB GLN 331 1HB GLN 31 -0.805 2.385 2.385 823 1HG GLN 331 2HG GLN 31 1.309 3.443 3.443 824 2HG GLN 331 1HG GLN 31 0.662 5.033 5.033 825 1HE2 GLN 331 2HE2 GLN 31 -0.459 3.353 3.353 826 2HE2 GLN 331 1HE2 GLN 31 -0.075 2.333 2.333 827 H ILE 332 H ILE 32 1.852 3.093 3.093 828 HA ILE 332 HA ILE 32 1.480 0.125 0.125 829 HB ILE 332 HB ILE 32 3.025 1.896 1.896 830 1HG1 ILE 332 2HG1 ILE 32 0.855 0.337 0.337 831 2HG1 ILE 332 1HG1 ILE 32 0.259 1.379 1.379 832 1HG2 ILE 332 1HG2 ILE 32 3.374 -0.806 -0.806 833 2HG2 ILE 332 3HG2 ILE 32 2.368 -0.819 -0.819 834 3HG2 ILE 332 2HG2 ILE 32 3.925 0.010 0.010 835 1HD1 ILE 332 2HD1 ILE 32 1.407 3.312 3.312 836 2HD1 ILE 332 1HD1 ILE 32 1.908 2.260 2.260 837 3HD1 ILE 332 3HD1 ILE 32 0.195 2.592 2.592 838 H ARG 333 H ARG 33 2.891 -0.919 -0.919 839 HA ARG 333 HA ARG 33 5.201 0.506 0.506 840 1HB ARG 333 2HB ARG 33 3.769 -1.126 -1.126 841 2HB ARG 333 1HB ARG 33 4.487 -2.417 -2.417 842 1HG ARG 333 2HG ARG 33 6.752 -1.634 -1.634 843 2HG ARG 333 1HG ARG 33 5.962 -0.474 -0.474 844 1HD ARG 333 2HD ARG 33 5.430 -2.064 -2.064 845 2HD ARG 333 1HD ARG 33 4.924 -3.207 -3.207 846 HE ARG 333 HE ARG 33 7.761 -2.814 -2.814 847 1HH1 ARG 333 1HH2 ARG 33 7.055 -4.054 -4.054 848 2HH1 ARG 333 2HH2 ARG 33 7.170 -5.740 -5.740 849 1HH2 ARG 333 2HH1 ARG 33 7.112 -5.243 -5.243 850 2HH2 ARG 333 1HH1 ARG 33 7.203 -6.413 -6.413 851 H GLY 334 H GLY 34 6.536 0.827 0.827 852 1HA GLY 334 2HA GLY 34 8.455 -1.203 -1.203 853 2HA GLY 334 1HA GLY 34 7.283 -1.209 -1.209 854 H ARG 335 H ARG 35 8.856 -0.426 -0.426 855 HA ARG 335 HA ARG 35 9.147 2.501 2.501 856 1HB ARG 335 2HB ARG 35 11.175 1.338 1.338 857 2HB ARG 335 1HB ARG 35 11.657 0.908 0.908 858 1HG ARG 335 2HG ARG 35 11.939 3.139 3.139 859 2HG ARG 335 1HG ARG 35 10.894 3.743 3.743 860 1HD ARG 335 2HD ARG 35 12.668 2.821 2.821 861 2HD ARG 335 1HD ARG 35 13.723 2.715 2.715 862 HE ARG 335 HE ARG 35 12.939 5.164 5.164 863 1HH1 ARG 335 1HH2 ARG 35 12.129 6.477 6.477 864 2HH1 ARG 335 2HH2 ARG 35 13.486 6.729 6.729 865 1HH2 ARG 335 1HH1 ARG 35 15.362 5.494 5.494 866 2HH2 ARG 335 2HH1 ARG 35 15.441 4.294 4.294 867 H GLU 336 H GLU 36 10.073 -0.519 -0.519 868 HA GLU 336 HA GLU 36 10.247 0.755 0.755 869 1HB GLU 336 2HB GLU 36 10.086 -2.118 -2.118 870 2HB GLU 336 1HB GLU 36 10.080 -1.697 -1.697 871 1HG GLU 336 2HG GLU 36 12.202 -0.684 -0.684 872 2HG GLU 336 1HG GLU 36 12.370 -2.204 -2.204 873 H ARG 337 H ARG 37 7.789 -1.324 -1.324 874 HA ARG 337 HA ARG 37 5.910 -1.215 -1.215 875 1HB ARG 337 2HB ARG 37 5.870 -1.981 -1.981 876 2HB ARG 337 1HB ARG 37 4.316 -1.454 -1.454 877 1HG ARG 337 2HG ARG 37 4.589 -3.058 -3.058 878 2HG ARG 337 1HG ARG 37 6.094 -3.622 -3.622 879 1HD ARG 337 2HD ARG 37 3.276 -3.955 -3.955 880 2HD ARG 337 1HD ARG 37 4.543 -5.171 -5.171 881 HE ARG 337 HE ARG 37 4.493 -3.097 -3.097 882 1HH1 ARG 337 2HH1 ARG 37 7.002 -4.737 -4.737 883 2HH1 ARG 337 1HH1 ARG 37 7.111 -5.894 -5.894 884 1HH2 ARG 337 1HH2 ARG 37 3.960 -5.184 -5.184 885 2HH2 ARG 337 2HH2 ARG 37 5.389 -6.145 -6.145 886 H PHE 338 H PHE 38 6.246 0.803 0.803 887 HA PHE 338 HA PHE 38 4.027 2.505 2.505 888 1HB PHE 338 2HB PHE 38 5.142 2.653 2.653 889 2HB PHE 338 1HB PHE 38 6.686 3.025 3.025 890 HD1 PHE 338 HD2 PHE 38 3.330 4.328 4.328 891 HD2 PHE 338 HD1 PHE 38 7.170 5.238 5.238 892 HE1 PHE 338 HE2 PHE 38 2.789 6.749 6.749 893 HE2 PHE 338 HE1 PHE 38 6.628 7.658 7.658 894 HZ PHE 338 HZ PHE 38 4.439 8.412 8.412 895 H GLU 339 H GLU 39 7.344 2.593 2.593 896 HA GLU 339 HA GLU 39 7.092 5.135 5.135 897 1HB GLU 339 2HB GLU 39 8.992 2.853 2.853 898 2HB GLU 339 1HB GLU 39 8.943 3.842 3.842 899 1HG GLU 339 2HG GLU 39 8.922 5.450 5.450 900 2HG GLU 339 1HG GLU 39 10.364 4.444 4.444 901 H MET 340 H MET 40 6.361 1.803 1.803 902 HA MET 340 HA MET 40 5.882 2.215 2.215 903 1HB MET 340 2HB MET 40 4.914 0.250 0.250 904 2HB MET 340 1HB MET 40 4.123 0.289 0.289 905 1HG MET 340 2HG MET 40 6.628 0.277 0.277 906 2HG MET 340 1HG MET 40 6.934 -0.466 -0.466 907 1HE MET 340 3HE MET 40 4.882 -2.182 -2.182 908 2HE MET 340 2HE MET 40 3.609 -1.431 -1.431 909 3HE MET 340 1HE MET 40 3.915 -3.159 -3.159 910 H PHE 341 H PHE 41 3.794 2.567 2.567 911 HA PHE 341 HA PHE 41 1.462 3.344 3.344 912 1HB PHE 341 2HB PHE 41 2.190 3.357 3.357 913 2HB PHE 341 1HB PHE 41 0.725 4.166 4.166 914 HD1 PHE 341 HD2 PHE 41 2.097 1.187 1.187 915 HD2 PHE 341 HD1 PHE 41 -0.800 2.642 2.642 916 HE1 PHE 341 HE2 PHE 41 0.923 -0.992 -0.992 917 HE2 PHE 341 HE1 PHE 41 -1.976 0.462 0.462 918 HZ PHE 341 HZ PHE 41 -1.114 -1.357 -1.357 919 H ARG 342 H ARG 42 4.205 4.977 4.977 920 HA ARG 342 HA ARG 42 3.122 7.626 7.626 921 1HB ARG 342 2HB ARG 42 5.771 6.371 6.371 922 2HB ARG 342 1HB ARG 42 5.806 7.967 7.967 923 1HG ARG 342 2HG ARG 42 4.399 7.379 7.379 924 2HG ARG 342 1HG ARG 42 6.043 8.011 8.011 925 1HD ARG 342 2HD ARG 42 5.344 10.088 10.088 926 2HD ARG 342 1HD ARG 42 4.006 9.450 9.450 927 HE ARG 342 HE ARG 42 3.181 8.952 8.952 928 1HH1 ARG 342 2HH1 ARG 42 4.176 10.844 10.844 929 2HH1 ARG 342 1HH1 ARG 42 3.466 12.365 12.365 930 1HH2 ARG 342 1HH2 ARG 42 2.373 11.287 11.287 931 2HH2 ARG 342 2HH2 ARG 42 2.441 12.616 12.616 932 H GLU 343 H GLU 43 4.697 5.744 5.744 933 HA GLU 343 HA GLU 43 4.680 7.973 7.973 934 1HB GLU 343 2HB GLU 43 6.324 6.059 6.059 935 2HB GLU 343 1HB GLU 43 4.993 5.014 5.014 936 1HG GLU 343 2HG GLU 43 4.654 6.237 6.237 937 2HG GLU 343 1HG GLU 43 5.684 7.562 7.562 938 H LEU 344 H LEU 44 2.838 4.922 4.922 939 HA LEU 344 HA LEU 44 1.092 5.222 5.222 940 1HB LEU 344 2HB LEU 44 0.893 3.943 3.943 941 2HB LEU 344 1HB LEU 44 -0.624 4.218 4.218 942 HG LEU 344 HG LEU 44 -0.050 2.082 2.082 943 1HD1 LEU 344 3HD1 LEU 44 -0.078 3.991 3.991 944 2HD1 LEU 344 2HD1 LEU 44 1.564 3.399 3.399 945 3HD1 LEU 344 1HD1 LEU 44 0.199 2.294 2.294 946 1HD2 LEU 344 1HD2 LEU 44 2.786 3.080 3.080 947 2HD2 LEU 344 3HD2 LEU 44 2.055 1.716 1.716 948 3HD2 LEU 344 2HD2 LEU 44 2.381 1.610 1.610 949 H ASN 345 H ASN 45 0.386 6.323 6.323 950 HA ASN 345 HA ASN 45 -1.896 7.875 7.875 951 1HB ASN 345 2HB ASN 45 -1.919 8.702 8.702 952 2HB ASN 345 1HB ASN 45 -1.415 7.015 7.015 953 1HD2 ASN 345 2HD2 ASN 45 0.995 8.931 8.931 954 2HD2 ASN 345 1HD2 ASN 45 -0.663 8.571 8.571 955 H GLU 346 H GLU 46 1.491 8.494 8.494 956 HA GLU 346 HA GLU 46 1.399 11.368 11.368 957 1HB GLU 346 2HB GLU 46 3.539 10.277 10.277 958 2HB GLU 346 1HB GLU 46 3.351 9.503 9.503 959 1HG GLU 346 2HG GLU 46 4.041 11.352 11.352 960 2HG GLU 346 1HG GLU 46 3.066 12.422 12.422 961 H ALA 347 H ALA 47 1.472 9.195 9.195 962 HA ALA 347 HA ALA 47 1.079 11.314 11.314 963 1HB ALA 347 1HB ALA 47 1.207 8.392 8.392 964 2HB ALA 347 3HB ALA 47 0.023 9.023 9.023 965 3HB ALA 347 2HB ALA 47 1.704 9.546 9.546 966 H LEU 348 H LEU 48 -1.147 9.190 9.190 967 HA LEU 348 HA LEU 48 -3.536 9.854 9.854 968 1HB LEU 348 2HB LEU 48 -3.066 9.183 9.183 969 2HB LEU 348 1HB LEU 48 -4.669 9.317 9.317 970 HG LEU 348 HG LEU 48 -2.514 7.472 7.472 971 1HD1 LEU 348 2HD1 LEU 48 -3.765 7.187 7.187 972 2HD1 LEU 348 1HD1 LEU 48 -4.841 6.293 6.293 973 3HD1 LEU 348 3HD1 LEU 48 -3.136 5.854 5.854 974 1HD2 LEU 348 1HD2 LEU 48 -4.641 8.366 8.366 975 2HD2 LEU 348 3HD2 LEU 48 -4.133 6.683 6.683 976 3HD2 LEU 348 2HD2 LEU 48 -5.463 7.121 7.121 977 H GLU 349 H GLU 49 -2.074 11.404 11.404 978 HA GLU 349 HA GLU 49 -4.022 13.497 13.497 979 1HB GLU 349 2HB GLU 49 -2.554 13.040 13.040 980 2HB GLU 349 1HB GLU 49 -1.128 13.384 13.384 981 1HG GLU 349 2HG GLU 49 -1.700 15.704 15.704 982 2HG GLU 349 1HG GLU 49 -3.307 15.425 15.425 983 H LEU 350 H LEU 50 -1.185 13.024 13.024 984 HA LEU 350 HA LEU 50 -0.875 15.761 15.761 985 1HB LEU 350 2HB LEU 50 0.948 14.875 14.875 986 2HB LEU 350 1HB LEU 50 0.422 13.282 13.282 987 HG LEU 350 HG LEU 50 -1.018 13.179 13.179 988 1HD1 LEU 350 2HD1 LEU 50 -0.073 15.888 15.888 989 2HD1 LEU 350 1HD1 LEU 50 0.482 14.982 14.982 990 3HD1 LEU 350 3HD1 LEU 50 -1.238 15.055 15.055 991 1HD2 LEU 350 2HD2 LEU 50 1.478 12.346 12.346 992 2HD2 LEU 350 1HD2 LEU 50 0.725 12.266 12.266 993 3HD2 LEU 350 3HD2 LEU 50 1.827 13.586 13.586 994 H LYS 351 H LYS 51 -3.008 13.156 13.156 995 HA LYS 351 HA LYS 51 -3.911 14.254 14.254 996 1HB LYS 351 2HB LYS 51 -4.244 11.860 11.860 997 2HB LYS 351 1HB LYS 51 -5.502 12.491 12.491 998 1HG LYS 351 2HG LYS 51 -6.389 13.606 13.606 999 2HG LYS 351 1HG LYS 51 -5.468 12.310 12.310 1000 1HD LYS 351 2HD LYS 51 -7.559 11.899 11.899 1001 2HD LYS 351 1HD LYS 51 -7.833 11.658 11.658 1002 1HE LYS 351 2HE LYS 51 -6.173 9.897 9.897 1003 2HE LYS 351 1HE LYS 51 -5.693 10.214 10.214 1004 1HZ LYS 351 2HZ LYS 51 -8.143 9.751 9.751 1005 2HZ LYS 351 1HZ LYS 51 -8.192 9.015 9.015 1006 3HZ LYS 351 3HZ LYS 51 -7.133 8.429 8.429 1007 H ASP 352 H ASP 52 -5.095 14.447 14.447 1008 HA ASP 352 HA ASP 52 -7.418 16.009 16.009 1009 1HB ASP 352 2HB ASP 52 -6.671 14.835 14.835 1010 2HB ASP 352 1HB ASP 52 -5.774 16.322 16.322 1011 H ALA 353 H ALA 53 -4.024 16.857 16.857 1012 HA ALA 353 HA ALA 53 -4.588 19.738 19.738 1013 1HB ALA 353 1HB ALA 53 -2.605 18.658 18.658 1014 2HB ALA 353 3HB ALA 53 -1.925 18.366 18.366 1015 3HB ALA 353 2HB ALA 53 -2.198 20.017 20.017 1016 H GLN 354 H GLN 54 -3.951 17.286 17.286 1017 HA GLN 354 HA GLN 54 -2.964 18.975 18.975 1018 1HB GLN 354 2HB GLN 54 -3.892 16.234 16.234 1019 2HB GLN 354 1HB GLN 54 -4.460 16.952 16.952 1020 1HG GLN 354 2HG GLN 54 -1.843 17.833 17.833 1021 2HG GLN 354 1HG GLN 54 -1.737 16.203 16.203 1022 1HE2 GLN 354 2HE2 GLN 54 -3.343 14.934 14.934 1023 2HE2 GLN 354 1HE2 GLN 54 -3.841 14.981 14.981 1024 H ALA 355 HN ALA 55 -4.324 19.395 19.395 1025 HA ALA 355 HA ALA 55 -7.170 19.608 19.608 1026 1HB ALA 355 1HB ALA 55 -5.576 21.888 21.888 1027 2HB ALA 355 3HB ALA 55 -6.957 22.283 22.283 1028 3HB ALA 355 2HB ALA 55 -7.190 21.337 21.337 Start of MODEL 14 1 1H GLY 325 2H GLY 25 14.411 1.188 1.188 2 2H GLY 325 1H GLY 25 13.095 2.249 2.249 3 3H GLY 325 3H GLY 25 14.331 2.235 2.235 4 1HA GLY 325 2HA GLY 25 13.672 0.230 0.230 5 2HA GLY 325 1HA GLY 25 12.146 1.038 1.038 6 H GLU 326 H GLU 26 11.013 -0.941 -0.941 7 HA GLU 326 HA GLU 26 11.417 -2.119 -2.119 8 1HB GLU 326 2HB GLU 26 12.595 -3.377 -3.377 9 2HB GLU 326 1HB GLU 26 11.054 -4.222 -4.222 10 1HG GLU 326 2HG GLU 26 12.496 -5.413 -5.413 11 2HG GLU 326 1HG GLU 26 11.598 -4.349 -4.349 12 H TYR 327 H TYR 27 9.630 -4.088 -4.088 13 HA TYR 327 HA TYR 27 7.099 -2.736 -2.736 14 1HB TYR 327 2HB TYR 27 7.911 -4.608 -4.608 15 2HB TYR 327 1HB TYR 27 6.277 -4.804 -4.804 16 HD1 TYR 327 HD2 TYR 27 8.625 -2.436 -2.436 17 HD2 TYR 327 HD1 TYR 27 4.576 -3.149 -3.149 18 HE1 TYR 327 HE2 TYR 27 7.877 -0.468 -0.468 19 HE2 TYR 327 HE1 TYR 27 3.827 -1.183 -1.183 20 HH TYR 327 HH TYR 27 5.100 0.088 0.088 21 H PHE 328 H PHE 28 6.162 -3.462 -3.462 22 HA PHE 328 HA PHE 28 6.631 -6.324 -6.324 23 1HB PHE 328 2HB PHE 28 6.108 -3.883 -3.883 24 2HB PHE 328 1HB PHE 28 6.037 -5.532 -5.532 25 HD1 PHE 328 HD2 PHE 28 8.058 -6.952 -6.952 26 HD2 PHE 328 HD1 PHE 28 8.220 -2.863 -2.863 27 HE1 PHE 328 HE2 PHE 28 10.529 -6.977 -6.977 28 HE2 PHE 328 HE1 PHE 28 10.690 -2.889 -2.889 29 HZ PHE 328 HZ PHE 28 11.844 -4.946 -4.946 30 H THR 329 H THR 29 4.756 -7.391 -7.391 31 HA THR 329 HA THR 29 2.114 -6.197 -6.197 32 HB THR 329 HB THR 29 2.423 -9.118 -9.118 33 HG1 THR 329 HG1 THR 29 4.286 -8.591 -8.591 34 1HG2 THR 329 3HG2 THR 29 0.492 -7.328 -7.328 35 2HG2 THR 329 2HG2 THR 29 1.353 -7.348 -7.348 36 3HG2 THR 329 1HG2 THR 29 0.699 -8.845 -8.845 37 H LEU 330 H LEU 30 0.617 -6.429 -6.429 38 HA LEU 330 HA LEU 30 1.282 -8.295 -8.295 39 1HB LEU 330 2HB LEU 30 0.526 -5.555 -5.555 40 2HB LEU 330 1HB LEU 30 -0.840 -6.473 -6.473 41 HG LEU 330 HG LEU 30 1.192 -7.718 -7.718 42 1HD1 LEU 330 1HD1 LEU 30 2.443 -5.503 -5.503 43 2HD1 LEU 330 3HD1 LEU 30 2.155 -5.028 -5.028 44 3HD1 LEU 330 2HD1 LEU 30 3.071 -6.492 -6.492 45 1HD2 LEU 330 2HD2 LEU 30 -0.184 -5.147 -5.147 46 2HD2 LEU 330 1HD2 LEU 30 -0.813 -6.780 -6.780 47 3HD2 LEU 330 3HD2 LEU 30 0.624 -6.263 -6.263 48 H GLN 331 H GLN 31 0.283 -10.170 -10.170 49 HA GLN 331 HA GLN 31 -2.465 -9.986 -9.986 50 1HB GLN 331 2HB GLN 31 -0.462 -12.222 -12.222 51 2HB GLN 331 1HB GLN 31 -2.143 -12.556 -12.556 52 1HG GLN 331 2HG GLN 31 -1.147 -10.437 -10.437 53 2HG GLN 331 1HG GLN 31 -0.112 -11.861 -11.861 54 1HE2 GLN 331 2HE2 GLN 31 -2.685 -13.925 -13.925 55 2HE2 GLN 331 1HE2 GLN 31 -1.248 -13.971 -13.971 56 H ILE 332 H ILE 32 -3.993 -9.709 -9.709 57 HA ILE 332 HA ILE 32 -3.726 -11.289 -11.289 58 HB ILE 332 HB ILE 32 -5.282 -8.731 -8.731 59 1HG1 ILE 332 2HG1 ILE 32 -3.222 -8.486 -8.486 60 2HG1 ILE 332 1HG1 ILE 32 -2.505 -9.183 -9.183 61 1HG2 ILE 332 3HG2 ILE 32 -5.208 -10.694 -10.694 62 2HG2 ILE 332 2HG2 ILE 32 -4.952 -9.029 -9.029 63 3HG2 ILE 332 1HG2 ILE 32 -6.414 -9.458 -9.458 64 1HD1 ILE 332 1HD1 ILE 32 -4.304 -6.753 -6.753 65 2HD1 ILE 332 3HD1 ILE 32 -2.555 -6.632 -6.632 66 3HD1 ILE 332 2HD1 ILE 32 -3.242 -7.357 -7.357 67 H ARG 333 H ARG 33 -5.054 -13.036 -13.036 68 HA ARG 333 HA ARG 33 -7.378 -13.148 -13.148 69 1HB ARG 333 2HB ARG 33 -6.135 -15.198 -15.198 70 2HB ARG 333 1HB ARG 33 -6.319 -15.053 -15.053 71 1HG ARG 333 2HG ARG 33 -8.706 -15.382 -15.382 72 2HG ARG 333 1HG ARG 33 -8.652 -15.304 -15.304 73 1HD ARG 333 2HD ARG 33 -7.458 -17.371 -17.371 74 2HD ARG 333 1HD ARG 33 -7.139 -17.388 -17.388 75 HE ARG 333 HE ARG 33 -9.444 -18.017 -18.017 76 1HH1 ARG 333 1HH2 ARG 33 -11.058 -16.700 -16.700 77 2HH1 ARG 333 2HH2 ARG 33 -11.358 -17.891 -17.891 78 1HH2 ARG 333 2HH1 ARG 33 -8.753 -19.951 -19.951 79 2HH2 ARG 333 1HH1 ARG 33 -10.052 -19.731 -19.731 80 H GLY 334 H GLY 34 -8.933 -11.684 -11.684 81 1HA GLY 334 2HA GLY 34 -10.666 -12.374 -12.374 82 2HA GLY 334 1HA GLY 34 -9.556 -11.139 -11.139 83 H ARG 335 H ARG 35 -10.590 -9.218 -9.218 84 HA ARG 335 HA ARG 35 -11.303 -7.928 -7.928 85 1HB ARG 335 2HB ARG 35 -13.186 -9.607 -9.607 86 2HB ARG 335 1HB ARG 35 -13.726 -8.838 -8.838 87 1HG ARG 335 2HG ARG 35 -14.273 -6.824 -6.824 88 2HG ARG 335 1HG ARG 35 -13.255 -7.190 -7.190 89 1HD ARG 335 2HD ARG 35 -14.927 -9.262 -9.262 90 2HD ARG 335 1HD ARG 35 -16.006 -8.159 -8.159 91 HE ARG 335 HE ARG 35 -14.797 -6.746 -6.746 92 1HH1 ARG 335 2HH1 ARG 35 -15.707 -9.683 -9.683 93 2HH1 ARG 335 1HH1 ARG 35 -17.199 -9.284 -9.284 94 1HH2 ARG 335 1HH2 ARG 35 -17.287 -6.046 -6.046 95 2HH2 ARG 335 2HH2 ARG 35 -18.095 -7.224 -7.224 96 H GLU 336 H GLU 36 -12.504 -8.155 -8.155 97 HA GLU 336 HA GLU 36 -12.733 -5.283 -5.283 98 1HB GLU 336 2HB GLU 36 -13.156 -5.734 -5.734 99 2HB GLU 336 1HB GLU 36 -13.990 -6.965 -6.965 100 1HG GLU 336 2HG GLU 36 -11.981 -8.455 -8.455 101 2HG GLU 336 1HG GLU 36 -11.334 -7.253 -7.253 102 H ARG 337 H ARG 37 -10.304 -7.671 -7.671 103 HA ARG 337 HA ARG 37 -8.588 -5.747 -5.747 104 1HB ARG 337 2HB ARG 37 -8.451 -8.576 -8.576 105 2HB ARG 337 1HB ARG 37 -6.899 -7.755 -7.755 106 1HG ARG 337 2HG ARG 37 -7.172 -6.854 -6.854 107 2HG ARG 337 1HG ARG 37 -8.637 -7.821 -7.821 108 1HD ARG 337 2HD ARG 37 -6.048 -9.127 -9.127 109 2HD ARG 337 1HD ARG 37 -6.383 -8.804 -8.804 110 HE ARG 337 HE ARG 37 -8.282 -10.327 -10.327 111 1HH1 ARG 337 2HH1 ARG 37 -5.687 -11.122 -11.122 112 2HH1 ARG 337 1HH1 ARG 37 -6.539 -12.132 -12.132 113 1HH2 ARG 337 1HH2 ARG 37 -9.679 -11.178 -11.178 114 2HH2 ARG 337 2HH2 ARG 37 -8.798 -12.163 -12.163 115 H PHE 338 H PHE 38 -8.666 -7.100 -7.100 116 HA PHE 338 HA PHE 38 -6.373 -5.732 -5.732 117 1HB PHE 338 2HB PHE 38 -7.357 -7.459 -7.459 118 2HB PHE 338 1HB PHE 38 -8.917 -6.635 -6.635 119 HD1 PHE 338 HD2 PHE 38 -5.385 -6.421 -6.421 120 HD2 PHE 338 HD1 PHE 38 -9.373 -4.875 -4.875 121 HE1 PHE 338 HE2 PHE 38 -4.695 -5.165 -5.165 122 HE2 PHE 338 HE1 PHE 38 -8.683 -3.620 -3.620 123 HZ PHE 338 HZ PHE 38 -6.344 -3.764 -3.764 124 H GLU 339 H GLU 39 -9.707 -4.687 -4.687 125 HA GLU 339 HA GLU 39 -9.492 -2.214 -2.214 126 1HB GLU 339 2HB GLU 39 -11.320 -3.273 -3.273 127 2HB GLU 339 1HB GLU 39 -11.369 -1.556 -1.556 128 1HG GLU 339 2HG GLU 39 -11.292 -2.896 -2.896 129 2HG GLU 339 1HG GLU 39 -12.432 -3.805 -3.805 130 H MET 340 H MET 40 -8.940 -3.110 -3.110 131 HA MET 340 HA MET 40 -8.391 -0.615 -0.615 132 1HB MET 340 2HB MET 40 -7.402 -3.370 -3.370 133 2HB MET 340 1HB MET 40 -6.471 -2.054 -2.054 134 1HG MET 340 2HG MET 40 -8.238 -1.357 -1.357 135 2HG MET 340 1HG MET 40 -9.458 -2.081 -2.081 136 1HE MET 340 1HE MET 40 -6.161 -3.098 -3.098 137 2HE MET 340 3HE MET 40 -6.344 -4.430 -4.430 138 3HE MET 340 2HE MET 40 -6.467 -4.730 -4.730 139 H PHE 341 H PHE 41 -6.160 -2.744 -2.744 140 HA PHE 341 HA PHE 41 -3.943 -0.954 -0.954 141 1HB PHE 341 2HB PHE 41 -4.715 -3.369 -3.369 142 2HB PHE 341 1HB PHE 41 -3.292 -2.444 -2.444 143 HD1 PHE 341 HD2 PHE 41 -3.969 -2.126 -2.126 144 HD2 PHE 341 HD1 PHE 41 -2.210 -4.803 -4.803 145 HE1 PHE 341 HE2 PHE 41 -2.761 -3.273 -3.273 146 HE2 PHE 341 HE1 PHE 41 -1.004 -5.958 -5.958 147 HZ PHE 341 HZ PHE 41 -1.293 -5.194 -5.194 148 H ARG 342 H ARG 42 -6.608 -1.430 -1.430 149 HA ARG 342 HA ARG 42 -5.706 0.151 0.151 150 1HB ARG 342 2HB ARG 42 -8.397 -0.599 -0.599 151 2HB ARG 342 1HB ARG 42 -8.315 0.702 0.702 152 1HG ARG 342 2HG ARG 42 -6.616 -1.301 -1.301 153 2HG ARG 342 1HG ARG 42 -8.041 -2.158 -2.158 154 1HD ARG 342 2HD ARG 42 -9.021 -1.572 -1.572 155 2HD ARG 342 1HD ARG 42 -9.117 0.057 0.057 156 HE ARG 342 HE ARG 42 -6.926 0.516 0.516 157 1HH1 ARG 342 2HH1 ARG 42 -9.421 -1.046 -1.046 158 2HH1 ARG 342 1HH1 ARG 42 -8.481 -1.690 -1.690 159 1HH2 ARG 342 1HH2 ARG 42 -5.436 -0.820 -0.820 160 2HH2 ARG 342 2HH2 ARG 42 -6.225 -1.561 -1.561 161 H GLU 343 H GLU 43 -7.004 1.025 1.025 162 HA GLU 343 HA GLU 43 -7.354 3.841 3.841 163 1HB GLU 343 2HB GLU 43 -8.409 2.460 2.460 164 2HB GLU 343 1HB GLU 43 -6.885 2.768 2.768 165 1HG GLU 343 2HG GLU 43 -7.517 4.872 4.872 166 2HG GLU 343 1HG GLU 43 -7.836 5.206 5.206 167 H LEU 344 H LEU 44 -4.963 2.195 2.195 168 HA LEU 344 HA LEU 44 -3.254 4.436 4.436 169 1HB LEU 344 2HB LEU 44 -2.672 1.462 1.462 170 2HB LEU 344 1HB LEU 44 -1.412 2.655 2.655 171 HG LEU 344 HG LEU 44 -2.102 2.161 2.161 172 1HD1 LEU 344 3HD1 LEU 44 -2.524 4.650 4.650 173 2HD1 LEU 344 2HD1 LEU 44 -4.217 4.232 4.232 174 3HD1 LEU 344 1HD1 LEU 44 -3.058 4.106 4.106 175 1HD2 LEU 344 2HD2 LEU 44 -4.320 1.061 1.061 176 2HD2 LEU 344 1HD2 LEU 44 -4.009 1.044 1.044 177 3HD2 LEU 344 3HD2 LEU 44 -5.004 2.318 2.318 178 H ASN 345 H ASN 45 -2.741 1.692 1.692 179 HA ASN 345 HA ASN 45 -0.688 2.676 2.676 180 1HB ASN 345 2HB ASN 45 -2.254 0.504 0.504 181 2HB ASN 345 1HB ASN 45 -2.992 1.458 1.458 182 1HD2 ASN 345 2HD2 ASN 45 -0.360 -0.300 -0.300 183 2HD2 ASN 345 1HD2 ASN 45 -1.934 -0.553 -0.553 184 H GLU 346 H GLU 46 -4.076 3.674 3.674 185 HA GLU 346 HA GLU 46 -3.935 5.210 5.210 186 1HB GLU 346 2HB GLU 46 -5.853 4.750 4.750 187 2HB GLU 346 1HB GLU 46 -5.883 6.415 6.415 188 1HG GLU 346 2HG GLU 46 -5.721 5.025 5.025 189 2HG GLU 346 1HG GLU 46 -6.692 3.931 3.931 190 H ALA 347 H ALA 47 -3.712 6.176 6.176 191 HA ALA 347 HA ALA 47 -3.271 8.946 8.946 192 1HB ALA 347 1HB ALA 47 -3.770 7.790 7.790 193 2HB ALA 347 3HB ALA 47 -2.036 7.475 7.475 194 3HB ALA 347 2HB ALA 47 -2.629 9.135 9.135 195 H LEU 348 H LEU 48 -0.994 6.231 6.231 196 HA LEU 348 HA LEU 48 1.405 7.765 7.765 197 1HB LEU 348 2HB LEU 48 0.836 4.985 4.985 198 2HB LEU 348 1HB LEU 48 2.445 5.671 5.671 199 HG LEU 348 HG LEU 48 0.433 5.471 5.471 200 1HD1 LEU 348 1HD1 LEU 48 1.090 3.223 3.223 201 2HD1 LEU 348 3HD1 LEU 48 2.706 3.538 3.538 202 3HD1 LEU 348 2HD1 LEU 48 1.343 3.382 3.382 203 1HD2 LEU 348 3HD2 LEU 48 2.941 6.728 6.728 204 2HD2 LEU 348 2HD2 LEU 48 2.052 6.483 6.483 205 3HD2 LEU 348 1HD2 LEU 48 3.241 5.292 5.292 206 H GLU 349 H GLU 49 -0.472 6.199 6.199 207 HA GLU 349 HA GLU 49 1.080 7.207 7.207 208 1HB GLU 349 2HB GLU 49 -0.611 5.441 5.441 209 2HB GLU 349 1HB GLU 49 -1.892 6.584 6.584 210 1HG GLU 349 2HG GLU 49 -1.533 7.862 7.862 211 2HG GLU 349 1HG GLU 49 0.036 7.115 7.115 212 H LEU 350 H LEU 50 -1.309 8.711 8.711 213 HA LEU 350 HA LEU 50 -1.773 10.958 10.958 214 1HB LEU 350 2HB LEU 50 -3.443 11.356 11.356 215 2HB LEU 350 1HB LEU 50 -2.914 9.946 9.946 216 HG LEU 350 HG LEU 50 -1.266 11.467 11.467 217 1HD1 LEU 350 2HD1 LEU 50 -2.392 13.281 13.281 218 2HD1 LEU 350 1HD1 LEU 50 -2.572 13.911 13.911 219 3HD1 LEU 350 3HD1 LEU 50 -0.976 13.487 13.487 220 1HD2 LEU 350 3HD2 LEU 50 -3.643 10.774 10.774 221 2HD2 LEU 350 2HD2 LEU 50 -2.863 12.128 12.128 222 3HD2 LEU 350 1HD2 LEU 50 -4.092 12.429 12.429 223 H LYS 351 H LYS 51 0.485 10.146 10.146 224 HA LYS 351 HA LYS 51 1.573 12.731 12.731 225 1HB LYS 351 2HB LYS 51 2.097 10.660 10.660 226 2HB LYS 351 1HB LYS 51 3.105 10.121 10.121 227 1HG LYS 351 2HG LYS 51 4.484 12.148 12.148 228 2HG LYS 351 1HG LYS 51 3.467 12.719 12.719 229 1HD LYS 351 2HD LYS 51 4.312 10.025 10.025 230 2HD LYS 351 1HD LYS 51 5.724 11.012 11.012 231 1HE LYS 351 2HE LYS 51 4.649 12.758 12.758 232 2HE LYS 351 1HE LYS 51 3.693 11.395 11.395 233 1HZ LYS 351 3HZ LYS 51 6.049 10.270 10.270 234 2HZ LYS 351 2HZ LYS 51 6.569 11.880 11.880 235 3HZ LYS 351 1HZ LYS 51 5.493 11.214 11.214 236 H ASP 352 H ASP 52 2.199 10.301 10.301 237 HA ASP 352 HA ASP 52 4.392 11.731 11.731 238 1HB ASP 352 2HB ASP 52 2.983 9.241 9.241 239 2HB ASP 352 1HB ASP 52 3.115 10.092 10.092 240 H ALA 353 H ALA 53 0.896 11.738 11.738 241 HA ALA 353 HA ALA 53 1.048 13.613 13.613 242 1HB ALA 353 2HB ALA 53 -1.263 12.134 12.134 243 2HB ALA 353 1HB ALA 53 -1.445 13.280 13.280 244 3HB ALA 353 3HB ALA 53 -0.526 11.792 11.792 245 H GLN 354 H GLN 54 1.995 14.857 14.857 246 HA GLN 354 HA GLN 54 -0.270 16.277 16.277 247 1HB GLN 354 2HB GLN 54 2.667 15.980 15.980 248 2HB GLN 354 1HB GLN 54 1.792 17.356 17.356 249 1HG GLN 354 2HG GLN 54 0.040 15.500 15.500 250 2HG GLN 354 1HG GLN 54 1.440 14.433 14.433 251 1HE2 GLN 354 2HE2 GLN 54 1.274 17.188 17.188 252 2HE2 GLN 354 1HE2 GLN 54 0.161 17.257 17.257 253 H ALA 355 HN ALA 55 -0.915 17.543 17.543 254 HA ALA 355 HA ALA 55 1.033 19.715 19.715 255 1HB ALA 355 1HB ALA 55 -0.721 18.045 18.045 256 2HB ALA 355 3HB ALA 55 -0.579 19.752 19.752 257 3HB ALA 355 2HB ALA 55 0.864 18.740 18.740 258 1H GLY 325 2H GLY 25 -15.081 -14.928 -14.928 259 2H GLY 325 1H GLY 25 -13.864 -15.270 -15.270 260 3H GLY 325 3H GLY 25 -15.219 -14.358 -14.358 261 1HA GLY 325 2HA GLY 25 -14.531 -12.478 -12.478 262 2HA GLY 325 1HA GLY 25 -13.025 -13.134 -13.134 263 H GLU 326 H GLU 26 -11.758 -12.257 -12.257 264 HA GLU 326 HA GLU 26 -11.812 -13.897 -13.897 265 1HB GLU 326 2HB GLU 26 -13.147 -11.471 -11.471 266 2HB GLU 326 1HB GLU 26 -11.555 -11.053 -11.053 267 1HG GLU 326 2HG GLU 26 -12.765 -11.718 -11.718 268 2HG GLU 326 1HG GLU 26 -11.825 -13.150 -13.150 269 H TYR 327 H TYR 27 -9.929 -12.830 -12.830 270 HA TYR 327 HA TYR 27 -7.563 -12.711 -12.711 271 1HB TYR 327 2HB TYR 27 -8.070 -13.574 -13.574 272 2HB TYR 327 1HB TYR 27 -6.497 -12.846 -12.846 273 HD1 TYR 327 HD2 TYR 27 -8.790 -15.615 -15.615 274 HD2 TYR 327 HD1 TYR 27 -4.855 -13.953 -13.953 275 HE1 TYR 327 HE2 TYR 27 -8.015 -17.735 -17.735 276 HE2 TYR 327 HE1 TYR 27 -4.083 -16.072 -16.072 277 HH TYR 327 HH TYR 27 -5.184 -18.763 -18.763 278 H PHE 328 H PHE 28 -6.764 -10.714 -10.714 279 HA PHE 328 HA PHE 28 -7.166 -8.570 -8.570 280 1HB PHE 328 2HB PHE 28 -6.966 -8.420 -8.420 281 2HB PHE 328 1HB PHE 28 -6.869 -7.000 -7.000 282 HD1 PHE 328 HD2 PHE 28 -8.801 -6.302 -6.302 283 HD2 PHE 328 HD1 PHE 28 -9.054 -9.610 -9.610 284 HE1 PHE 328 HE2 PHE 28 -11.276 -6.233 -6.233 285 HE2 PHE 328 HE1 PHE 28 -11.529 -9.542 -9.542 286 HZ PHE 328 HZ PHE 28 -12.640 -7.854 -7.854 287 H THR 329 H THR 29 -5.361 -7.006 -7.006 288 HA THR 329 HA THR 29 -2.749 -8.103 -8.103 289 HB THR 329 HB THR 29 -2.630 -6.839 -6.839 290 HG1 THR 329 HG1 THR 29 -4.612 -7.871 -7.871 291 1HG2 THR 329 3HG2 THR 29 -0.983 -8.371 -8.371 292 2HG2 THR 329 2HG2 THR 29 -1.839 -9.659 -9.659 293 3HG2 THR 329 1HG2 THR 29 -0.999 -8.406 -8.406 294 H LEU 330 H LEU 30 -1.313 -6.542 -6.542 295 HA LEU 330 HA LEU 30 -2.169 -3.694 -3.694 296 1HB LEU 330 2HB LEU 30 -1.520 -5.174 -5.174 297 2HB LEU 330 1HB LEU 30 -0.220 -4.010 -4.010 298 HG LEU 330 HG LEU 30 -2.416 -2.476 -2.476 299 1HD1 LEU 330 1HD1 LEU 30 -3.456 -4.792 -4.792 300 2HD1 LEU 330 3HD1 LEU 30 -3.386 -3.645 -3.645 301 3HD1 LEU 330 2HD1 LEU 30 -4.278 -3.237 -3.237 302 1HD2 LEU 330 1HD2 LEU 30 -0.495 -1.931 -1.931 303 2HD2 LEU 330 3HD2 LEU 30 -2.036 -1.521 -1.521 304 3HD2 LEU 330 2HD2 LEU 30 -1.175 -2.981 -2.981 305 H GLN 331 H GLN 31 -0.993 -3.445 -3.445 306 HA GLN 331 HA GLN 31 1.846 -4.133 -4.133 307 1HB GLN 331 2HB GLN 31 -0.059 -2.751 -2.751 308 2HB GLN 331 1HB GLN 31 1.676 -2.781 -2.781 309 1HG GLN 331 2HG GLN 31 0.741 -5.413 -5.413 310 2HG GLN 331 1HG GLN 31 -0.181 -4.805 -4.805 311 1HE2 GLN 331 2HE2 GLN 31 2.636 -4.771 -4.771 312 2HE2 GLN 331 1HE2 GLN 31 1.107 -4.086 -4.086 313 H ILE 332 H ILE 32 3.153 -2.913 -2.913 314 HA ILE 332 HA ILE 32 2.742 0.046 0.046 315 HB ILE 332 HB ILE 32 4.213 -1.679 -1.679 316 1HG1 ILE 332 2HG1 ILE 32 1.957 -0.300 -0.300 317 2HG1 ILE 332 1HG1 ILE 32 1.419 -1.146 -1.146 318 1HG2 ILE 332 3HG2 ILE 32 4.010 1.219 1.219 319 2HG2 ILE 332 2HG2 ILE 32 3.618 0.741 0.741 320 3HG2 ILE 332 1HG2 ILE 32 5.184 0.317 0.317 321 1HD1 ILE 332 1HD1 ILE 32 3.086 -2.493 -2.493 322 2HD1 ILE 332 3HD1 ILE 32 1.323 -2.491 -2.491 323 3HD1 ILE 332 2HD1 ILE 32 2.174 -3.258 -3.258 324 H ARG 333 H ARG 33 4.185 1.086 1.086 325 HA ARG 333 HA ARG 33 6.645 -0.268 -0.268 326 1HB ARG 333 2HB ARG 33 5.499 1.050 1.050 327 2HB ARG 333 1HB ARG 33 5.482 2.465 2.465 328 1HG ARG 333 2HG ARG 33 7.892 2.653 2.653 329 2HG ARG 333 1HG ARG 33 8.019 1.127 1.127 330 1HD ARG 333 2HD ARG 33 6.962 2.047 2.047 331 2HD ARG 333 1HD ARG 33 6.472 3.499 3.499 332 HE ARG 333 HE ARG 33 8.760 4.277 4.277 333 1HH1 ARG 333 1HH2 ARG 33 10.489 2.030 2.030 334 2HH1 ARG 333 2HH2 ARG 33 10.978 1.661 1.661 335 1HH2 ARG 333 2HH1 ARG 33 8.406 3.462 3.462 336 2HH2 ARG 333 1HH1 ARG 33 9.800 2.473 2.473 337 H GLY 334 H GLY 34 8.003 -0.388 -0.388 338 1HA GLY 334 2HA GLY 34 9.627 1.849 1.849 339 2HA GLY 334 1HA GLY 34 8.410 1.696 1.696 340 H ARG 335 H ARG 35 9.311 0.665 0.665 341 HA ARG 335 HA ARG 35 10.163 -2.044 -2.044 342 1HB ARG 335 2HB ARG 35 12.124 -0.972 -0.972 343 2HB ARG 335 1HB ARG 35 12.474 -0.106 -0.106 344 1HG ARG 335 2HG ARG 35 12.997 -2.080 -2.080 345 2HG ARG 335 1HG ARG 35 12.150 -3.100 -3.100 346 1HD ARG 335 2HD ARG 35 13.956 -2.066 -2.066 347 2HD ARG 335 1HD ARG 35 14.874 -1.885 -1.885 348 HE ARG 335 HE ARG 35 13.819 -4.531 -4.531 349 1HH1 ARG 335 2HH1 ARG 35 14.972 -3.582 -3.582 350 2HH1 ARG 335 1HH1 ARG 35 16.511 -4.374 -4.374 351 1HH2 ARG 335 1HH2 ARG 35 16.292 -5.085 -5.085 352 2HH2 ARG 335 2HH2 ARG 35 17.258 -5.227 -5.227 353 H GLU 336 H GLU 36 11.055 0.975 0.975 354 HA GLU 336 HA GLU 36 11.103 -0.310 -0.310 355 1HB GLU 336 2HB GLU 36 11.283 1.937 1.937 356 2HB GLU 336 1HB GLU 36 12.279 1.843 1.843 357 1HG GLU 336 2HG GLU 36 10.333 2.778 2.778 358 2HG GLU 336 1HG GLU 36 9.506 3.040 3.040 359 H ARG 337 H ARG 37 8.689 1.709 1.709 360 HA ARG 337 HA ARG 37 6.749 1.639 1.639 361 1HB ARG 337 2HB ARG 37 6.850 2.498 2.498 362 2HB ARG 337 1HB ARG 37 5.280 1.831 1.831 363 1HG ARG 337 2HG ARG 37 5.275 3.336 3.336 364 2HG ARG 337 1HG ARG 37 6.764 4.069 4.069 365 1HD ARG 337 2HD ARG 37 4.368 3.897 3.897 366 2HD ARG 337 1HD ARG 37 4.461 5.177 5.177 367 HE ARG 337 HE ARG 37 6.463 6.016 6.016 368 1HH1 ARG 337 2HH1 ARG 37 4.127 4.752 4.752 369 2HH1 ARG 337 1HH1 ARG 37 5.147 4.418 4.418 370 1HH2 ARG 337 1HH2 ARG 37 8.095 5.002 5.002 371 2HH2 ARG 337 2HH2 ARG 37 7.394 4.560 4.560 372 H PHE 338 H PHE 38 7.212 -0.405 -0.405 373 HA PHE 338 HA PHE 38 4.965 -2.111 -2.111 374 1HB PHE 338 2HB PHE 38 6.185 -2.262 -2.262 375 2HB PHE 338 1HB PHE 38 7.688 -2.637 -2.637 376 HD1 PHE 338 HD2 PHE 38 4.287 -3.917 -3.917 377 HD2 PHE 338 HD1 PHE 38 8.202 -4.863 -4.863 378 HE1 PHE 338 HE2 PHE 38 3.738 -6.334 -6.334 379 HE2 PHE 338 HE1 PHE 38 7.654 -7.279 -7.279 380 HZ PHE 338 HZ PHE 38 5.422 -8.015 -8.015 381 H GLU 339 H GLU 39 8.156 -2.034 -2.034 382 HA GLU 339 HA GLU 39 7.963 -4.605 -4.605 383 1HB GLU 339 2HB GLU 39 9.616 -2.126 -2.126 384 2HB GLU 339 1HB GLU 39 9.627 -3.395 -3.395 385 1HG GLU 339 2HG GLU 39 9.882 -4.727 -4.727 386 2HG GLU 339 1HG GLU 39 10.968 -3.339 -3.339 387 H MET 340 H MET 40 7.155 -1.282 -1.282 388 HA MET 340 HA MET 40 6.351 -1.730 -1.730 389 1HB MET 340 2HB MET 40 5.491 0.134 0.134 390 2HB MET 340 1HB MET 40 4.420 -0.021 -0.021 391 1HG MET 340 2HG MET 40 6.000 0.827 0.827 392 2HG MET 340 1HG MET 40 7.358 0.370 0.370 393 1HE MET 340 1HE MET 40 4.058 1.801 1.801 394 2HE MET 340 3HE MET 40 4.241 3.501 3.501 395 3HE MET 340 2HE MET 40 4.508 2.234 2.234 396 H PHE 341 H PHE 41 4.404 -2.081 -2.081 397 HA PHE 341 HA PHE 41 2.092 -3.154 -3.154 398 1HB PHE 341 2HB PHE 41 3.110 -3.192 -3.192 399 2HB PHE 341 1HB PHE 41 1.666 -4.101 -4.101 400 HD1 PHE 341 HD2 PHE 41 2.023 -1.300 -1.300 401 HD2 PHE 341 HD1 PHE 41 0.735 -2.396 -2.396 402 HE1 PHE 341 HE2 PHE 41 0.674 0.771 0.771 403 HE2 PHE 341 HE1 PHE 41 -0.615 -0.321 -0.321 404 HZ PHE 341 HZ PHE 41 -0.647 1.264 1.264 405 H ARG 342 H ARG 42 5.065 -4.578 -4.578 406 HA ARG 342 HA ARG 42 4.239 -7.304 -7.304 407 1HB ARG 342 2HB ARG 42 6.859 -5.869 -5.869 408 2HB ARG 342 1HB ARG 42 6.823 -7.569 -7.569 409 1HG ARG 342 2HG ARG 42 5.327 -7.441 -7.441 410 2HG ARG 342 1HG ARG 42 6.727 -6.407 -6.407 411 1HD ARG 342 2HD ARG 42 7.872 -8.308 -8.308 412 2HD ARG 342 1HD ARG 42 7.808 -8.608 -8.608 413 HE ARG 342 HE ARG 42 5.727 -9.942 -9.942 414 1HH1 ARG 342 2HH1 ARG 42 8.443 -10.248 -10.248 415 2HH1 ARG 342 1HH1 ARG 42 7.676 -11.053 -11.053 416 1HH2 ARG 342 1HH2 ARG 42 4.461 -10.502 -10.502 417 2HH2 ARG 342 2HH2 ARG 42 5.423 -11.197 -11.197 418 H GLU 343 H GLU 43 5.100 -5.061 -5.061 419 HA GLU 343 HA GLU 43 5.437 -7.089 -7.089 420 1HB GLU 343 2HB GLU 43 6.334 -4.644 -4.644 421 2HB GLU 343 1HB GLU 43 4.718 -4.212 -4.212 422 1HG GLU 343 2HG GLU 43 5.214 -4.888 -4.888 423 2HG GLU 343 1HG GLU 43 5.675 -6.483 -6.483 424 H LEU 344 H LEU 44 2.926 -4.545 -4.545 425 HA LEU 344 HA LEU 44 1.063 -5.638 -5.638 426 1HB LEU 344 2HB LEU 44 0.657 -4.083 -4.083 427 2HB LEU 344 1HB LEU 44 -0.691 -4.546 -4.546 428 HG LEU 344 HG LEU 44 -0.193 -2.401 -2.401 429 1HD1 LEU 344 3HD1 LEU 44 0.116 -4.346 -4.346 430 2HD1 LEU 344 2HD1 LEU 44 1.797 -3.815 -3.815 431 3HD1 LEU 344 1HD1 LEU 44 0.520 -2.687 -2.687 432 1HD2 LEU 344 2HD2 LEU 44 2.189 -2.751 -2.751 433 2HD2 LEU 344 1HD2 LEU 44 1.757 -1.329 -1.329 434 3HD2 LEU 344 3HD2 LEU 44 2.713 -2.621 -2.621 435 H ASN 345 H ASN 45 0.872 -6.001 -6.001 436 HA ASN 345 HA ASN 45 -0.998 -8.000 -8.000 437 1HB ASN 345 2HB ASN 45 0.754 -6.867 -6.867 438 2HB ASN 345 1HB ASN 45 1.527 -8.440 -8.440 439 1HD2 ASN 345 2HD2 ASN 45 -0.742 -9.007 -9.007 440 2HD2 ASN 345 1HD2 ASN 45 0.779 -8.342 -8.342 441 H GLU 346 H GLU 46 2.281 -8.344 -8.344 442 HA GLU 346 HA GLU 46 2.320 -11.237 -11.237 443 1HB GLU 346 2HB GLU 46 4.044 -9.068 -9.068 444 2HB GLU 346 1HB GLU 46 4.046 -10.448 -10.448 445 1HG GLU 346 2HG GLU 46 4.186 -11.694 -11.694 446 2HG GLU 346 1HG GLU 46 5.114 -10.225 -10.225 447 H ALA 347 H ALA 47 1.712 -8.851 -8.851 448 HA ALA 347 HA ALA 47 1.172 -10.766 -10.766 449 1HB ALA 347 1HB ALA 47 1.507 -8.216 -8.216 450 2HB ALA 347 3HB ALA 47 -0.205 -8.086 -8.086 451 3HB ALA 347 2HB ALA 47 0.299 -8.964 -8.964 452 H LEU 348 H LEU 48 -0.951 -9.253 -9.253 453 HA LEU 348 HA LEU 48 -3.411 -10.301 -10.301 454 1HB LEU 348 2HB LEU 48 -2.591 -9.673 -9.673 455 2HB LEU 348 1HB LEU 48 -4.247 -9.956 -9.956 456 HG LEU 348 HG LEU 48 -2.498 -7.831 -7.831 457 1HD1 LEU 348 1HD1 LEU 48 -2.887 -7.591 -7.591 458 2HD1 LEU 348 3HD1 LEU 48 -4.576 -7.312 -7.312 459 3HD1 LEU 348 2HD1 LEU 48 -3.326 -6.224 -6.224 460 1HD2 LEU 348 3HD2 LEU 48 -5.035 -8.918 -8.918 461 2HD2 LEU 348 2HD2 LEU 48 -4.306 -7.471 -7.471 462 3HD2 LEU 348 1HD2 LEU 48 -5.347 -7.339 -7.339 463 H GLU 349 H GLU 49 -1.194 -11.553 -11.553 464 HA GLU 349 HA GLU 49 -2.599 -13.983 -13.983 465 1HB GLU 349 2HB GLU 49 -0.783 -13.219 -13.219 466 2HB GLU 349 1HB GLU 49 0.379 -13.422 -13.422 467 1HG GLU 349 2HG GLU 49 0.146 -15.780 -15.780 468 2HG GLU 349 1HG GLU 49 -1.342 -15.712 -15.712 469 H LEU 350 H LEU 50 -0.485 -12.955 -12.955 470 HA LEU 350 HA LEU 50 0.015 -15.616 -15.616 471 1HB LEU 350 2HB LEU 50 1.481 -14.498 -14.498 472 2HB LEU 350 1HB LEU 50 0.946 -13.004 -13.004 473 HG LEU 350 HG LEU 50 -0.916 -12.921 -12.921 474 1HD1 LEU 350 2HD1 LEU 50 0.324 -15.471 -15.471 475 2HD1 LEU 350 1HD1 LEU 50 0.280 -14.398 -14.398 476 3HD1 LEU 350 3HD1 LEU 50 -1.212 -14.804 -14.804 477 1HD2 LEU 350 3HD2 LEU 50 1.410 -11.755 -11.755 478 2HD2 LEU 350 2HD2 LEU 50 0.468 -11.825 -11.825 479 3HD2 LEU 350 1HD2 LEU 50 1.800 -12.952 -12.952 480 H LYS 351 H LYS 51 -2.448 -13.142 -13.142 481 HA LYS 351 HA LYS 51 -3.724 -14.227 -14.227 482 1HB LYS 351 2HB LYS 51 -4.265 -12.013 -12.013 483 2HB LYS 351 1HB LYS 51 -5.096 -12.905 -12.905 484 1HG LYS 351 2HG LYS 51 -6.604 -13.907 -13.907 485 2HG LYS 351 1HG LYS 51 -5.764 -13.043 -13.043 486 1HD LYS 351 2HD LYS 51 -6.505 -11.176 -11.176 487 2HD LYS 351 1HD LYS 51 -7.925 -12.107 -12.107 488 1HE LYS 351 2HE LYS 51 -7.127 -11.636 -11.636 489 2HE LYS 351 1HE LYS 51 -6.158 -10.359 -10.359 490 1HZ LYS 351 3HZ LYS 51 -8.439 -9.837 -9.837 491 2HZ LYS 351 2HZ LYS 51 -9.065 -10.597 -10.597 492 3HZ LYS 351 1HZ LYS 51 -8.073 -9.225 -9.225 493 H ASP 352 H ASP 52 -3.976 -15.020 -15.020 494 HA ASP 352 HA ASP 52 -6.111 -16.951 -16.951 495 1HB ASP 352 2HB ASP 52 -4.534 -15.869 -15.869 496 2HB ASP 352 1HB ASP 52 -4.575 -17.629 -17.629 497 H ALA 353 H ALA 53 -2.619 -17.002 -17.002 498 HA ALA 353 HA ALA 53 -2.654 -19.964 -19.964 499 1HB ALA 353 2HB ALA 53 -0.380 -17.990 -17.990 500 2HB ALA 353 1HB ALA 53 -0.151 -19.717 -19.717 501 3HB ALA 353 3HB ALA 53 -0.965 -19.158 -19.158 502 H GLN 354 H GLN 54 -3.873 -18.825 -18.825 503 HA GLN 354 HA GLN 54 -1.822 -18.379 -18.379 504 1HB GLN 354 2HB GLN 54 -4.769 -17.873 -17.873 505 2HB GLN 354 1HB GLN 54 -4.060 -18.056 -18.056 506 1HG GLN 354 2HG GLN 54 -2.266 -16.364 -16.364 507 2HG GLN 354 1HG GLN 54 -3.518 -15.956 -15.956 508 1HE2 GLN 354 2HE2 GLN 54 -3.981 -14.866 -14.866 509 2HE2 GLN 354 1HE2 GLN 54 -2.704 -15.886 -15.886 510 H ALA 355 HN ALA 55 -1.063 -20.568 -20.568 511 HA ALA 355 HA ALA 55 -3.046 -22.415 -22.415 512 1HB ALA 355 1HB ALA 55 -1.032 -22.877 -22.877 513 2HB ALA 355 3HB ALA 55 -1.229 -24.156 -24.156 514 3HB ALA 355 2HB ALA 55 -2.611 -23.625 -23.625 515 1H GLY 325 2H GLY 25 12.938 -0.382 -0.382 516 2H GLY 325 1H GLY 25 11.715 -1.526 -1.526 517 3H GLY 325 3H GLY 25 13.047 -1.430 -1.430 518 1HA GLY 325 2HA GLY 25 12.343 0.529 0.529 519 2HA GLY 325 1HA GLY 25 10.845 -0.377 -0.377 520 H GLU 326 H GLU 26 9.554 1.513 1.513 521 HA GLU 326 HA GLU 26 9.641 2.717 2.717 522 1HB GLU 326 2HB GLU 26 10.930 4.052 4.052 523 2HB GLU 326 1HB GLU 26 9.330 4.795 4.795 524 1HG GLU 326 2HG GLU 26 10.554 6.077 6.077 525 2HG GLU 326 1HG GLU 26 9.635 4.953 4.953 526 H TYR 327 H TYR 27 7.739 4.567 4.567 527 HA TYR 327 HA TYR 27 5.382 3.072 3.072 528 1HB TYR 327 2HB TYR 27 5.875 4.975 4.975 529 2HB TYR 327 1HB TYR 27 4.298 5.074 5.074 530 HD1 TYR 327 HD2 TYR 27 6.627 2.844 2.844 531 HD2 TYR 327 HD1 TYR 27 2.673 3.309 3.309 532 HE1 TYR 327 HE2 TYR 27 5.884 0.828 0.828 533 HE2 TYR 327 HE1 TYR 27 1.931 1.291 1.291 534 HH TYR 327 HH TYR 27 3.071 0.097 0.097 535 H PHE 328 H PHE 28 4.550 3.763 3.763 536 HA PHE 328 HA PHE 28 4.928 6.641 6.641 537 1HB PHE 328 2HB PHE 28 4.721 4.169 4.169 538 2HB PHE 328 1HB PHE 28 4.599 5.806 5.806 539 HD1 PHE 328 HD2 PHE 28 6.524 7.363 7.363 540 HD2 PHE 328 HD1 PHE 28 6.824 3.284 3.284 541 HE1 PHE 328 HE2 PHE 28 8.999 7.544 7.544 542 HE2 PHE 328 HE1 PHE 28 9.297 3.465 3.465 543 HZ PHE 328 HZ PHE 28 10.385 5.596 5.596 544 H THR 329 H THR 29 3.099 7.608 7.608 545 HA THR 329 HA THR 29 0.504 6.217 6.217 546 HB THR 329 HB THR 29 0.470 9.141 9.141 547 HG1 THR 329 HG1 THR 29 2.355 8.762 8.762 548 1HG2 THR 329 3HG2 THR 29 -1.275 7.144 7.144 549 2HG2 THR 329 2HG2 THR 29 -0.504 7.187 7.187 550 3HG2 THR 329 1HG2 THR 29 -1.286 8.633 8.633 551 H LEU 330 H LEU 30 -0.919 6.418 6.418 552 HA LEU 330 HA LEU 30 -0.133 8.274 8.274 553 1HB LEU 330 2HB LEU 30 -0.718 5.494 5.494 554 2HB LEU 330 1HB LEU 30 -2.064 6.307 6.307 555 HG LEU 330 HG LEU 30 0.052 7.657 7.657 556 1HD1 LEU 330 1HD1 LEU 30 1.234 5.469 5.469 557 2HD1 LEU 330 3HD1 LEU 30 1.136 4.986 4.986 558 3HD1 LEU 330 2HD1 LEU 30 1.973 6.473 6.473 559 1HD2 LEU 330 2HD2 LEU 30 -1.147 5.053 5.053 560 2HD2 LEU 330 1HD2 LEU 30 -1.844 6.658 6.658 561 3HD2 LEU 330 3HD2 LEU 30 -0.311 6.245 6.245 562 H GLN 331 H GLN 31 -1.321 10.068 10.068 563 HA GLN 331 HA GLN 31 -4.156 9.755 9.755 564 1HB GLN 331 2HB GLN 31 -2.271 12.104 12.104 565 2HB GLN 331 1HB GLN 31 -4.006 12.337 12.337 566 1HG GLN 331 2HG GLN 31 -3.016 10.285 10.285 567 2HG GLN 331 1HG GLN 31 -2.113 11.786 11.786 568 1HE2 GLN 331 2HE2 GLN 31 -4.944 13.626 13.626 569 2HE2 GLN 331 1HE2 GLN 31 -3.428 13.783 13.783 570 H ILE 332 H ILE 32 -5.487 9.333 9.333 571 HA ILE 332 HA ILE 32 -5.093 10.925 10.925 572 HB ILE 332 HB ILE 32 -6.535 8.282 8.282 573 1HG1 ILE 332 2HG1 ILE 32 -4.297 8.140 8.140 574 2HG1 ILE 332 1HG1 ILE 32 -3.753 8.905 8.905 575 1HG2 ILE 332 3HG2 ILE 32 -6.379 10.246 10.246 576 2HG2 ILE 332 2HG2 ILE 32 -5.970 8.604 8.604 577 3HG2 ILE 332 1HG2 ILE 32 -7.533 8.937 8.937 578 1HD1 ILE 332 1HD1 ILE 32 -5.399 6.367 6.367 579 2HD1 ILE 332 3HD1 ILE 32 -3.636 6.355 6.355 580 3HD1 ILE 332 2HD1 ILE 32 -4.494 7.059 7.059 581 H ARG 333 H ARG 33 -6.540 12.578 12.578 582 HA ARG 333 HA ARG 33 -8.999 12.543 12.543 583 1HB ARG 333 2HB ARG 33 -7.869 14.668 14.668 584 2HB ARG 333 1HB ARG 33 -7.890 14.534 14.534 585 1HG ARG 333 2HG ARG 33 -10.301 14.705 14.705 586 2HG ARG 333 1HG ARG 33 -10.393 14.610 14.610 587 1HD ARG 333 2HD ARG 33 -9.364 16.753 16.753 588 2HD ARG 333 1HD ARG 33 -8.890 16.809 16.809 589 HE ARG 333 HE ARG 33 -11.191 17.279 17.279 590 1HH1 ARG 333 1HH2 ARG 33 -12.887 15.849 15.849 591 2HH1 ARG 333 2HH2 ARG 33 -13.375 17.012 17.012 592 1HH2 ARG 333 2HH1 ARG 33 -10.828 19.241 19.241 593 2HH2 ARG 333 1HH1 ARG 33 -12.209 18.933 18.933 594 H GLY 334 H GLY 34 -10.369 10.964 10.964 595 1HA GLY 334 2HA GLY 34 -12.028 11.594 11.594 596 2HA GLY 334 1HA GLY 34 -10.804 10.461 10.461 597 H ARG 335 H ARG 35 -11.700 8.456 8.456 598 HA ARG 335 HA ARG 35 -12.498 7.087 7.087 599 1HB ARG 335 2HB ARG 35 -14.480 8.635 8.635 600 2HB ARG 335 1HB ARG 35 -14.832 7.827 7.827 601 1HG ARG 335 2HG ARG 35 -15.325 5.781 5.781 602 2HG ARG 335 1HG ARG 35 -14.468 6.224 6.224 603 1HD ARG 335 2HD ARG 35 -16.293 8.172 8.172 604 2HD ARG 335 1HD ARG 35 -17.208 6.996 6.996 605 HE ARG 335 HE ARG 35 -16.118 5.667 5.667 606 1HH1 ARG 335 2HH1 ARG 35 -17.291 8.537 8.537 607 2HH1 ARG 335 1HH1 ARG 35 -18.819 8.038 8.038 608 1HH2 ARG 335 1HH2 ARG 35 -18.582 4.805 4.805 609 2HH2 ARG 335 2HH2 ARG 35 -19.549 5.926 5.926 610 H GLU 336 H GLU 36 -13.410 7.250 7.250 611 HA GLU 336 HA GLU 36 -13.436 4.375 4.375 612 1HB GLU 336 2HB GLU 36 -13.648 4.821 4.821 613 2HB GLU 336 1HB GLU 36 -14.642 5.993 5.993 614 1HG GLU 336 2HG GLU 36 -12.706 7.603 7.603 615 2HG GLU 336 1HG GLU 36 -11.883 6.451 6.451 616 H ARG 337 H ARG 37 -11.061 6.914 6.914 617 HA ARG 337 HA ARG 37 -9.110 5.115 5.115 618 1HB ARG 337 2HB ARG 37 -9.234 7.938 7.938 619 2HB ARG 337 1HB ARG 37 -7.655 7.215 7.215 620 1HG ARG 337 2HG ARG 37 -7.655 6.325 6.325 621 2HG ARG 337 1HG ARG 37 -9.154 7.207 7.207 622 1HD ARG 337 2HD ARG 37 -6.760 8.658 8.658 623 2HD ARG 337 1HD ARG 37 -6.868 8.323 8.323 624 HE ARG 337 HE ARG 37 -8.875 9.714 9.714 625 1HH1 ARG 337 2HH1 ARG 37 -6.540 10.692 10.692 626 2HH1 ARG 337 1HH1 ARG 37 -7.562 11.643 11.643 627 1HH2 ARG 337 1HH2 ARG 37 -10.508 10.469 10.469 628 2HH2 ARG 337 2HH2 ARG 37 -9.810 11.517 11.517 629 H PHE 338 H PHE 38 -9.576 6.447 6.447 630 HA PHE 338 HA PHE 38 -7.303 5.224 5.224 631 1HB PHE 338 2HB PHE 38 -8.520 6.873 6.873 632 2HB PHE 338 1HB PHE 38 -10.016 5.948 5.948 633 HD1 PHE 338 HD2 PHE 38 -6.600 5.965 5.965 634 HD2 PHE 338 HD1 PHE 38 -10.494 4.152 4.152 635 HE1 PHE 338 HE2 PHE 38 -6.018 4.744 4.744 636 HE2 PHE 338 HE1 PHE 38 -9.911 2.928 2.928 637 HZ PHE 338 HZ PHE 38 -7.674 3.225 3.225 638 H GLU 339 H GLU 39 -10.488 3.969 3.969 639 HA GLU 339 HA GLU 39 -10.258 1.499 1.499 640 1HB GLU 339 2HB GLU 39 -11.942 2.462 2.462 641 2HB GLU 339 1HB GLU 39 -11.930 0.746 0.746 642 1HG GLU 339 2HG GLU 39 -12.175 2.105 2.105 643 2HG GLU 339 1HG GLU 39 -13.281 2.916 2.916 644 H MET 340 H MET 40 -9.472 2.453 2.453 645 HA MET 340 HA MET 40 -8.664 -0.017 -0.017 646 1HB MET 340 2HB MET 40 -7.826 2.817 2.817 647 2HB MET 340 1HB MET 40 -6.750 1.565 1.565 648 1HG MET 340 2HG MET 40 -8.335 0.756 0.756 649 2HG MET 340 1HG MET 40 -9.691 1.365 1.365 650 1HE MET 340 1HE MET 40 -6.410 2.650 2.650 651 2HE MET 340 3HE MET 40 -6.613 3.933 3.933 652 3HE MET 340 2HE MET 40 -6.871 4.271 4.271 653 H PHE 341 H PHE 41 -6.726 2.303 2.303 654 HA PHE 341 HA PHE 41 -4.399 0.633 0.633 655 1HB PHE 341 2HB PHE 41 -5.418 3.000 3.000 656 2HB PHE 341 1HB PHE 41 -3.965 2.146 2.146 657 HD1 PHE 341 HD2 PHE 41 -4.342 1.830 1.830 658 HD2 PHE 341 HD1 PHE 41 -3.061 4.597 4.597 659 HE1 PHE 341 HE2 PHE 41 -3.014 3.062 3.062 660 HE2 PHE 341 HE1 PHE 41 -1.736 5.831 5.831 661 HZ PHE 341 HZ PHE 41 -1.711 5.064 5.064 662 H ARG 342 H ARG 42 -7.359 0.874 0.874 663 HA ARG 342 HA ARG 42 -6.509 -0.626 -0.626 664 1HB ARG 342 2HB ARG 42 -9.141 -0.020 -0.020 665 2HB ARG 342 1HB ARG 42 -9.085 -1.325 -1.325 666 1HG ARG 342 2HG ARG 42 -7.584 0.759 0.759 667 2HG ARG 342 1HG ARG 42 -9.001 1.541 1.541 668 1HD ARG 342 2HD ARG 42 -10.114 0.883 0.883 669 2HD ARG 342 1HD ARG 42 -10.048 -0.745 -0.745 670 HE ARG 342 HE ARG 42 -7.937 -1.064 -1.064 671 1HH1 ARG 342 2HH1 ARG 42 -10.658 0.326 0.326 672 2HH1 ARG 342 1HH1 ARG 42 -9.884 1.017 1.017 673 1HH2 ARG 342 1HH2 ARG 42 -6.673 0.347 0.347 674 2HH2 ARG 342 2HH2 ARG 42 -7.627 1.030 1.030 675 H GLU 343 H GLU 43 -7.352 -1.542 -1.542 676 HA GLU 343 HA GLU 43 -7.660 -4.382 -4.382 677 1HB GLU 343 2HB GLU 43 -8.588 -3.052 -3.052 678 2HB GLU 343 1HB GLU 43 -6.977 -3.296 -3.296 679 1HG GLU 343 2HG GLU 43 -7.475 -5.423 -5.423 680 2HG GLU 343 1HG GLU 43 -7.923 -5.767 -5.767 681 H LEU 344 H LEU 44 -5.192 -2.630 -2.630 682 HA LEU 344 HA LEU 44 -3.301 -4.715 -4.715 683 1HB LEU 344 2HB LEU 44 -2.938 -1.707 -1.707 684 2HB LEU 344 1HB LEU 44 -1.572 -2.803 -2.803 685 HG LEU 344 HG LEU 44 -2.052 -2.355 -2.355 686 1HD1 LEU 344 3HD1 LEU 44 -2.389 -4.864 -4.864 687 2HD1 LEU 344 2HD1 LEU 44 -4.075 -4.556 -4.556 688 3HD1 LEU 344 1HD1 LEU 44 -2.819 -4.349 -4.349 689 1HD2 LEU 344 2HD2 LEU 44 -4.434 -1.365 -1.365 690 2HD2 LEU 344 1HD2 LEU 44 -3.978 -1.388 -1.388 691 3HD2 LEU 344 3HD2 LEU 44 -4.960 -2.692 -2.692 692 H ASN 345 H ASN 45 -3.132 -1.927 -1.927 693 HA ASN 345 HA ASN 45 -1.228 -2.793 -2.793 694 1HB ASN 345 2HB ASN 45 -2.946 -0.731 -0.731 695 2HB ASN 345 1HB ASN 45 -3.733 -1.740 -1.740 696 1HD2 ASN 345 2HD2 ASN 45 -1.397 0.184 0.184 697 2HD2 ASN 345 1HD2 ASN 45 -2.922 0.338 0.338 698 H GLU 346 H GLU 46 -4.486 -4.053 -4.053 699 HA GLU 346 HA GLU 46 -4.479 -5.578 -5.578 700 1HB GLU 346 2HB GLU 46 -6.247 -5.203 -5.203 701 2HB GLU 346 1HB GLU 46 -6.226 -6.873 -6.873 702 1HG GLU 346 2HG GLU 46 -6.338 -5.499 -5.499 703 2HG GLU 346 1HG GLU 46 -7.288 -4.453 -4.453 704 H ALA 347 H ALA 47 -3.909 -6.462 -6.462 705 HA ALA 347 HA ALA 47 -3.354 -9.210 -9.210 706 1HB ALA 347 1HB ALA 47 -3.794 -8.059 -8.059 707 2HB ALA 347 3HB ALA 47 -2.084 -7.627 -7.627 708 3HB ALA 347 2HB ALA 47 -2.565 -9.323 -9.323 709 H LEU 348 H LEU 48 -1.288 -6.337 -6.337 710 HA LEU 348 HA LEU 48 1.209 -7.732 -7.732 711 1HB LEU 348 2HB LEU 48 0.378 -4.993 -4.993 712 2HB LEU 348 1HB LEU 48 2.038 -5.586 -5.586 713 HG LEU 348 HG LEU 48 0.269 -5.505 -5.505 714 1HD1 LEU 348 1HD1 LEU 48 0.665 -3.226 -3.226 715 2HD1 LEU 348 3HD1 LEU 48 2.348 -3.425 -3.425 716 3HD1 LEU 348 2HD1 LEU 48 1.078 -3.351 -3.351 717 1HD2 LEU 348 3HD2 LEU 48 2.824 -6.574 -6.574 718 2HD2 LEU 348 2HD2 LEU 48 2.072 -6.413 -6.413 719 3HD2 LEU 348 1HD2 LEU 48 3.108 -5.127 -5.127 720 H GLU 349 H GLU 49 -0.991 -6.312 -6.312 721 HA GLU 349 HA GLU 49 0.450 -7.201 -7.201 722 1HB GLU 349 2HB GLU 49 -1.384 -5.574 -5.574 723 2HB GLU 349 1HB GLU 49 -2.541 -6.799 -6.799 724 1HG GLU 349 2HG GLU 49 -2.274 -8.063 -8.063 725 2HG GLU 349 1HG GLU 49 -0.788 -7.215 -7.215 726 H LEU 350 H LEU 50 -1.678 -8.853 -8.853 727 HA LEU 350 HA LEU 50 -2.134 -11.161 -11.161 728 1HB LEU 350 2HB LEU 50 -3.610 -11.663 -11.663 729 2HB LEU 350 1HB LEU 50 -3.089 -10.216 -10.216 730 HG LEU 350 HG LEU 50 -1.223 -11.621 -11.621 731 1HD1 LEU 350 2HD1 LEU 50 -2.456 -13.552 -13.552 732 2HD1 LEU 350 1HD1 LEU 50 -2.409 -14.154 -14.154 733 3HD1 LEU 350 3HD1 LEU 50 -0.919 -13.653 -13.653 734 1HD2 LEU 350 3HD2 LEU 50 -3.553 -11.064 -11.064 735 2HD2 LEU 350 2HD2 LEU 50 -2.610 -12.356 -12.356 736 3HD2 LEU 350 1HD2 LEU 50 -3.938 -12.749 -12.749 737 H LYS 351 H LYS 51 0.301 -10.206 -10.206 738 HA LYS 351 HA LYS 51 1.602 -12.714 -12.714 739 1HB LYS 351 2HB LYS 51 2.108 -10.599 -10.599 740 2HB LYS 351 1HB LYS 51 2.950 -9.999 -9.999 741 1HG LYS 351 2HG LYS 51 4.474 -11.931 -11.931 742 2HG LYS 351 1HG LYS 51 3.623 -12.557 -12.557 743 1HD LYS 351 2HD LYS 51 4.333 -9.810 -9.810 744 2HD LYS 351 1HD LYS 51 5.768 -10.699 -10.699 745 1HE LYS 351 2HE LYS 51 4.971 -12.508 -12.508 746 2HE LYS 351 1HE LYS 51 3.982 -11.213 -11.213 747 1HZ LYS 351 3HZ LYS 51 6.253 -9.930 -9.930 748 2HZ LYS 351 2HZ LYS 51 6.892 -11.501 -11.501 749 3HZ LYS 351 1HZ LYS 51 5.881 -10.907 -10.907 750 H ASP 352 H ASP 52 1.834 -10.246 -10.246 751 HA ASP 352 HA ASP 52 4.003 -11.546 -11.546 752 1HB ASP 352 2HB ASP 52 2.412 -9.148 -9.148 753 2HB ASP 352 1HB ASP 52 2.475 -9.993 -9.993 754 H ALA 353 H ALA 53 0.516 -11.803 -11.803 755 HA ALA 353 HA ALA 53 0.589 -13.651 -13.651 756 1HB ALA 353 2HB ALA 53 -1.709 -12.306 -12.306 757 2HB ALA 353 1HB ALA 53 -1.919 -13.470 -13.470 758 3HB ALA 353 3HB ALA 53 -1.114 -11.932 -11.932 759 H GLN 354 H GLN 54 1.802 -14.809 -14.809 760 HA GLN 354 HA GLN 54 -0.243 -16.365 -16.365 761 1HB GLN 354 2HB GLN 54 2.696 -15.864 -15.864 762 2HB GLN 354 1HB GLN 54 2.002 -17.327 -17.327 763 1HG GLN 354 2HG GLN 54 0.182 -15.682 -15.682 764 2HG GLN 354 1HG GLN 54 1.422 -14.456 -14.456 765 1HE2 GLN 354 2HE2 GLN 54 1.887 -17.171 -17.171 766 2HE2 GLN 354 1HE2 GLN 54 0.618 -17.338 -17.338 767 H ALA 355 HN ALA 55 -0.978 -17.695 -17.695 768 HA ALA 355 HA ALA 55 1.034 -19.737 -19.737 769 1HB ALA 355 1HB ALA 55 -0.978 -18.193 -18.193 770 2HB ALA 355 3HB ALA 55 -0.767 -19.890 -19.890 771 3HB ALA 355 2HB ALA 55 0.609 -18.789 -18.789 772 1H GLY 325 2H GLY 25 -16.860 13.752 13.752 773 2H GLY 325 1H GLY 25 -15.556 14.185 14.185 774 3H GLY 325 3H GLY 25 -16.784 13.181 13.181 775 1HA GLY 325 2HA GLY 25 -16.096 11.350 11.350 776 2HA GLY 325 1HA GLY 25 -14.580 12.109 12.109 777 H GLU 326 H GLU 26 -13.430 11.330 11.330 778 HA GLU 326 HA GLU 26 -13.848 12.940 12.940 779 1HB GLU 326 2HB GLU 26 -15.001 10.426 10.426 780 2HB GLU 326 1HB GLU 26 -13.454 10.118 10.118 781 1HG GLU 326 2HG GLU 26 -14.898 10.682 10.682 782 2HG GLU 326 1HG GLU 26 -14.016 12.176 12.176 783 H TYR 327 H TYR 27 -12.054 11.959 11.959 784 HA TYR 327 HA TYR 27 -9.524 12.027 12.027 785 1HB TYR 327 2HB TYR 27 -10.348 12.857 12.857 786 2HB TYR 327 1HB TYR 27 -8.707 12.234 12.234 787 HD1 TYR 327 HD2 TYR 27 -11.081 14.841 14.841 788 HD2 TYR 327 HD1 TYR 27 -7.018 13.450 13.450 789 HE1 TYR 327 HE2 TYR 27 -10.357 17.007 17.007 790 HE2 TYR 327 HE1 TYR 27 -6.293 15.617 15.617 791 HH TYR 327 HH TYR 27 -7.603 18.227 18.227 792 H PHE 328 H PHE 28 -8.554 10.094 10.094 793 HA PHE 328 HA PHE 28 -9.006 7.916 7.916 794 1HB PHE 328 2HB PHE 28 -8.490 7.800 7.800 795 2HB PHE 328 1HB PHE 28 -8.403 6.384 6.384 796 HD1 PHE 328 HD2 PHE 28 -10.417 5.553 5.553 797 HD2 PHE 328 HD1 PHE 28 -10.610 8.843 8.843 798 HE1 PHE 328 HE2 PHE 28 -12.885 5.328 5.328 799 HE2 PHE 328 HE1 PHE 28 -13.076 8.616 8.616 800 HZ PHE 328 HZ PHE 28 -14.215 6.858 6.858 801 H THR 329 H THR 29 -7.119 6.468 6.468 802 HA THR 329 HA THR 29 -4.513 7.765 7.765 803 HB THR 329 HB THR 29 -4.677 6.519 6.519 804 HG1 THR 329 HG1 THR 29 -6.637 7.533 7.533 805 1HG2 THR 329 3HG2 THR 29 -2.880 8.059 8.059 806 2HG2 THR 329 2HG2 THR 29 -3.807 9.323 9.323 807 3HG2 THR 329 1HG2 THR 29 -3.041 8.047 8.047 808 H LEU 330 H LEU 30 -2.943 6.317 6.317 809 HA LEU 330 HA LEU 30 -3.608 3.418 3.418 810 1HB LEU 330 2HB LEU 30 -2.869 4.925 4.925 811 2HB LEU 330 1HB LEU 30 -1.498 3.887 3.887 812 HG LEU 330 HG LEU 30 -3.571 2.150 2.150 813 1HD1 LEU 330 1HD1 LEU 30 -4.744 4.340 4.340 814 2HD1 LEU 330 3HD1 LEU 30 -4.456 3.178 3.178 815 3HD1 LEU 330 2HD1 LEU 30 -5.416 2.713 2.713 816 1HD2 LEU 330 2HD2 LEU 30 -2.135 2.774 2.774 817 2HD2 LEU 330 1HD2 LEU 30 -1.508 1.761 1.761 818 3HD2 LEU 330 3HD2 LEU 30 -2.930 1.248 1.248 819 H GLN 331 H GLN 31 -2.611 3.225 3.225 820 HA GLN 331 HA GLN 31 0.158 4.101 4.101 821 1HB GLN 331 2HB GLN 31 -1.825 2.586 2.586 822 2HB GLN 331 1HB GLN 31 -0.137 2.744 2.744 823 1HG GLN 331 2HG GLN 31 -1.186 5.301 5.301 824 2HG GLN 331 1HG GLN 31 -2.188 4.623 4.623 825 1HE2 GLN 331 2HE2 GLN 31 0.401 4.789 4.789 826 2HE2 GLN 331 1HE2 GLN 31 -1.040 3.996 3.996 827 H ILE 332 H ILE 32 1.674 2.970 2.970 828 HA ILE 332 HA ILE 32 1.442 -0.012 -0.012 829 HB ILE 332 HB ILE 32 2.985 1.812 1.812 830 1HG1 ILE 332 2HG1 ILE 32 0.949 0.275 0.275 831 2HG1 ILE 332 1HG1 ILE 32 0.216 1.092 1.092 832 1HG2 ILE 332 3HG2 ILE 32 2.945 -1.091 -1.091 833 2HG2 ILE 332 2HG2 ILE 32 2.681 -0.645 -0.645 834 3HG2 ILE 332 1HG2 ILE 32 4.137 -0.107 -0.107 835 1HD1 ILE 332 1HD1 ILE 32 2.000 2.527 2.527 836 2HD1 ILE 332 3HD1 ILE 32 0.252 2.421 2.421 837 3HD1 ILE 332 2HD1 ILE 32 0.927 3.240 3.240 838 H ARG 333 H ARG 33 2.803 -0.945 -0.945 839 HA ARG 333 HA ARG 33 5.083 0.555 0.555 840 1HB ARG 333 2HB ARG 33 3.873 -0.847 -0.847 841 2HB ARG 333 1HB ARG 33 4.073 -2.256 -2.256 842 1HG ARG 333 2HG ARG 33 6.464 -2.263 -2.263 843 2HG ARG 333 1HG ARG 33 6.390 -0.727 -0.727 844 1HD ARG 333 2HD ARG 33 5.223 -1.713 -1.713 845 2HD ARG 333 1HD ARG 33 4.916 -3.197 -3.197 846 HE ARG 333 HE ARG 33 7.234 -3.818 -3.818 847 1HH1 ARG 333 1HH2 ARG 33 8.824 -1.459 -1.459 848 2HH1 ARG 333 2HH2 ARG 33 9.123 -1.067 -1.067 849 1HH2 ARG 333 1HH1 ARG 33 7.829 -1.961 -1.961 850 2HH2 ARG 333 2HH1 ARG 33 6.538 -3.039 -3.039 851 H GLY 334 H GLY 34 6.624 0.780 0.780 852 1HA GLY 334 2HA GLY 34 8.457 -1.323 -1.323 853 2HA GLY 334 1HA GLY 34 7.365 -1.269 -1.269 854 H ARG 335 H ARG 35 8.372 -0.187 -0.187 855 HA ARG 335 HA ARG 35 9.004 2.586 2.586 856 1HB ARG 335 2HB ARG 35 10.909 1.647 1.647 857 2HB ARG 335 1HB ARG 35 11.461 0.811 0.811 858 1HG ARG 335 2HG ARG 35 11.957 2.820 2.820 859 2HG ARG 335 1HG ARG 35 10.934 3.777 3.777 860 1HD ARG 335 2HD ARG 35 12.637 2.861 2.861 861 2HD ARG 335 1HD ARG 35 13.706 2.751 2.751 862 HE ARG 335 HE ARG 35 12.461 5.315 5.315 863 1HH1 ARG 335 2HH1 ARG 35 13.402 4.447 4.447 864 2HH1 ARG 335 1HH1 ARG 35 14.881 5.347 5.347 865 1HH2 ARG 335 1HH2 ARG 35 14.944 6.035 6.035 866 2HH2 ARG 335 2HH2 ARG 35 15.754 6.245 6.245 867 H GLU 336 H GLU 36 10.250 -0.364 -0.364 868 HA GLU 336 HA GLU 36 10.472 0.926 0.926 869 1HB GLU 336 2HB GLU 36 10.896 -1.300 -1.300 870 2HB GLU 336 1HB GLU 36 11.724 -1.148 -1.148 871 1HG GLU 336 2HG GLU 36 9.720 -2.212 -2.212 872 2HG GLU 336 1HG GLU 36 9.073 -2.519 -2.519 873 H ARG 337 H ARG 37 8.047 -1.255 -1.255 874 HA ARG 337 HA ARG 37 6.320 -1.309 -1.309 875 1HB ARG 337 2HB ARG 37 6.213 -2.174 -2.174 876 2HB ARG 337 1HB ARG 37 4.651 -1.606 -1.606 877 1HG ARG 337 2HG ARG 37 4.934 -3.093 -3.093 878 2HG ARG 337 1HG ARG 37 6.400 -3.738 -3.738 879 1HD ARG 337 2HD ARG 37 3.831 -3.721 -3.721 880 2HD ARG 337 1HD ARG 37 4.125 -4.989 -4.989 881 HE ARG 337 HE ARG 37 6.053 -5.704 -5.704 882 1HH1 ARG 337 2HH1 ARG 37 3.463 -4.599 -4.599 883 2HH1 ARG 337 1HH1 ARG 37 4.320 -4.199 -4.199 884 1HH2 ARG 337 1HH2 ARG 37 7.456 -4.582 -4.582 885 2HH2 ARG 337 2HH2 ARG 37 6.582 -4.188 -4.188 886 H PHE 338 H PHE 38 6.381 0.761 0.761 887 HA PHE 338 HA PHE 38 4.066 2.295 2.295 888 1HB PHE 338 2HB PHE 38 5.054 2.537 2.537 889 2HB PHE 338 1HB PHE 38 6.603 3.018 3.018 890 HD1 PHE 338 HD2 PHE 38 3.059 4.057 4.057 891 HD2 PHE 338 HD1 PHE 38 7.027 5.272 5.272 892 HE1 PHE 338 HE2 PHE 38 2.338 6.431 6.431 893 HE2 PHE 338 HE1 PHE 38 6.305 7.644 7.644 894 HZ PHE 338 HZ PHE 38 3.962 8.225 8.225 895 H GLU 339 H GLU 39 7.381 2.448 2.448 896 HA GLU 339 HA GLU 39 7.144 5.000 5.000 897 1HB GLU 339 2HB GLU 39 8.993 2.640 2.640 898 2HB GLU 339 1HB GLU 39 9.038 3.905 3.905 899 1HG GLU 339 2HG GLU 39 8.956 5.251 5.251 900 2HG GLU 339 1HG GLU 39 10.123 3.945 3.945 901 H MET 340 H MET 40 6.637 1.632 1.632 902 HA MET 340 HA MET 40 6.077 2.032 2.032 903 1HB MET 340 2HB MET 40 5.133 0.110 0.110 904 2HB MET 340 1HB MET 40 4.195 0.197 0.197 905 1HG MET 340 2HG MET 40 5.971 -0.531 -0.531 906 2HG MET 340 1HG MET 40 7.185 0.003 0.003 907 1HE MET 340 1HE MET 40 3.939 -1.650 -1.650 908 2HE MET 340 3HE MET 40 4.191 -3.332 -3.332 909 3HE MET 340 2HE MET 40 4.251 -2.045 -2.045 910 H PHE 341 H PHE 41 3.836 2.265 2.265 911 HA PHE 341 HA PHE 41 1.602 3.181 3.181 912 1HB PHE 341 2HB PHE 41 2.321 3.282 3.282 913 2HB PHE 341 1HB PHE 41 0.873 4.090 4.090 914 HD1 PHE 341 HD2 PHE 41 1.628 1.325 1.325 915 HD2 PHE 341 HD1 PHE 41 -0.113 2.321 2.321 916 HE1 PHE 341 HE2 PHE 41 0.415 -0.833 -0.833 917 HE2 PHE 341 HE1 PHE 41 -1.327 0.158 0.158 918 HZ PHE 341 HZ PHE 41 -1.063 -1.420 -1.420 919 H ARG 342 H ARG 42 4.348 4.791 4.791 920 HA ARG 342 HA ARG 42 3.354 7.465 7.465 921 1HB ARG 342 2HB ARG 42 6.066 6.203 6.203 922 2HB ARG 342 1HB ARG 42 5.962 7.899 7.899 923 1HG ARG 342 2HG ARG 42 4.242 7.654 7.654 924 2HG ARG 342 1HG ARG 42 5.676 6.720 6.720 925 1HD ARG 342 2HD ARG 42 6.635 8.694 8.694 926 2HD ARG 342 1HD ARG 42 6.722 9.001 9.001 927 HE ARG 342 HE ARG 42 4.514 10.175 10.175 928 1HH1 ARG 342 2HH1 ARG 42 7.008 10.664 10.664 929 2HH1 ARG 342 1HH1 ARG 42 6.062 11.411 11.411 930 1HH2 ARG 342 1HH2 ARG 42 3.023 10.650 10.650 931 2HH2 ARG 342 2HH2 ARG 42 3.805 11.403 11.403 932 H GLU 343 H GLU 43 4.565 5.265 5.265 933 HA GLU 343 HA GLU 43 4.979 7.317 7.317 934 1HB GLU 343 2HB GLU 43 6.038 4.940 4.940 935 2HB GLU 343 1HB GLU 43 4.519 4.398 4.398 936 1HG GLU 343 2HG GLU 43 5.172 5.113 5.113 937 2HG GLU 343 1HG GLU 43 5.464 6.733 6.733 938 H LEU 344 H LEU 44 2.617 4.608 4.608 939 HA LEU 344 HA LEU 44 0.871 5.577 5.577 940 1HB LEU 344 2HB LEU 44 0.333 3.978 3.978 941 2HB LEU 344 1HB LEU 44 -0.948 4.373 4.373 942 HG LEU 344 HG LEU 44 -0.280 2.283 2.283 943 1HD1 LEU 344 3HD1 LEU 44 0.120 4.246 4.246 944 2HD1 LEU 344 2HD1 LEU 44 1.819 3.816 3.816 945 3HD1 LEU 344 1HD1 LEU 44 0.671 2.620 2.620 946 1HD2 LEU 344 2HD2 LEU 44 1.932 2.695 2.695 947 2HD2 LEU 344 1HD2 LEU 44 1.649 1.274 1.274 948 3HD2 LEU 344 3HD2 LEU 44 2.630 2.606 2.606 949 H ASN 345 H ASN 45 0.325 5.926 5.926 950 HA ASN 345 HA ASN 45 -1.703 7.788 7.788 951 1HB ASN 345 2HB ASN 45 -0.113 6.781 6.781 952 2HB ASN 345 1HB ASN 45 0.604 8.388 8.388 953 1HD2 ASN 345 2HD2 ASN 45 -2.025 8.929 8.929 954 2HD2 ASN 345 1HD2 ASN 45 -0.446 8.315 8.315 955 H GLU 346 H GLU 46 1.640 8.349 8.349 956 HA GLU 346 HA GLU 46 1.476 11.241 11.241 957 1HB GLU 346 2HB GLU 46 3.432 9.198 9.198 958 2HB GLU 346 1HB GLU 46 3.447 10.580 10.580 959 1HG GLU 346 2HG GLU 46 3.257 11.825 11.825 960 2HG GLU 346 1HG GLU 46 4.247 10.422 10.422 961 H ALA 347 H ALA 47 1.290 8.814 8.814 962 HA ALA 347 HA ALA 47 0.831 10.690 10.690 963 1HB ALA 347 1HB ALA 47 1.361 8.177 8.177 964 2HB ALA 347 3HB ALA 47 -0.367 7.921 7.921 965 3HB ALA 347 2HB ALA 47 0.204 8.836 8.836 966 H LEU 348 H LEU 48 -1.407 9.053 9.053 967 HA LEU 348 HA LEU 48 -3.826 9.931 9.931 968 1HB LEU 348 2HB LEU 48 -3.244 9.353 9.353 969 2HB LEU 348 1HB LEU 48 -4.856 9.524 9.524 970 HG LEU 348 HG LEU 48 -2.851 7.527 7.527 971 1HD1 LEU 348 1HD1 LEU 48 -3.478 7.254 7.254 972 2HD1 LEU 348 3HD1 LEU 48 -5.092 6.858 6.858 973 3HD1 LEU 348 2HD1 LEU 48 -3.713 5.862 5.862 974 1HD2 LEU 348 3HD2 LEU 48 -5.393 8.444 8.444 975 2HD2 LEU 348 2HD2 LEU 48 -4.491 7.070 7.070 976 3HD2 LEU 348 1HD2 LEU 48 -5.652 6.833 6.833 977 H GLU 349 H GLU 49 -1.943 11.329 11.329 978 HA GLU 349 HA GLU 49 -3.551 13.658 13.658 979 1HB GLU 349 2HB GLU 49 -1.835 13.018 13.018 980 2HB GLU 349 1HB GLU 49 -0.568 13.302 13.302 981 1HG GLU 349 2HG GLU 49 -0.960 15.640 15.640 982 2HG GLU 349 1HG GLU 49 -2.527 15.468 15.468 983 H LEU 350 H LEU 50 -1.127 12.788 12.788 984 HA LEU 350 HA LEU 50 -0.704 15.478 15.478 985 1HB LEU 350 2HB LEU 50 0.940 14.455 14.455 986 2HB LEU 350 1HB LEU 50 0.443 12.934 12.934 987 HG LEU 350 HG LEU 50 -1.257 12.713 12.713 988 1HD1 LEU 350 2HD1 LEU 50 -0.132 15.335 15.335 989 2HD1 LEU 350 1HD1 LEU 50 0.047 14.253 14.253 990 3HD1 LEU 350 3HD1 LEU 50 -1.551 14.557 14.557 991 1HD2 LEU 350 3HD2 LEU 50 1.135 11.692 11.692 992 2HD2 LEU 350 2HD2 LEU 50 0.324 11.700 11.700 993 3HD2 LEU 350 1HD2 LEU 50 1.558 12.906 12.906 994 H LYS 351 H LYS 51 -2.943 12.848 12.848 995 HA LYS 351 HA LYS 51 -4.066 13.852 13.852 996 1HB LYS 351 2HB LYS 51 -4.556 11.601 11.601 997 2HB LYS 351 1HB LYS 51 -5.570 12.433 12.433 998 1HG LYS 351 2HG LYS 51 -6.970 13.329 13.329 999 2HG LYS 351 1HG LYS 51 -5.950 12.526 12.526 1000 1HD LYS 351 2HD LYS 51 -6.763 10.610 10.610 1001 2HD LYS 351 1HD LYS 51 -8.189 11.442 11.442 1002 1HE LYS 351 2HE LYS 51 -7.126 11.030 11.030 1003 2HE LYS 351 1HE LYS 51 -6.147 9.820 9.820 1004 1HZ LYS 351 3HZ LYS 51 -8.492 9.140 9.140 1005 2HZ LYS 351 2HZ LYS 51 -9.027 9.858 9.858 1006 3HZ LYS 351 1HZ LYS 51 -7.933 8.558 8.558 1007 H ASP 352 H ASP 52 -4.699 14.619 14.619 1008 HA ASP 352 HA ASP 52 -6.921 16.399 16.399 1009 1HB ASP 352 2HB ASP 52 -5.490 15.423 15.423 1010 2HB ASP 352 1HB ASP 52 -5.667 17.175 17.175 1011 H ALA 353 H ALA 53 -3.439 16.688 16.688 1012 HA ALA 353 HA ALA 53 -3.641 19.642 19.642 1013 1HB ALA 353 2HB ALA 53 -1.292 17.819 17.819 1014 2HB ALA 353 1HB ALA 53 -1.143 19.556 19.556 1015 3HB ALA 353 3HB ALA 53 -2.063 18.949 18.949 1016 H GLN 354 H GLN 54 -4.567 18.429 18.429 1017 HA GLN 354 HA GLN 54 -2.288 18.137 18.137 1018 1HB GLN 354 2HB GLN 54 -5.182 17.382 17.382 1019 2HB GLN 354 1HB GLN 54 -4.384 17.682 17.682 1020 1HG GLN 354 2HG GLN 54 -2.508 16.134 16.134 1021 2HG GLN 354 1HG GLN 54 -3.747 15.595 15.595 1022 1HE2 GLN 354 2HE2 GLN 54 -3.877 14.385 14.385 1023 2HE2 GLN 354 1HE2 GLN 54 -2.680 15.456 15.456 1024 H ALA 355 HN ALA 55 -1.667 20.362 20.362 1025 HA ALA 355 HA ALA 55 -3.641 22.072 22.072 1026 1HB ALA 355 1HB ALA 55 -1.880 22.667 22.667 1027 2HB ALA 355 3HB ALA 55 -2.053 23.931 23.931 1028 3HB ALA 355 2HB ALA 55 -3.478 23.301 23.301 Start of MODEL 15 1 1H GLY 325 2H GLY 25 12.822 2.303 2.303 2 2H GLY 325 1H GLY 25 12.271 2.880 2.880 3 3H GLY 325 3H GLY 25 13.935 2.737 2.737 4 1HA GLY 325 2HA GLY 25 13.959 0.653 0.653 5 2HA GLY 325 1HA GLY 25 12.267 0.855 0.855 6 H GLU 326 H GLU 26 10.840 -0.457 -0.457 7 HA GLU 326 HA GLU 26 11.156 -1.169 -1.169 8 1HB GLU 326 2HB GLU 26 11.827 -3.108 -3.108 9 2HB GLU 326 1HB GLU 26 11.032 -3.709 -3.709 10 1HG GLU 326 2HG GLU 26 12.992 -2.051 -2.051 11 2HG GLU 326 1HG GLU 26 13.791 -2.783 -2.783 12 H TYR 327 H TYR 27 9.437 -3.273 -3.273 13 HA TYR 327 HA TYR 27 6.931 -2.110 -2.110 14 1HB TYR 327 2HB TYR 27 7.644 -3.564 -3.564 15 2HB TYR 327 1HB TYR 27 6.065 -3.937 -3.937 16 HD1 TYR 327 HD2 TYR 27 8.208 -1.256 -1.256 17 HD2 TYR 327 HD1 TYR 27 4.297 -2.291 -2.291 18 HE1 TYR 327 HE2 TYR 27 7.311 0.870 0.870 19 HE2 TYR 327 HE1 TYR 27 3.400 -0.166 -0.166 20 HH TYR 327 HH TYR 27 5.044 1.727 1.727 21 H PHE 328 H PHE 28 6.417 -3.132 -3.132 22 HA PHE 328 HA PHE 28 6.911 -6.071 -6.071 23 1HB PHE 328 2HB PHE 28 6.556 -3.874 -3.874 24 2HB PHE 328 1HB PHE 28 6.222 -5.545 -5.545 25 HD1 PHE 328 HD2 PHE 28 8.043 -7.304 -7.304 26 HD2 PHE 328 HD1 PHE 28 8.777 -3.074 -3.074 27 HE1 PHE 328 HE2 PHE 28 10.474 -7.718 -7.718 28 HE2 PHE 328 HE1 PHE 28 11.208 -3.489 -3.489 29 HZ PHE 328 HZ PHE 28 12.057 -5.810 -5.810 30 H THR 329 H THR 29 5.122 -7.351 -7.351 31 HA THR 329 HA THR 29 2.422 -6.199 -6.199 32 HB THR 329 HB THR 29 2.748 -9.123 -9.123 33 HG1 THR 329 HG1 THR 29 4.641 -8.561 -8.561 34 1HG2 THR 329 1HG2 THR 29 0.806 -7.391 -7.391 35 2HG2 THR 329 3HG2 THR 29 1.670 -7.390 -7.390 36 3HG2 THR 329 2HG2 THR 29 1.038 -8.901 -8.901 37 H LEU 330 H LEU 30 0.882 -6.540 -6.540 38 HA LEU 330 HA LEU 30 1.650 -8.261 -8.261 39 1HB LEU 330 2HB LEU 30 1.172 -5.545 -5.545 40 2HB LEU 330 1HB LEU 30 -0.383 -6.230 -6.230 41 HG LEU 330 HG LEU 30 1.438 -7.738 -7.738 42 1HD1 LEU 330 1HD1 LEU 30 2.847 -5.499 -5.499 43 2HD1 LEU 330 3HD1 LEU 30 2.226 -5.026 -5.026 44 3HD1 LEU 330 2HD1 LEU 30 3.214 -6.479 -6.479 45 1HD2 LEU 330 3HD2 LEU 30 -0.060 -5.228 -5.228 46 2HD2 LEU 330 2HD2 LEU 30 -0.734 -6.857 -6.857 47 3HD2 LEU 330 1HD2 LEU 30 0.545 -6.460 -6.460 48 H GLN 331 H GLN 31 0.566 -10.134 -10.134 49 HA GLN 331 HA GLN 31 -2.209 -9.894 -9.894 50 1HB GLN 331 2HB GLN 31 -0.552 -12.375 -12.375 51 2HB GLN 331 1HB GLN 31 -2.093 -12.323 -12.323 52 1HG GLN 331 2HG GLN 31 -1.099 -10.919 -10.919 53 2HG GLN 331 1HG GLN 31 0.445 -10.937 -10.937 54 1HE2 GLN 331 2HE2 GLN 31 -0.679 -14.178 -14.178 55 2HE2 GLN 331 1HE2 GLN 31 -1.730 -12.860 -12.860 56 H ILE 332 H ILE 32 -3.685 -9.517 -9.517 57 HA ILE 332 HA ILE 32 -3.295 -10.821 -10.821 58 HB ILE 332 HB ILE 32 -5.050 -8.526 -8.526 59 1HG1 ILE 332 2HG1 ILE 32 -3.251 -8.197 -8.197 60 2HG1 ILE 332 1HG1 ILE 32 -2.397 -8.610 -8.610 61 1HG2 ILE 332 2HG2 ILE 32 -4.901 -9.932 -9.932 62 2HG2 ILE 332 1HG2 ILE 32 -5.676 -8.368 -8.368 63 3HG2 ILE 332 3HG2 ILE 32 -6.313 -9.807 -9.807 64 1HD1 ILE 332 2HD1 ILE 32 -4.490 -6.637 -6.637 65 2HD1 ILE 332 1HD1 ILE 32 -3.315 -6.073 -6.073 66 3HD1 ILE 332 3HD1 ILE 32 -2.777 -6.570 -6.570 67 H ARG 333 H ARG 33 -4.376 -12.697 -12.697 68 HA ARG 333 HA ARG 33 -6.573 -13.475 -13.475 69 1HB ARG 333 2HB ARG 33 -4.776 -14.778 -14.778 70 2HB ARG 333 1HB ARG 33 -6.432 -15.181 -15.181 71 1HG ARG 333 2HG ARG 33 -6.800 -15.611 -15.611 72 2HG ARG 333 1HG ARG 33 -5.039 -15.662 -15.662 73 1HD ARG 333 2HD ARG 33 -6.685 -17.347 -17.347 74 2HD ARG 333 1HD ARG 33 -6.078 -17.918 -17.918 75 HE ARG 333 HE ARG 33 -3.764 -17.156 -17.156 76 1HH1 ARG 333 1HH2 ARG 33 -5.055 -16.915 -16.915 77 2HH1 ARG 333 2HH2 ARG 33 -4.751 -18.481 -18.481 78 1HH2 ARG 333 2HH1 ARG 33 -3.983 -19.942 -19.942 79 2HH2 ARG 333 1HH1 ARG 33 -4.145 -20.194 -20.194 80 H GLY 334 H GLY 34 -8.222 -11.936 -11.936 81 1HA GLY 334 2HA GLY 34 -10.163 -12.518 -12.518 82 2HA GLY 334 1HA GLY 34 -9.108 -11.335 -11.335 83 H ARG 335 H ARG 35 -10.545 -9.601 -9.601 84 HA ARG 335 HA ARG 35 -10.765 -8.198 -8.198 85 1HB ARG 335 2HB ARG 35 -12.803 -9.875 -9.875 86 2HB ARG 335 1HB ARG 35 -13.393 -8.593 -8.593 87 1HG ARG 335 2HG ARG 35 -13.808 -7.186 -7.186 88 2HG ARG 335 1HG ARG 35 -12.316 -7.628 -7.628 89 1HD ARG 335 2HD ARG 35 -13.482 -9.867 -9.867 90 2HD ARG 335 1HD ARG 35 -14.976 -9.055 -9.055 91 HE ARG 335 HE ARG 35 -13.637 -7.395 -7.395 92 1HH1 ARG 335 1HH2 ARG 35 -13.101 -10.027 -10.027 93 2HH1 ARG 335 2HH2 ARG 35 -14.522 -10.254 -10.254 94 1HH2 ARG 335 2HH1 ARG 35 -16.379 -7.865 -7.865 95 2HH2 ARG 335 1HH1 ARG 35 -16.377 -9.029 -9.029 96 H GLU 336 H GLU 36 -12.260 -8.270 -8.270 97 HA GLU 336 HA GLU 36 -12.433 -5.456 -5.456 98 1HB GLU 336 2HB GLU 36 -13.195 -7.555 -7.555 99 2HB GLU 336 1HB GLU 36 -11.749 -7.063 -7.063 100 1HG GLU 336 2HG GLU 36 -12.722 -5.163 -5.163 101 2HG GLU 336 1HG GLU 36 -13.453 -4.808 -4.808 102 H ARG 337 H ARG 37 -9.835 -7.708 -7.708 103 HA ARG 337 HA ARG 37 -8.085 -5.735 -5.735 104 1HB ARG 337 2HB ARG 37 -7.981 -8.461 -8.461 105 2HB ARG 337 1HB ARG 37 -6.783 -7.946 -7.946 106 1HG ARG 337 2HG ARG 37 -5.325 -7.675 -7.675 107 2HG ARG 337 1HG ARG 37 -6.323 -6.334 -6.334 108 1HD ARG 337 2HD ARG 37 -6.721 -9.247 -9.247 109 2HD ARG 337 1HD ARG 37 -5.977 -8.019 -8.019 110 HE ARG 337 HE ARG 37 -8.298 -6.813 -6.813 111 1HH1 ARG 337 1HH2 ARG 37 -7.509 -9.808 -9.808 112 2HH1 ARG 337 2HH2 ARG 37 -9.141 -10.364 -10.364 113 1HH2 ARG 337 2HH1 ARG 37 -10.506 -7.686 -7.686 114 2HH2 ARG 337 1HH1 ARG 37 -10.838 -9.163 -9.163 115 H PHE 338 H PHE 38 -8.543 -6.917 -6.917 116 HA PHE 338 HA PHE 38 -6.365 -5.525 -5.525 117 1HB PHE 338 2HB PHE 38 -7.662 -7.238 -7.238 118 2HB PHE 338 1HB PHE 38 -9.084 -6.197 -6.197 119 HD1 PHE 338 HD1 PHE 38 -5.519 -6.272 -6.272 120 HD2 PHE 338 HD2 PHE 38 -9.445 -4.628 -4.628 121 HE1 PHE 338 HE1 PHE 38 -4.740 -5.138 -5.138 122 HE2 PHE 338 HE2 PHE 38 -8.665 -3.494 -3.494 123 HZ PHE 338 HZ PHE 38 -6.312 -3.748 -3.748 124 H GLU 339 H GLU 39 -9.650 -4.491 -4.491 125 HA GLU 339 HA GLU 39 -9.453 -1.928 -1.928 126 1HB GLU 339 2HB GLU 39 -11.256 -3.035 -3.035 127 2HB GLU 339 1HB GLU 39 -11.373 -1.357 -1.357 128 1HG GLU 339 2HG GLU 39 -11.228 -2.866 -2.866 129 2HG GLU 339 1HG GLU 39 -12.315 -3.763 -3.763 130 H MET 340 H MET 40 -8.753 -3.111 -3.111 131 HA MET 340 HA MET 40 -8.294 -0.636 -0.636 132 1HB MET 340 2HB MET 40 -7.674 -3.437 -3.437 133 2HB MET 340 1HB MET 40 -6.382 -2.377 -2.377 134 1HG MET 340 2HG MET 40 -7.973 -1.080 -1.080 135 2HG MET 340 1HG MET 40 -9.314 -2.037 -2.037 136 1HE MET 340 2HE MET 40 -5.768 -2.571 -2.571 137 2HE MET 340 1HE MET 40 -5.793 -3.936 -3.936 138 3HE MET 340 3HE MET 40 -6.078 -4.193 -4.193 139 H PHE 341 H PHE 41 -6.068 -2.709 -2.709 140 HA PHE 341 HA PHE 41 -3.821 -0.945 -0.945 141 1HB PHE 341 2HB PHE 41 -4.501 -3.357 -3.357 142 2HB PHE 341 1HB PHE 41 -3.102 -2.395 -2.395 143 HD1 PHE 341 HD1 PHE 41 -4.396 -2.736 -2.736 144 HD2 PHE 341 HD2 PHE 41 -1.368 -4.007 -4.007 145 HE1 PHE 341 HE1 PHE 41 -3.156 -3.796 -3.796 146 HE2 PHE 341 HE2 PHE 41 -0.122 -5.073 -5.073 147 HZ PHE 341 HZ PHE 41 -1.021 -4.967 -4.967 148 H ARG 342 H ARG 42 -6.387 -1.339 -1.339 149 HA ARG 342 HA ARG 42 -5.386 0.233 0.233 150 1HB ARG 342 2HB ARG 42 -7.882 -0.899 -0.899 151 2HB ARG 342 1HB ARG 42 -8.185 0.825 0.825 152 1HG ARG 342 2HG ARG 42 -6.524 -0.710 -0.710 153 2HG ARG 342 1HG ARG 42 -8.286 -0.733 -0.733 154 1HD ARG 342 2HD ARG 42 -8.089 1.864 1.864 155 2HD ARG 342 1HD ARG 42 -6.412 1.603 1.603 156 HE ARG 342 HE ARG 42 -8.093 0.168 0.168 157 1HH1 ARG 342 2HH1 ARG 42 -9.316 3.015 3.015 158 2HH1 ARG 342 1HH1 ARG 42 -8.757 3.870 3.870 159 1HH2 ARG 342 1HH2 ARG 42 -6.478 1.419 1.419 160 2HH2 ARG 342 2HH2 ARG 42 -7.148 2.966 2.966 161 H GLU 343 H GLU 43 -6.837 1.156 1.156 162 HA GLU 343 HA GLU 43 -6.964 3.986 3.986 163 1HB GLU 343 2HB GLU 43 -8.323 2.842 2.842 164 2HB GLU 343 1HB GLU 43 -6.841 2.703 2.703 165 1HG GLU 343 2HG GLU 43 -7.884 4.710 4.710 166 2HG GLU 343 1HG GLU 43 -6.581 5.234 5.234 167 H LEU 344 H LEU 44 -4.816 2.194 2.194 168 HA LEU 344 HA LEU 44 -3.018 4.316 4.316 169 1HB LEU 344 2HB LEU 44 -2.654 1.321 1.321 170 2HB LEU 344 1HB LEU 44 -1.259 2.363 2.363 171 HG LEU 344 HG LEU 44 -1.885 1.925 1.925 172 1HD1 LEU 344 3HD1 LEU 44 -2.130 4.462 4.462 173 2HD1 LEU 344 2HD1 LEU 44 -3.814 4.190 4.190 174 3HD1 LEU 344 1HD1 LEU 44 -2.532 3.951 3.951 175 1HD2 LEU 344 3HD2 LEU 44 -3.959 0.676 0.676 176 2HD2 LEU 344 2HD2 LEU 44 -4.123 1.532 1.532 177 3HD2 LEU 344 1HD2 LEU 44 -4.811 2.218 2.218 178 H ASN 345 H ASN 45 -2.472 1.672 1.672 179 HA ASN 345 HA ASN 45 -0.297 2.635 2.635 180 1HB ASN 345 2HB ASN 45 -1.958 0.540 0.540 181 2HB ASN 345 1HB ASN 45 -2.520 1.560 1.560 182 1HD2 ASN 345 2HD2 ASN 45 0.155 -0.262 -0.262 183 2HD2 ASN 345 1HD2 ASN 45 -1.486 -0.415 -0.415 184 H GLU 346 H GLU 46 -3.655 3.730 3.730 185 HA GLU 346 HA GLU 46 -3.264 5.320 5.320 186 1HB GLU 346 2HB GLU 46 -5.502 4.662 4.662 187 2HB GLU 346 1HB GLU 46 -5.297 5.594 5.594 188 1HG GLU 346 2HG GLU 46 -6.552 6.990 6.990 189 2HG GLU 346 1HG GLU 46 -4.909 7.631 7.631 190 H ALA 347 H ALA 47 -3.283 6.195 6.195 191 HA ALA 347 HA ALA 47 -2.741 8.964 8.964 192 1HB ALA 347 2HB ALA 47 -3.436 7.793 7.793 193 2HB ALA 347 1HB ALA 47 -1.734 7.365 7.365 194 3HB ALA 347 3HB ALA 47 -2.217 9.061 9.061 195 H LEU 348 H LEU 48 -0.512 6.233 6.233 196 HA LEU 348 HA LEU 48 1.904 7.689 7.689 197 1HB LEU 348 2HB LEU 48 1.422 4.962 4.962 198 2HB LEU 348 1HB LEU 48 2.980 5.600 5.600 199 HG LEU 348 HG LEU 48 0.637 5.369 5.369 200 1HD1 LEU 348 1HD1 LEU 48 2.170 3.231 3.231 201 2HD1 LEU 348 3HD1 LEU 48 2.509 3.322 3.322 202 3HD1 LEU 348 2HD1 LEU 48 0.850 3.128 3.128 203 1HD2 LEU 348 3HD2 LEU 48 3.268 6.442 6.442 204 2HD2 LEU 348 2HD2 LEU 48 2.098 6.289 6.289 205 3HD2 LEU 348 1HD2 LEU 48 3.249 4.989 4.989 206 H GLU 349 H GLU 49 0.329 6.152 6.152 207 HA GLU 349 HA GLU 49 2.116 7.217 7.217 208 1HB GLU 349 2HB GLU 49 -0.516 5.918 5.918 209 2HB GLU 349 1HB GLU 49 -0.311 7.077 7.077 210 1HG GLU 349 2HG GLU 49 2.036 5.921 5.921 211 2HG GLU 349 1HG GLU 49 1.252 4.593 4.593 212 H LEU 350 H LEU 50 -0.538 8.664 8.664 213 HA LEU 350 HA LEU 50 -0.837 10.895 10.895 214 1HB LEU 350 2HB LEU 50 -2.671 11.264 11.264 215 2HB LEU 350 1HB LEU 50 -2.214 9.888 9.888 216 HG LEU 350 HG LEU 50 -0.752 11.475 11.475 217 1HD1 LEU 350 2HD1 LEU 50 -1.513 13.192 13.192 218 2HD1 LEU 350 1HD1 LEU 50 -2.178 13.843 13.843 219 3HD1 LEU 350 3HD1 LEU 50 -0.448 13.545 13.545 220 1HD2 LEU 350 1HD2 LEU 50 -3.196 10.751 10.751 221 2HD2 LEU 350 3HD2 LEU 50 -2.549 12.144 12.144 222 3HD2 LEU 350 2HD2 LEU 50 -3.624 12.382 12.382 223 H LYS 351 H LYS 51 1.163 10.140 10.140 224 HA LYS 351 HA LYS 51 2.124 12.764 12.764 225 1HB LYS 351 2HB LYS 51 2.520 10.766 10.766 226 2HB LYS 351 1HB LYS 51 3.653 10.163 10.163 227 1HG LYS 351 2HG LYS 51 5.255 11.714 11.714 228 2HG LYS 351 1HG LYS 51 4.067 12.963 12.963 229 1HD LYS 351 2HD LYS 51 3.561 11.156 11.156 230 2HD LYS 351 1HD LYS 51 5.300 10.948 10.948 231 1HE LYS 351 2HE LYS 51 5.245 13.614 13.614 232 2HE LYS 351 1HE LYS 51 3.774 13.350 13.350 233 1HZ LYS 351 2HZ LYS 51 5.069 11.905 11.905 234 2HZ LYS 351 1HZ LYS 51 6.479 12.299 12.299 235 3HZ LYS 351 3HZ LYS 51 5.642 13.504 13.504 236 H ASP 352 H ASP 52 3.124 10.284 10.284 237 HA ASP 352 HA ASP 52 5.414 11.775 11.775 238 1HB ASP 352 2HB ASP 52 4.278 9.189 9.189 239 2HB ASP 352 1HB ASP 52 4.414 9.973 9.973 240 H ALA 353 H ALA 53 1.991 11.687 11.687 241 HA ALA 353 HA ALA 53 2.366 13.287 13.287 242 1HB ALA 353 1HB ALA 53 -0.013 12.031 12.031 243 2HB ALA 353 3HB ALA 53 -0.212 13.182 13.182 244 3HB ALA 353 2HB ALA 53 0.653 11.667 11.667 245 H GLN 354 H GLN 54 2.937 14.286 14.286 246 HA GLN 354 HA GLN 54 0.880 16.375 16.375 247 1HB GLN 354 2HB GLN 54 3.144 15.259 15.259 248 2HB GLN 354 1HB GLN 54 2.866 16.990 16.990 249 1HG GLN 354 2HG GLN 54 0.313 16.075 16.075 250 2HG GLN 354 1HG GLN 54 1.168 14.690 14.690 251 1HE2 GLN 354 2HE2 GLN 54 0.452 17.613 17.613 252 2HE2 GLN 354 1HE2 GLN 54 -0.509 17.101 17.101 253 H ALA 355 HN ALA 55 3.275 16.065 16.065 254 HA ALA 355 HA ALA 55 3.948 18.979 18.979 255 1HB ALA 355 3HB ALA 55 5.800 17.078 17.078 256 2HB ALA 355 2HB ALA 55 5.781 17.078 17.078 257 3HB ALA 355 1HB ALA 55 6.156 18.561 18.561 258 1H GLY 325 2H GLY 25 -13.052 -15.306 -15.306 259 2H GLY 325 1H GLY 25 -12.730 -14.338 -14.338 260 3H GLY 325 3H GLY 25 -14.333 -14.616 -14.616 261 1HA GLY 325 2HA GLY 25 -14.306 -12.885 -12.885 262 2HA GLY 325 1HA GLY 25 -12.698 -12.507 -12.507 263 H GLU 326 H GLU 26 -11.069 -12.549 -12.549 264 HA GLU 326 HA GLU 26 -11.002 -14.517 -14.517 265 1HB GLU 326 2HB GLU 26 -11.801 -11.672 -11.672 266 2HB GLU 326 1HB GLU 26 -10.801 -12.502 -12.502 267 1HG GLU 326 2HG GLU 26 -12.726 -14.396 -14.396 268 2HG GLU 326 1HG GLU 26 -13.639 -12.887 -12.887 269 H TYR 327 H TYR 27 -9.147 -13.391 -13.391 270 HA TYR 327 HA TYR 27 -6.860 -12.935 -12.935 271 1HB TYR 327 2HB TYR 27 -7.188 -14.282 -14.282 272 2HB TYR 327 1HB TYR 27 -5.678 -13.404 -13.404 273 HD1 TYR 327 HD2 TYR 27 -7.814 -16.152 -16.152 274 HD2 TYR 327 HD1 TYR 27 -4.047 -14.124 -14.124 275 HE1 TYR 327 HE2 TYR 27 -6.957 -18.011 -18.011 276 HE2 TYR 327 HE1 TYR 27 -3.190 -15.983 -15.983 277 HH TYR 327 HH TYR 27 -4.660 -18.969 -18.969 278 H PHE 328 H PHE 28 -6.557 -10.756 -10.756 279 HA PHE 328 HA PHE 28 -6.853 -9.006 -9.006 280 1HB PHE 328 2HB PHE 28 -6.890 -8.529 -8.529 281 2HB PHE 328 1HB PHE 28 -6.509 -7.201 -7.201 282 HD1 PHE 328 HD2 PHE 28 -8.146 -6.714 -6.714 283 HD2 PHE 328 HD1 PHE 28 -9.124 -9.195 -9.195 284 HE1 PHE 328 HE2 PHE 28 -10.561 -6.419 -6.419 285 HE2 PHE 328 HE1 PHE 28 -11.539 -8.901 -8.901 286 HZ PHE 328 HZ PHE 28 -12.257 -7.513 -7.513 287 H THR 329 H THR 29 -5.124 -7.346 -7.346 288 HA THR 329 HA THR 29 -2.472 -8.298 -8.298 289 HB THR 329 HB THR 29 -2.371 -6.888 -6.888 290 HG1 THR 329 HG1 THR 29 -4.347 -8.020 -8.020 291 1HG2 THR 329 1HG2 THR 29 -0.680 -8.408 -8.408 292 2HG2 THR 329 3HG2 THR 29 -1.480 -9.704 -9.704 293 3HG2 THR 329 2HG2 THR 29 -0.685 -8.397 -8.397 294 H LEU 330 H LEU 30 -1.014 -6.684 -6.684 295 HA LEU 330 HA LEU 30 -2.025 -3.868 -3.868 296 1HB LEU 330 2HB LEU 30 -1.663 -5.378 -5.378 297 2HB LEU 330 1HB LEU 30 -0.168 -4.452 -4.452 298 HG LEU 330 HG LEU 30 -2.217 -2.637 -2.637 299 1HD1 LEU 330 1HD1 LEU 30 -3.378 -4.752 -4.752 300 2HD1 LEU 330 3HD1 LEU 30 -2.982 -3.653 -3.653 301 3HD1 LEU 330 2HD1 LEU 30 -4.001 -3.103 -3.103 302 1HD2 LEU 330 2HD2 LEU 30 -0.094 -2.235 -2.235 303 2HD2 LEU 330 1HD2 LEU 30 -1.506 -1.583 -1.583 304 3HD2 LEU 330 3HD2 LEU 30 -0.786 -3.099 -3.099 305 H GLN 331 H GLN 31 -0.728 -3.485 -3.485 306 HA GLN 331 HA GLN 31 2.121 -4.099 -4.099 307 1HB GLN 331 2HB GLN 31 0.566 -2.366 -2.366 308 2HB GLN 331 1HB GLN 31 2.201 -2.983 -2.983 309 1HG GLN 331 2HG GLN 31 1.357 -5.293 -5.293 310 2HG GLN 331 1HG GLN 31 -0.280 -4.691 -4.691 311 1HE2 GLN 331 2HE2 GLN 31 1.291 -4.682 -4.682 312 2HE2 GLN 331 1HE2 GLN 31 2.217 -5.185 -5.185 313 H ILE 332 H ILE 32 3.350 -2.907 -2.907 314 HA ILE 332 HA ILE 32 2.745 -0.008 -0.008 315 HB ILE 332 HB ILE 32 4.448 -1.919 -1.919 316 1HG1 ILE 332 2HG1 ILE 32 2.378 -0.307 -0.307 317 2HG1 ILE 332 1HG1 ILE 32 1.728 -1.367 -1.367 318 1HG2 ILE 332 2HG2 ILE 32 4.074 1.080 1.080 319 2HG2 ILE 332 1HG2 ILE 32 4.771 0.062 0.062 320 3HG2 ILE 332 3HG2 ILE 32 5.588 0.223 0.223 321 1HD1 ILE 332 2HD1 ILE 32 3.733 -2.725 -2.725 322 2HD1 ILE 332 1HD1 ILE 32 2.401 -2.116 -2.116 323 3HD1 ILE 332 3HD1 ILE 32 2.076 -3.207 -3.207 324 H ARG 333 H ARG 33 3.920 1.352 1.352 325 HA ARG 333 HA ARG 33 6.328 0.421 0.421 326 1HB ARG 333 2HB ARG 33 4.419 2.535 2.535 327 2HB ARG 333 1HB ARG 33 6.024 3.258 3.258 328 1HG ARG 333 2HG ARG 33 6.741 1.413 1.413 329 2HG ARG 333 1HG ARG 33 5.013 1.240 1.240 330 1HD ARG 333 2HD ARG 33 6.518 3.864 3.864 331 2HD ARG 333 1HD ARG 33 6.140 2.845 2.845 332 HE ARG 333 HE ARG 33 3.670 3.175 3.175 333 1HH1 ARG 333 1HH2 ARG 33 4.609 5.383 5.383 334 2HH1 ARG 333 2HH2 ARG 33 4.333 6.788 6.788 335 1HH2 ARG 333 2HH1 ARG 33 4.026 5.002 5.002 336 2HH2 ARG 333 1HH1 ARG 33 4.000 6.572 6.572 337 H GLY 334 H GLY 34 7.790 0.031 0.031 338 1HA GLY 334 2HA GLY 34 9.577 2.059 2.059 339 2HA GLY 334 1HA GLY 34 8.385 2.040 2.040 340 H ARG 335 H ARG 35 9.656 1.139 1.139 341 HA ARG 335 HA ARG 35 10.099 -1.742 -1.742 342 1HB ARG 335 2HB ARG 35 12.179 -0.410 -0.410 343 2HB ARG 335 1HB ARG 35 12.559 -0.193 -0.193 344 1HG ARG 335 2HG ARG 35 13.117 -2.374 -2.374 345 2HG ARG 335 1HG ARG 35 11.752 -2.936 -2.936 346 1HD ARG 335 2HD ARG 35 13.077 -2.073 -2.073 347 2HD ARG 335 1HD ARG 35 14.464 -2.019 -2.019 348 HE ARG 335 HE ARG 35 13.255 -4.585 -4.585 349 1HH1 ARG 335 1HH2 ARG 35 13.057 -4.272 -4.272 350 2HH1 ARG 335 2HH2 ARG 35 14.593 -4.865 -4.865 351 1HH2 ARG 335 2HH1 ARG 35 16.070 -4.638 -4.638 352 2HH2 ARG 335 1HH1 ARG 35 16.300 -5.072 -5.072 353 H GLU 336 H GLU 36 11.196 1.114 1.114 354 HA GLU 336 HA GLU 36 11.164 -0.152 -0.152 355 1HB GLU 336 2HB GLU 36 11.856 2.321 2.321 356 2HB GLU 336 1HB GLU 36 10.285 2.689 2.689 357 1HG GLU 336 2HG GLU 36 11.041 2.350 2.350 358 2HG GLU 336 1HG GLU 36 11.923 0.893 0.893 359 H ARG 337 H ARG 37 8.598 1.707 1.707 360 HA ARG 337 HA ARG 37 6.619 1.411 1.411 361 1HB ARG 337 2HB ARG 37 6.718 2.653 2.653 362 2HB ARG 337 1HB ARG 37 5.635 1.303 1.303 363 1HG ARG 337 2HG ARG 37 3.982 2.485 2.485 364 2HG ARG 337 1HG ARG 37 4.824 2.281 2.281 365 1HD ARG 337 2HD ARG 37 5.324 4.528 4.528 366 2HD ARG 337 1HD ARG 37 4.387 4.672 4.672 367 HE ARG 337 HE ARG 37 6.652 3.866 3.866 368 1HH1 ARG 337 1HH2 ARG 37 5.887 6.543 6.543 369 2HH1 ARG 337 2HH2 ARG 37 7.517 7.102 7.102 370 1HH2 ARG 337 2HH1 ARG 37 8.922 4.285 4.285 371 2HH2 ARG 337 1HH1 ARG 37 9.235 5.823 5.823 372 H PHE 338 H PHE 38 7.504 -0.680 -0.680 373 HA PHE 338 HA PHE 38 5.408 -2.598 -2.598 374 1HB PHE 338 2HB PHE 38 6.950 -2.563 -2.563 375 2HB PHE 338 1HB PHE 38 8.291 -3.013 -3.013 376 HD1 PHE 338 HD1 PHE 38 4.900 -4.151 -4.151 377 HD2 PHE 338 HD2 PHE 38 8.762 -5.277 -5.277 378 HE1 PHE 338 HE1 PHE 38 4.308 -6.544 -6.544 379 HE2 PHE 338 HE2 PHE 38 8.170 -7.670 -7.670 380 HZ PHE 338 HZ PHE 38 5.942 -8.303 -8.303 381 H GLU 339 H GLU 39 8.499 -2.232 -2.232 382 HA GLU 339 HA GLU 39 8.300 -4.749 -4.749 383 1HB GLU 339 2HB GLU 39 9.911 -2.227 -2.227 384 2HB GLU 339 1HB GLU 39 9.992 -3.586 -3.586 385 1HG GLU 339 2HG GLU 39 10.229 -4.725 -4.725 386 2HG GLU 339 1HG GLU 39 11.251 -3.287 -3.287 387 H MET 340 H MET 40 7.329 -1.411 -1.411 388 HA MET 340 HA MET 40 6.562 -1.714 -1.714 389 1HB MET 340 2HB MET 40 6.090 0.185 0.185 390 2HB MET 340 1HB MET 40 4.664 -0.005 -0.005 391 1HG MET 340 2HG MET 40 5.978 0.478 0.478 392 2HG MET 340 1HG MET 40 7.456 0.559 0.559 393 1HE MET 340 2HE MET 40 3.854 1.575 1.575 394 2HE MET 340 1HE MET 40 3.846 3.252 3.252 395 3HE MET 340 3HE MET 40 4.335 1.965 1.965 396 H PHE 341 H PHE 41 4.685 -2.194 -2.194 397 HA PHE 341 HA PHE 41 2.309 -3.096 -3.096 398 1HB PHE 341 2HB PHE 41 3.280 -3.140 -3.140 399 2HB PHE 341 1HB PHE 41 1.859 -4.084 -4.084 400 HD1 PHE 341 HD1 PHE 41 2.833 -0.948 -0.948 401 HD2 PHE 341 HD2 PHE 41 0.244 -2.749 -2.749 402 HE1 PHE 341 HE1 PHE 41 1.454 1.109 1.109 403 HE2 PHE 341 HE2 PHE 41 -1.137 -0.690 -0.690 404 HZ PHE 341 HZ PHE 41 -0.532 1.240 1.240 405 H ARG 342 H ARG 42 5.213 -4.655 -4.655 406 HA ARG 342 HA ARG 42 4.313 -7.344 -7.344 407 1HB ARG 342 2HB ARG 42 6.786 -6.015 -6.015 408 2HB ARG 342 1HB ARG 42 7.009 -7.131 -7.131 409 1HG ARG 342 2HG ARG 42 5.670 -8.054 -8.054 410 2HG ARG 342 1HG ARG 42 7.429 -8.010 -8.010 411 1HD ARG 342 2HD ARG 42 7.058 -9.296 -9.296 412 2HD ARG 342 1HD ARG 42 5.473 -9.672 -9.672 413 HE ARG 342 HE ARG 42 7.450 -10.263 -10.263 414 1HH1 ARG 342 2HH1 ARG 42 8.405 -11.223 -11.223 415 2HH1 ARG 342 1HH1 ARG 42 7.964 -12.894 -12.894 416 1HH2 ARG 342 1HH2 ARG 42 5.976 -12.458 -12.458 417 2HH2 ARG 342 2HH2 ARG 42 6.591 -13.594 -13.594 418 H GLU 343 H GLU 43 5.304 -5.192 -5.192 419 HA GLU 343 HA GLU 43 5.366 -7.256 -7.256 420 1HB GLU 343 2HB GLU 43 6.536 -5.022 -5.022 421 2HB GLU 343 1HB GLU 43 4.952 -4.281 -4.281 422 1HG GLU 343 2HG GLU 43 5.812 -4.670 -4.670 423 2HG GLU 343 1HG GLU 43 4.603 -5.924 -5.924 424 H LEU 344 H LEU 44 3.071 -4.509 -4.509 425 HA LEU 344 HA LEU 44 1.068 -5.447 -5.447 426 1HB LEU 344 2HB LEU 44 0.924 -3.908 -3.908 427 2HB LEU 344 1HB LEU 44 -0.551 -4.361 -4.361 428 HG LEU 344 HG LEU 44 -0.138 -2.234 -2.234 429 1HD1 LEU 344 3HD1 LEU 44 -0.027 -4.226 -4.226 430 2HD1 LEU 344 2HD1 LEU 44 1.610 -3.614 -3.614 431 3HD1 LEU 344 1HD1 LEU 44 0.225 -2.555 -2.555 432 1HD2 LEU 344 3HD2 LEU 44 2.094 -2.074 -2.074 433 2HD2 LEU 344 2HD2 LEU 44 2.040 -1.301 -1.301 434 3HD2 LEU 344 1HD2 LEU 44 2.810 -2.876 -2.876 435 H ASN 345 H ASN 45 0.906 -5.875 -5.875 436 HA ASN 345 HA ASN 45 -1.055 -7.767 -7.767 437 1HB ASN 345 2HB ASN 45 0.830 -6.777 -6.777 438 2HB ASN 345 1HB ASN 45 1.452 -8.413 -8.413 439 1HD2 ASN 345 2HD2 ASN 45 -0.785 -8.819 -8.819 440 2HD2 ASN 345 1HD2 ASN 45 0.788 -8.321 -8.321 441 H GLU 346 H GLU 46 2.224 -8.359 -8.359 442 HA GLU 346 HA GLU 46 2.016 -11.232 -11.232 443 1HB GLU 346 2HB GLU 46 4.190 -10.102 -10.102 444 2HB GLU 346 1HB GLU 46 3.760 -9.394 -9.394 445 1HG GLU 346 2HG GLU 46 5.083 -11.321 -11.321 446 2HG GLU 346 1HG GLU 46 3.413 -11.780 -11.780 447 H ALA 347 H ALA 47 1.586 -8.802 -8.802 448 HA ALA 347 HA ALA 47 0.916 -10.667 -10.667 449 1HB ALA 347 2HB ALA 47 1.447 -8.170 -8.170 450 2HB ALA 347 1HB ALA 47 -0.234 -7.881 -7.881 451 3HB ALA 347 3HB ALA 47 0.147 -8.799 -8.799 452 H LEU 348 H LEU 48 -1.167 -8.879 -8.879 453 HA LEU 348 HA LEU 48 -3.667 -9.784 -9.784 454 1HB LEU 348 2HB LEU 48 -2.867 -9.287 -9.287 455 2HB LEU 348 1HB LEU 48 -4.516 -9.316 -9.316 456 HG LEU 348 HG LEU 48 -2.432 -7.445 -7.445 457 1HD1 LEU 348 1HD1 LEU 48 -3.658 -7.374 -7.374 458 2HD1 LEU 348 3HD1 LEU 48 -4.201 -6.001 -6.001 459 3HD1 LEU 348 2HD1 LEU 48 -2.478 -6.266 -6.266 460 1HD2 LEU 348 3HD2 LEU 48 -5.128 -8.114 -8.114 461 2HD2 LEU 348 2HD2 LEU 48 -4.132 -6.853 -6.853 462 3HD2 LEU 348 1HD2 LEU 48 -5.138 -6.482 -6.482 463 H GLU 349 H GLU 49 -1.688 -11.199 -11.199 464 HA GLU 349 HA GLU 49 -3.312 -13.503 -13.503 465 1HB GLU 349 2HB GLU 49 -0.630 -12.632 -12.632 466 2HB GLU 349 1HB GLU 49 -0.732 -14.375 -14.375 467 1HG GLU 349 2HG GLU 49 -2.960 -14.154 -14.154 468 2HG GLU 349 1HG GLU 49 -2.216 -12.664 -12.664 469 H LEU 350 H LEU 50 -0.939 -12.705 -12.705 470 HA LEU 350 HA LEU 50 -0.580 -15.424 -15.424 471 1HB LEU 350 2HB LEU 50 1.042 -14.459 -14.459 472 2HB LEU 350 1HB LEU 50 0.576 -12.906 -12.906 473 HG LEU 350 HG LEU 50 -1.153 -12.725 -12.725 474 1HD1 LEU 350 2HD1 LEU 50 -0.289 -15.414 -15.414 475 2HD1 LEU 350 1HD1 LEU 50 0.157 -14.468 -14.468 476 3HD1 LEU 350 3HD1 LEU 50 -1.521 -14.516 -14.516 477 1HD2 LEU 350 1HD2 LEU 50 1.259 -11.764 -11.764 478 2HD2 LEU 350 3HD2 LEU 50 0.415 -11.846 -11.846 479 3HD2 LEU 350 2HD2 LEU 50 1.626 -13.060 -13.060 480 H LYS 351 H LYS 51 -2.852 -12.826 -12.826 481 HA LYS 351 HA LYS 51 -4.039 -13.886 -13.886 482 1HB LYS 351 2HB LYS 51 -4.489 -11.601 -11.601 483 2HB LYS 351 1HB LYS 51 -5.433 -12.364 -12.364 484 1HG LYS 351 2HG LYS 51 -7.170 -12.880 -12.880 485 2HG LYS 351 1HG LYS 51 -6.109 -13.167 -13.167 486 1HD LYS 351 2HD LYS 51 -5.739 -10.490 -10.490 487 2HD LYS 351 1HD LYS 51 -7.422 -10.669 -10.669 488 1HE LYS 351 2HE LYS 51 -7.544 -12.143 -12.143 489 2HE LYS 351 1HE LYS 51 -6.177 -11.129 -11.129 490 1HZ LYS 351 2HZ LYS 51 -7.537 -9.176 -9.176 491 2HZ LYS 351 1HZ LYS 51 -8.862 -10.199 -10.199 492 3HZ LYS 351 3HZ LYS 51 -8.205 -10.094 -10.094 493 H ASP 352 H ASP 52 -4.628 -14.506 -14.506 494 HA ASP 352 HA ASP 52 -6.868 -16.289 -16.289 495 1HB ASP 352 2HB ASP 52 -5.541 -15.137 -15.137 496 2HB ASP 352 1HB ASP 52 -5.543 -16.887 -16.887 497 H ALA 353 H ALA 53 -3.396 -16.615 -16.615 498 HA ALA 353 HA ALA 53 -3.578 -19.572 -19.572 499 1HB ALA 353 1HB ALA 53 -1.288 -17.604 -17.604 500 2HB ALA 353 3HB ALA 53 -1.016 -19.326 -19.326 501 3HB ALA 353 2HB ALA 53 -1.764 -18.773 -18.773 502 H GLN 354 H GLN 54 -4.539 -17.824 -17.824 503 HA GLN 354 HA GLN 54 -2.657 -18.554 -18.554 504 1HB GLN 354 2HB GLN 54 -4.937 -16.717 -16.717 505 2HB GLN 354 1HB GLN 54 -4.881 -17.536 -17.536 506 1HG GLN 354 2HG GLN 54 -2.288 -16.882 -16.882 507 2HG GLN 354 1HG GLN 54 -2.971 -15.587 -15.587 508 1HE2 GLN 354 2HE2 GLN 54 -2.975 -14.839 -14.839 509 2HE2 GLN 354 1HE2 GLN 54 -1.784 -15.598 -15.598 510 H ALA 355 HN ALA 55 -4.742 -20.316 -20.316 511 HA ALA 355 HA ALA 55 -5.637 -21.856 -21.856 512 1HB ALA 355 3HB ALA 55 -7.379 -20.610 -20.610 513 2HB ALA 355 2HB ALA 55 -7.161 -22.086 -22.086 514 3HB ALA 355 1HB ALA 55 -7.738 -22.178 -22.178 515 1H GLY 325 2H GLY 25 10.749 -1.782 -1.782 516 2H GLY 325 1H GLY 25 10.436 -2.373 -2.373 517 3H GLY 325 3H GLY 25 12.036 -2.155 -2.155 518 1HA GLY 325 2HA GLY 25 12.057 -0.070 -0.070 519 2HA GLY 325 1HA GLY 25 10.448 -0.343 -0.343 520 H GLU 326 H GLU 26 8.839 0.891 0.891 521 HA GLU 326 HA GLU 26 8.770 1.610 1.610 522 1HB GLU 326 2HB GLU 26 9.621 3.580 3.580 523 2HB GLU 326 1HB GLU 26 8.625 4.144 4.144 524 1HG GLU 326 2HG GLU 26 10.513 2.568 2.568 525 2HG GLU 326 1HG GLU 26 11.446 3.339 3.339 526 H TYR 327 H TYR 27 6.957 3.676 3.676 527 HA TYR 327 HA TYR 27 4.655 2.402 2.402 528 1HB TYR 327 2HB TYR 27 4.987 3.863 3.863 529 2HB TYR 327 1HB TYR 27 3.492 4.174 4.174 530 HD1 TYR 327 HD2 TYR 27 5.555 1.574 1.574 531 HD2 TYR 327 HD1 TYR 27 1.819 2.452 2.452 532 HE1 TYR 327 HE2 TYR 27 4.642 -0.594 -0.594 533 HE2 TYR 327 HE1 TYR 27 0.905 0.283 0.283 534 HH TYR 327 HH TYR 27 2.348 -1.557 -1.557 535 H PHE 328 H PHE 28 4.380 3.398 3.398 536 HA PHE 328 HA PHE 28 4.744 6.352 6.352 537 1HB PHE 328 2HB PHE 28 4.754 4.135 4.135 538 2HB PHE 328 1HB PHE 28 4.411 5.788 5.788 539 HD1 PHE 328 HD2 PHE 28 6.082 7.627 7.627 540 HD2 PHE 328 HD1 PHE 28 6.971 3.431 3.431 541 HE1 PHE 328 HE2 PHE 28 8.507 8.143 8.143 542 HE2 PHE 328 HE1 PHE 28 9.396 3.947 3.947 543 HZ PHE 328 HZ PHE 28 10.165 6.303 6.303 544 H THR 329 H THR 29 3.059 7.573 7.573 545 HA THR 329 HA THR 29 0.371 6.279 6.279 546 HB THR 329 HB THR 29 0.447 9.212 9.212 547 HG1 THR 329 HG1 THR 29 2.290 8.738 8.738 548 1HG2 THR 329 1HG2 THR 29 -1.401 7.318 7.318 549 2HG2 THR 329 3HG2 THR 29 -0.697 7.362 7.362 550 3HG2 THR 329 2HG2 THR 29 -1.385 8.827 8.827 551 H LEU 330 H LEU 30 -1.032 6.634 6.634 552 HA LEU 330 HA LEU 30 0.004 8.330 8.330 553 1HB LEU 330 2HB LEU 30 -0.365 5.588 5.588 554 2HB LEU 330 1HB LEU 30 -1.866 6.195 6.195 555 HG LEU 330 HG LEU 30 0.135 7.760 7.760 556 1HD1 LEU 330 1HD1 LEU 30 1.420 5.522 5.522 557 2HD1 LEU 330 3HD1 LEU 30 1.022 5.037 5.037 558 3HD1 LEU 330 2HD1 LEU 30 1.978 6.492 6.492 559 1HD2 LEU 330 2HD2 LEU 30 -1.934 6.902 6.902 560 2HD2 LEU 330 1HD2 LEU 30 -0.518 6.532 6.532 561 3HD2 LEU 330 3HD2 LEU 30 -1.258 5.274 5.274 562 H GLN 331 H GLN 31 -1.271 10.135 10.135 563 HA GLN 331 HA GLN 31 -4.145 9.809 9.809 564 1HB GLN 331 2HB GLN 31 -2.528 12.348 12.348 565 2HB GLN 331 1HB GLN 31 -4.167 12.236 12.236 566 1HG GLN 331 2HG GLN 31 -3.353 10.883 10.883 567 2HG GLN 331 1HG GLN 31 -1.712 10.958 10.958 568 1HE2 GLN 331 2HE2 GLN 31 -3.226 14.138 14.138 569 2HE2 GLN 331 1HE2 GLN 31 -4.184 12.775 12.775 570 H ILE 332 H ILE 32 -5.362 9.339 9.339 571 HA ILE 332 HA ILE 32 -4.669 10.654 10.654 572 HB ILE 332 HB ILE 32 -6.437 8.290 8.290 573 1HG1 ILE 332 2HG1 ILE 32 -4.351 8.033 8.033 574 2HG1 ILE 332 1HG1 ILE 32 -3.707 8.487 8.487 575 1HG2 ILE 332 2HG2 ILE 32 -6.005 9.722 9.722 576 2HG2 ILE 332 1HG2 ILE 32 -6.732 8.121 8.121 577 3HG2 ILE 332 3HG2 ILE 32 -7.532 9.520 9.520 578 1HD1 ILE 332 2HD1 ILE 32 -5.759 6.428 6.428 579 2HD1 ILE 332 1HD1 ILE 32 -4.419 5.912 5.912 580 3HD1 ILE 332 3HD1 ILE 32 -4.112 6.438 6.438 581 H ARG 333 H ARG 33 -5.791 12.478 12.478 582 HA ARG 333 HA ARG 33 -8.209 13.165 13.165 583 1HB ARG 333 2HB ARG 33 -6.261 14.553 14.553 584 2HB ARG 333 1HB ARG 33 -7.855 14.882 14.882 585 1HG ARG 333 2HG ARG 33 -8.584 15.282 15.282 586 2HG ARG 333 1HG ARG 33 -6.857 15.422 15.422 587 1HD ARG 333 2HD ARG 33 -8.310 17.026 17.026 588 2HD ARG 333 1HD ARG 33 -7.963 17.622 17.622 589 HE ARG 333 HE ARG 33 -5.480 16.989 16.989 590 1HH1 ARG 333 1HH2 ARG 33 -6.396 16.702 16.702 591 2HH1 ARG 333 2HH2 ARG 33 -6.072 18.281 18.281 592 1HH2 ARG 333 2HH1 ARG 33 -5.766 19.757 19.757 593 2HH2 ARG 333 1HH1 ARG 33 -5.719 20.012 20.012 594 H GLY 334 H GLY 34 -9.726 11.555 11.555 595 1HA GLY 334 2HA GLY 34 -11.489 12.098 12.098 596 2HA GLY 334 1HA GLY 34 -10.314 10.985 10.985 597 H ARG 335 H ARG 35 -11.637 9.170 9.170 598 HA ARG 335 HA ARG 35 -12.107 7.724 7.724 599 1HB ARG 335 2HB ARG 35 -14.155 9.315 9.315 600 2HB ARG 335 1HB ARG 35 -14.544 8.011 8.011 601 1HG ARG 335 2HG ARG 35 -15.145 6.596 6.596 602 2HG ARG 335 1HG ARG 35 -13.779 7.069 7.069 603 1HD ARG 335 2HD ARG 35 -15.065 9.273 9.273 604 2HD ARG 335 1HD ARG 35 -16.465 8.419 8.419 605 HE ARG 335 HE ARG 35 -15.301 6.794 6.794 606 1HH1 ARG 335 1HH2 ARG 35 -15.062 9.444 9.444 607 2HH1 ARG 335 2HH2 ARG 35 -16.602 9.596 9.596 608 1HH2 ARG 335 1HH1 ARG 35 -18.329 8.288 8.288 609 2HH2 ARG 335 2HH1 ARG 35 -18.112 7.133 7.133 610 H GLU 336 H GLU 36 -13.167 7.747 7.747 611 HA GLU 336 HA GLU 36 -13.182 4.931 4.931 612 1HB GLU 336 2HB GLU 36 -13.817 7.003 7.003 613 2HB GLU 336 1HB GLU 36 -12.247 6.576 6.576 614 1HG GLU 336 2HG GLU 36 -13.031 4.642 4.642 615 2HG GLU 336 1HG GLU 36 -13.941 4.246 4.246 616 H ARG 337 H ARG 37 -10.562 7.286 7.286 617 HA ARG 337 HA ARG 37 -8.612 5.385 5.385 618 1HB ARG 337 2HB ARG 37 -8.658 8.113 8.113 619 2HB ARG 337 1HB ARG 37 -7.597 7.638 7.638 620 1HG ARG 337 2HG ARG 37 -5.933 7.433 7.433 621 2HG ARG 337 1HG ARG 37 -6.800 6.055 6.055 622 1HD ARG 337 2HD ARG 37 -7.227 8.949 8.949 623 2HD ARG 337 1HD ARG 37 -6.307 7.763 7.763 624 HE ARG 337 HE ARG 37 -8.602 6.460 6.460 625 1HH1 ARG 337 1HH2 ARG 37 -7.759 9.492 9.492 626 2HH1 ARG 337 2HH2 ARG 37 -9.375 9.980 9.980 627 1HH2 ARG 337 2HH1 ARG 37 -10.855 7.245 7.245 628 2HH2 ARG 337 1HH1 ARG 37 -11.127 8.709 8.709 629 H PHE 338 H PHE 38 -9.536 6.545 6.545 630 HA PHE 338 HA PHE 38 -7.479 5.245 5.245 631 1HB PHE 338 2HB PHE 38 -8.997 6.892 6.892 632 2HB PHE 338 1HB PHE 38 -10.354 5.788 5.788 633 HD1 PHE 338 HD1 PHE 38 -6.970 6.015 6.015 634 HD2 PHE 338 HD2 PHE 38 -10.864 4.204 4.204 635 HE1 PHE 338 HE1 PHE 38 -6.412 4.908 4.908 636 HE2 PHE 338 HE2 PHE 38 -10.306 3.096 3.096 637 HZ PHE 338 HZ PHE 38 -8.079 3.448 3.448 638 H GLU 339 H GLU 39 -10.576 4.071 4.071 639 HA GLU 339 HA GLU 39 -10.429 1.499 1.499 640 1HB GLU 339 2HB GLU 39 -12.000 2.552 2.552 641 2HB GLU 339 1HB GLU 39 -12.118 0.871 0.871 642 1HG GLU 339 2HG GLU 39 -12.349 2.389 2.389 643 2HG GLU 339 1HG GLU 39 -13.341 3.228 3.228 644 H MET 340 H MET 40 -9.400 2.754 2.754 645 HA MET 340 HA MET 40 -8.671 0.303 0.303 646 1HB MET 340 2HB MET 40 -8.133 3.141 3.141 647 2HB MET 340 1HB MET 40 -6.723 2.153 2.153 648 1HG MET 340 2HG MET 40 -8.046 0.774 0.774 649 2HG MET 340 1HG MET 40 -9.513 1.648 1.648 650 1HE MET 340 2HE MET 40 -5.892 2.350 2.350 651 2HE MET 340 1HE MET 40 -5.840 3.716 3.716 652 3HE MET 340 3HE MET 40 -6.335 3.958 3.958 653 H PHE 341 H PHE 41 -6.775 2.496 2.496 654 HA PHE 341 HA PHE 41 -4.435 0.797 0.797 655 1HB PHE 341 2HB PHE 41 -5.368 3.172 3.172 656 2HB PHE 341 1HB PHE 41 -3.972 2.246 2.246 657 HD1 PHE 341 HD1 PHE 41 -4.906 2.589 2.589 658 HD2 PHE 341 HD2 PHE 41 -2.311 3.970 3.970 659 HE1 PHE 341 HE1 PHE 41 -3.486 3.723 3.723 660 HE2 PHE 341 HE2 PHE 41 -0.888 5.109 5.109 661 HZ PHE 341 HZ PHE 41 -1.475 4.984 4.984 662 H ARG 342 H ARG 42 -7.351 1.033 1.033 663 HA ARG 342 HA ARG 42 -6.518 -0.485 -0.485 664 1HB ARG 342 2HB ARG 42 -8.953 0.548 0.548 665 2HB ARG 342 1HB ARG 42 -9.214 -1.185 -1.185 666 1HG ARG 342 2HG ARG 42 -7.864 0.409 0.409 667 2HG ARG 342 1HG ARG 42 -9.624 0.364 0.364 668 1HD ARG 342 2HD ARG 42 -9.296 -2.225 -2.225 669 2HD ARG 342 1HD ARG 42 -7.711 -1.892 -1.892 670 HE ARG 342 HE ARG 42 -9.675 -0.539 -0.539 671 1HH1 ARG 342 2HH1 ARG 42 -10.680 -3.433 -3.433 672 2HH1 ARG 342 1HH1 ARG 42 -10.268 -4.269 -4.269 673 1HH2 ARG 342 1HH2 ARG 42 -8.236 -1.725 -1.725 674 2HH2 ARG 342 2HH2 ARG 42 -8.883 -3.302 -3.302 675 H GLU 343 H GLU 43 -7.474 -1.447 -1.447 676 HA GLU 343 HA GLU 43 -7.596 -4.286 -4.286 677 1HB GLU 343 2HB GLU 43 -8.731 -3.181 -3.181 678 2HB GLU 343 1HB GLU 43 -7.135 -2.995 -2.995 679 1HG GLU 343 2HG GLU 43 -8.020 -5.031 -5.031 680 2HG GLU 343 1HG GLU 43 -6.838 -5.510 -5.510 681 H LEU 344 H LEU 44 -5.257 -2.464 -2.464 682 HA LEU 344 HA LEU 44 -3.288 -4.442 -4.442 683 1HB LEU 344 2HB LEU 44 -3.108 -1.430 -1.430 684 2HB LEU 344 1HB LEU 44 -1.639 -2.394 -2.394 685 HG LEU 344 HG LEU 44 -1.955 -2.003 -2.003 686 1HD1 LEU 344 3HD1 LEU 44 -2.203 -4.542 -4.542 687 2HD1 LEU 344 2HD1 LEU 44 -3.826 -4.337 -4.337 688 3HD1 LEU 344 1HD1 LEU 44 -2.414 -4.045 -4.045 689 1HD2 LEU 344 3HD2 LEU 44 -4.147 -0.813 -0.813 690 2HD2 LEU 344 2HD2 LEU 44 -4.083 -1.725 -1.725 691 3HD2 LEU 344 1HD2 LEU 44 -4.943 -2.382 -2.382 692 H ASN 345 H ASN 45 -3.093 -1.744 -1.744 693 HA ASN 345 HA ASN 45 -1.150 -2.630 -2.630 694 1HB ASN 345 2HB ASN 45 -2.944 -0.621 -0.621 695 2HB ASN 345 1HB ASN 45 -3.628 -1.679 -1.679 696 1HD2 ASN 345 2HD2 ASN 45 -1.277 0.267 0.267 697 2HD2 ASN 345 1HD2 ASN 45 -2.853 0.354 0.354 698 H GLU 346 H GLU 46 -4.453 -3.886 -3.886 699 HA GLU 346 HA GLU 46 -4.284 -5.489 -5.489 700 1HB GLU 346 2HB GLU 46 -6.446 -4.900 -4.900 701 2HB GLU 346 1HB GLU 46 -6.036 -5.814 -5.814 702 1HG GLU 346 2HG GLU 46 -7.394 -7.273 -7.273 703 2HG GLU 346 1HG GLU 46 -5.739 -7.840 -7.840 704 H ALA 347 H ALA 47 -3.877 -6.316 -6.316 705 HA ALA 347 HA ALA 47 -3.277 -9.062 -9.062 706 1HB ALA 347 2HB ALA 47 -3.821 -7.916 -7.916 707 2HB ALA 347 1HB ALA 47 -2.142 -7.380 -7.380 708 3HB ALA 347 3HB ALA 47 -2.518 -9.103 -9.103 709 H LEU 348 H LEU 48 -1.150 -6.207 -6.207 710 HA LEU 348 HA LEU 48 1.331 -7.582 -7.582 711 1HB LEU 348 2HB LEU 48 0.589 -4.879 -4.879 712 2HB LEU 348 1HB LEU 48 2.227 -5.460 -5.460 713 HG LEU 348 HG LEU 48 0.173 -5.319 -5.319 714 1HD1 LEU 348 1HD1 LEU 48 1.440 -3.123 -3.123 715 2HD1 LEU 348 3HD1 LEU 48 1.990 -3.182 -3.182 716 3HD1 LEU 348 2HD1 LEU 48 0.267 -3.070 -3.070 717 1HD2 LEU 348 3HD2 LEU 48 2.851 -6.261 -6.261 718 2HD2 LEU 348 2HD2 LEU 48 1.873 -6.165 -6.165 719 3HD2 LEU 348 1HD2 LEU 48 2.899 -4.808 -4.808 720 H GLU 349 H GLU 49 -0.631 -6.114 -6.114 721 HA GLU 349 HA GLU 49 0.957 -7.103 -7.103 722 1HB GLU 349 2HB GLU 49 -1.695 -5.905 -5.905 723 2HB GLU 349 1HB GLU 49 -1.634 -7.082 -7.082 724 1HG GLU 349 2HG GLU 49 0.619 -5.854 -5.854 725 2HG GLU 349 1HG GLU 49 -0.087 -4.531 -4.531 726 H LEU 350 H LEU 50 -1.426 -8.666 -8.666 727 HA LEU 350 HA LEU 50 -1.847 -10.928 -10.928 728 1HB LEU 350 2HB LEU 50 -3.463 -11.399 -11.399 729 2HB LEU 350 1HB LEU 50 -2.959 -9.985 -9.985 730 HG LEU 350 HG LEU 50 -1.244 -11.466 -11.466 731 1HD1 LEU 350 2HD1 LEU 50 -2.163 -13.280 -13.280 732 2HD1 LEU 350 1HD1 LEU 50 -2.628 -13.932 -13.932 733 3HD1 LEU 350 3HD1 LEU 50 -0.937 -13.560 -13.560 734 1HD2 LEU 350 1HD2 LEU 50 -3.640 -10.875 -10.875 735 2HD2 LEU 350 3HD2 LEU 50 -2.806 -12.213 -12.213 736 3HD2 LEU 350 2HD2 LEU 50 -4.039 -12.535 -12.535 737 H LYS 351 H LYS 51 0.459 -10.098 -10.098 738 HA LYS 351 HA LYS 51 1.606 -12.677 -12.677 739 1HB LYS 351 2HB LYS 51 2.104 -10.646 -10.646 740 2HB LYS 351 1HB LYS 51 3.047 -10.008 -10.008 741 1HG LYS 351 2HG LYS 51 4.762 -11.493 -11.493 742 2HG LYS 351 1HG LYS 51 3.684 -12.783 -12.783 743 1HD LYS 351 2HD LYS 51 3.370 -10.981 -10.981 744 2HD LYS 351 1HD LYS 51 5.056 -10.707 -10.707 745 1HE LYS 351 2HE LYS 51 5.108 -13.372 -13.372 746 2HE LYS 351 1HE LYS 51 3.759 -13.160 -13.160 747 1HZ LYS 351 2HZ LYS 51 5.175 -11.657 -11.657 748 2HZ LYS 351 1HZ LYS 51 6.477 -11.995 -11.995 749 3HZ LYS 351 3HZ LYS 51 5.809 -13.231 -13.231 750 H ASP 352 H ASP 52 2.216 -10.158 -10.158 751 HA ASP 352 HA ASP 52 4.421 -11.569 -11.569 752 1HB ASP 352 2HB ASP 52 3.143 -9.030 -9.030 753 2HB ASP 352 1HB ASP 52 3.114 -9.807 -9.807 754 H ALA 353 H ALA 53 0.944 -11.649 -11.649 755 HA ALA 353 HA ALA 53 1.073 -13.214 -13.214 756 1HB ALA 353 1HB ALA 53 -1.179 -12.036 -12.036 757 2HB ALA 353 3HB ALA 53 -1.486 -13.199 -13.199 758 3HB ALA 353 2HB ALA 53 -0.713 -11.657 -11.657 759 H GLN 354 H GLN 54 2.041 -14.194 -14.194 760 HA GLN 354 HA GLN 54 0.117 -16.355 -16.355 761 1HB GLN 354 2HB GLN 54 2.437 -15.131 -15.131 762 2HB GLN 354 1HB GLN 54 2.347 -16.884 -16.884 763 1HG GLN 354 2HG GLN 54 -0.232 -16.297 -16.297 764 2HG GLN 354 1HG GLN 54 0.490 -14.782 -14.782 765 1HE2 GLN 354 2HE2 GLN 54 0.458 -17.540 -17.540 766 2HE2 GLN 354 1HE2 GLN 54 -0.736 -17.139 -17.139 767 H ALA 355 HN ALA 55 2.200 -15.952 -15.952 768 HA ALA 355 HA ALA 55 3.026 -18.828 -18.828 769 1HB ALA 355 3HB ALA 55 4.809 -16.825 -16.825 770 2HB ALA 355 2HB ALA 55 4.576 -16.866 -16.866 771 3HB ALA 355 1HB ALA 55 5.131 -18.308 -18.308 772 1H GLY 325 2H GLY 25 -14.747 14.630 14.630 773 2H GLY 325 1H GLY 25 -14.207 13.679 13.679 774 3H GLY 325 3H GLY 25 -15.870 13.880 13.880 775 1HA GLY 325 2HA GLY 25 -15.936 12.147 12.147 776 2HA GLY 325 1HA GLY 25 -14.243 11.854 11.854 777 H GLU 326 H GLU 26 -12.832 11.972 11.972 778 HA GLU 326 HA GLU 26 -13.163 13.933 13.933 779 1HB GLU 326 2HB GLU 26 -13.870 11.045 11.045 780 2HB GLU 326 1HB GLU 26 -13.087 11.918 11.918 781 1HG GLU 326 2HG GLU 26 -15.011 13.712 13.712 782 2HG GLU 326 1HG GLU 26 -15.826 12.156 12.156 783 H TYR 327 H TYR 27 -11.493 12.871 12.871 784 HA TYR 327 HA TYR 27 -8.958 12.553 12.553 785 1HB TYR 327 2HB TYR 27 -9.699 13.864 13.864 786 2HB TYR 327 1HB TYR 27 -8.130 13.058 13.058 787 HD1 TYR 327 HD2 TYR 27 -10.205 15.708 15.708 788 HD2 TYR 327 HD1 TYR 27 -6.326 13.869 13.869 789 HE1 TYR 327 HE2 TYR 27 -9.249 17.612 17.612 790 HE2 TYR 327 HE1 TYR 27 -5.370 15.773 15.773 791 HH TYR 327 HH TYR 27 -6.965 18.687 18.687 792 H PHE 328 H PHE 28 -8.511 10.390 10.390 793 HA PHE 328 HA PHE 28 -9.041 8.615 8.615 794 1HB PHE 328 2HB PHE 28 -8.650 8.149 8.149 795 2HB PHE 328 1HB PHE 28 -8.354 6.837 6.837 796 HD1 PHE 328 HD2 PHE 28 -10.209 6.265 6.265 797 HD2 PHE 328 HD1 PHE 28 -10.850 8.701 8.701 798 HE1 PHE 328 HE2 PHE 28 -12.649 5.850 5.850 799 HE2 PHE 328 HE1 PHE 28 -13.290 8.286 8.286 800 HZ PHE 328 HZ PHE 28 -14.189 6.861 6.861 801 H THR 329 H THR 29 -7.298 7.042 7.042 802 HA THR 329 HA THR 29 -4.584 8.136 8.136 803 HB THR 329 HB THR 29 -4.882 6.742 6.742 804 HG1 THR 329 HG1 THR 29 -6.821 7.860 7.860 805 1HG2 THR 329 1HG2 THR 29 -2.978 8.251 8.251 806 2HG2 THR 329 3HG2 THR 29 -3.876 9.531 9.531 807 3HG2 THR 329 2HG2 THR 29 -3.207 8.189 8.189 808 H LEU 330 H LEU 30 -3.008 6.613 6.613 809 HA LEU 330 HA LEU 30 -3.867 3.747 3.747 810 1HB LEU 330 2HB LEU 30 -3.318 5.240 5.240 811 2HB LEU 330 1HB LEU 30 -1.783 4.430 4.430 812 HG LEU 330 HG LEU 30 -3.719 2.454 2.454 813 1HD1 LEU 330 1HD1 LEU 30 -4.970 4.415 4.415 814 2HD1 LEU 330 3HD1 LEU 30 -4.332 3.346 3.346 815 3HD1 LEU 330 2HD1 LEU 30 -5.411 2.707 2.707 816 1HD2 LEU 330 2HD2 LEU 30 -1.479 2.195 2.195 817 2HD2 LEU 330 1HD2 LEU 30 -2.733 1.476 1.476 818 3HD2 LEU 330 3HD2 LEU 30 -2.049 3.044 3.044 819 H GLN 331 H GLN 31 -2.806 3.419 3.419 820 HA GLN 331 HA GLN 31 0.008 4.148 4.148 821 1HB GLN 331 2HB GLN 31 -1.707 2.336 2.336 822 2HB GLN 331 1HB GLN 31 -0.156 3.044 3.044 823 1HG GLN 331 2HG GLN 31 -1.108 5.301 5.301 824 2HG GLN 331 1HG GLN 31 -2.658 4.613 4.613 825 1HE2 GLN 331 2HE2 GLN 31 -1.616 4.662 4.662 826 2HE2 GLN 331 1HE2 GLN 31 -0.542 5.216 5.216 827 H ILE 332 H ILE 32 1.462 3.014 3.014 828 HA ILE 332 HA ILE 32 1.016 0.096 0.096 829 HB ILE 332 HB ILE 32 2.836 2.084 2.084 830 1HG1 ILE 332 2HG1 ILE 32 1.042 0.381 0.381 831 2HG1 ILE 332 1HG1 ILE 32 0.178 1.402 1.402 832 1HG2 ILE 332 2HG2 ILE 32 2.641 -0.927 -0.927 833 2HG2 ILE 332 1HG2 ILE 32 3.453 0.126 0.126 834 3HG2 ILE 332 3HG2 ILE 32 4.059 0.000 0.000 835 1HD1 ILE 332 2HD1 ILE 32 2.321 2.855 2.855 836 2HD1 ILE 332 1HD1 ILE 32 1.149 2.199 2.199 837 3HD1 ILE 332 3HD1 ILE 32 0.613 3.269 3.269 838 H ARG 333 H ARG 33 2.067 -1.220 -1.220 839 HA ARG 333 HA ARG 33 4.234 -0.199 -0.199 840 1HB ARG 333 2HB ARG 33 2.406 -2.401 -2.401 841 2HB ARG 333 1HB ARG 33 4.047 -3.042 -3.042 842 1HG ARG 333 2HG ARG 33 4.442 -1.163 -1.163 843 2HG ARG 333 1HG ARG 33 2.682 -1.081 -1.081 844 1HD ARG 333 2HD ARG 33 4.280 -3.628 -3.628 845 2HD ARG 333 1HD ARG 33 3.688 -2.630 -2.630 846 HE ARG 333 HE ARG 33 1.370 -3.074 -3.074 847 1HH1 ARG 333 1HH2 ARG 33 2.656 -5.232 -5.232 848 2HH1 ARG 333 2HH2 ARG 33 2.313 -6.650 -6.650 849 1HH2 ARG 333 2HH1 ARG 33 1.513 -4.887 -4.887 850 2HH2 ARG 333 1HH1 ARG 33 1.666 -6.455 -6.455 851 H GLY 334 H GLY 34 5.921 0.274 0.274 852 1HA GLY 334 2HA GLY 34 7.884 -1.638 -1.638 853 2HA GLY 334 1HA GLY 34 6.881 -1.691 -1.691 854 H ARG 335 H ARG 35 8.332 -0.731 -0.731 855 HA ARG 335 HA ARG 35 8.580 2.178 2.178 856 1HB ARG 335 2HB ARG 35 10.582 0.949 0.949 857 2HB ARG 335 1HB ARG 35 11.188 0.762 0.762 858 1HG ARG 335 2HG ARG 35 11.666 2.970 2.970 859 2HG ARG 335 1HG ARG 35 10.155 3.453 3.453 860 1HD ARG 335 2HD ARG 35 11.232 2.653 2.653 861 2HD ARG 335 1HD ARG 35 12.756 2.672 2.672 862 HE ARG 335 HE ARG 35 11.465 5.176 5.176 863 1HH1 ARG 335 1HH2 ARG 35 10.883 4.846 4.846 864 2HH1 ARG 335 2HH2 ARG 35 12.304 5.508 5.508 865 1HH2 ARG 335 2HH1 ARG 35 14.198 5.360 5.360 866 2HH2 ARG 335 1HH1 ARG 35 14.180 5.801 5.801 867 H GLU 336 H GLU 36 10.049 -0.616 -0.616 868 HA GLU 336 HA GLU 36 10.286 0.658 0.658 869 1HB GLU 336 2HB GLU 36 10.978 -1.785 -1.785 870 2HB GLU 336 1HB GLU 36 9.537 -2.222 -2.222 871 1HG GLU 336 2HG GLU 36 10.554 -1.837 -1.837 872 2HG GLU 336 1HG GLU 36 11.290 -0.340 -0.340 873 H ARG 337 H ARG 37 7.618 -1.339 -1.339 874 HA ARG 337 HA ARG 37 5.912 -1.121 -1.121 875 1HB ARG 337 2HB ARG 37 5.745 -2.373 -2.373 876 2HB ARG 337 1HB ARG 37 4.565 -1.075 -1.075 877 1HG ARG 337 2HG ARG 37 3.113 -2.328 -2.328 878 2HG ARG 337 1HG ARG 37 4.139 -2.072 -2.072 879 1HD ARG 337 2HD ARG 37 4.477 -4.308 -4.308 880 2HD ARG 337 1HD ARG 37 3.757 -4.485 -4.485 881 HE ARG 337 HE ARG 37 6.107 -3.565 -3.565 882 1HH1 ARG 337 1HH2 ARG 37 5.227 -6.282 -6.282 883 2HH1 ARG 337 2HH2 ARG 37 6.843 -6.764 -6.764 884 1HH2 ARG 337 2HH1 ARG 37 8.294 -3.881 -3.881 885 2HH2 ARG 337 1HH1 ARG 37 8.580 -5.404 -5.404 886 H PHE 338 H PHE 38 6.356 0.999 0.999 887 HA PHE 338 HA PHE 38 4.220 2.802 2.802 888 1HB PHE 338 2HB PHE 38 5.493 2.847 2.847 889 2HB PHE 338 1HB PHE 38 6.934 3.370 3.370 890 HD1 PHE 338 HD1 PHE 38 3.370 4.326 4.326 891 HD2 PHE 338 HD2 PHE 38 7.334 5.658 5.658 892 HE1 PHE 338 HE1 PHE 38 2.621 6.682 6.682 893 HE2 PHE 338 HE2 PHE 38 6.585 8.016 8.016 894 HZ PHE 338 HZ PHE 38 4.228 8.528 8.528 895 H GLU 339 H GLU 39 7.520 2.621 2.621 896 HA GLU 339 HA GLU 39 7.376 5.122 5.122 897 1HB GLU 339 2HB GLU 39 9.156 2.686 2.686 898 2HB GLU 339 1HB GLU 39 9.316 4.053 4.053 899 1HG GLU 339 2HG GLU 39 9.151 5.190 5.190 900 2HG GLU 339 1HG GLU 39 10.232 3.806 3.806 901 H MET 340 H MET 40 6.663 1.741 1.741 902 HA MET 340 HA MET 40 6.252 2.014 2.014 903 1HB MET 340 2HB MET 40 5.586 0.086 0.086 904 2HB MET 340 1HB MET 40 4.300 0.215 0.215 905 1HG MET 340 2HG MET 40 5.891 -0.195 -0.195 906 2HG MET 340 1HG MET 40 7.229 -0.216 -0.216 907 1HE MET 340 2HE MET 40 3.674 -1.400 -1.400 908 2HE MET 340 1HE MET 40 3.671 -3.076 -3.076 909 3HE MET 340 3HE MET 40 3.936 -1.770 -1.770 910 H PHE 341 H PHE 41 3.974 2.403 2.403 911 HA PHE 341 HA PHE 41 1.768 3.196 3.196 912 1HB PHE 341 2HB PHE 41 2.340 3.273 3.273 913 2HB PHE 341 1HB PHE 41 0.950 4.153 4.153 914 HD1 PHE 341 HD1 PHE 41 2.287 1.071 1.071 915 HD2 PHE 341 HD2 PHE 41 -0.755 2.741 2.741 916 HE1 PHE 341 HE1 PHE 41 1.010 -1.047 -1.047 917 HE2 PHE 341 HE2 PHE 41 -2.034 0.620 0.620 918 HZ PHE 341 HZ PHE 41 -1.151 -1.274 -1.274 919 H ARG 342 H ARG 42 4.410 4.887 4.887 920 HA ARG 342 HA ARG 42 3.397 7.536 7.536 921 1HB ARG 342 2HB ARG 42 5.867 6.318 6.318 922 2HB ARG 342 1HB ARG 42 6.212 7.458 7.458 923 1HG ARG 342 2HG ARG 42 4.496 8.282 8.282 924 2HG ARG 342 1HG ARG 42 6.255 8.335 8.335 925 1HD ARG 342 2HD ARG 42 6.117 9.617 9.617 926 2HD ARG 342 1HD ARG 42 4.439 9.902 9.902 927 HE ARG 342 HE ARG 42 6.098 10.585 10.585 928 1HH1 ARG 342 2HH1 ARG 42 7.377 11.605 11.605 929 2HH1 ARG 342 1HH1 ARG 42 6.845 13.252 13.252 930 1HH2 ARG 342 1HH2 ARG 42 4.524 12.703 12.703 931 2HH2 ARG 342 2HH2 ARG 42 5.229 13.873 13.873 932 H GLU 343 H GLU 43 4.807 5.424 5.424 933 HA GLU 343 HA GLU 43 5.048 7.495 7.495 934 1HB GLU 343 2HB GLU 43 6.332 5.319 5.319 935 2HB GLU 343 1HB GLU 43 4.829 4.506 4.506 936 1HG GLU 343 2HG GLU 43 5.966 4.947 4.947 937 2HG GLU 343 1HG GLU 43 4.665 6.134 6.134 938 H LEU 344 H LEU 44 2.849 4.643 4.643 939 HA LEU 344 HA LEU 44 1.051 5.487 5.487 940 1HB LEU 344 2HB LEU 44 0.652 3.918 3.918 941 2HB LEU 344 1HB LEU 44 -0.733 4.326 4.326 942 HG LEU 344 HG LEU 44 -0.158 2.241 2.241 943 1HD1 LEU 344 3HD1 LEU 44 0.131 4.243 4.243 944 2HD1 LEU 344 2HD1 LEU 44 1.809 3.700 3.700 945 3HD1 LEU 344 1HD1 LEU 44 0.520 2.590 2.590 946 1HD2 LEU 344 3HD2 LEU 44 1.893 2.095 2.095 947 2HD2 LEU 344 2HD2 LEU 44 2.074 1.356 1.356 948 3HD2 LEU 344 1HD2 LEU 44 2.777 2.941 2.941 949 H ASN 345 H ASN 45 0.407 5.908 5.908 950 HA ASN 345 HA ASN 45 -1.671 7.694 7.694 951 1HB ASN 345 2HB ASN 45 -0.040 6.798 6.798 952 2HB ASN 345 1HB ASN 45 0.547 8.456 8.456 953 1HD2 ASN 345 2HD2 ASN 45 -2.158 8.850 8.850 954 2HD2 ASN 345 1HD2 ASN 45 -0.521 8.408 8.408 955 H GLU 346 H GLU 46 1.700 8.443 8.443 956 HA GLU 346 HA GLU 46 1.353 11.306 11.306 957 1HB GLU 346 2HB GLU 46 3.576 10.279 10.279 958 2HB GLU 346 1HB GLU 46 3.401 9.563 9.563 959 1HG GLU 346 2HG GLU 46 4.686 11.554 11.554 960 2HG GLU 346 1HG GLU 46 3.059 11.937 11.937 961 H ALA 347 H ALA 47 1.407 8.854 8.854 962 HA ALA 347 HA ALA 47 0.925 10.678 10.678 963 1HB ALA 347 2HB ALA 47 1.598 8.217 8.217 964 2HB ALA 347 1HB ALA 47 -0.105 7.836 7.836 965 3HB ALA 347 3HB ALA 47 0.385 8.766 8.766 966 H LEU 348 H LEU 48 -1.354 8.808 8.808 967 HA LEU 348 HA LEU 48 -3.746 9.599 9.599 968 1HB LEU 348 2HB LEU 48 -3.309 9.128 9.128 969 2HB LEU 348 1HB LEU 48 -4.862 9.083 9.083 970 HG LEU 348 HG LEU 48 -2.562 7.314 7.314 971 1HD1 LEU 348 1HD1 LEU 48 -4.121 7.181 7.181 972 2HD1 LEU 348 3HD1 LEU 48 -4.469 5.787 5.787 973 3HD1 LEU 348 2HD1 LEU 48 -2.810 6.130 6.130 974 1HD2 LEU 348 3HD2 LEU 48 -5.182 7.860 7.860 975 2HD2 LEU 348 2HD2 LEU 48 -4.041 6.653 6.653 976 3HD2 LEU 348 1HD2 LEU 48 -5.204 6.227 6.227 977 H GLU 349 H GLU 49 -2.204 11.097 11.097 978 HA GLU 349 HA GLU 49 -3.969 13.319 13.319 979 1HB GLU 349 2HB GLU 49 -1.383 12.571 12.571 980 2HB GLU 349 1HB GLU 49 -1.527 14.309 14.309 981 1HG GLU 349 2HG GLU 49 -3.913 13.979 13.979 982 2HG GLU 349 1HG GLU 49 -3.184 12.527 12.527 983 H LEU 350 H LEU 50 -1.257 12.656 12.656 984 HA LEU 350 HA LEU 50 -0.910 15.394 15.394 985 1HB LEU 350 2HB LEU 50 0.899 14.513 14.513 986 2HB LEU 350 1HB LEU 50 0.433 12.943 12.943 987 HG LEU 350 HG LEU 50 -1.035 12.651 12.651 988 1HD1 LEU 350 2HD1 LEU 50 -0.271 15.384 15.384 989 2HD1 LEU 350 1HD1 LEU 50 0.394 14.448 14.448 990 3HD1 LEU 350 3HD1 LEU 50 -1.337 14.409 14.409 991 1HD2 LEU 350 1HD2 LEU 50 1.408 11.830 11.830 992 2HD2 LEU 350 3HD2 LEU 50 0.757 11.848 11.848 993 3HD2 LEU 350 2HD2 LEU 50 1.839 13.132 13.132 994 H LYS 351 H LYS 51 -2.944 12.687 12.687 995 HA LYS 351 HA LYS 51 -3.862 13.702 13.702 996 1HB LYS 351 2HB LYS 51 -4.314 11.389 11.389 997 2HB LYS 351 1HB LYS 51 -5.460 12.089 12.089 998 1HG LYS 351 2HG LYS 51 -7.019 12.529 12.529 999 2HG LYS 351 1HG LYS 51 -5.799 12.876 12.876 1000 1HD LYS 351 2HD LYS 51 -5.350 10.219 10.219 1001 2HD LYS 351 1HD LYS 51 -7.091 10.311 10.311 1002 1HE LYS 351 2HE LYS 51 -6.982 11.787 11.787 1003 2HE LYS 351 1HE LYS 51 -5.522 10.835 10.835 1004 1HZ LYS 351 2HZ LYS 51 -6.856 8.823 8.823 1005 2HZ LYS 351 1HZ LYS 51 -8.253 9.783 9.783 1006 3HZ LYS 351 3HZ LYS 51 -7.398 9.716 9.716 1007 H ASP 352 H ASP 52 -4.929 14.277 14.277 1008 HA ASP 352 HA ASP 52 -7.178 15.945 15.945 1009 1HB ASP 352 2HB ASP 52 -6.110 14.852 14.852 1010 2HB ASP 352 1HB ASP 52 -6.229 16.598 16.598 1011 H ALA 353 H ALA 53 -3.764 16.440 16.440 1012 HA ALA 353 HA ALA 53 -4.098 19.386 19.386 1013 1HB ALA 353 1HB ALA 53 -1.744 17.534 17.534 1014 2HB ALA 353 3HB ALA 53 -1.525 19.269 19.269 1015 3HB ALA 353 2HB ALA 53 -2.437 18.668 18.668 1016 H GLN 354 H GLN 54 -4.647 17.594 17.594 1017 HA GLN 354 HA GLN 54 -2.527 18.432 18.432 1018 1HB GLN 354 2HB GLN 54 -4.701 16.456 16.456 1019 2HB GLN 354 1HB GLN 54 -4.533 17.310 17.310 1020 1HG GLN 354 2HG GLN 54 -1.945 16.842 16.842 1021 2HG GLN 354 1HG GLN 54 -2.602 15.505 15.505 1022 1HE2 GLN 354 2HE2 GLN 54 -2.175 14.636 14.636 1023 2HE2 GLN 354 1HE2 GLN 54 -1.141 15.476 15.476 1024 H ALA 355 HN ALA 55 -4.907 20.082 20.082 1025 HA ALA 355 HA ALA 55 -5.541 21.581 21.581 1026 1HB ALA 355 3HB ALA 55 -7.422 20.248 20.248 1027 2HB ALA 355 2HB ALA 55 -7.411 21.739 21.739 1028 3HB ALA 355 1HB ALA 55 -7.757 21.791 21.791 Start of MODEL 16 1 1H GLY 325 3H GLY 25 13.274 2.373 2.373 2 2H GLY 325 2H GLY 25 13.297 3.356 3.356 3 3H GLY 325 1H GLY 25 14.116 1.867 1.867 4 1HA GLY 325 2HA GLY 25 12.197 1.389 1.389 5 2HA GLY 325 1HA GLY 25 11.213 2.382 2.382 6 H GLU 326 H GLU 26 11.380 -0.654 -0.654 7 HA GLU 326 HA GLU 26 11.457 -1.725 -1.725 8 1HB GLU 326 2HB GLU 26 11.872 -2.938 -2.938 9 2HB GLU 326 1HB GLU 26 11.312 -3.963 -3.963 10 1HG GLU 326 2HG GLU 26 13.457 -2.270 -2.270 11 2HG GLU 326 1HG GLU 26 13.968 -3.144 -3.144 12 H TYR 327 H TYR 27 9.759 -3.528 -3.528 13 HA TYR 327 HA TYR 27 7.142 -2.469 -2.469 14 1HB TYR 327 2HB TYR 27 8.074 -3.957 -3.957 15 2HB TYR 327 1HB TYR 27 6.423 -4.251 -4.251 16 HD1 TYR 327 HD2 TYR 27 4.837 -2.312 -2.312 17 HD2 TYR 327 HD1 TYR 27 8.689 -1.904 -1.904 18 HE1 TYR 327 HE2 TYR 27 4.121 -0.165 -0.165 19 HE2 TYR 327 HE1 TYR 27 7.973 0.243 0.243 20 HH TYR 327 HH TYR 27 6.034 1.456 1.456 21 H PHE 328 H PHE 28 6.313 -3.514 -3.514 22 HA PHE 328 HA PHE 28 6.844 -6.453 -6.453 23 1HB PHE 328 2HB PHE 28 6.280 -4.424 -4.424 24 2HB PHE 328 1HB PHE 28 6.483 -6.157 -6.157 25 HD1 PHE 328 HD2 PHE 28 8.674 -7.244 -7.244 26 HD2 PHE 328 HD1 PHE 28 8.168 -2.994 -2.994 27 HE1 PHE 328 HE2 PHE 28 11.134 -6.944 -6.944 28 HE2 PHE 328 HE1 PHE 28 10.628 -2.695 -2.695 29 HZ PHE 328 HZ PHE 28 12.112 -4.669 -4.669 30 H THR 329 H THR 29 5.048 -7.773 -7.773 31 HA THR 329 HA THR 29 2.384 -6.464 -6.464 32 HB THR 329 HB THR 29 2.428 -9.357 -9.357 33 HG1 THR 329 HG1 THR 29 4.242 -9.438 -9.438 34 1HG2 THR 329 3HG2 THR 29 0.803 -7.427 -7.427 35 2HG2 THR 329 2HG2 THR 29 1.884 -7.370 -7.370 36 3HG2 THR 329 1HG2 THR 29 1.031 -8.861 -8.861 37 H LEU 330 H LEU 30 1.086 -6.507 -6.507 38 HA LEU 330 HA LEU 30 1.755 -8.456 -8.456 39 1HB LEU 330 2HB LEU 30 0.991 -5.655 -5.655 40 2HB LEU 330 1HB LEU 30 -0.181 -6.598 -6.598 41 HG LEU 330 HG LEU 30 2.746 -7.101 -7.101 42 1HD1 LEU 330 1HD1 LEU 30 1.163 -4.722 -4.722 43 2HD1 LEU 330 3HD1 LEU 30 2.523 -5.358 -5.358 44 3HD1 LEU 330 2HD1 LEU 30 2.778 -4.749 -4.749 45 1HD2 LEU 330 3HD2 LEU 30 0.164 -7.573 -7.573 46 2HD2 LEU 330 2HD2 LEU 30 1.650 -8.522 -8.522 47 3HD2 LEU 330 1HD2 LEU 30 1.484 -7.091 -7.091 48 H GLN 331 H GLN 31 0.612 -10.270 -10.270 49 HA GLN 331 HA GLN 31 -2.209 -9.934 -9.934 50 1HB GLN 331 2HB GLN 31 -0.898 -11.500 -11.500 51 2HB GLN 331 1HB GLN 31 -0.400 -12.364 -12.364 52 1HG GLN 331 2HG GLN 31 -2.768 -12.937 -12.937 53 2HG GLN 331 1HG GLN 31 -3.235 -12.124 -12.124 54 1HE2 GLN 331 2HE2 GLN 31 -1.037 -14.714 -14.714 55 2HE2 GLN 331 1HE2 GLN 31 -0.779 -13.066 -13.066 56 H ILE 332 H ILE 32 -3.715 -9.880 -9.880 57 HA ILE 332 HA ILE 32 -3.219 -11.526 -11.526 58 HB ILE 332 HB ILE 32 -4.785 -8.937 -8.937 59 1HG1 ILE 332 2HG1 ILE 32 -2.502 -8.996 -8.996 60 2HG1 ILE 332 1HG1 ILE 32 -2.019 -9.332 -9.332 61 1HG2 ILE 332 2HG2 ILE 32 -4.193 -10.798 -10.798 62 2HG2 ILE 332 1HG2 ILE 32 -4.696 -9.123 -9.123 63 3HG2 ILE 332 3HG2 ILE 32 -5.770 -10.261 -10.261 64 1HD1 ILE 332 3HD1 ILE 32 -3.317 -7.295 -7.295 65 2HD1 ILE 332 2HD1 ILE 32 -3.574 -6.927 -6.927 66 3HD1 ILE 332 1HD1 ILE 32 -1.940 -6.933 -6.933 67 H ARG 333 H ARG 33 -4.718 -13.077 -13.077 68 HA ARG 333 HA ARG 33 -7.064 -13.269 -13.269 69 1HB ARG 333 2HB ARG 33 -5.881 -15.331 -15.331 70 2HB ARG 333 1HB ARG 33 -5.880 -15.106 -15.106 71 1HG ARG 333 2HG ARG 33 -8.353 -15.278 -15.278 72 2HG ARG 333 1HG ARG 33 -8.332 -15.549 -15.549 73 1HD ARG 333 2HD ARG 33 -8.412 -17.732 -17.732 74 2HD ARG 333 1HD ARG 33 -6.694 -17.494 -17.494 75 HE ARG 333 HE ARG 33 -7.923 -17.247 -17.247 76 1HH1 ARG 333 2HH1 ARG 33 -5.732 -16.326 -16.326 77 2HH1 ARG 333 1HH1 ARG 33 -4.455 -17.488 -17.488 78 1HH2 ARG 333 1HH2 ARG 33 -6.097 -19.441 -19.441 79 2HH2 ARG 333 2HH2 ARG 33 -4.660 -19.250 -19.250 80 H GLY 334 H GLY 34 -8.481 -11.655 -11.655 81 1HA GLY 334 2HA GLY 34 -10.184 -12.298 -12.298 82 2HA GLY 334 1HA GLY 34 -9.038 -11.060 -11.060 83 H ARG 335 H ARG 35 -10.353 -9.264 -9.264 84 HA ARG 335 HA ARG 35 -11.047 -7.999 -7.999 85 1HB ARG 335 2HB ARG 35 -12.937 -9.736 -9.736 86 2HB ARG 335 1HB ARG 35 -13.443 -8.615 -8.615 87 1HG ARG 335 2HG ARG 35 -13.971 -6.925 -6.925 88 2HG ARG 335 1HG ARG 35 -12.885 -7.557 -7.557 89 1HD ARG 335 2HD ARG 35 -14.575 -9.653 -9.653 90 2HD ARG 335 1HD ARG 35 -15.677 -8.348 -8.348 91 HE ARG 335 HE ARG 35 -14.324 -8.658 -8.658 92 1HH1 ARG 335 2HH1 ARG 35 -14.722 -5.801 -5.801 93 2HH1 ARG 335 1HH1 ARG 35 -16.187 -5.349 -5.349 94 1HH2 ARG 335 1HH2 ARG 35 -16.951 -8.581 -8.581 95 2HH2 ARG 335 2HH2 ARG 35 -17.448 -6.922 -6.922 96 H GLU 336 H GLU 36 -11.867 -8.120 -8.120 97 HA GLU 336 HA GLU 36 -12.123 -5.220 -5.220 98 1HB GLU 336 2HB GLU 36 -11.932 -7.374 -7.374 99 2HB GLU 336 1HB GLU 36 -12.165 -5.665 -5.665 100 1HG GLU 336 2HG GLU 36 -14.192 -5.763 -5.763 101 2HG GLU 336 1HG GLU 36 -14.026 -7.518 -7.518 102 H ARG 337 H ARG 37 -9.637 -7.612 -7.612 103 HA ARG 337 HA ARG 37 -7.839 -5.686 -5.686 104 1HB ARG 337 2HB ARG 37 -7.302 -8.396 -8.396 105 2HB ARG 337 1HB ARG 37 -6.098 -7.459 -7.459 106 1HG ARG 337 2HG ARG 37 -8.128 -7.435 -7.435 107 2HG ARG 337 1HG ARG 37 -8.425 -8.988 -8.988 108 1HD ARG 337 2HD ARG 37 -5.604 -8.756 -8.756 109 2HD ARG 337 1HD ARG 37 -6.440 -8.360 -8.360 110 HE ARG 337 HE ARG 37 -6.447 -10.976 -10.976 111 1HH1 ARG 337 1HH2 ARG 37 -8.900 -9.211 -9.211 112 2HH1 ARG 337 2HH2 ARG 37 -9.204 -10.283 -10.283 113 1HH2 ARG 337 2HH1 ARG 37 -6.378 -12.213 -12.213 114 2HH2 ARG 337 1HH1 ARG 37 -7.774 -11.983 -11.983 115 H PHE 338 H PHE 38 -8.238 -6.982 -6.982 116 HA PHE 338 HA PHE 38 -5.962 -5.691 -5.691 117 1HB PHE 338 2HB PHE 38 -7.175 -7.435 -7.435 118 2HB PHE 338 1HB PHE 38 -8.622 -6.427 -6.427 119 HD1 PHE 338 HD2 PHE 38 -5.045 -6.539 -6.539 120 HD2 PHE 338 HD1 PHE 38 -8.930 -4.825 -4.825 121 HE1 PHE 338 HE2 PHE 38 -4.218 -5.444 -5.444 122 HE2 PHE 338 HE1 PHE 38 -8.103 -3.729 -3.729 123 HZ PHE 338 HZ PHE 38 -5.748 -4.038 -4.038 124 H GLU 339 H GLU 39 -9.311 -4.592 -4.592 125 HA GLU 339 HA GLU 39 -9.019 -2.110 -2.110 126 1HB GLU 339 2HB GLU 39 -10.864 -3.009 -3.009 127 2HB GLU 339 1HB GLU 39 -10.939 -1.383 -1.383 128 1HG GLU 339 2HG GLU 39 -10.845 -3.017 -3.017 129 2HG GLU 339 1HG GLU 39 -11.873 -3.904 -3.904 130 H MET 340 H MET 40 -8.570 -3.002 -3.002 131 HA MET 340 HA MET 40 -7.992 -0.486 -0.486 132 1HB MET 340 2HB MET 40 -7.055 -3.256 -3.256 133 2HB MET 340 1HB MET 40 -6.316 -1.892 -1.892 134 1HG MET 340 2HG MET 40 -8.350 -1.244 -1.244 135 2HG MET 340 1HG MET 40 -9.314 -2.155 -2.155 136 1HE MET 340 1HE MET 40 -6.223 -2.773 -2.773 137 2HE MET 340 3HE MET 40 -6.377 -4.511 -4.511 138 3HE MET 340 2HE MET 40 -6.143 -3.909 -3.909 139 H PHE 341 H PHE 41 -5.693 -2.771 -2.771 140 HA PHE 341 HA PHE 41 -3.427 -1.075 -1.075 141 1HB PHE 341 2HB PHE 41 -4.186 -3.458 -3.458 142 2HB PHE 341 1HB PHE 41 -2.676 -2.616 -2.616 143 HD1 PHE 341 HD1 PHE 41 -1.763 -1.825 -1.825 144 HD2 PHE 341 HD2 PHE 41 -3.737 -5.426 -5.426 145 HE1 PHE 341 HE1 PHE 41 -0.818 -3.040 -3.040 146 HE2 PHE 341 HE2 PHE 41 -2.794 -6.635 -6.635 147 HZ PHE 341 HZ PHE 41 -1.347 -5.444 -5.444 148 H ARG 342 H ARG 42 -5.954 -1.454 -1.454 149 HA ARG 342 HA ARG 42 -4.823 0.028 0.028 150 1HB ARG 342 2HB ARG 42 -7.490 -0.910 -0.910 151 2HB ARG 342 1HB ARG 42 -7.535 0.628 0.628 152 1HG ARG 342 2HG ARG 42 -5.652 -1.241 -1.241 153 2HG ARG 342 1HG ARG 42 -7.291 -1.894 -1.894 154 1HD ARG 342 2HD ARG 42 -6.608 0.873 0.873 155 2HD ARG 342 1HD ARG 42 -6.794 -0.543 -0.543 156 HE ARG 342 HE ARG 42 -9.058 0.197 0.197 157 1HH1 ARG 342 2HH1 ARG 42 -8.017 1.540 1.540 158 2HH1 ARG 342 1HH1 ARG 42 -9.323 1.007 1.007 159 1HH2 ARG 342 1HH2 ARG 42 -10.587 -1.200 -1.200 160 2HH2 ARG 342 2HH2 ARG 42 -10.776 -0.544 -0.544 161 H GLU 343 H GLU 43 -6.473 1.059 1.059 162 HA GLU 343 HA GLU 43 -6.708 3.838 3.838 163 1HB GLU 343 2HB GLU 43 -8.042 2.687 2.687 164 2HB GLU 343 1HB GLU 43 -6.584 2.757 2.757 165 1HG GLU 343 2HG GLU 43 -6.889 4.947 4.947 166 2HG GLU 343 1HG GLU 43 -7.165 5.327 5.327 167 H LEU 344 H LEU 44 -4.457 2.136 2.136 168 HA LEU 344 HA LEU 44 -2.796 4.326 4.326 169 1HB LEU 344 2HB LEU 44 -2.145 1.391 1.391 170 2HB LEU 344 1HB LEU 44 -0.946 2.559 2.559 171 HG LEU 344 HG LEU 44 -1.761 1.732 1.732 172 1HD1 LEU 344 3HD1 LEU 44 -2.132 4.299 4.299 173 2HD1 LEU 344 2HD1 LEU 44 -3.841 3.870 3.870 174 3HD1 LEU 344 1HD1 LEU 44 -2.795 3.535 3.535 175 1HD2 LEU 344 3HD2 LEU 44 -3.680 0.532 0.532 176 2HD2 LEU 344 2HD2 LEU 44 -3.898 0.891 0.891 177 3HD2 LEU 344 1HD2 LEU 44 -4.642 1.927 1.927 178 H ASN 345 H ASN 45 -2.509 2.054 2.054 179 HA ASN 345 HA ASN 45 -0.245 3.310 3.310 180 1HB ASN 345 2HB ASN 45 -2.202 1.229 1.229 181 2HB ASN 345 1HB ASN 45 -1.636 2.138 2.138 182 1HD2 ASN 345 2HD2 ASN 45 0.729 -0.709 -0.709 183 2HD2 ASN 345 1HD2 ASN 45 -0.958 -0.648 -0.648 184 H GLU 346 H GLU 46 -3.664 4.019 4.019 185 HA GLU 346 HA GLU 46 -3.708 5.604 5.604 186 1HB GLU 346 2HB GLU 46 -5.719 4.713 4.713 187 2HB GLU 346 1HB GLU 46 -5.452 6.022 6.022 188 1HG GLU 346 2HG GLU 46 -5.639 7.668 7.668 189 2HG GLU 346 1HG GLU 46 -5.950 6.353 6.353 190 H ALA 347 H ALA 47 -3.249 6.475 6.475 191 HA ALA 347 HA ALA 47 -2.911 9.297 9.297 192 1HB ALA 347 2HB ALA 47 -3.462 8.174 8.174 193 2HB ALA 347 1HB ALA 47 -1.745 7.784 7.784 194 3HB ALA 347 3HB ALA 47 -2.267 9.468 9.468 195 H LEU 348 H LEU 48 -0.616 6.605 6.605 196 HA LEU 348 HA LEU 48 1.779 8.100 8.100 197 1HB LEU 348 2HB LEU 48 1.202 5.335 5.335 198 2HB LEU 348 1HB LEU 48 2.819 6.001 6.001 199 HG LEU 348 HG LEU 48 0.782 5.753 5.753 200 1HD1 LEU 348 3HD1 LEU 48 2.348 3.710 3.710 201 2HD1 LEU 348 2HD1 LEU 48 2.957 3.956 3.956 202 3HD1 LEU 348 1HD1 LEU 48 1.260 3.553 3.553 203 1HD2 LEU 348 3HD2 LEU 48 3.231 7.143 7.143 204 2HD2 LEU 348 2HD2 LEU 48 2.312 6.868 6.868 205 3HD2 LEU 348 1HD2 LEU 48 3.575 5.733 5.733 206 H GLU 349 H GLU 49 0.026 6.571 6.571 207 HA GLU 349 HA GLU 49 1.699 7.626 7.626 208 1HB GLU 349 2HB GLU 49 -0.989 6.389 6.389 209 2HB GLU 349 1HB GLU 49 -0.721 7.437 7.437 210 1HG GLU 349 2HG GLU 49 1.579 6.104 6.104 211 2HG GLU 349 1HG GLU 49 0.632 4.878 4.878 212 H LEU 350 H LEU 50 -0.946 9.028 9.028 213 HA LEU 350 HA LEU 50 -1.370 11.246 11.246 214 1HB LEU 350 2HB LEU 50 -3.073 11.671 11.671 215 2HB LEU 350 1HB LEU 50 -2.596 10.214 10.214 216 HG LEU 350 HG LEU 50 -0.884 11.814 11.814 217 1HD1 LEU 350 1HD1 LEU 50 -2.353 13.570 13.570 218 2HD1 LEU 350 3HD1 LEU 50 -2.679 13.989 13.989 219 3HD1 LEU 350 2HD1 LEU 50 -1.022 13.940 13.940 220 1HD2 LEU 350 2HD2 LEU 50 -3.617 11.041 11.041 221 2HD2 LEU 350 1HD2 LEU 50 -2.305 11.252 11.252 222 3HD2 LEU 350 3HD2 LEU 50 -3.305 12.630 12.630 223 H LYS 351 H LYS 51 0.891 10.489 10.489 224 HA LYS 351 HA LYS 51 1.875 13.155 13.155 225 1HB LYS 351 2HB LYS 51 2.285 10.916 10.916 226 2HB LYS 351 1HB LYS 51 3.651 10.755 10.755 227 1HG LYS 351 2HG LYS 51 4.679 12.717 12.717 228 2HG LYS 351 1HG LYS 51 3.179 13.336 13.336 229 1HD LYS 351 2HD LYS 51 3.220 11.558 11.558 230 2HD LYS 351 1HD LYS 51 4.705 10.916 10.916 231 1HE LYS 351 2HE LYS 51 4.943 13.763 13.763 232 2HE LYS 351 1HE LYS 51 4.517 12.878 12.878 233 1HZ LYS 351 1HZ LYS 51 6.342 11.307 11.307 234 2HZ LYS 351 3HZ LYS 51 6.815 12.372 12.372 235 3HZ LYS 351 2HZ LYS 51 6.866 12.877 12.877 236 H ASP 352 H ASP 52 2.729 10.559 10.559 237 HA ASP 352 HA ASP 52 5.040 11.772 11.772 238 1HB ASP 352 2HB ASP 52 3.762 9.393 9.393 239 2HB ASP 352 1HB ASP 52 3.275 10.256 10.256 240 H ALA 353 H ALA 53 1.590 11.969 11.969 241 HA ALA 353 HA ALA 53 2.014 13.791 13.791 242 1HB ALA 353 1HB ALA 53 -0.066 12.261 12.261 243 2HB ALA 353 3HB ALA 53 -0.575 13.739 13.739 244 3HB ALA 353 2HB ALA 53 -0.291 13.744 13.744 245 H GLN 354 H GLN 54 2.019 14.132 14.132 246 HA GLN 354 HA GLN 54 1.086 16.872 16.872 247 1HB GLN 354 2HB GLN 54 2.210 14.831 14.831 248 2HB GLN 354 1HB GLN 54 2.750 16.465 16.465 249 1HG GLN 354 2HG GLN 54 -0.008 16.667 16.667 250 2HG GLN 354 1HG GLN 54 0.171 15.262 15.262 251 1HE2 GLN 354 2HE2 GLN 54 2.022 17.496 17.496 252 2HE2 GLN 354 1HE2 GLN 54 2.508 16.195 16.195 253 H ALA 355 HN ALA 55 2.227 18.671 18.671 254 HA ALA 355 HA ALA 55 5.208 18.454 18.454 255 1HB ALA 355 2HB ALA 55 3.276 19.515 19.515 256 2HB ALA 355 1HB ALA 55 4.886 20.224 20.224 257 3HB ALA 355 3HB ALA 55 4.703 18.506 18.506 258 1H GLY 325 3H GLY 25 -13.575 -15.849 -15.849 259 2H GLY 325 2H GLY 25 -13.819 -15.215 -15.215 260 3H GLY 325 1H GLY 25 -14.545 -14.475 -14.475 261 1HA GLY 325 2HA GLY 25 -12.756 -13.090 -13.090 262 2HA GLY 325 1HA GLY 25 -11.708 -14.462 -14.462 263 H GLU 326 H GLU 26 -11.777 -12.179 -12.179 264 HA GLU 326 HA GLU 26 -11.485 -13.933 -13.933 265 1HB GLU 326 2HB GLU 26 -12.127 -11.027 -11.027 266 2HB GLU 326 1HB GLU 26 -11.367 -11.543 -11.543 267 1HG GLU 326 2HG GLU 26 -13.496 -13.364 -13.364 268 2HG GLU 326 1HG GLU 26 -14.106 -11.709 -11.709 269 H TYR 327 H TYR 27 -9.662 -13.154 -13.154 270 HA TYR 327 HA TYR 27 -7.227 -12.766 -12.766 271 1HB TYR 327 2HB TYR 27 -7.806 -14.043 -14.043 272 2HB TYR 327 1HB TYR 27 -6.209 -13.328 -13.328 273 HD1 TYR 327 HD2 TYR 27 -4.780 -14.067 -14.067 274 HD2 TYR 327 HD1 TYR 27 -8.426 -16.071 -16.071 275 HE1 TYR 327 HE2 TYR 27 -4.089 -16.041 -16.041 276 HE2 TYR 327 HE1 TYR 27 -7.735 -18.043 -18.043 277 HH TYR 327 HH TYR 27 -5.816 -19.052 -19.052 278 H PHE 328 H PHE 28 -6.519 -10.695 -10.695 279 HA PHE 328 HA PHE 28 -6.916 -8.940 -8.940 280 1HB PHE 328 2HB PHE 28 -6.713 -8.181 -8.181 281 2HB PHE 328 1HB PHE 28 -6.851 -7.036 -7.036 282 HD1 PHE 328 HD2 PHE 28 -8.926 -6.907 -6.907 283 HD2 PHE 328 HD1 PHE 28 -8.604 -9.496 -9.496 284 HE1 PHE 328 HE2 PHE 28 -11.393 -7.162 -7.162 285 HE2 PHE 328 HE1 PHE 28 -11.071 -9.750 -9.750 286 HZ PHE 328 HZ PHE 28 -12.465 -8.583 -8.583 287 H THR 329 H THR 29 -5.140 -7.541 -7.541 288 HA THR 329 HA THR 29 -2.531 -8.418 -8.418 289 HB THR 329 HB THR 29 -2.289 -7.129 -7.129 290 HG1 THR 329 HG1 THR 29 -4.011 -7.989 -7.989 291 1HG2 THR 329 3HG2 THR 29 -0.782 -8.791 -8.791 292 2HG2 THR 329 2HG2 THR 29 -1.737 -10.023 -10.023 293 3HG2 THR 329 1HG2 THR 29 -0.798 -8.863 -8.863 294 H LEU 330 H LEU 30 -1.316 -6.829 -6.829 295 HA LEU 330 HA LEU 30 -2.207 -4.003 -4.003 296 1HB LEU 330 2HB LEU 30 -1.585 -5.569 -5.569 297 2HB LEU 330 1HB LEU 30 -0.468 -4.208 -4.208 298 HG LEU 330 HG LEU 30 -3.396 -3.745 -3.745 299 1HD1 LEU 330 1HD1 LEU 30 -2.006 -4.203 -4.203 300 2HD1 LEU 330 3HD1 LEU 30 -3.443 -3.188 -3.188 301 3HD1 LEU 330 2HD1 LEU 30 -3.526 -4.891 -4.891 302 1HD2 LEU 330 3HD2 LEU 30 -0.939 -2.200 -2.200 303 2HD2 LEU 330 2HD2 LEU 30 -2.367 -1.727 -1.727 304 3HD2 LEU 330 1HD2 LEU 30 -2.392 -1.661 -1.661 305 H GLN 331 H GLN 31 -0.856 -3.887 -3.887 306 HA GLN 331 HA GLN 31 2.010 -4.343 -4.343 307 1HB GLN 331 2HB GLN 31 0.901 -4.633 -4.633 308 2HB GLN 331 1HB GLN 31 0.359 -2.954 -2.954 309 1HG GLN 331 2HG GLN 31 2.723 -2.207 -2.207 310 2HG GLN 331 1HG GLN 31 3.242 -3.891 -3.891 311 1HE2 GLN 331 2HE2 GLN 31 1.414 -4.012 -4.012 312 2HE2 GLN 331 1HE2 GLN 31 1.020 -4.670 -4.670 313 H ILE 332 H ILE 32 3.332 -2.958 -2.958 314 HA ILE 332 HA ILE 32 2.642 -0.048 -0.048 315 HB ILE 332 HB ILE 32 4.088 -1.585 -1.585 316 1HG1 ILE 332 2HG1 ILE 32 1.631 -0.231 -0.231 317 2HG1 ILE 332 1HG1 ILE 32 1.332 -1.384 -1.384 318 1HG2 ILE 332 2HG2 ILE 32 3.328 1.320 1.320 319 2HG2 ILE 332 1HG2 ILE 32 3.702 0.630 0.630 320 3HG2 ILE 332 3HG2 ILE 32 4.929 0.649 0.649 321 1HD1 ILE 332 3HD1 ILE 32 2.577 -3.118 -3.118 322 2HD1 ILE 332 2HD1 ILE 32 2.648 -1.957 -1.957 323 3HD1 ILE 332 1HD1 ILE 32 1.089 -2.559 -2.559 324 H ARG 333 H ARG 33 4.197 1.252 1.252 325 HA ARG 333 HA ARG 33 6.712 -0.012 -0.012 326 1HB ARG 333 2HB ARG 33 5.613 1.330 1.330 327 2HB ARG 333 1HB ARG 33 5.422 2.676 2.676 328 1HG ARG 333 2HG ARG 33 7.885 2.918 2.918 329 2HG ARG 333 1HG ARG 33 8.057 1.601 1.601 330 1HD ARG 333 2HD ARG 33 8.171 3.519 3.519 331 2HD ARG 333 1HD ARG 33 6.485 3.025 3.025 332 HE ARG 333 HE ARG 33 7.409 5.244 5.244 333 1HH1 ARG 333 2HH1 ARG 33 5.080 5.416 5.416 334 2HH1 ARG 333 1HH1 ARG 33 3.886 5.865 5.865 335 1HH2 ARG 333 1HH2 ARG 33 5.871 5.058 5.058 336 2HH2 ARG 333 2HH2 ARG 33 4.334 5.665 5.665 337 H GLY 334 H GLY 34 7.904 -0.186 -0.186 338 1HA GLY 334 2HA GLY 34 9.451 2.090 2.090 339 2HA GLY 334 1HA GLY 34 8.190 1.834 1.834 340 H ARG 335 H ARG 35 9.360 0.984 0.984 341 HA ARG 335 HA ARG 35 10.232 -1.764 -1.764 342 1HB ARG 335 2HB ARG 35 12.158 -0.321 -0.321 343 2HB ARG 335 1HB ARG 35 12.471 0.141 0.141 344 1HG ARG 335 2HG ARG 35 13.047 -2.029 -2.029 345 2HG ARG 335 1HG ARG 35 12.140 -2.764 -2.764 346 1HD ARG 335 2HD ARG 35 13.923 -1.350 -1.350 347 2HD ARG 335 1HD ARG 35 14.889 -1.625 -1.625 348 HE ARG 335 HE ARG 35 13.859 -3.740 -3.740 349 1HH1 ARG 335 2HH1 ARG 35 13.966 -4.284 -4.284 350 2HH1 ARG 335 1HH1 ARG 35 15.480 -5.119 -5.119 351 1HH2 ARG 335 1HH2 ARG 35 16.527 -4.156 -4.156 352 2HH2 ARG 335 2HH2 ARG 35 16.932 -5.043 -5.043 353 H GLU 336 H GLU 36 10.680 1.270 1.270 354 HA GLU 336 HA GLU 36 10.765 -0.139 -0.139 355 1HB GLU 336 2HB GLU 36 10.438 2.788 2.788 356 2HB GLU 336 1HB GLU 36 10.538 2.195 2.195 357 1HG GLU 336 2HG GLU 36 12.722 1.051 1.051 358 2HG GLU 336 1HG GLU 36 12.649 2.056 2.056 359 H ARG 337 H ARG 37 8.321 1.700 1.700 360 HA ARG 337 HA ARG 37 6.286 1.537 1.537 361 1HB ARG 337 2HB ARG 37 6.073 1.857 1.857 362 2HB ARG 337 1HB ARG 37 4.725 2.055 2.055 363 1HG ARG 337 2HG ARG 37 6.587 3.665 3.665 364 2HG ARG 337 1HG ARG 37 7.013 3.854 3.854 365 1HD ARG 337 2HD ARG 37 4.173 3.939 3.939 366 2HD ARG 337 1HD ARG 37 4.809 5.017 5.017 367 HE ARG 337 HE ARG 37 5.091 5.369 5.369 368 1HH1 ARG 337 1HH2 ARG 37 7.275 5.687 5.687 369 2HH1 ARG 337 2HH2 ARG 37 7.490 7.399 7.399 370 1HH2 ARG 337 2HH1 ARG 37 4.872 7.796 7.796 371 2HH2 ARG 337 1HH1 ARG 37 6.127 8.594 8.594 372 H PHE 338 H PHE 38 7.088 -0.509 -0.509 373 HA PHE 338 HA PHE 38 4.895 -2.332 -2.332 374 1HB PHE 338 2HB PHE 38 6.354 -2.307 -2.307 375 2HB PHE 338 1HB PHE 38 7.728 -2.809 -2.809 376 HD1 PHE 338 HD2 PHE 38 4.307 -3.854 -3.854 377 HD2 PHE 338 HD1 PHE 38 8.133 -5.092 -5.092 378 HE1 PHE 338 HE2 PHE 38 3.658 -6.229 -6.229 379 HE2 PHE 338 HE1 PHE 38 7.484 -7.466 -7.466 380 HZ PHE 338 HZ PHE 38 5.245 -8.035 -8.035 381 H GLU 339 H GLU 39 8.097 -2.270 -2.270 382 HA GLU 339 HA GLU 39 7.823 -4.805 -4.805 383 1HB GLU 339 2HB GLU 39 9.459 -2.334 -2.334 384 2HB GLU 339 1HB GLU 39 9.529 -3.779 -3.779 385 1HG GLU 339 2HG GLU 39 9.772 -4.772 -4.772 386 2HG GLU 339 1HG GLU 39 10.732 -3.293 -3.293 387 H MET 340 H MET 40 7.116 -1.473 -1.473 388 HA MET 340 HA MET 40 6.240 -1.972 -1.972 389 1HB MET 340 2HB MET 40 5.431 0.011 0.011 390 2HB MET 340 1HB MET 40 4.516 -0.067 -0.067 391 1HG MET 340 2HG MET 40 6.370 0.545 0.545 392 2HG MET 340 1HG MET 40 7.522 0.087 0.087 393 1HE MET 340 1HE MET 40 4.296 2.237 2.237 394 2HE MET 340 3HE MET 40 4.533 3.437 3.437 395 3HE MET 340 2HE MET 40 4.384 1.730 1.730 396 H PHE 341 H PHE 41 4.228 -1.949 -1.949 397 HA PHE 341 HA PHE 41 1.860 -2.930 -2.930 398 1HB PHE 341 2HB PHE 41 2.883 -3.008 -3.008 399 2HB PHE 341 1HB PHE 41 1.339 -3.738 -3.738 400 HD1 PHE 341 HD1 PHE 41 0.211 -1.971 -1.971 401 HD2 PHE 341 HD2 PHE 41 2.466 -0.993 -0.993 402 HE1 PHE 341 HE1 PHE 41 -0.864 0.262 0.262 403 HE2 PHE 341 HE2 PHE 41 1.391 1.240 1.240 404 HZ PHE 341 HZ PHE 41 -0.274 1.868 1.868 405 H ARG 342 H ARG 42 4.733 -4.539 -4.539 406 HA ARG 342 HA ARG 42 3.668 -7.186 -7.186 407 1HB ARG 342 2HB ARG 42 6.311 -5.930 -5.930 408 2HB ARG 342 1HB ARG 42 6.333 -7.481 -7.481 409 1HG ARG 342 2HG ARG 42 4.708 -7.596 -7.596 410 2HG ARG 342 1HG ARG 42 6.362 -7.098 -7.098 411 1HD ARG 342 2HD ARG 42 5.659 -9.509 -9.509 412 2HD ARG 342 1HD ARG 42 6.026 -9.593 -9.593 413 HE ARG 342 HE ARG 42 8.046 -8.359 -8.359 414 1HH1 ARG 342 2HH1 ARG 42 7.229 -11.490 -11.490 415 2HH1 ARG 342 1HH1 ARG 42 8.666 -11.968 -11.968 416 1HH2 ARG 342 1HH2 ARG 42 9.805 -8.721 -8.721 417 2HH2 ARG 342 2HH2 ARG 42 10.126 -10.400 -10.400 418 H GLU 343 H GLU 43 4.942 -5.218 -5.218 419 HA GLU 343 HA GLU 43 5.091 -7.365 -7.365 420 1HB GLU 343 2HB GLU 43 6.267 -5.116 -5.116 421 2HB GLU 343 1HB GLU 43 4.704 -4.423 -4.423 422 1HG GLU 343 2HG GLU 43 4.850 -5.213 -5.213 423 2HG GLU 343 1HG GLU 43 5.274 -6.828 -6.828 424 H LEU 344 H LEU 44 2.699 -4.723 -4.723 425 HA LEU 344 HA LEU 44 0.861 -5.531 -5.531 426 1HB LEU 344 2HB LEU 44 0.398 -4.279 -4.279 427 2HB LEU 344 1HB LEU 44 -0.902 -4.533 -4.533 428 HG LEU 344 HG LEU 44 -0.257 -2.338 -2.338 429 1HD1 LEU 344 3HD1 LEU 44 0.033 -4.040 -4.040 430 2HD1 LEU 344 2HD1 LEU 44 1.744 -3.643 -3.643 431 3HD1 LEU 344 1HD1 LEU 44 0.575 -2.373 -2.373 432 1HD2 LEU 344 3HD2 LEU 44 1.808 -2.650 -2.650 433 2HD2 LEU 344 2HD2 LEU 44 1.899 -1.446 -1.446 434 3HD2 LEU 344 1HD2 LEU 44 2.675 -3.016 -3.016 435 H ASN 345 H ASN 45 0.997 -6.536 -6.536 436 HA ASN 345 HA ASN 45 -1.165 -8.402 -8.402 437 1HB ASN 345 2HB ASN 45 1.018 -7.758 -7.758 438 2HB ASN 345 1HB ASN 45 0.494 -9.440 -9.440 439 1HD2 ASN 345 2HD2 ASN 45 -1.710 -6.832 -6.832 440 2HD2 ASN 345 1HD2 ASN 45 -0.061 -6.674 -6.674 441 H GLU 346 H GLU 46 2.196 -8.611 -8.611 442 HA GLU 346 HA GLU 46 2.395 -11.475 -11.475 443 1HB GLU 346 2HB GLU 46 4.311 -9.797 -9.797 444 2HB GLU 346 1HB GLU 46 3.853 -9.557 -9.557 445 1HG GLU 346 2HG GLU 46 4.125 -11.990 -11.990 446 2HG GLU 346 1HG GLU 46 4.642 -12.196 -12.196 447 H ALA 347 H ALA 47 1.533 -9.076 -9.076 448 HA ALA 347 HA ALA 47 1.101 -11.057 -11.057 449 1HB ALA 347 2HB ALA 47 1.500 -8.545 -8.545 450 2HB ALA 347 1HB ALA 47 -0.195 -8.327 -8.327 451 3HB ALA 347 3HB ALA 47 0.233 -9.263 -9.263 452 H LEU 348 H LEU 48 -1.054 -9.395 -9.395 453 HA LEU 348 HA LEU 48 -3.524 -10.383 -10.383 454 1HB LEU 348 2HB LEU 48 -2.659 -9.798 -9.798 455 2HB LEU 348 1HB LEU 48 -4.329 -10.083 -10.083 456 HG LEU 348 HG LEU 48 -2.581 -7.926 -7.926 457 1HD1 LEU 348 3HD1 LEU 48 -3.870 -8.026 -8.026 458 2HD1 LEU 348 2HD1 LEU 48 -4.675 -6.825 -6.825 459 3HD1 LEU 348 1HD1 LEU 48 -2.940 -6.710 -6.710 460 1HD2 LEU 348 3HD2 LEU 48 -5.051 -9.080 -9.080 461 2HD2 LEU 348 2HD2 LEU 48 -4.312 -7.621 -7.621 462 3HD2 LEU 348 1HD2 LEU 48 -5.440 -7.505 -7.505 463 H GLU 349 H GLU 49 -1.436 -11.764 -11.764 464 HA GLU 349 HA GLU 49 -2.954 -14.142 -14.142 465 1HB GLU 349 2HB GLU 49 -0.208 -13.225 -13.225 466 2HB GLU 349 1HB GLU 49 -0.419 -14.974 -14.974 467 1HG GLU 349 2HG GLU 49 -2.580 -14.450 -14.450 468 2HG GLU 349 1HG GLU 49 -1.645 -13.023 -13.023 469 H LEU 350 H LEU 50 -0.483 -13.258 -13.258 470 HA LEU 350 HA LEU 50 -0.047 -15.887 -15.887 471 1HB LEU 350 2HB LEU 50 1.415 -14.810 -14.810 472 2HB LEU 350 1HB LEU 50 0.964 -13.337 -13.337 473 HG LEU 350 HG LEU 50 -1.009 -13.264 -13.264 474 1HD1 LEU 350 1HD1 LEU 50 0.549 -15.536 -15.536 475 2HD1 LEU 350 3HD1 LEU 50 0.559 -14.291 -14.291 476 3HD1 LEU 350 2HD1 LEU 50 -0.972 -14.926 -14.926 477 1HD2 LEU 350 2HD2 LEU 50 1.688 -12.263 -12.263 478 2HD2 LEU 350 1HD2 LEU 50 0.247 -11.497 -11.497 479 3HD2 LEU 350 3HD2 LEU 50 1.220 -12.571 -12.571 480 H LYS 351 H LYS 51 -2.545 -13.491 -13.491 481 HA LYS 351 HA LYS 51 -3.735 -14.642 -14.642 482 1HB LYS 351 2HB LYS 51 -4.168 -12.334 -12.334 483 2HB LYS 351 1HB LYS 51 -5.384 -13.263 -13.263 484 1HG LYS 351 2HG LYS 51 -6.608 -13.738 -13.738 485 2HG LYS 351 1HG LYS 51 -5.240 -13.386 -13.386 486 1HD LYS 351 2HD LYS 51 -5.382 -10.998 -10.998 487 2HD LYS 351 1HD LYS 51 -6.747 -11.347 -11.347 488 1HE LYS 351 2HE LYS 51 -7.189 -12.458 -12.458 489 2HE LYS 351 1HE LYS 51 -6.864 -10.726 -10.726 490 1HZ LYS 351 1HZ LYS 51 -8.533 -10.447 -10.447 491 2HZ LYS 351 3HZ LYS 51 -8.939 -12.083 -12.083 492 3HZ LYS 351 2HZ LYS 51 -9.178 -11.002 -11.002 493 H ASP 352 H ASP 52 -4.211 -15.147 -15.147 494 HA ASP 352 HA ASP 52 -6.443 -16.911 -16.911 495 1HB ASP 352 2HB ASP 52 -4.999 -15.859 -15.859 496 2HB ASP 352 1HB ASP 52 -4.416 -17.524 -17.524 497 H ALA 353 H ALA 53 -2.941 -17.534 -17.534 498 HA ALA 353 HA ALA 53 -3.236 -20.403 -20.403 499 1HB ALA 353 1HB ALA 53 -1.155 -18.891 -18.891 500 2HB ALA 353 3HB ALA 53 -0.817 -18.973 -18.973 501 3HB ALA 353 2HB ALA 53 -0.922 -20.456 -20.456 502 H GLN 354 H GLN 54 -3.627 -17.746 -17.746 503 HA GLN 354 HA GLN 54 -2.877 -19.063 -19.063 504 1HB GLN 354 2HB GLN 54 -4.015 -16.494 -16.494 505 2HB GLN 354 1HB GLN 54 -4.734 -17.109 -17.109 506 1HG GLN 354 2HG GLN 54 -1.998 -17.620 -17.620 507 2HG GLN 354 1HG GLN 54 -2.082 -16.013 -16.013 508 1HE2 GLN 354 2HE2 GLN 54 -4.384 -15.059 -15.059 509 2HE2 GLN 354 1HE2 GLN 54 -4.656 -15.276 -15.276 510 H ALA 355 HN ALA 55 -4.057 -20.563 -20.563 511 HA ALA 355 HA ALA 55 -6.987 -20.714 -20.714 512 1HB ALA 355 2HB ALA 55 -4.908 -22.880 -22.880 513 2HB ALA 355 1HB ALA 55 -6.559 -23.267 -23.267 514 3HB ALA 355 3HB ALA 55 -6.242 -22.622 -22.622 515 1H GLY 325 3H GLY 25 11.499 -1.598 -1.598 516 2H GLY 325 2H GLY 25 11.707 -2.597 -2.597 517 3H GLY 325 1H GLY 25 12.443 -1.068 -1.068 518 1HA GLY 325 2HA GLY 25 10.635 -0.685 -0.685 519 2HA GLY 325 1HA GLY 25 9.604 -1.747 -1.747 520 H GLU 326 H GLU 26 9.659 1.301 1.301 521 HA GLU 326 HA GLU 26 9.363 2.355 2.355 522 1HB GLU 326 2HB GLU 26 10.002 3.613 3.613 523 2HB GLU 326 1HB GLU 26 9.235 4.593 4.593 524 1HG GLU 326 2HG GLU 26 11.373 3.032 3.032 525 2HG GLU 326 1HG GLU 26 11.979 3.950 3.950 526 H TYR 327 H TYR 27 7.534 4.060 4.060 527 HA TYR 327 HA TYR 27 5.108 2.857 2.857 528 1HB TYR 327 2HB TYR 27 5.671 4.367 4.367 529 2HB TYR 327 1HB TYR 27 4.076 4.562 4.562 530 HD1 TYR 327 HD2 TYR 27 2.655 2.530 2.530 531 HD2 TYR 327 HD1 TYR 27 6.297 2.345 2.345 532 HE1 TYR 327 HE2 TYR 27 1.969 0.332 0.332 533 HE2 TYR 327 HE1 TYR 27 5.612 0.149 0.149 534 HH TYR 327 HH TYR 27 3.700 -1.183 -1.183 535 H PHE 328 H PHE 28 4.400 3.886 3.886 536 HA PHE 328 HA PHE 28 4.787 6.848 6.848 537 1HB PHE 328 2HB PHE 28 4.581 4.807 4.807 538 2HB PHE 328 1HB PHE 28 4.718 6.550 6.550 539 HD1 PHE 328 HD2 PHE 28 6.787 7.749 7.749 540 HD2 PHE 328 HD1 PHE 28 6.479 3.474 3.474 541 HE1 PHE 328 HE2 PHE 28 9.253 7.584 7.584 542 HE2 PHE 328 HE1 PHE 28 8.946 3.310 3.310 543 HZ PHE 328 HZ PHE 28 10.334 5.365 5.365 544 H THR 329 H THR 29 3.005 8.072 8.072 545 HA THR 329 HA THR 29 0.400 6.603 6.603 546 HB THR 329 HB THR 29 0.214 9.493 9.493 547 HG1 THR 329 HG1 THR 29 1.905 9.646 9.646 548 1HG2 THR 329 3HG2 THR 29 -1.372 7.450 7.450 549 2HG2 THR 329 2HG2 THR 29 -0.475 7.447 7.447 550 3HG2 THR 329 1HG2 THR 29 -1.367 8.885 8.885 551 H LEU 330 H LEU 30 -0.738 6.608 6.608 552 HA LEU 330 HA LEU 30 0.078 8.549 8.549 553 1HB LEU 330 2HB LEU 30 -0.512 5.725 5.725 554 2HB LEU 330 1HB LEU 30 -1.637 6.573 6.573 555 HG LEU 330 HG LEU 30 1.274 7.275 7.275 556 1HD1 LEU 330 1HD1 LEU 30 -0.037 4.789 4.789 557 2HD1 LEU 330 3HD1 LEU 30 1.382 5.498 5.498 558 3HD1 LEU 330 2HD1 LEU 30 1.478 4.924 4.924 559 1HD2 LEU 330 3HD2 LEU 30 -1.184 7.573 7.573 560 2HD2 LEU 330 2HD2 LEU 30 0.224 8.630 8.630 561 3HD2 LEU 330 1HD2 LEU 30 0.274 7.200 7.200 562 H GLN 331 H GLN 31 -1.270 10.250 10.250 563 HA GLN 331 HA GLN 31 -4.145 9.792 9.792 564 1HB GLN 331 2HB GLN 31 -3.062 11.426 11.426 565 2HB GLN 331 1HB GLN 31 -2.488 12.330 12.330 566 1HG GLN 331 2HG GLN 31 -4.834 12.749 12.749 567 2HG GLN 331 1HG GLN 31 -5.391 11.882 11.882 568 1HE2 GLN 331 2HE2 GLN 31 -3.574 14.585 14.585 569 2HE2 GLN 331 1HE2 GLN 31 -3.179 12.961 12.961 570 H ILE 332 H ILE 32 -5.451 9.672 9.672 571 HA ILE 332 HA ILE 32 -4.751 11.328 11.328 572 HB ILE 332 HB ILE 32 -6.200 8.664 8.664 573 1HG1 ILE 332 2HG1 ILE 32 -3.747 8.801 8.801 574 2HG1 ILE 332 1HG1 ILE 32 -3.451 9.224 9.224 575 1HG2 ILE 332 2HG2 ILE 32 -5.468 10.561 10.561 576 2HG2 ILE 332 1HG2 ILE 32 -5.827 8.859 8.859 577 3HG2 ILE 332 3HG2 ILE 32 -7.059 9.916 9.916 578 1HD1 ILE 332 3HD1 ILE 32 -4.723 7.148 7.148 579 2HD1 ILE 332 2HD1 ILE 32 -4.762 6.700 6.700 580 3HD1 ILE 332 1HD1 ILE 32 -3.218 6.828 6.828 581 H ARG 333 H ARG 33 -6.304 12.778 12.778 582 HA ARG 333 HA ARG 33 -8.821 12.820 12.820 583 1HB ARG 333 2HB ARG 33 -7.736 14.950 14.950 584 2HB ARG 333 1HB ARG 33 -7.566 14.758 14.758 585 1HG ARG 333 2HG ARG 33 -10.033 14.772 14.772 586 2HG ARG 333 1HG ARG 33 -10.184 15.011 15.011 587 1HD ARG 333 2HD ARG 33 -10.335 17.200 17.200 588 2HD ARG 333 1HD ARG 33 -8.649 17.072 17.072 589 HE ARG 333 HE ARG 33 -9.560 16.798 16.798 590 1HH1 ARG 333 2HH1 ARG 33 -7.224 15.999 15.999 591 2HH1 ARG 333 1HH1 ARG 33 -6.035 17.230 17.230 592 1HH2 ARG 333 1HH2 ARG 33 -8.036 19.067 19.067 593 2HH2 ARG 333 2HH2 ARG 33 -6.494 18.966 18.966 594 H GLY 334 H GLY 34 -10.037 11.118 11.118 595 1HA GLY 334 2HA GLY 34 -11.585 11.703 11.703 596 2HA GLY 334 1HA GLY 34 -10.324 10.552 10.552 597 H ARG 335 H ARG 35 -11.499 8.670 8.670 598 HA ARG 335 HA ARG 35 -12.365 7.326 7.326 599 1HB ARG 335 2HB ARG 35 -14.298 8.952 8.952 600 2HB ARG 335 1HB ARG 35 -14.594 7.811 7.811 601 1HG ARG 335 2HG ARG 35 -15.177 6.081 6.081 602 2HG ARG 335 1HG ARG 35 -14.275 6.775 6.775 603 1HD ARG 335 2HD ARG 35 -16.066 8.756 8.756 604 2HD ARG 335 1HD ARG 35 -17.024 7.386 7.386 605 HE ARG 335 HE ARG 35 -15.993 7.756 7.756 606 1HH1 ARG 335 2HH1 ARG 35 -16.085 4.889 4.889 607 2HH1 ARG 335 1HH1 ARG 35 -17.598 4.341 4.341 608 1HH2 ARG 335 1HH2 ARG 35 -18.663 7.511 7.511 609 2HH2 ARG 335 2HH2 ARG 35 -19.057 5.824 5.824 610 H GLU 336 H GLU 36 -12.802 7.435 7.435 611 HA GLU 336 HA GLU 36 -12.878 4.529 4.529 612 1HB GLU 336 2HB GLU 36 -12.560 6.727 6.727 613 2HB GLU 336 1HB GLU 36 -12.645 5.014 5.014 614 1HG GLU 336 2HG GLU 36 -14.836 4.964 4.964 615 2HG GLU 336 1HG GLU 36 -14.774 6.727 6.727 616 H ARG 337 H ARG 37 -10.445 7.064 7.064 617 HA ARG 337 HA ARG 37 -8.402 5.285 5.285 618 1HB ARG 337 2HB ARG 37 -8.203 7.985 7.985 619 2HB ARG 337 1HB ARG 37 -6.849 7.157 7.157 620 1HG ARG 337 2HG ARG 37 -8.705 7.047 7.047 621 2HG ARG 337 1HG ARG 37 -9.136 8.576 8.576 622 1HD ARG 337 2HD ARG 37 -6.292 8.475 8.475 623 2HD ARG 337 1HD ARG 37 -6.930 8.028 8.028 624 HE ARG 337 HE ARG 37 -7.209 10.653 10.653 625 1HH1 ARG 337 1HH2 ARG 37 -9.392 8.744 8.744 626 2HH1 ARG 337 2HH2 ARG 37 -9.605 9.804 9.804 627 1HH2 ARG 337 2HH1 ARG 37 -6.991 11.900 11.900 628 2HH2 ARG 337 1HH1 ARG 37 -8.247 11.590 11.590 629 H PHE 338 H PHE 38 -9.224 6.513 6.513 630 HA PHE 338 HA PHE 38 -7.026 5.345 5.345 631 1HB PHE 338 2HB PHE 38 -8.484 6.990 6.990 632 2HB PHE 338 1HB PHE 38 -9.857 5.888 5.888 633 HD1 PHE 338 HD2 PHE 38 -6.436 6.218 6.218 634 HD2 PHE 338 HD1 PHE 38 -10.257 4.267 4.267 635 HE1 PHE 338 HE2 PHE 38 -5.784 5.162 5.162 636 HE2 PHE 338 HE1 PHE 38 -9.605 3.210 3.210 637 HZ PHE 338 HZ PHE 38 -7.368 3.656 3.656 638 H GLU 339 H GLU 39 -10.225 4.046 4.046 639 HA GLU 339 HA GLU 39 -9.936 1.555 1.555 640 1HB GLU 339 2HB GLU 39 -11.565 2.382 2.382 641 2HB GLU 339 1HB GLU 39 -11.629 0.749 0.749 642 1HG GLU 339 2HG GLU 39 -11.894 2.371 2.371 643 2HG GLU 339 1HG GLU 39 -12.847 3.202 3.202 644 H MET 340 H MET 40 -9.232 2.489 2.489 645 HA MET 340 HA MET 40 -8.338 0.032 0.032 646 1HB MET 340 2HB MET 40 -7.536 2.883 2.883 647 2HB MET 340 1HB MET 40 -6.614 1.582 1.582 648 1HG MET 340 2HG MET 40 -8.457 0.817 0.817 649 2HG MET 340 1HG MET 40 -9.618 1.608 1.608 650 1HE MET 340 1HE MET 40 -6.393 2.491 2.491 651 2HE MET 340 3HE MET 40 -6.634 4.219 4.219 652 3HE MET 340 2HE MET 40 -6.482 3.614 3.614 653 H PHE 341 H PHE 41 -6.355 2.520 2.520 654 HA PHE 341 HA PHE 41 -3.976 0.944 0.944 655 1HB PHE 341 2HB PHE 41 -5.005 3.281 3.281 656 2HB PHE 341 1HB PHE 41 -3.459 2.517 2.517 657 HD1 PHE 341 HD1 PHE 41 -2.333 1.812 1.812 658 HD2 PHE 341 HD2 PHE 41 -4.595 5.302 5.302 659 HE1 PHE 341 HE1 PHE 41 -1.266 3.064 3.064 660 HE2 PHE 341 HE2 PHE 41 -3.525 6.560 6.560 661 HZ PHE 341 HZ PHE 41 -1.859 5.443 5.443 662 H ARG 342 H ARG 42 -6.856 1.048 1.048 663 HA ARG 342 HA ARG 42 -5.798 -0.317 -0.317 664 1HB ARG 342 2HB ARG 42 -8.434 0.433 0.433 665 2HB ARG 342 1HB ARG 42 -8.453 -1.107 -1.107 666 1HG ARG 342 2HG ARG 42 -6.830 0.870 0.870 667 2HG ARG 342 1HG ARG 42 -8.488 1.432 1.432 668 1HD ARG 342 2HD ARG 42 -7.763 -1.291 -1.291 669 2HD ARG 342 1HD ARG 42 -8.152 0.112 0.112 670 HE ARG 342 HE ARG 42 -10.150 -0.754 -0.754 671 1HH1 ARG 342 2HH1 ARG 42 -9.341 -2.064 -2.064 672 2HH1 ARG 342 1HH1 ARG 42 -10.784 -1.630 -1.630 673 1HH2 ARG 342 1HH2 ARG 42 -11.920 0.520 0.520 674 2HH2 ARG 342 2HH2 ARG 42 -12.242 -0.168 -0.168 675 H GLU 343 H GLU 43 -7.037 -1.424 -1.424 676 HA GLU 343 HA GLU 43 -7.178 -4.223 -4.223 677 1HB GLU 343 2HB GLU 43 -8.358 -3.125 -3.125 678 2HB GLU 343 1HB GLU 43 -6.793 -3.096 -3.096 679 1HG GLU 343 2HG GLU 43 -6.922 -5.291 -5.291 680 2HG GLU 343 1HG GLU 43 -7.347 -5.712 -5.712 681 H LEU 344 H LEU 44 -4.807 -2.366 -2.366 682 HA LEU 344 HA LEU 44 -2.944 -4.435 -4.435 683 1HB LEU 344 2HB LEU 44 -2.553 -1.465 -1.465 684 2HB LEU 344 1HB LEU 44 -1.213 -2.537 -2.537 685 HG LEU 344 HG LEU 44 -1.817 -1.783 -1.783 686 1HD1 LEU 344 3HD1 LEU 44 -2.099 -4.357 -4.357 687 2HD1 LEU 344 2HD1 LEU 44 -3.817 -4.024 -4.024 688 3HD1 LEU 344 1HD1 LEU 44 -2.665 -3.625 -3.625 689 1HD2 LEU 344 3HD2 LEU 44 -3.938 -0.676 -0.676 690 2HD2 LEU 344 2HD2 LEU 44 -3.927 -1.032 -1.032 691 3HD2 LEU 344 1HD2 LEU 44 -4.767 -2.110 -2.110 692 H ASN 345 H ASN 45 -3.110 -2.137 -2.137 693 HA ASN 345 HA ASN 45 -0.929 -3.263 -3.263 694 1HB ASN 345 2HB ASN 45 -3.082 -1.319 -1.319 695 2HB ASN 345 1HB ASN 45 -2.614 -2.213 -2.213 696 1HD2 ASN 345 2HD2 ASN 45 -0.298 0.792 0.792 697 2HD2 ASN 345 1HD2 ASN 45 -1.944 0.625 0.625 698 H GLU 346 H GLU 46 -4.284 -4.181 -4.181 699 HA GLU 346 HA GLU 46 -4.467 -5.812 -5.812 700 1HB GLU 346 2HB GLU 46 -6.400 -5.014 -5.014 701 2HB GLU 346 1HB GLU 46 -5.941 -6.272 -6.272 702 1HG GLU 346 2HG GLU 46 -6.190 -7.973 -7.973 703 2HG GLU 346 1HG GLU 46 -6.720 -6.704 -6.704 704 H ALA 347 H ALA 47 -3.608 -6.553 -6.553 705 HA ALA 347 HA ALA 47 -3.180 -9.365 -9.365 706 1HB ALA 347 2HB ALA 47 -3.650 -8.283 -8.283 707 2HB ALA 347 1HB ALA 47 -1.967 -7.757 -7.757 708 3HB ALA 347 3HB ALA 47 -2.355 -9.478 -9.478 709 H LEU 348 H LEU 48 -1.060 -6.514 -6.514 710 HA LEU 348 HA LEU 48 1.427 -7.894 -7.894 711 1HB LEU 348 2HB LEU 48 0.578 -5.187 -5.187 712 2HB LEU 348 1HB LEU 48 2.245 -5.765 -5.765 713 HG LEU 348 HG LEU 48 0.501 -5.597 -5.597 714 1HD1 LEU 348 3HD1 LEU 48 1.796 -3.497 -3.497 715 2HD1 LEU 348 2HD1 LEU 48 2.596 -3.690 -3.690 716 3HD1 LEU 348 1HD1 LEU 48 0.861 -3.376 -3.376 717 1HD2 LEU 348 3HD2 LEU 48 2.982 -6.848 -6.848 718 2HD2 LEU 348 2HD2 LEU 48 2.226 -6.638 -6.638 719 3HD2 LEU 348 1HD2 LEU 48 3.352 -5.423 -5.423 720 H GLU 349 H GLU 49 -0.653 -6.516 -6.516 721 HA GLU 349 HA GLU 49 0.869 -7.493 -7.493 722 1HB GLU 349 2HB GLU 49 -1.882 -6.474 -6.474 723 2HB GLU 349 1HB GLU 49 -1.672 -7.518 -7.518 724 1HG GLU 349 2HG GLU 49 0.484 -6.006 -6.006 725 2HG GLU 349 1HG GLU 49 -0.455 -4.848 -4.848 726 H LEU 350 H LEU 50 -1.590 -9.016 -9.016 727 HA LEU 350 HA LEU 50 -2.000 -11.328 -11.328 728 1HB LEU 350 2HB LEU 50 -3.468 -11.876 -11.876 729 2HB LEU 350 1HB LEU 50 -3.029 -10.357 -10.357 730 HG LEU 350 HG LEU 50 -1.052 -11.762 -11.762 731 1HD1 LEU 350 1HD1 LEU 50 -2.618 -13.744 -13.744 732 2HD1 LEU 350 3HD1 LEU 50 -2.579 -14.108 -14.108 733 3HD1 LEU 350 2HD1 LEU 50 -1.073 -13.933 -13.933 734 1HD2 LEU 350 2HD2 LEU 50 -3.759 -11.198 -11.198 735 2HD2 LEU 350 1HD2 LEU 50 -2.315 -11.306 -11.306 736 3HD2 LEU 350 3HD2 LEU 50 -3.265 -12.753 -12.753 737 H LYS 351 H LYS 51 0.482 -10.410 -10.410 738 HA LYS 351 HA LYS 51 1.680 -13.005 -13.005 739 1HB LYS 351 2HB LYS 51 2.096 -10.724 -10.724 740 2HB LYS 351 1HB LYS 51 3.314 -10.485 -10.485 741 1HG LYS 351 2HG LYS 51 4.552 -12.369 -12.369 742 2HG LYS 351 1HG LYS 51 3.186 -13.074 -13.074 743 1HD LYS 351 2HD LYS 51 3.308 -11.276 -11.276 744 2HD LYS 351 1HD LYS 51 4.663 -10.553 -10.553 745 1HE LYS 351 2HE LYS 51 5.138 -13.373 -13.373 746 2HE LYS 351 1HE LYS 51 4.819 -12.508 -12.508 747 1HZ LYS 351 1HZ LYS 51 6.468 -10.824 -10.824 748 2HZ LYS 351 3HZ LYS 51 6.877 -11.883 -11.883 749 3HZ LYS 351 2HZ LYS 51 7.125 -12.351 -12.351 750 H ASP 352 H ASP 52 2.135 -10.370 -10.370 751 HA ASP 352 HA ASP 52 4.378 -11.469 -11.469 752 1HB ASP 352 2HB ASP 52 2.929 -9.174 -9.174 753 2HB ASP 352 1HB ASP 52 2.342 -10.079 -10.079 754 H ALA 353 H ALA 53 0.876 -11.892 -11.892 755 HA ALA 353 HA ALA 53 1.183 -13.699 -13.699 756 1HB ALA 353 1HB ALA 53 -0.910 -12.296 -12.296 757 2HB ALA 353 3HB ALA 53 -1.240 -13.794 -13.794 758 3HB ALA 353 2HB ALA 53 -1.131 -13.801 -13.801 759 H GLN 354 H GLN 54 1.584 -14.019 -14.019 760 HA GLN 354 HA GLN 54 0.834 -16.813 -16.813 761 1HB GLN 354 2HB GLN 54 1.949 -14.720 -14.720 762 2HB GLN 354 1HB GLN 54 2.691 -16.293 -16.293 763 1HG GLN 354 2HG GLN 54 -0.035 -16.853 -16.853 764 2HG GLN 354 1HG GLN 54 0.017 -15.370 -15.370 765 1HE2 GLN 354 2HE2 GLN 54 2.345 -17.202 -17.202 766 2HE2 GLN 354 1HE2 GLN 54 2.604 -15.930 -15.930 767 H ALA 355 HN ALA 55 2.028 -18.546 -18.546 768 HA ALA 355 HA ALA 55 4.957 -18.138 -18.138 769 1HB ALA 355 2HB ALA 55 2.879 -19.347 -19.347 770 2HB ALA 355 1HB ALA 55 4.534 -19.953 -19.953 771 3HB ALA 355 3HB ALA 55 4.203 -18.255 -18.255 772 1H GLY 325 3H GLY 25 -15.442 14.887 14.887 773 2H GLY 325 2H GLY 25 -15.470 14.230 14.230 774 3H GLY 325 1H GLY 25 -16.282 13.444 13.444 775 1HA GLY 325 2HA GLY 25 -14.357 12.196 12.196 776 2HA GLY 325 1HA GLY 25 -13.379 13.644 13.644 777 H GLU 326 H GLU 26 -13.553 11.343 11.343 778 HA GLU 326 HA GLU 26 -13.650 13.108 13.108 779 1HB GLU 326 2HB GLU 26 -14.045 10.167 10.167 780 2HB GLU 326 1HB GLU 26 -13.504 10.730 10.730 781 1HG GLU 326 2HG GLU 26 -15.658 12.401 12.401 782 2HG GLU 326 1HG GLU 26 -16.149 10.707 10.707 783 H TYR 327 H TYR 27 -11.968 12.438 12.438 784 HA TYR 327 HA TYR 27 -9.337 12.211 12.211 785 1HB TYR 327 2HB TYR 27 -10.290 13.460 13.460 786 2HB TYR 327 1HB TYR 27 -8.636 12.847 12.847 787 HD1 TYR 327 HD2 TYR 27 -7.043 13.666 13.666 788 HD2 TYR 327 HD1 TYR 27 -10.905 15.440 15.440 789 HE1 TYR 327 HE2 TYR 27 -6.326 15.674 15.674 790 HE2 TYR 327 HE1 TYR 27 -10.189 17.446 17.446 791 HH TYR 327 HH TYR 27 -8.231 18.574 18.574 792 H PHE 328 H PHE 28 -8.487 10.192 10.192 793 HA PHE 328 HA PHE 28 -9.044 8.419 8.419 794 1HB PHE 328 2HB PHE 28 -8.443 7.677 7.677 795 2HB PHE 328 1HB PHE 28 -8.659 6.523 6.523 796 HD1 PHE 328 HD2 PHE 28 -10.863 6.266 6.266 797 HD2 PHE 328 HD1 PHE 28 -10.322 8.848 8.848 798 HE1 PHE 328 HE2 PHE 28 -13.319 6.351 6.351 799 HE2 PHE 328 HE1 PHE 28 -12.779 8.933 8.933 800 HZ PHE 328 HZ PHE 28 -14.278 7.685 7.685 801 H THR 329 H THR 29 -7.249 7.126 7.126 802 HA THR 329 HA THR 29 -4.589 8.201 8.201 803 HB THR 329 HB THR 29 -4.630 6.938 6.938 804 HG1 THR 329 HG1 THR 29 -6.465 7.770 7.770 805 1HG2 THR 329 3HG2 THR 29 -2.998 8.622 8.622 806 2HG2 THR 329 2HG2 THR 29 -4.065 9.833 9.833 807 3HG2 THR 329 1HG2 THR 29 -3.212 8.693 8.693 808 H LEU 330 H LEU 30 -3.241 6.701 6.701 809 HA LEU 330 HA LEU 30 -3.921 3.821 3.821 810 1HB LEU 330 2HB LEU 30 -3.149 5.378 5.378 811 2HB LEU 330 1HB LEU 30 -1.963 4.102 4.102 812 HG LEU 330 HG LEU 30 -4.879 3.428 3.428 813 1HD1 LEU 330 1HD1 LEU 30 -3.280 3.952 3.952 814 2HD1 LEU 330 3HD1 LEU 30 -4.645 2.834 2.834 815 3HD1 LEU 330 2HD1 LEU 30 -4.895 4.533 4.533 816 1HD2 LEU 330 3HD2 LEU 30 -2.268 2.070 2.070 817 2HD2 LEU 330 2HD2 LEU 30 -3.740 1.498 1.498 818 3HD2 LEU 330 1HD2 LEU 30 -3.587 1.412 1.412 819 H GLN 331 H GLN 31 -2.798 3.723 3.723 820 HA GLN 331 HA GLN 31 0.043 4.407 4.407 821 1HB GLN 331 2HB GLN 31 -1.305 4.639 4.639 822 2HB GLN 331 1HB GLN 31 -1.769 2.939 2.939 823 1HG GLN 331 2HG GLN 31 0.603 2.287 2.287 824 2HG GLN 331 1HG GLN 31 1.050 3.990 3.990 825 1HE2 GLN 331 2HE2 GLN 31 -1.163 4.071 4.071 826 2HE2 GLN 331 1HE2 GLN 31 -1.413 4.691 4.691 827 H ILE 332 H ILE 32 1.559 3.101 3.101 828 HA ILE 332 HA ILE 32 1.042 0.153 0.153 829 HB ILE 332 HB ILE 32 2.635 1.764 1.764 830 1HG1 ILE 332 2HG1 ILE 32 0.380 0.223 0.223 831 2HG1 ILE 332 1HG1 ILE 32 -0.140 1.391 1.391 832 1HG2 ILE 332 2HG2 ILE 32 2.052 -1.186 -1.186 833 2HG2 ILE 332 1HG2 ILE 32 2.543 -0.487 -0.487 834 3HG2 ILE 332 3HG2 ILE 32 3.623 -0.400 -0.400 835 1HD1 ILE 332 3HD1 ILE 32 1.168 3.151 3.151 836 2HD1 ILE 332 2HD1 ILE 32 1.448 1.964 1.964 837 3HD1 ILE 332 1HD1 ILE 32 -0.194 2.495 2.495 838 H ARG 333 H ARG 33 2.557 -1.050 -1.050 839 HA ARG 333 HA ARG 33 4.870 0.372 0.372 840 1HB ARG 333 2HB ARG 33 3.682 -1.033 -1.033 841 2HB ARG 333 1HB ARG 33 3.721 -2.398 -2.398 842 1HG ARG 333 2HG ARG 33 6.192 -2.454 -2.454 843 2HG ARG 333 1HG ARG 33 6.133 -1.118 -1.118 844 1HD ARG 333 2HD ARG 33 6.236 -3.020 -3.020 845 2HD ARG 333 1HD ARG 33 4.514 -2.638 -2.638 846 HE ARG 333 HE ARG 33 5.770 -4.801 -4.801 847 1HH1 ARG 333 2HH1 ARG 33 3.596 -5.137 -5.137 848 2HH1 ARG 333 1HH1 ARG 33 2.310 -5.661 -5.661 849 1HH2 ARG 333 1HH2 ARG 33 3.915 -4.693 -4.693 850 2HH2 ARG 333 2HH2 ARG 33 2.488 -5.404 -5.404 851 H GLY 334 H GLY 34 6.298 0.623 0.623 852 1HA GLY 334 2HA GLY 34 8.062 -1.537 -1.537 853 2HA GLY 334 1HA GLY 34 6.938 -1.372 -1.372 854 H ARG 335 H ARG 35 8.259 -0.457 -0.457 855 HA ARG 335 HA ARG 35 8.909 2.352 2.352 856 1HB ARG 335 2HB ARG 35 10.796 1.040 1.040 857 2HB ARG 335 1HB ARG 35 11.323 0.591 0.591 858 1HG ARG 335 2HG ARG 35 11.836 2.789 2.789 859 2HG ARG 335 1HG ARG 35 10.733 3.472 3.472 860 1HD ARG 335 2HD ARG 35 12.421 2.183 2.183 861 2HD ARG 335 1HD ARG 35 13.531 2.515 2.515 862 HE ARG 335 HE ARG 35 12.162 4.565 4.565 863 1HH1 ARG 335 2HH1 ARG 35 12.582 5.106 5.106 864 2HH1 ARG 335 1HH1 ARG 35 14.043 6.034 6.034 865 1HH2 ARG 335 1HH2 ARG 35 14.782 5.152 5.152 866 2HH2 ARG 335 2HH2 ARG 35 15.287 6.063 6.063 867 H GLU 336 H GLU 36 9.753 -0.645 -0.645 868 HA GLU 336 HA GLU 36 10.041 0.764 0.764 869 1HB GLU 336 2HB GLU 36 9.830 -2.177 -2.177 870 2HB GLU 336 1HB GLU 36 10.067 -1.585 -1.585 871 1HG GLU 336 2HG GLU 36 12.084 -0.296 -0.296 872 2HG GLU 336 1HG GLU 36 11.919 -1.291 -1.291 873 H ARG 337 H ARG 37 7.530 -1.239 -1.239 874 HA ARG 337 HA ARG 37 5.741 -1.205 -1.205 875 1HB ARG 337 2HB ARG 37 5.196 -1.541 -1.541 876 2HB ARG 337 1HB ARG 37 4.005 -1.820 -1.820 877 1HG ARG 337 2HG ARG 37 6.079 -3.315 -3.315 878 2HG ARG 337 1HG ARG 37 6.323 -3.474 -3.474 879 1HD ARG 337 2HD ARG 37 3.530 -3.729 -3.729 880 2HD ARG 337 1HD ARG 37 4.369 -4.775 -4.775 881 HE ARG 337 HE ARG 37 4.331 -5.093 -5.093 882 1HH1 ARG 337 1HH2 ARG 37 6.802 -5.280 -5.280 883 2HH1 ARG 337 2HH2 ARG 37 7.106 -6.974 -6.974 884 1HH2 ARG 337 2HH1 ARG 37 4.281 -7.533 -7.533 885 2HH2 ARG 337 1HH1 ARG 37 5.679 -8.250 -8.250 886 H PHE 338 H PHE 38 6.100 0.890 0.890 887 HA PHE 338 HA PHE 38 3.828 2.542 2.542 888 1HB PHE 338 2HB PHE 38 5.033 2.634 2.634 889 2HB PHE 338 1HB PHE 38 6.480 3.224 3.224 890 HD1 PHE 338 HD2 PHE 38 2.894 4.043 4.043 891 HD2 PHE 338 HD1 PHE 38 6.778 5.526 5.526 892 HE1 PHE 338 HE2 PHE 38 2.059 6.371 6.371 893 HE2 PHE 338 HE1 PHE 38 5.945 7.854 7.854 894 HZ PHE 338 HZ PHE 38 3.584 8.277 8.277 895 H GLU 339 H GLU 39 7.181 2.726 2.726 896 HA GLU 339 HA GLU 39 6.895 5.228 5.228 897 1HB GLU 339 2HB GLU 39 8.740 2.864 2.864 898 2HB GLU 339 1HB GLU 39 8.835 4.311 4.311 899 1HG GLU 339 2HG GLU 39 8.712 5.313 5.313 900 2HG GLU 339 1HG GLU 39 9.762 3.902 3.902 901 H MET 340 H MET 40 6.528 1.854 1.854 902 HA MET 340 HA MET 40 5.922 2.294 2.294 903 1HB MET 340 2HB MET 40 4.996 0.269 0.269 904 2HB MET 340 1HB MET 40 4.259 0.287 0.287 905 1HG MET 340 2HG MET 40 6.284 -0.216 -0.216 906 2HG MET 340 1HG MET 40 7.254 0.317 0.317 907 1HE MET 340 1HE MET 40 4.232 -2.039 -2.039 908 2HE MET 340 3HE MET 40 4.392 -3.208 -3.208 909 3HE MET 340 2HE MET 40 4.089 -1.511 -1.511 910 H PHE 341 H PHE 41 3.603 2.178 2.178 911 HA PHE 341 HA PHE 41 1.333 2.989 2.989 912 1HB PHE 341 2HB PHE 41 2.020 3.135 3.135 913 2HB PHE 341 1HB PHE 41 0.492 3.770 3.770 914 HD1 PHE 341 HD1 PHE 41 -0.273 1.950 1.950 915 HD2 PHE 341 HD2 PHE 41 1.595 1.089 1.089 916 HE1 PHE 341 HE1 PHE 41 -1.197 -0.341 -0.341 917 HE2 PHE 341 HE2 PHE 41 0.667 -1.210 -1.210 918 HZ PHE 341 HZ PHE 41 -0.732 -1.928 -1.928 919 H ARG 342 H ARG 42 3.948 4.789 4.789 920 HA ARG 342 HA ARG 42 2.711 7.374 7.374 921 1HB ARG 342 2HB ARG 42 5.399 6.277 6.277 922 2HB ARG 342 1HB ARG 42 5.414 7.834 7.834 923 1HG ARG 342 2HG ARG 42 3.506 7.818 7.818 924 2HG ARG 342 1HG ARG 42 5.134 7.427 7.427 925 1HD ARG 342 2HD ARG 42 4.476 9.800 9.800 926 2HD ARG 342 1HD ARG 42 4.643 9.891 9.891 927 HE ARG 342 HE ARG 42 6.924 8.800 8.800 928 1HH1 ARG 342 2HH1 ARG 42 5.863 11.871 11.871 929 2HH1 ARG 342 1HH1 ARG 42 7.160 12.440 12.440 930 1HH2 ARG 342 1HH2 ARG 42 8.442 9.274 9.274 931 2HH2 ARG 342 2HH2 ARG 42 8.620 10.970 10.970 932 H GLU 343 H GLU 43 4.370 5.448 5.448 933 HA GLU 343 HA GLU 43 4.617 7.595 7.595 934 1HB GLU 343 2HB GLU 43 5.940 5.420 5.420 935 2HB GLU 343 1HB GLU 43 4.483 4.631 4.631 936 1HG GLU 343 2HG GLU 43 4.830 5.416 5.416 937 2HG GLU 343 1HG GLU 43 5.075 7.059 7.059 938 H LEU 344 H LEU 44 2.366 4.811 4.811 939 HA LEU 344 HA LEU 44 0.703 5.482 5.482 940 1HB LEU 344 2HB LEU 44 0.097 4.186 4.186 941 2HB LEU 344 1HB LEU 44 -1.145 4.394 4.394 942 HG LEU 344 HG LEU 44 -0.395 2.260 2.260 943 1HD1 LEU 344 3HD1 LEU 44 0.037 3.963 3.963 944 2HD1 LEU 344 2HD1 LEU 44 1.741 3.690 3.690 945 3HD1 LEU 344 1HD1 LEU 44 0.719 2.343 2.343 946 1HD2 LEU 344 3HD2 LEU 44 1.503 2.548 2.548 947 2HD2 LEU 344 2HD2 LEU 44 1.716 1.374 1.374 948 3HD2 LEU 344 1HD2 LEU 44 2.503 2.949 2.949 949 H ASN 345 H ASN 45 0.396 6.509 6.509 950 HA ASN 345 HA ASN 45 -1.859 8.221 8.221 951 1HB ASN 345 2HB ASN 45 0.097 7.692 7.692 952 2HB ASN 345 1HB ASN 45 -0.475 9.361 9.361 953 1HD2 ASN 345 2HD2 ASN 45 -2.845 6.686 6.686 954 2HD2 ASN 345 1HD2 ASN 45 -1.158 6.562 6.562 955 H GLU 346 H GLU 46 1.559 8.648 8.648 956 HA GLU 346 HA GLU 46 1.576 11.523 11.523 957 1HB GLU 346 2HB GLU 46 3.604 9.977 9.977 958 2HB GLU 346 1HB GLU 46 3.362 9.699 9.699 959 1HG GLU 346 2HG GLU 46 3.522 12.140 12.140 960 2HG GLU 346 1HG GLU 46 3.817 12.393 12.393 961 H ALA 347 H ALA 47 1.169 9.057 9.057 962 HA ALA 347 HA ALA 47 0.847 10.992 10.992 963 1HB ALA 347 2HB ALA 47 1.446 8.517 8.517 964 2HB ALA 347 1HB ALA 47 -0.266 8.180 8.180 965 3HB ALA 347 3HB ALA 47 0.244 9.139 9.139 966 H LEU 348 H LEU 48 -1.441 9.229 9.229 967 HA LEU 348 HA LEU 48 -3.834 10.055 10.055 968 1HB LEU 348 2HB LEU 48 -3.286 9.502 9.502 969 2HB LEU 348 1HB LEU 48 -4.898 9.689 9.689 970 HG LEU 348 HG LEU 48 -2.890 7.668 7.668 971 1HD1 LEU 348 3HD1 LEU 48 -4.438 7.648 7.648 972 2HD1 LEU 348 2HD1 LEU 48 -5.029 6.393 6.393 973 3HD1 LEU 348 1HD1 LEU 48 -3.331 6.419 6.419 974 1HD2 LEU 348 3HD2 LEU 48 -5.359 8.654 8.654 975 2HD2 LEU 348 2HD2 LEU 48 -4.452 7.266 7.266 976 3HD2 LEU 348 1HD2 LEU 48 -5.690 7.042 7.042 977 H GLU 349 H GLU 49 -2.142 11.562 11.562 978 HA GLU 349 HA GLU 49 -3.844 13.836 13.836 979 1HB GLU 349 2HB GLU 49 -1.137 13.099 13.099 980 2HB GLU 349 1HB GLU 49 -1.438 14.830 14.830 981 1HG GLU 349 2HG GLU 49 -3.719 14.182 14.182 982 2HG GLU 349 1HG GLU 49 -2.756 12.820 12.820 983 H LEU 350 H LEU 50 -1.068 13.126 13.126 984 HA LEU 350 HA LEU 50 -0.697 15.780 15.780 985 1HB LEU 350 2HB LEU 50 0.970 14.802 14.802 986 2HB LEU 350 1HB LEU 50 0.538 13.307 13.307 987 HG LEU 350 HG LEU 50 -1.238 13.088 13.088 988 1HD1 LEU 350 1HD1 LEU 50 0.268 15.438 15.438 989 2HD1 LEU 350 3HD1 LEU 50 0.477 14.174 14.174 990 3HD1 LEU 350 2HD1 LEU 50 -1.141 14.728 14.728 991 1HD2 LEU 350 2HD2 LEU 50 1.486 12.238 12.238 992 2HD2 LEU 350 1HD2 LEU 50 0.173 11.397 11.397 993 3HD2 LEU 350 3HD2 LEU 50 1.195 12.522 12.522 994 H LYS 351 H LYS 51 -2.963 13.221 13.221 995 HA LYS 351 HA LYS 51 -3.947 14.295 14.295 996 1HB LYS 351 2HB LYS 51 -4.355 11.960 11.960 997 2HB LYS 351 1HB LYS 51 -5.732 12.798 12.798 998 1HG LYS 351 2HG LYS 51 -6.746 13.181 13.181 999 2HG LYS 351 1HG LYS 51 -5.238 12.934 12.934 1000 1HD LYS 351 2HD LYS 51 -5.270 10.544 10.544 1001 2HD LYS 351 1HD LYS 51 -6.765 10.782 10.782 1002 1HE LYS 351 2HE LYS 51 -6.989 11.862 11.862 1003 2HE LYS 351 1HE LYS 51 -6.554 10.153 10.153 1004 1HZ LYS 351 1HZ LYS 51 -8.394 9.788 9.788 1005 2HZ LYS 351 3HZ LYS 51 -8.874 11.395 11.395 1006 3HZ LYS 351 2HZ LYS 51 -8.902 10.289 10.289 1007 H ASP 352 H ASP 52 -4.846 14.772 14.772 1008 HA ASP 352 HA ASP 52 -7.158 16.383 16.383 1009 1HB ASP 352 2HB ASP 52 -5.894 15.433 15.433 1010 2HB ASP 352 1HB ASP 52 -5.424 17.132 17.132 1011 H ALA 353 H ALA 53 -3.712 17.224 17.224 1012 HA ALA 353 HA ALA 53 -4.158 20.070 20.070 1013 1HB ALA 353 1HB ALA 53 -2.076 18.695 18.695 1014 2HB ALA 353 3HB ALA 53 -1.548 18.804 18.804 1015 3HB ALA 353 2HB ALA 53 -1.859 20.274 20.274 1016 H GLN 354 H GLN 54 -4.120 17.392 17.392 1017 HA GLN 354 HA GLN 54 -3.178 18.770 18.770 1018 1HB GLN 354 2HB GLN 54 -4.201 16.122 16.122 1019 2HB GLN 354 1HB GLN 54 -4.805 16.684 16.684 1020 1HG GLN 354 2HG GLN 54 -2.110 17.410 17.410 1021 2HG GLN 354 1HG GLN 54 -2.115 15.823 15.823 1022 1HE2 GLN 354 2HE2 GLN 54 -4.012 14.557 14.557 1023 2HE2 GLN 354 1HE2 GLN 54 -4.494 14.827 14.827 1024 H ALA 355 HN ALA 55 -4.329 20.170 20.170 1025 HA ALA 355 HA ALA 55 -7.310 20.125 20.125 1026 1HB ALA 355 2HB ALA 55 -5.387 22.420 22.420 1027 2HB ALA 355 1HB ALA 55 -6.989 22.701 22.701 1028 3HB ALA 355 3HB ALA 55 -6.826 22.082 22.082 Start of MODEL 17 1 1H GLY 325 2H GLY 25 12.742 -0.491 -0.491 2 2H GLY 325 1H GLY 25 14.069 0.410 0.410 3 3H GLY 325 3H GLY 25 13.236 0.904 0.904 4 1HA GLY 325 2HA GLY 25 11.425 1.683 1.683 5 2HA GLY 325 1HA GLY 25 12.776 2.105 2.105 6 H GLU 326 H GLU 26 10.698 -0.746 -0.746 7 HA GLU 326 HA GLU 26 10.386 -1.009 -1.009 8 1HB GLU 326 2HB GLU 26 10.972 -3.200 -3.200 9 2HB GLU 326 1HB GLU 26 10.417 -3.509 -3.509 10 1HG GLU 326 2HG GLU 26 12.431 -1.874 -1.874 11 2HG GLU 326 1HG GLU 26 13.046 -2.449 -2.449 12 H TYR 327 H TYR 27 8.627 -3.125 -3.125 13 HA TYR 327 HA TYR 27 6.295 -1.985 -1.985 14 1HB TYR 327 2HB TYR 27 6.612 -3.253 -3.253 15 2HB TYR 327 1HB TYR 27 5.074 -3.447 -3.447 16 HD1 TYR 327 HD1 TYR 27 4.027 -1.265 -1.265 17 HD2 TYR 327 HD2 TYR 27 7.008 -1.308 -1.308 18 HE1 TYR 327 HE1 TYR 27 3.370 1.032 1.032 19 HE2 TYR 327 HE2 TYR 27 6.352 0.990 0.990 20 HH TYR 327 HH TYR 27 4.026 2.387 2.387 21 H PHE 328 H PHE 28 5.955 -3.203 -3.203 22 HA PHE 328 HA PHE 28 6.444 -6.130 -6.130 23 1HB PHE 328 2HB PHE 28 5.943 -4.214 -4.214 24 2HB PHE 328 1HB PHE 28 5.975 -5.965 -5.965 25 HD1 PHE 328 HD2 PHE 28 7.994 -3.169 -3.169 26 HD2 PHE 328 HD1 PHE 28 8.018 -7.050 -7.050 27 HE1 PHE 328 HE2 PHE 28 10.471 -3.116 -3.116 28 HE2 PHE 328 HE1 PHE 28 10.496 -6.998 -6.998 29 HZ PHE 328 HZ PHE 28 11.723 -5.031 -5.031 30 H THR 329 H THR 29 4.683 -7.380 -7.380 31 HA THR 329 HA THR 29 1.954 -6.366 -6.366 32 HB THR 329 HB THR 29 2.449 -9.283 -9.283 33 HG1 THR 329 HG1 THR 29 3.692 -9.226 -9.226 34 1HG2 THR 329 1HG2 THR 29 0.385 -7.612 -7.612 35 2HG2 THR 329 3HG2 THR 29 1.126 -7.840 -7.840 36 3HG2 THR 329 2HG2 THR 29 0.574 -9.237 -9.237 37 H LEU 330 H LEU 30 0.496 -6.595 -6.595 38 HA LEU 330 HA LEU 30 1.301 -8.294 -8.294 39 1HB LEU 330 2HB LEU 30 0.789 -5.567 -5.567 40 2HB LEU 330 1HB LEU 30 -0.717 -6.277 -6.277 41 HG LEU 330 HG LEU 30 1.212 -7.702 -7.702 42 1HD1 LEU 330 1HD1 LEU 30 2.654 -5.657 -5.657 43 2HD1 LEU 330 3HD1 LEU 30 1.961 -4.859 -4.859 44 3HD1 LEU 330 2HD1 LEU 30 2.929 -6.319 -6.319 45 1HD2 LEU 330 1HD2 LEU 30 -0.436 -5.262 -5.262 46 2HD2 LEU 330 3HD2 LEU 30 -0.805 -6.950 -6.950 47 3HD2 LEU 330 2HD2 LEU 30 0.505 -6.137 -6.137 48 H GLN 331 H GLN 31 0.213 -10.162 -10.162 49 HA GLN 331 HA GLN 31 -2.590 -9.938 -9.938 50 1HB GLN 331 2HB GLN 31 -0.496 -12.027 -12.027 51 2HB GLN 331 1HB GLN 31 -2.132 -12.608 -12.608 52 1HG GLN 331 2HG GLN 31 -2.832 -12.034 -12.034 53 2HG GLN 331 1HG GLN 31 -1.805 -10.601 -10.601 54 1HE2 GLN 331 2HE2 GLN 31 -0.488 -13.428 -13.428 55 2HE2 GLN 331 1HE2 GLN 31 -2.060 -12.818 -12.818 56 H ILE 332 H ILE 32 -4.066 -9.658 -9.658 57 HA ILE 332 HA ILE 32 -3.586 -11.067 -11.067 58 HB ILE 332 HB ILE 32 -5.332 -8.648 -8.648 59 1HG1 ILE 332 2HG1 ILE 32 -3.024 -8.322 -8.322 60 2HG1 ILE 332 1HG1 ILE 32 -2.550 -8.775 -8.775 61 1HG2 ILE 332 3HG2 ILE 32 -4.482 -10.016 -10.016 62 2HG2 ILE 332 2HG2 ILE 32 -5.384 -8.504 -8.504 63 3HG2 ILE 332 1HG2 ILE 32 -6.110 -10.000 -10.000 64 1HD1 ILE 332 3HD1 ILE 32 -4.651 -6.676 -6.676 65 2HD1 ILE 332 2HD1 ILE 32 -2.995 -6.223 -6.223 66 3HD1 ILE 332 1HD1 ILE 32 -3.376 -6.834 -6.834 67 H ARG 333 H ARG 33 -5.110 -12.499 -12.499 68 HA ARG 333 HA ARG 33 -7.357 -13.102 -13.102 69 1HB ARG 333 2HB ARG 33 -5.707 -14.858 -14.858 70 2HB ARG 333 1HB ARG 33 -6.632 -14.678 -14.678 71 1HG ARG 333 2HG ARG 33 -8.667 -15.360 -15.360 72 2HG ARG 333 1HG ARG 33 -7.906 -15.296 -15.296 73 1HD ARG 333 2HD ARG 33 -7.543 -17.517 -17.517 74 2HD ARG 333 1HD ARG 33 -6.232 -17.001 -17.001 75 HE ARG 333 HE ARG 33 -7.489 -18.087 -18.087 76 1HH1 ARG 333 2HH1 ARG 33 -9.692 -18.042 -18.042 77 2HH1 ARG 333 1HH1 ARG 33 -11.068 -17.622 -17.622 78 1HH2 ARG 333 1HH2 ARG 33 -9.189 -16.820 -16.820 79 2HH2 ARG 333 2HH2 ARG 33 -10.782 -16.932 -16.932 80 H GLY 334 H GLY 34 -9.436 -12.575 -12.575 81 1HA GLY 334 2HA GLY 34 -10.995 -12.640 -12.640 82 2HA GLY 334 1HA GLY 34 -9.880 -11.411 -11.411 83 H ARG 335 H ARG 35 -10.761 -9.429 -9.429 84 HA ARG 335 HA ARG 35 -11.431 -8.252 -8.252 85 1HB ARG 335 2HB ARG 35 -13.389 -9.955 -9.955 86 2HB ARG 335 1HB ARG 35 -13.955 -8.732 -8.732 87 1HG ARG 335 2HG ARG 35 -14.593 -7.325 -7.325 88 2HG ARG 335 1HG ARG 35 -13.119 -7.615 -7.615 89 1HD ARG 335 2HD ARG 35 -14.090 -9.859 -9.859 90 2HD ARG 335 1HD ARG 35 -15.608 -9.340 -9.340 91 HE ARG 335 HE ARG 35 -14.354 -7.766 -7.766 92 1HH1 ARG 335 2HH1 ARG 35 -16.963 -7.061 -7.061 93 2HH1 ARG 335 1HH1 ARG 35 -18.138 -7.594 -7.594 94 1HH2 ARG 335 1HH2 ARG 35 -15.873 -9.480 -9.480 95 2HH2 ARG 335 2HH2 ARG 35 -17.520 -8.962 -8.962 96 H GLU 336 H GLU 36 -12.600 -8.265 -8.265 97 HA GLU 336 HA GLU 36 -12.837 -5.401 -5.401 98 1HB GLU 336 2HB GLU 36 -12.382 -7.368 -7.368 99 2HB GLU 336 1HB GLU 36 -13.032 -5.734 -5.734 100 1HG GLU 336 2HG GLU 36 -14.786 -6.637 -6.637 101 2HG GLU 336 1HG GLU 36 -14.329 -8.199 -8.199 102 H ARG 337 H ARG 37 -10.303 -7.650 -7.650 103 HA ARG 337 HA ARG 37 -8.526 -5.677 -5.677 104 1HB ARG 337 2HB ARG 37 -8.101 -8.435 -8.435 105 2HB ARG 337 1HB ARG 37 -6.727 -7.441 -7.441 106 1HG ARG 337 2HG ARG 37 -8.005 -7.129 -7.129 107 2HG ARG 337 1HG ARG 37 -8.957 -8.519 -8.519 108 1HD ARG 337 2HD ARG 37 -6.142 -9.053 -9.053 109 2HD ARG 337 1HD ARG 37 -6.434 -8.560 -8.560 110 HE ARG 337 HE ARG 37 -7.392 -10.674 -10.674 111 1HH1 ARG 337 2HH1 ARG 37 -9.837 -10.987 -10.987 112 2HH1 ARG 337 1HH1 ARG 37 -9.784 -11.805 -11.805 113 1HH2 ARG 337 1HH2 ARG 37 -6.424 -11.142 -11.142 114 2HH2 ARG 337 2HH2 ARG 37 -7.852 -11.892 -11.892 115 H PHE 338 H PHE 38 -8.868 -7.027 -7.027 116 HA PHE 338 HA PHE 38 -6.701 -5.638 -5.638 117 1HB PHE 338 2HB PHE 38 -7.959 -7.432 -7.432 118 2HB PHE 338 1HB PHE 38 -9.379 -6.388 -6.388 119 HD1 PHE 338 HD2 PHE 38 -5.932 -6.900 -6.900 120 HD2 PHE 338 HD1 PHE 38 -9.510 -4.545 -4.545 121 HE1 PHE 338 HE2 PHE 38 -5.077 -5.882 -5.882 122 HE2 PHE 338 HE1 PHE 38 -8.655 -3.528 -3.528 123 HZ PHE 338 HZ PHE 38 -6.438 -4.198 -4.198 124 H GLU 339 H GLU 39 -10.034 -4.634 -4.634 125 HA GLU 339 HA GLU 39 -9.960 -2.163 -2.163 126 1HB GLU 339 2HB GLU 39 -11.495 -2.967 -2.967 127 2HB GLU 339 1HB GLU 39 -11.773 -1.467 -1.467 128 1HG GLU 339 2HG GLU 39 -11.901 -3.189 -3.189 129 2HG GLU 339 1HG GLU 39 -12.424 -4.267 -4.267 130 H MET 340 H MET 40 -9.018 -3.032 -3.032 131 HA MET 340 HA MET 40 -8.404 -0.438 -0.438 132 1HB MET 340 2HB MET 40 -6.837 -2.906 -2.906 133 2HB MET 340 1HB MET 40 -7.110 -1.488 -1.488 134 1HG MET 340 2HG MET 40 -9.563 -2.024 -2.024 135 2HG MET 340 1HG MET 40 -9.185 -3.520 -3.520 136 1HE MET 340 1HE MET 40 -6.144 -3.280 -3.280 137 2HE MET 340 3HE MET 40 -6.304 -4.648 -4.648 138 3HE MET 340 2HE MET 40 -6.800 -4.810 -4.810 139 H PHE 341 H PHE 41 -6.307 -2.819 -2.819 140 HA PHE 341 HA PHE 41 -3.983 -1.195 -1.195 141 1HB PHE 341 2HB PHE 41 -4.969 -3.635 -3.635 142 2HB PHE 341 1HB PHE 41 -3.549 -2.810 -2.810 143 HD1 PHE 341 HD2 PHE 41 -4.746 -3.116 -3.116 144 HD2 PHE 341 HD1 PHE 41 -1.711 -4.245 -4.245 145 HE1 PHE 341 HE2 PHE 41 -3.456 -4.169 -4.169 146 HE2 PHE 341 HE1 PHE 41 -0.412 -5.304 -5.304 147 HZ PHE 341 HZ PHE 41 -1.295 -5.263 -5.263 148 H ARG 342 H ARG 42 -6.802 -1.409 -1.409 149 HA ARG 342 HA ARG 42 -5.786 -0.033 -0.033 150 1HB ARG 342 2HB ARG 42 -8.410 -0.919 -0.919 151 2HB ARG 342 1HB ARG 42 -8.478 0.572 0.572 152 1HG ARG 342 2HG ARG 42 -6.845 -1.725 -1.725 153 2HG ARG 342 1HG ARG 42 -8.598 -1.761 -1.761 154 1HD ARG 342 2HD ARG 42 -8.372 0.614 0.614 155 2HD ARG 342 1HD ARG 42 -6.643 0.281 0.281 156 HE ARG 342 HE ARG 42 -8.763 -1.108 -1.108 157 1HH1 ARG 342 2HH1 ARG 42 -5.753 -1.877 -1.877 158 2HH1 ARG 342 1HH1 ARG 42 -4.998 -2.116 -2.116 159 1HH2 ARG 342 1HH2 ARG 42 -7.674 -0.844 -0.844 160 2HH2 ARG 342 2HH2 ARG 42 -6.086 -1.531 -1.531 161 H GLU 343 H GLU 43 -7.099 1.001 1.001 162 HA GLU 343 HA GLU 43 -7.396 3.792 3.792 163 1HB GLU 343 2HB GLU 43 -8.581 2.529 2.529 164 2HB GLU 343 1HB GLU 43 -7.096 2.841 2.841 165 1HG GLU 343 2HG GLU 43 -7.980 4.862 4.862 166 2HG GLU 343 1HG GLU 43 -7.656 5.292 5.292 167 H LEU 344 H LEU 44 -5.107 2.101 2.101 168 HA LEU 344 HA LEU 44 -3.353 4.277 4.277 169 1HB LEU 344 2HB LEU 44 -2.998 1.287 1.287 170 2HB LEU 344 1HB LEU 44 -1.578 2.315 2.315 171 HG LEU 344 HG LEU 44 -2.126 1.935 1.935 172 1HD1 LEU 344 3HD1 LEU 44 -2.170 4.441 4.441 173 2HD1 LEU 344 2HD1 LEU 44 -3.882 4.339 4.339 174 3HD1 LEU 344 1HD1 LEU 44 -2.661 4.028 4.028 175 1HD2 LEU 344 1HD2 LEU 44 -4.718 1.413 1.413 176 2HD2 LEU 344 3HD2 LEU 44 -4.107 1.016 1.016 177 3HD2 LEU 344 2HD2 LEU 44 -4.897 2.569 2.569 178 H ASN 345 H ASN 45 -3.363 1.834 1.834 179 HA ASN 345 HA ASN 45 -1.041 2.782 2.782 180 1HB ASN 345 2HB ASN 45 -2.583 0.590 0.590 181 2HB ASN 345 1HB ASN 45 -3.270 1.562 1.562 182 1HD2 ASN 345 2HD2 ASN 45 -0.450 -0.278 -0.278 183 2HD2 ASN 345 1HD2 ASN 45 -1.980 -0.654 -0.654 184 H GLU 346 H GLU 46 -4.405 3.777 3.777 185 HA GLU 346 HA GLU 46 -4.297 5.324 5.324 186 1HB GLU 346 2HB GLU 46 -6.371 4.537 4.537 187 2HB GLU 346 1HB GLU 46 -6.091 5.976 5.976 188 1HG GLU 346 2HG GLU 46 -6.277 7.408 7.408 189 2HG GLU 346 1HG GLU 46 -6.397 6.002 6.002 190 H ALA 347 H ALA 47 -3.888 6.186 6.186 191 HA ALA 347 HA ALA 47 -3.419 8.978 8.978 192 1HB ALA 347 3HB ALA 47 -3.836 7.607 7.607 193 2HB ALA 347 2HB ALA 47 -2.072 7.554 7.554 194 3HB ALA 347 1HB ALA 47 -2.908 9.107 9.107 195 H LEU 348 H LEU 48 -1.155 6.240 6.240 196 HA LEU 348 HA LEU 48 1.257 7.689 7.689 197 1HB LEU 348 2HB LEU 48 0.677 4.933 4.933 198 2HB LEU 348 1HB LEU 48 2.267 5.585 5.585 199 HG LEU 348 HG LEU 48 0.081 5.386 5.386 200 1HD1 LEU 348 1HD1 LEU 48 1.448 3.214 3.214 201 2HD1 LEU 348 3HD1 LEU 48 1.981 3.315 3.315 202 3HD1 LEU 348 2HD1 LEU 48 0.266 3.145 3.145 203 1HD2 LEU 348 2HD2 LEU 48 2.363 6.734 6.734 204 2HD2 LEU 348 1HD2 LEU 48 1.778 5.822 5.822 205 3HD2 LEU 348 3HD2 LEU 48 3.027 5.138 5.138 206 H GLU 349 H GLU 49 -0.580 6.044 6.044 207 HA GLU 349 HA GLU 49 0.937 7.038 7.038 208 1HB GLU 349 2HB GLU 49 -1.206 5.378 5.378 209 2HB GLU 349 1HB GLU 49 -1.996 6.835 6.835 210 1HG GLU 349 2HG GLU 49 -0.277 6.957 6.957 211 2HG GLU 349 1HG GLU 49 0.367 5.421 5.421 212 H LEU 350 H LEU 50 -1.469 8.525 8.525 213 HA LEU 350 HA LEU 50 -2.052 10.737 10.737 214 1HB LEU 350 2HB LEU 50 -3.579 11.178 11.178 215 2HB LEU 350 1HB LEU 50 -2.980 9.767 9.767 216 HG LEU 350 HG LEU 50 -1.204 11.310 11.310 217 1HD1 LEU 350 2HD1 LEU 50 -2.406 13.060 13.060 218 2HD1 LEU 350 1HD1 LEU 50 -2.809 13.674 13.674 219 3HD1 LEU 350 3HD1 LEU 50 -1.122 13.432 13.432 220 1HD2 LEU 350 1HD2 LEU 50 -4.151 11.470 11.470 221 2HD2 LEU 350 3HD2 LEU 50 -2.886 10.691 10.691 222 3HD2 LEU 350 2HD2 LEU 50 -3.030 12.449 12.449 223 H LYS 351 H LYS 51 0.359 10.131 10.131 224 HA LYS 351 HA LYS 51 1.453 12.735 12.735 225 1HB LYS 351 2HB LYS 51 2.167 10.933 10.933 226 2HB LYS 351 1HB LYS 51 2.865 10.058 10.058 227 1HG LYS 351 2HG LYS 51 4.677 11.460 11.460 228 2HG LYS 351 1HG LYS 51 3.766 12.869 12.869 229 1HD LYS 351 2HD LYS 51 5.293 12.329 12.329 230 2HD LYS 351 1HD LYS 51 3.701 11.790 11.790 231 1HE LYS 351 2HE LYS 51 4.959 9.899 9.899 232 2HE LYS 351 1HE LYS 51 4.434 9.528 9.528 233 1HZ LYS 351 3HZ LYS 51 6.552 10.676 10.676 234 2HZ LYS 351 2HZ LYS 51 7.052 10.574 10.574 235 3HZ LYS 351 1HZ LYS 51 6.728 9.158 9.158 236 H ASP 352 H ASP 52 2.040 10.126 10.126 237 HA ASP 352 HA ASP 52 4.133 11.471 11.471 238 1HB ASP 352 2HB ASP 52 2.752 8.968 8.968 239 2HB ASP 352 1HB ASP 52 2.687 9.722 9.722 240 H ALA 353 H ALA 53 0.620 11.553 11.553 241 HA ALA 353 HA ALA 53 0.610 13.027 13.027 242 1HB ALA 353 1HB ALA 53 -1.546 12.245 12.245 243 2HB ALA 353 3HB ALA 53 -1.874 13.259 13.259 244 3HB ALA 353 2HB ALA 53 -1.281 11.612 11.612 245 H GLN 354 H GLN 54 1.121 13.806 13.806 246 HA GLN 354 HA GLN 54 -0.199 16.273 16.273 247 1HB GLN 354 2HB GLN 54 2.352 15.081 15.081 248 2HB GLN 354 1HB GLN 54 2.077 16.804 16.804 249 1HG GLN 354 2HG GLN 54 -0.358 15.804 15.804 250 2HG GLN 354 1HG GLN 54 0.687 14.470 14.470 251 1HE2 GLN 354 2HE2 GLN 54 0.427 17.471 17.471 252 2HE2 GLN 354 1HE2 GLN 54 -0.768 16.943 16.943 253 H ALA 355 HN ALA 55 3.175 15.863 15.863 254 HA ALA 355 HA ALA 55 4.508 17.356 17.356 255 1HB ALA 355 3HB ALA 55 2.695 16.315 16.315 256 2HB ALA 355 2HB ALA 55 2.063 17.961 17.961 257 3HB ALA 355 1HB ALA 55 3.711 17.643 17.643 258 1H GLY 325 2H GLY 25 -13.828 -12.128 -12.128 259 2H GLY 325 1H GLY 25 -15.150 -13.139 -13.139 260 3H GLY 325 3H GLY 25 -14.467 -12.194 -12.194 261 1HA GLY 325 2HA GLY 25 -12.608 -13.514 -13.514 262 2HA GLY 325 1HA GLY 25 -13.885 -14.688 -14.688 263 H GLU 326 H GLU 26 -11.722 -12.539 -12.539 264 HA GLU 326 HA GLU 26 -11.151 -14.888 -14.888 265 1HB GLU 326 2HB GLU 26 -11.790 -12.048 -12.048 266 2HB GLU 326 1HB GLU 26 -11.081 -13.246 -13.246 267 1HG GLU 326 2HG GLU 26 -13.116 -14.723 -14.723 268 2HG GLU 326 1HG GLU 26 -13.833 -13.135 -13.135 269 H TYR 327 H TYR 27 -9.285 -13.678 -13.678 270 HA TYR 327 HA TYR 27 -7.151 -12.938 -12.938 271 1HB TYR 327 2HB TYR 27 -7.165 -14.556 -14.556 272 2HB TYR 327 1HB TYR 27 -5.700 -13.667 -13.667 273 HD1 TYR 327 HD1 TYR 27 -4.852 -13.923 -13.923 274 HD2 TYR 327 HD2 TYR 27 -7.548 -16.660 -16.660 275 HE1 TYR 327 HE1 TYR 27 -4.254 -15.673 -15.673 276 HE2 TYR 327 HE2 TYR 27 -6.949 -18.410 -18.410 277 HH TYR 327 HH TYR 27 -4.727 -18.807 -18.807 278 H PHE 328 H PHE 28 -6.924 -10.740 -10.740 279 HA PHE 328 HA PHE 28 -7.228 -9.306 -9.306 280 1HB PHE 328 2HB PHE 28 -7.067 -8.373 -8.373 281 2HB PHE 328 1HB PHE 28 -7.025 -7.259 -7.259 282 HD1 PHE 328 HD2 PHE 28 -9.039 -10.089 -10.089 283 HD2 PHE 328 HD1 PHE 28 -9.027 -6.477 -6.477 284 HE1 PHE 328 HE2 PHE 28 -11.513 -10.177 -10.177 285 HE2 PHE 328 HE1 PHE 28 -11.502 -6.563 -6.563 286 HZ PHE 328 HZ PHE 28 -12.744 -8.413 -8.413 287 H THR 329 H THR 29 -5.563 -7.470 -7.470 288 HA THR 329 HA THR 29 -2.852 -8.401 -8.401 289 HB THR 329 HB THR 29 -2.924 -6.963 -6.963 290 HG1 THR 329 HG1 THR 29 -4.128 -8.340 -8.340 291 1HG2 THR 329 1HG2 THR 29 -1.173 -8.541 -8.541 292 2HG2 THR 329 3HG2 THR 29 -1.930 -9.742 -9.742 293 3HG2 THR 329 2HG2 THR 29 -1.162 -8.321 -8.321 294 H LEU 330 H LEU 30 -1.435 -6.783 -6.783 295 HA LEU 330 HA LEU 30 -2.452 -3.968 -3.968 296 1HB LEU 330 2HB LEU 30 -2.026 -5.491 -5.491 297 2HB LEU 330 1HB LEU 30 -0.575 -4.501 -4.501 298 HG LEU 330 HG LEU 30 -2.688 -2.764 -2.764 299 1HD1 LEU 330 1HD1 LEU 30 -3.917 -4.844 -4.844 300 2HD1 LEU 330 3HD1 LEU 30 -3.354 -4.046 -4.046 301 3HD1 LEU 330 2HD1 LEU 30 -4.403 -3.184 -3.184 302 1HD2 LEU 330 1HD2 LEU 30 -1.059 -3.263 -3.263 303 2HD2 LEU 330 3HD2 LEU 30 -0.705 -2.107 -2.107 304 3HD2 LEU 330 2HD2 LEU 30 -2.089 -1.849 -1.849 305 H GLN 331 H GLN 31 -1.170 -3.641 -3.641 306 HA GLN 331 HA GLN 31 1.691 -4.207 -4.207 307 1HB GLN 331 2HB GLN 31 -0.251 -3.157 -3.157 308 2HB GLN 331 1HB GLN 31 1.403 -2.566 -2.566 309 1HG GLN 331 2HG GLN 31 2.209 -4.608 -4.608 310 2HG GLN 331 1HG GLN 31 1.151 -5.471 -5.471 311 1HE2 GLN 331 2HE2 GLN 31 0.095 -5.952 -5.952 312 2HE2 GLN 331 1HE2 GLN 31 1.624 -6.037 -6.037 313 H ILE 332 H ILE 32 2.991 -2.920 -2.920 314 HA ILE 332 HA ILE 32 2.334 -0.006 -0.006 315 HB ILE 332 HB ILE 32 4.008 -1.675 -1.675 316 1HG1 ILE 332 2HG1 ILE 32 1.545 -0.470 -0.470 317 2HG1 ILE 332 1HG1 ILE 32 1.234 -1.629 -1.629 318 1HG2 ILE 332 3HG2 ILE 32 3.006 1.187 1.187 319 2HG2 ILE 332 2HG2 ILE 32 3.835 0.348 0.348 320 3HG2 ILE 332 1HG2 ILE 32 4.684 0.681 0.681 321 1HD1 ILE 332 3HD1 ILE 32 3.204 -2.417 -2.417 322 2HD1 ILE 332 2HD1 ILE 32 1.500 -2.402 -2.402 323 3HD1 ILE 332 1HD1 ILE 32 2.046 -3.412 -3.412 324 H ARG 333 H ARG 33 3.859 1.445 1.445 325 HA ARG 333 HA ARG 33 6.286 0.306 0.306 326 1HB ARG 333 2HB ARG 33 4.654 1.984 1.984 327 2HB ARG 333 1HB ARG 33 5.434 3.197 3.197 328 1HG ARG 333 2HG ARG 33 7.589 2.733 2.733 329 2HG ARG 333 1HG ARG 33 6.967 1.316 1.316 330 1HD ARG 333 2HD ARG 33 6.693 2.726 2.726 331 2HD ARG 333 1HD ARG 33 5.270 3.292 3.292 332 HE ARG 333 HE ARG 33 6.431 5.338 5.338 333 1HH1 ARG 333 2HH1 ARG 33 8.832 3.383 3.383 334 2HH1 ARG 333 1HH1 ARG 33 10.093 4.041 4.041 335 1HH2 ARG 333 1HH2 ARG 33 7.934 5.897 5.897 336 2HH2 ARG 333 2HH2 ARG 33 9.585 5.466 5.466 337 H GLY 334 H GLY 34 8.279 0.572 0.572 338 1HA GLY 334 2HA GLY 34 9.671 2.452 2.452 339 2HA GLY 334 1HA GLY 34 8.454 2.284 2.284 340 H ARG 335 H ARG 35 9.239 1.096 1.096 341 HA ARG 335 HA ARG 35 10.056 -1.608 -1.608 342 1HB ARG 335 2HB ARG 35 12.053 -0.251 -0.251 343 2HB ARG 335 1HB ARG 35 12.459 0.083 0.083 344 1HG ARG 335 2HG ARG 35 13.166 -2.039 -2.039 345 2HG ARG 335 1HG ARG 35 11.795 -2.735 -2.735 346 1HD ARG 335 2HD ARG 35 12.929 -2.050 -2.050 347 2HD ARG 335 1HD ARG 35 14.348 -1.632 -1.632 348 HE ARG 335 HE ARG 35 13.220 -4.400 -4.400 349 1HH1 ARG 335 2HH1 ARG 35 15.657 -3.394 -3.394 350 2HH1 ARG 335 1HH1 ARG 35 16.951 -4.032 -4.032 351 1HH2 ARG 335 1HH2 ARG 35 14.945 -4.691 -4.691 352 2HH2 ARG 335 2HH2 ARG 35 16.548 -4.766 -4.766 353 H GLU 336 H GLU 36 10.926 1.322 1.322 354 HA GLU 336 HA GLU 36 11.018 -0.055 -0.055 355 1HB GLU 336 2HB GLU 36 10.453 2.880 2.880 356 2HB GLU 336 1HB GLU 36 11.004 2.178 2.178 357 1HG GLU 336 2HG GLU 36 12.952 1.230 1.230 358 2HG GLU 336 1HG GLU 36 12.517 2.613 2.613 359 H ARG 337 H ARG 37 8.492 1.987 1.987 360 HA ARG 337 HA ARG 37 6.543 1.702 1.702 361 1HB ARG 337 2HB ARG 37 6.365 2.139 2.139 362 2HB ARG 337 1HB ARG 37 4.905 1.966 1.966 363 1HG ARG 337 2HG ARG 37 5.972 3.768 3.768 364 2HG ARG 337 1HG ARG 37 7.028 4.099 4.099 365 1HD ARG 337 2HD ARG 37 4.311 3.888 3.888 366 2HD ARG 337 1HD ARG 37 4.385 5.040 5.040 367 HE ARG 337 HE ARG 37 5.431 6.507 6.507 368 1HH1 ARG 337 2HH1 ARG 37 7.961 6.038 6.038 369 2HH1 ARG 337 1HH1 ARG 37 8.087 5.196 5.196 370 1HH2 ARG 337 1HH2 ARG 37 4.764 4.205 4.205 371 2HH2 ARG 337 2HH2 ARG 37 6.276 4.158 4.158 372 H PHE 338 H PHE 38 7.195 -0.347 -0.347 373 HA PHE 338 HA PHE 38 5.096 -2.236 -2.236 374 1HB PHE 338 2HB PHE 38 6.543 -2.163 -2.163 375 2HB PHE 338 1HB PHE 38 7.911 -2.714 -2.714 376 HD1 PHE 338 HD2 PHE 38 4.621 -3.657 -3.657 377 HD2 PHE 338 HD1 PHE 38 8.094 -5.009 -5.009 378 HE1 PHE 338 HE2 PHE 38 3.905 -6.009 -6.009 379 HE2 PHE 338 HE1 PHE 38 7.379 -7.361 -7.361 380 HZ PHE 338 HZ PHE 38 5.285 -7.861 -7.861 381 H GLU 339 H GLU 39 8.312 -1.984 -1.984 382 HA GLU 339 HA GLU 39 8.265 -4.515 -4.515 383 1HB GLU 339 2HB GLU 39 9.601 -1.897 -1.897 384 2HB GLU 339 1HB GLU 39 9.898 -3.431 -3.431 385 1HG GLU 339 2HG GLU 39 10.279 -4.218 -4.218 386 2HG GLU 339 1HG GLU 39 10.762 -2.527 -2.527 387 H MET 340 H MET 40 7.105 -1.290 -1.290 388 HA MET 340 HA MET 40 6.273 -1.931 -1.931 389 1HB MET 340 2HB MET 40 4.763 -0.067 -0.067 390 2HB MET 340 1HB MET 40 4.916 0.034 0.034 391 1HG MET 340 2HG MET 40 7.381 0.408 0.408 392 2HG MET 340 1HG MET 40 7.114 0.479 0.479 393 1HE MET 340 1HE MET 40 3.977 1.572 1.572 394 2HE MET 340 3HE MET 40 4.143 3.261 3.261 395 3HE MET 340 2HE MET 40 4.793 1.972 1.972 396 H PHE 341 H PHE 41 4.414 -1.971 -1.971 397 HA PHE 341 HA PHE 41 2.037 -3.088 -3.088 398 1HB PHE 341 2HB PHE 41 3.214 -2.976 -2.976 399 2HB PHE 341 1HB PHE 41 1.779 -3.959 -3.959 400 HD1 PHE 341 HD2 PHE 41 2.764 -0.778 -0.778 401 HD2 PHE 341 HD1 PHE 41 0.051 -2.711 -2.711 402 HE1 PHE 341 HE2 PHE 41 1.363 1.262 1.262 403 HE2 PHE 341 HE1 PHE 41 -1.357 -0.668 -0.668 404 HZ PHE 341 HZ PHE 41 -0.699 1.319 1.319 405 H ARG 342 H ARG 42 5.091 -4.501 -4.501 406 HA ARG 342 HA ARG 42 4.147 -7.228 -7.228 407 1HB ARG 342 2HB ARG 42 6.735 -5.827 -5.827 408 2HB ARG 342 1HB ARG 42 6.794 -7.415 -7.415 409 1HG ARG 342 2HG ARG 42 5.349 -7.130 -7.130 410 2HG ARG 342 1HG ARG 42 7.111 -7.191 -7.191 411 1HD ARG 342 2HD ARG 42 6.870 -9.274 -9.274 412 2HD ARG 342 1HD ARG 42 5.175 -9.277 -9.277 413 HE ARG 342 HE ARG 42 7.488 -9.742 -9.742 414 1HH1 ARG 342 2HH1 ARG 42 4.428 -8.482 -8.482 415 2HH1 ARG 342 1HH1 ARG 42 3.822 -9.693 -9.693 416 1HH2 ARG 342 1HH2 ARG 42 6.582 -11.763 -11.763 417 2HH2 ARG 342 2HH2 ARG 42 5.044 -11.553 -11.553 418 H GLU 343 H GLU 43 5.110 -5.106 -5.106 419 HA GLU 343 HA GLU 43 5.362 -7.246 -7.246 420 1HB GLU 343 2HB GLU 43 6.433 -4.873 -4.873 421 2HB GLU 343 1HB GLU 43 4.862 -4.351 -4.351 422 1HG GLU 343 2HG GLU 43 5.617 -4.961 -4.961 423 2HG GLU 343 1HG GLU 43 5.405 -6.625 -6.625 424 H LEU 344 H LEU 44 2.969 -4.614 -4.614 425 HA LEU 344 HA LEU 44 1.083 -5.512 -5.512 426 1HB LEU 344 2HB LEU 44 0.868 -3.944 -3.944 427 2HB LEU 344 1HB LEU 44 -0.602 -4.459 -4.459 428 HG LEU 344 HG LEU 44 -0.223 -2.328 -2.328 429 1HD1 LEU 344 3HD1 LEU 44 -0.270 -4.321 -4.321 430 2HD1 LEU 344 2HD1 LEU 44 1.408 -3.863 -3.863 431 3HD1 LEU 344 1HD1 LEU 44 0.115 -2.698 -2.698 432 1HD2 LEU 344 1HD2 LEU 44 2.466 -2.853 -2.853 433 2HD2 LEU 344 3HD2 LEU 44 1.763 -1.319 -1.319 434 3HD2 LEU 344 2HD2 LEU 44 2.486 -2.400 -2.400 435 H ASN 345 H ASN 45 1.447 -6.361 -6.361 436 HA ASN 345 HA ASN 45 -0.786 -8.146 -8.146 437 1HB ASN 345 2HB ASN 45 0.960 -7.127 -7.127 438 2HB ASN 345 1HB ASN 45 1.652 -8.733 -8.733 439 1HD2 ASN 345 2HD2 ASN 45 -0.824 -8.969 -8.969 440 2HD2 ASN 345 1HD2 ASN 45 0.671 -8.229 -8.229 441 H GLU 346 H GLU 46 2.496 -8.510 -8.510 442 HA GLU 346 HA GLU 46 2.524 -11.397 -11.397 443 1HB GLU 346 2HB GLU 46 4.511 -9.734 -9.734 444 2HB GLU 346 1HB GLU 46 4.082 -9.680 -9.680 445 1HG GLU 346 2HG GLU 46 4.359 -12.086 -12.086 446 2HG GLU 346 1HG GLU 46 4.632 -12.233 -12.233 447 H ALA 347 H ALA 47 1.786 -8.941 -8.941 448 HA ALA 347 HA ALA 47 1.229 -10.825 -10.825 449 1HB ALA 347 3HB ALA 47 1.523 -8.189 -8.189 450 2HB ALA 347 2HB ALA 47 -0.231 -8.212 -8.212 451 3HB ALA 347 1HB ALA 47 0.524 -8.997 -8.997 452 H LEU 348 H LEU 48 -0.921 -9.147 -9.147 453 HA LEU 348 HA LEU 48 -3.373 -10.236 -10.236 454 1HB LEU 348 2HB LEU 48 -2.563 -9.705 -9.705 455 2HB LEU 348 1HB LEU 48 -4.212 -9.802 -9.802 456 HG LEU 348 HG LEU 48 -2.230 -7.827 -7.827 457 1HD1 LEU 348 1HD1 LEU 48 -3.347 -7.850 -7.850 458 2HD1 LEU 348 3HD1 LEU 48 -4.030 -6.505 -6.505 459 3HD1 LEU 348 2HD1 LEU 48 -2.282 -6.654 -6.654 460 1HD2 LEU 348 2HD2 LEU 48 -4.604 -8.551 -8.551 461 2HD2 LEU 348 1HD2 LEU 48 -4.085 -6.867 -6.867 462 3HD2 LEU 348 3HD2 LEU 48 -5.185 -7.418 -7.418 463 H GLU 349 H GLU 49 -1.249 -11.478 -11.478 464 HA GLU 349 HA GLU 49 -2.642 -13.910 -13.910 465 1HB GLU 349 2HB GLU 49 -0.450 -12.766 -12.766 466 2HB GLU 349 1HB GLU 49 0.323 -14.018 -14.018 467 1HG GLU 349 2HG GLU 49 -1.272 -15.684 -15.684 468 2HG GLU 349 1HG GLU 49 -1.836 -14.413 -14.413 469 H LEU 350 H LEU 50 -0.463 -12.891 -12.891 470 HA LEU 350 HA LEU 50 0.157 -15.509 -15.509 471 1HB LEU 350 2HB LEU 50 1.487 -14.323 -14.323 472 2HB LEU 350 1HB LEU 50 0.908 -12.868 -12.868 473 HG LEU 350 HG LEU 50 -1.057 -12.925 -12.925 474 1HD1 LEU 350 2HD1 LEU 50 0.212 -15.370 -15.370 475 2HD1 LEU 350 1HD1 LEU 50 0.429 -14.292 -14.292 476 3HD1 LEU 350 3HD1 LEU 50 -1.192 -14.641 -14.641 477 1HD2 LEU 350 1HD2 LEU 50 1.814 -12.381 -12.381 478 2HD2 LEU 350 3HD2 LEU 50 0.500 -11.236 -11.236 479 3HD2 LEU 350 2HD2 LEU 50 0.569 -12.166 -12.166 480 H LYS 351 H LYS 51 -2.450 -13.188 -13.188 481 HA LYS 351 HA LYS 51 -3.686 -14.468 -14.468 482 1HB LYS 351 2HB LYS 51 -4.438 -12.273 -12.273 483 2HB LYS 351 1HB LYS 51 -4.976 -13.004 -13.004 484 1HG LYS 351 2HG LYS 51 -6.833 -13.957 -13.957 485 2HG LYS 351 1HG LYS 51 -6.037 -14.193 -14.193 486 1HD LYS 351 2HD LYS 51 -7.686 -12.481 -12.481 487 2HD LYS 351 1HD LYS 51 -6.121 -11.669 -11.669 488 1HE LYS 351 2HE LYS 51 -7.319 -10.326 -10.326 489 2HE LYS 351 1HE LYS 51 -6.637 -11.497 -11.497 490 1HZ LYS 351 3HZ LYS 51 -8.738 -12.816 -12.816 491 2HZ LYS 351 2HZ LYS 51 -9.371 -11.419 -11.419 492 3HZ LYS 351 1HZ LYS 51 -8.905 -11.392 -11.392 493 H ASP 352 H ASP 52 -3.935 -15.066 -15.066 494 HA ASP 352 HA ASP 52 -5.966 -17.101 -17.101 495 1HB ASP 352 2HB ASP 52 -4.466 -15.822 -15.822 496 2HB ASP 352 1HB ASP 52 -4.303 -17.567 -17.567 497 H ALA 353 H ALA 53 -2.473 -17.090 -17.090 498 HA ALA 353 HA ALA 53 -2.300 -20.024 -20.024 499 1HB ALA 353 1HB ALA 53 -0.295 -17.832 -17.832 500 2HB ALA 353 3HB ALA 53 0.112 -19.543 -19.543 501 3HB ALA 353 2HB ALA 53 -0.385 -18.878 -18.878 502 H GLN 354 H GLN 54 -3.137 -17.722 -17.722 503 HA GLN 354 HA GLN 54 -1.964 -18.691 -18.691 504 1HB GLN 354 2HB GLN 54 -4.518 -17.287 -17.287 505 2HB GLN 354 1HB GLN 54 -4.359 -17.990 -17.990 506 1HG GLN 354 2HG GLN 54 -1.946 -16.787 -16.787 507 2HG GLN 354 1HG GLN 54 -2.906 -15.705 -15.705 508 1HE2 GLN 354 2HE2 GLN 54 -3.120 -15.051 -15.051 509 2HE2 GLN 354 1HE2 GLN 54 -1.787 -15.638 -15.638 510 H ALA 355 HN ALA 55 -5.213 -19.582 -19.582 511 HA ALA 355 HA ALA 55 -6.506 -21.494 -21.494 512 1HB ALA 355 3HB ALA 55 -4.502 -22.214 -22.214 513 2HB ALA 355 2HB ALA 55 -3.963 -23.082 -23.082 514 3HB ALA 355 1HB ALA 55 -5.538 -23.440 -23.440 515 1H GLY 325 2H GLY 25 11.570 1.151 1.151 516 2H GLY 325 1H GLY 25 12.908 0.344 0.344 517 3H GLY 325 3H GLY 25 12.227 -0.208 -0.208 518 1HA GLY 325 2HA GLY 25 10.379 -1.102 -1.102 519 2HA GLY 325 1HA GLY 25 11.668 -1.443 -1.443 520 H GLU 326 H GLU 26 9.459 1.269 1.269 521 HA GLU 326 HA GLU 26 8.915 1.492 1.492 522 1HB GLU 326 2HB GLU 26 9.501 3.729 3.729 523 2HB GLU 326 1HB GLU 26 8.801 3.996 3.996 524 1HG GLU 326 2HG GLU 26 10.867 2.496 2.496 525 2HG GLU 326 1HG GLU 26 11.561 3.114 3.114 526 H TYR 327 H TYR 27 7.018 3.516 3.516 527 HA TYR 327 HA TYR 27 4.886 2.222 2.222 528 1HB TYR 327 2HB TYR 27 4.907 3.491 3.491 529 2HB TYR 327 1HB TYR 27 3.432 3.589 3.589 530 HD1 TYR 327 HD1 TYR 27 2.613 1.350 1.350 531 HD2 TYR 327 HD2 TYR 27 5.332 1.568 1.568 532 HE1 TYR 327 HE1 TYR 27 2.057 -0.988 -0.988 533 HE2 TYR 327 HE2 TYR 27 4.776 -0.772 -0.772 534 HH TYR 327 HH TYR 27 2.586 -2.316 -2.316 535 H PHE 328 H PHE 28 4.618 3.428 3.428 536 HA PHE 328 HA PHE 28 4.907 6.380 6.380 537 1HB PHE 328 2HB PHE 28 4.713 4.444 4.444 538 2HB PHE 328 1HB PHE 28 4.649 6.194 6.194 539 HD1 PHE 328 HD2 PHE 28 6.719 3.526 3.526 540 HD2 PHE 328 HD1 PHE 28 6.642 7.409 7.409 541 HE1 PHE 328 HE2 PHE 28 9.194 3.630 3.630 542 HE2 PHE 328 HE1 PHE 28 9.116 7.514 7.514 543 HZ PHE 328 HZ PHE 28 10.393 5.625 5.625 544 H THR 329 H THR 29 3.199 7.564 7.564 545 HA THR 329 HA THR 29 0.510 6.345 6.345 546 HB THR 329 HB THR 29 0.693 9.294 9.294 547 HG1 THR 329 HG1 THR 29 1.856 9.345 9.345 548 1HG2 THR 329 1HG2 THR 29 -1.207 7.400 7.400 549 2HG2 THR 329 3HG2 THR 29 -0.553 7.654 7.654 550 3HG2 THR 329 2HG2 THR 29 -1.214 9.014 9.014 551 H LEU 330 H LEU 30 -0.878 6.548 6.548 552 HA LEU 330 HA LEU 30 0.038 8.244 8.244 553 1HB LEU 330 2HB LEU 30 -0.304 5.483 5.483 554 2HB LEU 330 1HB LEU 30 -1.800 6.075 6.075 555 HG LEU 330 HG LEU 30 0.192 7.612 7.612 556 1HD1 LEU 330 1HD1 LEU 30 1.619 5.622 5.622 557 2HD1 LEU 330 3HD1 LEU 30 1.076 4.783 4.783 558 3HD1 LEU 330 2HD1 LEU 30 2.005 6.276 6.276 559 1HD2 LEU 330 1HD2 LEU 30 -1.329 5.137 5.137 560 2HD2 LEU 330 3HD2 LEU 30 -1.738 6.821 6.821 561 3HD2 LEU 330 2HD2 LEU 30 -0.343 6.084 6.084 562 H GLN 331 H GLN 31 -1.258 10.031 10.031 563 HA GLN 331 HA GLN 31 -4.121 9.636 9.636 564 1HB GLN 331 2HB GLN 31 -2.190 11.881 11.881 565 2HB GLN 331 1HB GLN 31 -3.851 12.325 12.325 566 1HG GLN 331 2HG GLN 31 -4.641 11.731 11.731 567 2HG GLN 331 1HG GLN 31 -3.552 10.350 10.350 568 1HE2 GLN 331 2HE2 GLN 31 -2.537 13.210 13.210 569 2HE2 GLN 331 1HE2 GLN 31 -4.055 12.514 12.514 570 H ILE 332 H ILE 32 -5.417 9.249 9.249 571 HA ILE 332 HA ILE 32 -4.806 10.688 10.688 572 HB ILE 332 HB ILE 32 -6.441 8.167 8.167 573 1HG1 ILE 332 2HG1 ILE 32 -3.991 7.980 7.980 574 2HG1 ILE 332 1HG1 ILE 32 -3.670 8.468 8.468 575 1HG2 ILE 332 3HG2 ILE 32 -5.483 9.592 9.592 576 2HG2 ILE 332 2HG2 ILE 32 -6.294 8.026 8.026 577 3HG2 ILE 332 1HG2 ILE 32 -7.154 9.472 9.472 578 1HD1 ILE 332 3HD1 ILE 32 -5.612 6.244 6.244 579 2HD1 ILE 332 2HD1 ILE 32 -3.907 5.890 5.890 580 3HD1 ILE 332 1HD1 ILE 32 -4.442 6.483 6.483 581 H ARG 333 H ARG 33 -6.365 12.031 12.031 582 HA ARG 333 HA ARG 33 -8.776 12.476 12.476 583 1HB ARG 333 2HB ARG 33 -7.180 14.345 14.345 584 2HB ARG 333 1HB ARG 33 -7.979 14.119 14.119 585 1HG ARG 333 2HG ARG 33 -10.130 14.655 14.655 586 2HG ARG 333 1HG ARG 33 -9.488 14.621 14.621 587 1HD ARG 333 2HD ARG 33 -9.259 16.866 16.866 588 2HD ARG 333 1HD ARG 33 -7.834 16.451 16.451 589 HE ARG 333 HE ARG 33 -9.021 17.465 17.465 590 1HH1 ARG 333 2HH1 ARG 33 -11.403 17.258 17.258 591 2HH1 ARG 333 1HH1 ARG 33 -12.667 16.759 16.759 592 1HH2 ARG 333 1HH2 ARG 33 -10.520 16.101 16.101 593 2HH2 ARG 333 2HH2 ARG 33 -12.166 16.104 16.104 594 H GLY 334 H GLY 34 -10.770 11.820 11.820 595 1HA GLY 334 2HA GLY 34 -12.197 11.816 11.816 596 2HA GLY 334 1HA GLY 34 -10.972 10.673 10.673 597 H ARG 335 H ARG 35 -11.721 8.625 8.625 598 HA ARG 335 HA ARG 35 -12.494 7.384 7.384 599 1HB ARG 335 2HB ARG 35 -14.520 8.960 8.960 600 2HB ARG 335 1HB ARG 35 -14.916 7.708 7.708 601 1HG ARG 335 2HG ARG 35 -15.585 6.254 6.254 602 2HG ARG 335 1HG ARG 35 -14.211 6.638 6.638 603 1HD ARG 335 2HD ARG 35 -15.375 8.808 8.808 604 2HD ARG 335 1HD ARG 35 -16.791 8.197 8.197 605 HE ARG 335 HE ARG 35 -15.621 6.696 6.696 606 1HH1 ARG 335 2HH1 ARG 35 -18.052 5.833 5.833 607 2HH1 ARG 335 1HH1 ARG 35 -19.348 6.282 6.282 608 1HH2 ARG 335 1HH2 ARG 35 -17.361 8.297 8.297 609 2HH2 ARG 335 2HH2 ARG 35 -18.957 7.679 7.679 610 H GLU 336 H GLU 36 -13.402 7.342 7.342 611 HA GLU 336 HA GLU 36 -13.450 4.472 4.472 612 1HB GLU 336 2HB GLU 36 -12.931 6.483 6.483 613 2HB GLU 336 1HB GLU 36 -13.459 4.813 4.813 614 1HG GLU 336 2HG GLU 36 -15.408 5.585 5.585 615 2HG GLU 336 1HG GLU 36 -15.000 7.177 7.177 616 H ARG 337 H ARG 37 -10.971 6.872 6.872 617 HA ARG 337 HA ARG 37 -9.002 5.024 5.024 618 1HB ARG 337 2HB ARG 37 -8.848 7.786 7.786 619 2HB ARG 337 1HB ARG 37 -7.380 6.886 6.886 620 1HG ARG 337 2HG ARG 37 -8.456 6.525 6.525 621 2HG ARG 337 1HG ARG 37 -9.529 7.850 7.850 622 1HD ARG 337 2HD ARG 37 -6.816 8.558 8.558 623 2HD ARG 337 1HD ARG 37 -6.896 8.043 8.043 624 HE ARG 337 HE ARG 37 -7.976 10.081 10.081 625 1HH1 ARG 337 2HH1 ARG 37 -10.501 10.257 10.257 626 2HH1 ARG 337 1HH1 ARG 37 -10.622 11.088 11.088 627 1HH2 ARG 337 1HH2 ARG 37 -7.285 10.628 10.628 628 2HH2 ARG 337 2HH2 ARG 37 -8.802 11.298 11.298 629 H PHE 338 H PHE 38 -9.671 6.335 6.335 630 HA PHE 338 HA PHE 38 -7.531 5.075 5.075 631 1HB PHE 338 2HB PHE 38 -8.993 6.777 6.777 632 2HB PHE 338 1HB PHE 38 -10.339 5.638 5.638 633 HD1 PHE 338 HD2 PHE 38 -7.036 6.371 6.371 634 HD2 PHE 338 HD1 PHE 38 -10.469 3.789 3.789 635 HE1 PHE 338 HE2 PHE 38 -6.273 5.402 5.402 636 HE2 PHE 338 HE1 PHE 38 -9.707 2.821 2.821 637 HZ PHE 338 HZ PHE 38 -7.608 3.628 3.628 638 H GLU 339 H GLU 39 -10.729 3.869 3.869 639 HA GLU 339 HA GLU 39 -10.618 1.392 1.392 640 1HB GLU 339 2HB GLU 39 -11.986 2.115 2.115 641 2HB GLU 339 1HB GLU 39 -12.254 0.605 0.605 642 1HG GLU 339 2HG GLU 39 -12.641 2.349 2.349 643 2HG GLU 339 1HG GLU 39 -13.146 3.361 3.361 644 H MET 340 H MET 40 -9.490 2.329 2.329 645 HA MET 340 HA MET 40 -8.629 -0.239 -0.239 646 1HB MET 340 2HB MET 40 -7.163 2.338 2.338 647 2HB MET 340 1HB MET 40 -7.300 0.906 0.906 648 1HG MET 340 2HG MET 40 -9.778 1.318 1.318 649 2HG MET 340 1HG MET 40 -9.519 2.839 2.839 650 1HE MET 340 1HE MET 40 -6.396 2.835 2.835 651 2HE MET 340 3HE MET 40 -6.593 4.157 4.157 652 3HE MET 340 2HE MET 40 -7.226 4.314 4.314 653 H PHE 341 H PHE 41 -6.795 2.348 2.348 654 HA PHE 341 HA PHE 41 -4.391 0.845 0.845 655 1HB PHE 341 2HB PHE 41 -5.590 3.234 3.234 656 2HB PHE 341 1HB PHE 41 -4.138 2.482 2.482 657 HD1 PHE 341 HD2 PHE 41 -5.162 2.748 2.748 658 HD2 PHE 341 HD1 PHE 41 -2.433 4.054 4.054 659 HE1 PHE 341 HE2 PHE 41 -3.794 3.892 3.892 660 HE2 PHE 341 HE1 PHE 41 -1.060 5.198 5.198 661 HZ PHE 341 HZ PHE 41 -1.739 5.118 5.118 662 H ARG 342 H ARG 42 -7.432 0.800 0.800 663 HA ARG 342 HA ARG 42 -6.453 -0.467 -0.467 664 1HB ARG 342 2HB ARG 42 -9.054 0.247 0.247 665 2HB ARG 342 1HB ARG 42 -9.089 -1.247 -1.247 666 1HG ARG 342 2HG ARG 42 -7.678 1.142 1.142 667 2HG ARG 342 1HG ARG 42 -9.440 1.075 1.075 668 1HD ARG 342 2HD ARG 42 -9.139 -1.290 -1.290 669 2HD ARG 342 1HD ARG 42 -7.450 -0.844 -0.844 670 HE ARG 342 HE ARG 42 -9.772 0.398 0.398 671 1HH1 ARG 342 2HH1 ARG 42 -6.733 1.360 1.360 672 2HH1 ARG 342 1HH1 ARG 42 -6.120 1.646 1.646 673 1HH2 ARG 342 1HH2 ARG 42 -8.845 0.205 0.205 674 2HH2 ARG 342 2HH2 ARG 42 -7.315 0.990 0.990 675 H GLU 343 H GLU 43 -7.410 -1.562 -1.562 676 HA GLU 343 HA GLU 43 -7.608 -4.372 -4.372 677 1HB GLU 343 2HB GLU 43 -8.725 -3.172 -3.172 678 2HB GLU 343 1HB GLU 43 -7.162 -3.383 -3.383 679 1HG GLU 343 2HG GLU 43 -7.879 -5.451 -5.451 680 2HG GLU 343 1HG GLU 43 -7.654 -5.872 -5.872 681 H LEU 344 H LEU 44 -5.274 -2.506 -2.506 682 HA LEU 344 HA LEU 44 -3.353 -4.564 -4.564 683 1HB LEU 344 2HB LEU 44 -3.190 -1.558 -1.558 684 2HB LEU 344 1HB LEU 44 -1.702 -2.495 -2.495 685 HG LEU 344 HG LEU 44 -2.089 -2.139 -2.139 686 1HD1 LEU 344 3HD1 LEU 44 -2.037 -4.647 -4.647 687 2HD1 LEU 344 2HD1 LEU 44 -3.713 -4.653 -4.653 688 3HD1 LEU 344 1HD1 LEU 44 -2.418 -4.260 -4.260 689 1HD2 LEU 344 1HD2 LEU 44 -4.791 -1.792 -1.792 690 2HD2 LEU 344 3HD2 LEU 44 -4.079 -1.346 -1.346 691 3HD2 LEU 344 2HD2 LEU 44 -4.784 -2.949 -2.949 692 H ASN 345 H ASN 45 -3.742 -2.139 -2.139 693 HA ASN 345 HA ASN 45 -1.469 -2.946 -2.946 694 1HB ASN 345 2HB ASN 45 -3.156 -0.859 -0.859 695 2HB ASN 345 1HB ASN 45 -3.885 -1.880 -1.880 696 1HD2 ASN 345 2HD2 ASN 45 -1.317 0.109 0.109 697 2HD2 ASN 345 1HD2 ASN 45 -2.815 0.392 0.392 698 H GLU 346 H GLU 46 -4.733 -4.179 -4.179 699 HA GLU 346 HA GLU 46 -4.709 -5.732 -5.732 700 1HB GLU 346 2HB GLU 46 -6.727 -5.054 -5.054 701 2HB GLU 346 1HB GLU 46 -6.291 -6.463 -6.463 702 1HG GLU 346 2HG GLU 46 -6.526 -7.924 -7.924 703 2HG GLU 346 1HG GLU 46 -6.817 -6.539 -6.539 704 H ALA 347 H ALA 47 -4.008 -6.511 -6.511 705 HA ALA 347 HA ALA 47 -3.412 -9.273 -9.273 706 1HB ALA 347 3HB ALA 47 -3.795 -7.913 -7.913 707 2HB ALA 347 2HB ALA 47 -2.040 -7.749 -7.749 708 3HB ALA 347 1HB ALA 47 -2.773 -9.352 -9.352 709 H LEU 348 H LEU 48 -1.316 -6.382 -6.382 710 HA LEU 348 HA LEU 48 1.167 -7.690 -7.690 711 1HB LEU 348 2HB LEU 48 0.328 -4.987 -4.987 712 2HB LEU 348 1HB LEU 48 1.983 -5.539 -5.539 713 HG LEU 348 HG LEU 48 -0.011 -5.468 -5.468 714 1HD1 LEU 348 1HD1 LEU 48 1.083 -3.219 -3.219 715 2HD1 LEU 348 3HD1 LEU 48 1.758 -3.264 -3.264 716 3HD1 LEU 348 2HD1 LEU 48 0.010 -3.217 -3.217 717 1HD2 LEU 348 2HD2 LEU 48 2.371 -6.644 -6.644 718 2HD2 LEU 348 1HD2 LEU 48 1.849 -5.769 -5.769 719 3HD2 LEU 348 3HD2 LEU 48 2.942 -5.000 -5.000 720 H GLU 349 H GLU 49 -0.947 -6.178 -6.178 721 HA GLU 349 HA GLU 49 0.478 -7.092 -7.092 722 1HB GLU 349 2HB GLU 49 -1.741 -5.564 -5.564 723 2HB GLU 349 1HB GLU 49 -2.487 -7.067 -7.067 724 1HG GLU 349 2HG GLU 49 -0.878 -7.082 -7.082 725 2HG GLU 349 1HG GLU 49 -0.337 -5.480 -5.480 726 H LEU 350 H LEU 50 -1.701 -8.728 -8.728 727 HA LEU 350 HA LEU 50 -2.266 -10.987 -10.987 728 1HB LEU 350 2HB LEU 50 -3.606 -11.552 -11.552 729 2HB LEU 350 1HB LEU 50 -3.055 -10.090 -10.090 730 HG LEU 350 HG LEU 50 -1.077 -11.490 -11.490 731 1HD1 LEU 350 2HD1 LEU 50 -2.324 -13.383 -13.383 732 2HD1 LEU 350 1HD1 LEU 50 -2.532 -13.970 -13.970 733 3HD1 LEU 350 3HD1 LEU 50 -0.916 -13.629 -13.629 734 1HD2 LEU 350 1HD2 LEU 50 -3.951 -11.806 -11.806 735 2HD2 LEU 350 3HD2 LEU 50 -2.646 -10.963 -10.963 736 3HD2 LEU 350 2HD2 LEU 50 -2.708 -12.726 -12.726 737 H LYS 351 H LYS 51 0.300 -10.231 -10.231 738 HA LYS 351 HA LYS 51 1.577 -12.759 -12.759 739 1HB LYS 351 2HB LYS 51 2.287 -10.892 -10.892 740 2HB LYS 351 1HB LYS 51 2.818 -9.986 -9.986 741 1HG LYS 351 2HG LYS 51 4.703 -11.266 -11.266 742 2HG LYS 351 1HG LYS 51 3.930 -12.729 -12.729 743 1HD LYS 351 2HD LYS 51 5.549 -12.079 -12.079 744 2HD LYS 351 1HD LYS 51 3.971 -11.642 -11.642 745 1HE LYS 351 2HE LYS 51 5.137 -9.671 -9.671 746 2HE LYS 351 1HE LYS 51 4.462 -9.344 -9.344 747 1HZ LYS 351 3HZ LYS 51 6.588 -10.356 -10.356 748 2HZ LYS 351 2HZ LYS 51 7.205 -10.212 -10.212 749 3HZ LYS 351 1HZ LYS 51 6.722 -8.826 -8.826 750 H ASP 352 H ASP 52 1.817 -10.128 -10.128 751 HA ASP 352 HA ASP 52 3.881 -11.356 -11.356 752 1HB ASP 352 2HB ASP 52 2.343 -8.943 -8.943 753 2HB ASP 352 1HB ASP 52 2.206 -9.703 -9.703 754 H ALA 353 H ALA 53 0.393 -11.677 -11.677 755 HA ALA 353 HA ALA 53 0.269 -13.136 -13.136 756 1HB ALA 353 1HB ALA 53 -1.766 -12.472 -12.472 757 2HB ALA 353 3HB ALA 53 -2.146 -13.520 -13.520 758 3HB ALA 353 2HB ALA 53 -1.674 -11.843 -11.843 759 H GLN 354 H GLN 54 1.090 -13.878 -13.878 760 HA GLN 354 HA GLN 54 -0.052 -16.423 -16.423 761 1HB GLN 354 2HB GLN 54 2.477 -15.081 -15.081 762 2HB GLN 354 1HB GLN 54 2.331 -16.818 -16.818 763 1HG GLN 354 2HG GLN 54 -0.100 -16.021 -16.021 764 2HG GLN 354 1HG GLN 54 0.842 -14.578 -14.578 765 1HE2 GLN 354 2HE2 GLN 54 1.060 -17.483 -17.483 766 2HE2 GLN 354 1HE2 GLN 54 -0.263 -17.088 -17.088 767 H ALA 355 HN ALA 55 3.205 -15.799 -15.799 768 HA ALA 355 HA ALA 55 4.531 -17.207 -17.207 769 1HB ALA 355 3HB ALA 55 2.536 -16.282 -16.282 770 2HB ALA 355 2HB ALA 55 2.009 -17.965 -17.965 771 3HB ALA 355 1HB ALA 55 3.588 -17.544 -17.544 772 1H GLY 325 2H GLY 25 -15.276 10.991 10.991 773 2H GLY 325 1H GLY 25 -16.633 11.904 11.904 774 3H GLY 325 3H GLY 25 -15.778 11.010 11.010 775 1HA GLY 325 2HA GLY 25 -14.012 12.461 12.461 776 2HA GLY 325 1HA GLY 25 -15.391 13.541 13.541 777 H GLU 326 H GLU 26 -13.247 11.542 11.542 778 HA GLU 326 HA GLU 26 -12.985 13.922 13.922 779 1HB GLU 326 2HB GLU 26 -13.491 11.043 11.043 780 2HB GLU 326 1HB GLU 26 -12.958 12.284 12.284 781 1HG GLU 326 2HG GLU 26 -15.013 13.615 13.615 782 2HG GLU 326 1HG GLU 26 -15.590 11.980 11.980 783 H TYR 327 H TYR 27 -11.182 12.838 12.838 784 HA TYR 327 HA TYR 27 -8.850 12.244 12.244 785 1HB TYR 327 2HB TYR 27 -9.173 13.863 13.863 786 2HB TYR 327 1HB TYR 27 -7.624 13.071 13.071 787 HD1 TYR 327 HD1 TYR 27 -6.597 13.379 13.379 788 HD2 TYR 327 HD2 TYR 27 -9.621 15.931 15.931 789 HE1 TYR 327 HE1 TYR 27 -5.985 15.162 15.162 790 HE2 TYR 327 HE2 TYR 27 -9.009 17.713 17.713 791 HH TYR 327 HH TYR 27 -6.702 18.258 18.258 792 H PHE 328 H PHE 28 -8.459 10.069 10.069 793 HA PHE 328 HA PHE 28 -8.908 8.626 8.626 794 1HB PHE 328 2HB PHE 28 -8.408 7.701 7.701 795 2HB PHE 328 1HB PHE 28 -8.410 6.594 6.594 796 HD1 PHE 328 HD2 PHE 28 -10.492 9.273 9.273 797 HD2 PHE 328 HD1 PHE 28 -10.428 5.667 5.667 798 HE1 PHE 328 HE2 PHE 28 -12.969 9.184 9.184 799 HE2 PHE 328 HE1 PHE 28 -12.904 5.577 5.577 800 HZ PHE 328 HZ PHE 28 -14.176 7.335 7.335 801 H THR 329 H THR 29 -7.133 6.840 6.840 802 HA THR 329 HA THR 29 -4.441 8.013 8.013 803 HB THR 329 HB THR 29 -4.783 6.601 6.601 804 HG1 THR 329 HG1 THR 29 -6.106 7.992 7.992 805 1HG2 THR 329 1HG2 THR 29 -2.846 8.121 8.121 806 2HG2 THR 329 3HG2 THR 29 -3.652 9.323 9.323 807 3HG2 THR 329 2HG2 THR 29 -2.981 7.867 7.867 808 H LEU 330 H LEU 30 -2.915 6.525 6.525 809 HA LEU 330 HA LEU 30 -3.700 3.640 3.640 810 1HB LEU 330 2HB LEU 30 -3.226 5.158 5.158 811 2HB LEU 330 1HB LEU 30 -1.703 4.311 4.311 812 HG LEU 330 HG LEU 30 -3.646 2.369 2.369 813 1HD1 LEU 330 1HD1 LEU 30 -5.064 4.274 4.274 814 2HD1 LEU 330 3HD1 LEU 30 -4.353 3.511 3.511 815 3HD1 LEU 330 2HD1 LEU 30 -5.339 2.560 2.560 816 1HD2 LEU 330 1HD2 LEU 30 -1.939 3.034 3.034 817 2HD2 LEU 330 3HD2 LEU 30 -1.575 1.892 1.892 818 3HD2 LEU 330 2HD2 LEU 30 -2.856 1.534 1.534 819 H GLN 331 H GLN 31 -2.559 3.355 3.355 820 HA GLN 331 HA GLN 31 0.261 4.122 4.122 821 1HB GLN 331 2HB GLN 31 -1.778 2.962 2.962 822 2HB GLN 331 1HB GLN 31 -0.112 2.475 2.475 823 1HG GLN 331 2HG GLN 31 0.516 4.569 4.569 824 2HG GLN 331 1HG GLN 31 -0.508 5.359 5.359 825 1HE2 GLN 331 2HE2 GLN 31 -1.869 5.758 5.758 826 2HE2 GLN 331 1HE2 GLN 31 -0.297 5.944 5.944 827 H ILE 332 H ILE 32 1.728 2.933 2.933 828 HA ILE 332 HA ILE 32 1.284 -0.018 -0.018 829 HB ILE 332 HB ILE 32 2.995 1.762 1.762 830 1HG1 ILE 332 2HG1 ILE 32 0.710 0.394 0.394 831 2HG1 ILE 332 1HG1 ILE 32 0.219 1.529 1.529 832 1HG2 ILE 332 3HG2 ILE 32 2.203 -1.160 -1.160 833 2HG2 ILE 332 2HG2 ILE 32 3.086 -0.264 -0.264 834 3HG2 ILE 332 1HG2 ILE 32 3.820 -0.545 -0.545 835 1HD1 ILE 332 3HD1 ILE 32 2.298 2.451 2.451 836 2HD1 ILE 332 2HD1 ILE 32 0.644 2.317 2.317 837 3HD1 ILE 332 1HD1 ILE 32 1.002 3.362 3.362 838 H ARG 333 H ARG 33 2.845 -1.371 -1.371 839 HA ARG 333 HA ARG 33 5.070 -0.072 -0.072 840 1HB ARG 333 2HB ARG 33 3.473 -1.860 -1.860 841 2HB ARG 333 1HB ARG 33 4.417 -3.016 -3.016 842 1HG ARG 333 2HG ARG 33 6.450 -2.396 -2.396 843 2HG ARG 333 1HG ARG 33 5.664 -1.025 -1.025 844 1HD ARG 333 2HD ARG 33 5.355 -2.448 -2.448 845 2HD ARG 333 1HD ARG 33 4.047 -3.114 -3.114 846 HE ARG 333 HE ARG 33 5.348 -5.074 -5.074 847 1HH1 ARG 333 2HH1 ARG 33 7.519 -2.964 -2.964 848 2HH1 ARG 333 1HH1 ARG 33 8.898 -3.533 -3.533 849 1HH2 ARG 333 1HH2 ARG 33 7.041 -5.523 -5.523 850 2HH2 ARG 333 2HH2 ARG 33 8.629 -4.984 -4.984 851 H GLY 334 H GLY 34 7.148 -0.198 -0.198 852 1HA GLY 334 2HA GLY 34 8.764 -1.973 -1.973 853 2HA GLY 334 1HA GLY 34 7.651 -1.893 -1.893 854 H ARG 335 H ARG 35 8.490 -0.656 -0.656 855 HA ARG 335 HA ARG 35 9.095 2.099 2.099 856 1HB ARG 335 2HB ARG 35 11.088 0.886 0.886 857 2HB ARG 335 1HB ARG 35 11.650 0.577 0.577 858 1HG ARG 335 2HG ARG 35 12.233 2.743 2.743 859 2HG ARG 335 1HG ARG 35 10.754 3.343 3.343 860 1HD ARG 335 2HD ARG 35 11.765 2.741 2.741 861 2HD ARG 335 1HD ARG 35 13.279 2.422 2.422 862 HE ARG 335 HE ARG 35 11.972 5.105 5.105 863 1HH1 ARG 335 2HH1 ARG 35 14.593 4.267 4.267 864 2HH1 ARG 335 1HH1 ARG 35 15.758 4.994 4.994 865 1HH2 ARG 335 1HH2 ARG 35 13.495 5.509 5.509 866 2HH2 ARG 335 2HH2 ARG 35 15.137 5.695 5.695 867 H GLU 336 H GLU 36 10.312 -0.762 -0.762 868 HA GLU 336 HA GLU 36 10.515 0.625 0.625 869 1HB GLU 336 2HB GLU 36 10.114 -2.345 -2.345 870 2HB GLU 336 1HB GLU 36 10.738 -1.600 -1.600 871 1HG GLU 336 2HG GLU 36 12.484 -0.526 -0.526 872 2HG GLU 336 1HG GLU 36 12.064 -1.938 -1.938 873 H ARG 337 H ARG 37 8.028 -1.604 -1.604 874 HA ARG 337 HA ARG 37 6.232 -1.440 -1.440 875 1HB ARG 337 2HB ARG 37 5.843 -1.898 -1.898 876 2HB ARG 337 1HB ARG 37 4.457 -1.817 -1.817 877 1HG ARG 337 2HG ARG 37 5.757 -3.543 -3.543 878 2HG ARG 337 1HG ARG 37 6.720 -3.809 -3.809 879 1HD ARG 337 2HD ARG 37 3.928 -3.769 -3.769 880 2HD ARG 337 1HD ARG 37 4.185 -4.917 -4.917 881 HE ARG 337 HE ARG 37 5.198 -6.309 -6.309 882 1HH1 ARG 337 2HH1 ARG 37 7.644 -5.668 -5.668 883 2HH1 ARG 337 1HH1 ARG 37 7.591 -4.819 -4.819 884 1HH2 ARG 337 1HH2 ARG 37 4.217 -4.054 -4.054 885 2HH2 ARG 337 2HH2 ARG 37 5.650 -3.907 -3.907 886 H PHE 338 H PHE 38 6.539 0.642 0.642 887 HA PHE 338 HA PHE 38 4.349 2.366 2.366 888 1HB PHE 338 2HB PHE 38 5.626 2.413 2.413 889 2HB PHE 338 1HB PHE 38 7.023 3.060 3.060 890 HD1 PHE 338 HD2 PHE 38 3.566 3.767 3.767 891 HD2 PHE 338 HD1 PHE 38 7.101 5.361 5.361 892 HE1 PHE 338 HE2 PHE 38 2.661 6.063 6.063 893 HE2 PHE 338 HE1 PHE 38 6.195 7.657 7.657 894 HZ PHE 338 HZ PHE 38 3.975 8.008 8.008 895 H GLU 339 H GLU 39 7.677 2.373 2.373 896 HA GLU 339 HA GLU 39 7.554 4.884 4.884 897 1HB GLU 339 2HB GLU 39 9.123 2.366 2.366 898 2HB GLU 339 1HB GLU 39 9.380 3.921 3.921 899 1HG GLU 339 2HG GLU 39 9.492 4.721 4.721 900 2HG GLU 339 1HG GLU 39 10.077 3.067 3.067 901 H MET 340 H MET 40 6.689 1.586 1.586 902 HA MET 340 HA MET 40 6.028 2.170 2.170 903 1HB MET 340 2HB MET 40 4.502 0.213 0.213 904 2HB MET 340 1HB MET 40 4.801 0.120 0.120 905 1HG MET 340 2HG MET 40 7.257 -0.082 -0.082 906 2HG MET 340 1HG MET 40 6.849 -0.180 -0.180 907 1HE MET 340 1HE MET 40 3.863 -1.480 -1.480 908 2HE MET 340 3HE MET 40 4.105 -3.151 -3.151 909 3HE MET 340 2HE MET 40 4.580 -1.814 -1.814 910 H PHE 341 H PHE 41 3.931 2.094 2.094 911 HA PHE 341 HA PHE 41 1.584 3.050 3.050 912 1HB PHE 341 2HB PHE 41 2.535 3.011 3.011 913 2HB PHE 341 1HB PHE 41 1.066 3.893 3.893 914 HD1 PHE 341 HD2 PHE 41 2.396 0.788 0.788 915 HD2 PHE 341 HD1 PHE 41 -0.651 2.528 2.528 916 HE1 PHE 341 HE2 PHE 41 1.136 -1.342 -1.342 917 HE2 PHE 341 HE1 PHE 41 -1.915 0.394 0.394 918 HZ PHE 341 HZ PHE 41 -1.022 -1.542 -1.542 919 H ARG 342 H ARG 42 4.461 4.656 4.656 920 HA ARG 342 HA ARG 42 3.326 7.319 7.319 921 1HB ARG 342 2HB ARG 42 5.990 6.091 6.091 922 2HB ARG 342 1HB ARG 42 6.006 7.679 7.679 923 1HG ARG 342 2HG ARG 42 4.377 7.291 7.291 924 2HG ARG 342 1HG ARG 42 6.126 7.481 7.481 925 1HD ARG 342 2HD ARG 42 5.850 9.544 9.544 926 2HD ARG 342 1HD ARG 42 4.126 9.421 9.421 927 HE ARG 342 HE ARG 42 6.251 10.049 10.049 928 1HH1 ARG 342 2HH1 ARG 42 3.268 8.581 8.581 929 2HH1 ARG 342 1HH1 ARG 42 2.499 9.748 9.748 930 1HH2 ARG 342 1HH2 ARG 42 5.128 12.004 12.004 931 2HH2 ARG 342 2HH2 ARG 42 3.551 11.687 11.687 932 H GLU 343 H GLU 43 4.625 5.261 5.261 933 HA GLU 343 HA GLU 43 4.893 7.408 7.408 934 1HB GLU 343 2HB GLU 43 6.120 5.112 5.112 935 2HB GLU 343 1HB GLU 43 4.645 4.483 4.483 936 1HG GLU 343 2HG GLU 43 5.524 5.138 5.138 937 2HG GLU 343 1HG GLU 43 5.151 6.784 6.784 938 H LEU 344 H LEU 44 2.653 4.617 4.617 939 HA LEU 344 HA LEU 44 0.870 5.390 5.390 940 1HB LEU 344 2HB LEU 44 0.572 3.793 3.793 941 2HB LEU 344 1HB LEU 44 -0.874 4.230 4.230 942 HG LEU 344 HG LEU 44 -0.332 2.146 2.146 943 1HD1 LEU 344 3HD1 LEU 44 -0.347 4.131 4.131 944 2HD1 LEU 344 2HD1 LEU 44 1.377 3.791 3.791 945 3HD1 LEU 344 1HD1 LEU 44 0.198 2.544 2.544 946 1HD2 LEU 344 1HD2 LEU 44 2.287 2.799 2.799 947 2HD2 LEU 344 3HD2 LEU 44 1.655 1.226 1.226 948 3HD2 LEU 344 2HD2 LEU 44 2.410 2.279 2.279 949 H ASN 345 H ASN 45 0.910 6.277 6.277 950 HA ASN 345 HA ASN 45 -1.453 7.899 7.899 951 1HB ASN 345 2HB ASN 45 0.114 7.000 7.000 952 2HB ASN 345 1HB ASN 45 0.766 8.632 8.632 953 1HD2 ASN 345 2HD2 ASN 45 -2.048 8.910 8.910 954 2HD2 ASN 345 1HD2 ASN 45 -0.501 8.212 8.212 955 H GLU 346 H GLU 46 1.880 8.480 8.480 956 HA GLU 346 HA GLU 46 1.714 11.366 11.366 957 1HB GLU 346 2HB GLU 46 3.820 9.839 9.839 958 2HB GLU 346 1HB GLU 46 3.538 9.762 9.762 959 1HG GLU 346 2HG GLU 46 3.671 12.180 12.180 960 2HG GLU 346 1HG GLU 46 3.790 12.342 12.342 961 H ALA 347 H ALA 47 1.348 8.863 8.863 962 HA ALA 347 HA ALA 47 0.836 10.697 10.697 963 1HB ALA 347 3HB ALA 47 1.309 8.087 8.087 964 2HB ALA 347 2HB ALA 47 -0.452 7.992 7.992 965 3HB ALA 347 1HB ALA 47 0.360 8.820 8.820 966 H LEU 348 H LEU 48 -1.378 8.879 8.879 967 HA LEU 348 HA LEU 48 -3.817 9.804 9.804 968 1HB LEU 348 2HB LEU 48 -3.204 9.330 9.330 969 2HB LEU 348 1HB LEU 48 -4.802 9.320 9.320 970 HG LEU 348 HG LEU 48 -2.616 7.480 7.480 971 1HD1 LEU 348 1HD1 LEU 48 -3.932 7.426 7.426 972 2HD1 LEU 348 3HD1 LEU 48 -4.447 6.037 6.037 973 3HD1 LEU 348 2HD1 LEU 48 -2.732 6.308 6.308 974 1HD2 LEU 348 2HD2 LEU 48 -4.943 8.045 8.045 975 2HD2 LEU 348 1HD2 LEU 48 -4.332 6.391 6.391 976 3HD2 LEU 348 3HD2 LEU 48 -5.556 6.896 6.896 977 H GLU 349 H GLU 49 -1.997 11.189 11.189 978 HA GLU 349 HA GLU 49 -3.582 13.521 13.521 979 1HB GLU 349 2HB GLU 49 -1.415 12.529 12.529 980 2HB GLU 349 1HB GLU 49 -0.653 13.830 13.830 981 1HG GLU 349 2HG GLU 49 -2.431 15.387 15.387 982 2HG GLU 349 1HG GLU 49 -2.997 14.078 14.078 983 H LEU 350 H LEU 50 -1.139 12.664 12.664 984 HA LEU 350 HA LEU 50 -0.624 15.323 15.323 985 1HB LEU 350 2HB LEU 50 0.888 14.228 14.228 986 2HB LEU 350 1HB LEU 50 0.352 12.740 12.740 987 HG LEU 350 HG LEU 50 -1.484 12.653 12.653 988 1HD1 LEU 350 2HD1 LEU 50 -0.330 15.175 15.175 989 2HD1 LEU 350 1HD1 LEU 50 0.059 14.099 14.099 990 3HD1 LEU 350 3HD1 LEU 50 -1.621 14.345 14.345 991 1HD2 LEU 350 1HD2 LEU 50 1.460 12.276 12.276 992 2HD2 LEU 350 3HD2 LEU 50 0.187 11.063 11.063 993 3HD2 LEU 350 2HD2 LEU 50 0.352 12.014 12.014 994 H LYS 351 H LYS 51 -3.005 12.822 12.822 995 HA LYS 351 HA LYS 51 -4.147 14.014 14.014 996 1HB LYS 351 2HB LYS 51 -4.807 11.772 11.772 997 2HB LYS 351 1HB LYS 51 -5.513 12.459 12.459 998 1HG LYS 351 2HG LYS 51 -7.353 13.277 13.277 999 2HG LYS 351 1HG LYS 51 -6.454 13.576 13.576 1000 1HD LYS 351 2HD LYS 51 -7.937 11.749 11.749 1001 2HD LYS 351 1HD LYS 51 -6.327 11.050 11.050 1002 1HE LYS 351 2HE LYS 51 -7.554 9.624 9.624 1003 2HE LYS 351 1HE LYS 51 -7.046 10.836 10.836 1004 1HZ LYS 351 3HZ LYS 51 -9.191 12.014 12.014 1005 2HZ LYS 351 2HZ LYS 51 -9.667 10.574 10.574 1006 3HZ LYS 351 1HZ LYS 51 -9.334 10.586 10.586 1007 H ASP 352 H ASP 52 -4.720 14.597 14.597 1008 HA ASP 352 HA ASP 52 -6.861 16.490 16.490 1009 1HB ASP 352 2HB ASP 52 -5.452 15.313 15.313 1010 2HB ASP 352 1HB ASP 52 -5.426 17.064 17.064 1011 H ALA 353 H ALA 53 -3.365 16.716 16.716 1012 HA ALA 353 HA ALA 53 -3.400 19.656 19.656 1013 1HB ALA 353 1HB ALA 53 -1.214 17.602 17.602 1014 2HB ALA 353 3HB ALA 53 -0.910 19.334 19.334 1015 3HB ALA 353 2HB ALA 53 -1.489 18.649 18.649 1016 H GLN 354 H GLN 54 -3.891 17.308 17.308 1017 HA GLN 354 HA GLN 54 -2.581 18.367 18.367 1018 1HB GLN 354 2HB GLN 54 -5.057 16.756 16.756 1019 2HB GLN 354 1HB GLN 54 -4.835 17.490 17.490 1020 1HG GLN 354 2HG GLN 54 -2.359 16.507 16.507 1021 2HG GLN 354 1HG GLN 54 -3.249 15.353 15.353 1022 1HE2 GLN 354 2HE2 GLN 54 -3.185 14.551 14.551 1023 2HE2 GLN 354 1HE2 GLN 54 -1.968 15.285 15.285 1024 H ALA 355 HN ALA 55 -5.978 19.019 19.019 1025 HA ALA 355 HA ALA 55 -7.358 20.832 20.832 1026 1HB ALA 355 3HB ALA 55 -5.552 21.691 21.691 1027 2HB ALA 355 2HB ALA 55 -4.946 22.589 22.589 1028 3HB ALA 355 1HB ALA 55 -6.598 22.845 22.845 Start of MODEL 18 1 1H GLY 325 1H GLY 25 12.474 3.510 3.510 2 2H GLY 325 3H GLY 25 12.895 4.266 4.266 3 3H GLY 325 2H GLY 25 13.661 2.821 2.821 4 1HA GLY 325 2HA GLY 25 12.062 2.318 2.318 5 2HA GLY 325 1HA GLY 25 10.813 3.156 3.156 6 H GLU 326 H GLU 26 11.257 0.222 0.222 7 HA GLU 326 HA GLU 26 11.219 -1.008 -1.008 8 1HB GLU 326 2HB GLU 26 11.909 -1.962 -1.962 9 2HB GLU 326 1HB GLU 26 11.135 -3.130 -3.130 10 1HG GLU 326 2HG GLU 26 13.409 -1.466 -1.466 11 2HG GLU 326 1HG GLU 26 13.752 -2.877 -2.877 12 H TYR 327 H TYR 27 9.553 -2.798 -2.798 13 HA TYR 327 HA TYR 27 6.964 -1.862 -1.862 14 1HB TYR 327 2HB TYR 27 7.807 -2.979 -2.979 15 2HB TYR 327 1HB TYR 27 6.294 -3.637 -3.637 16 HD1 TYR 327 HD1 TYR 27 8.042 -0.554 -0.554 17 HD2 TYR 327 HD2 TYR 27 4.319 -2.262 -2.262 18 HE1 TYR 327 HE1 TYR 27 6.854 1.514 1.514 19 HE2 TYR 327 HE2 TYR 27 3.133 -0.193 -0.193 20 HH TYR 327 HH TYR 27 3.969 1.839 1.839 21 H PHE 328 H PHE 28 5.942 -3.149 -3.149 22 HA PHE 328 HA PHE 28 6.751 -6.026 -6.026 23 1HB PHE 328 2HB PHE 28 6.060 -4.186 -4.186 24 2HB PHE 328 1HB PHE 28 6.425 -5.906 -5.906 25 HD1 PHE 328 HD2 PHE 28 7.846 -2.679 -2.679 26 HD2 PHE 328 HD1 PHE 28 8.654 -6.636 -6.636 27 HE1 PHE 328 HE2 PHE 28 10.270 -2.159 -2.159 28 HE2 PHE 328 HE1 PHE 28 11.078 -6.115 -6.115 29 HZ PHE 328 HZ PHE 28 11.886 -3.876 -3.876 30 H THR 329 H THR 29 4.965 -7.278 -7.278 31 HA THR 329 HA THR 29 2.259 -6.210 -6.210 32 HB THR 329 HB THR 29 2.615 -9.120 -9.120 33 HG1 THR 329 HG1 THR 29 3.799 -9.034 -9.034 34 1HG2 THR 329 3HG2 THR 29 0.672 -7.379 -7.379 35 2HG2 THR 329 2HG2 THR 29 1.555 -7.368 -7.368 36 3HG2 THR 329 1HG2 THR 29 0.914 -8.882 -8.882 37 H LEU 330 H LEU 30 0.820 -6.453 -6.453 38 HA LEU 330 HA LEU 30 1.574 -8.239 -8.239 39 1HB LEU 330 2HB LEU 30 1.047 -5.538 -5.538 40 2HB LEU 330 1HB LEU 30 -0.506 -6.242 -6.242 41 HG LEU 330 HG LEU 30 1.357 -7.711 -7.711 42 1HD1 LEU 330 1HD1 LEU 30 2.641 -5.364 -5.364 43 2HD1 LEU 330 3HD1 LEU 30 1.991 -4.985 -4.985 44 3HD1 LEU 330 2HD1 LEU 30 3.065 -6.368 -6.368 45 1HD2 LEU 330 2HD2 LEU 30 -0.351 -5.318 -5.318 46 2HD2 LEU 330 1HD2 LEU 30 -0.842 -7.010 -7.010 47 3HD2 LEU 330 3HD2 LEU 30 0.380 -6.420 -6.420 48 H GLN 331 H GLN 31 0.533 -10.133 -10.133 49 HA GLN 331 HA GLN 31 -2.246 -9.948 -9.948 50 1HB GLN 331 2HB GLN 31 -0.510 -12.383 -12.383 51 2HB GLN 331 1HB GLN 31 -2.063 -12.376 -12.376 52 1HG GLN 331 2HG GLN 31 -1.204 -11.407 -11.407 53 2HG GLN 331 1HG GLN 31 0.045 -10.530 -10.530 54 1HE2 GLN 331 2HE2 GLN 31 0.891 -14.529 -14.529 55 2HE2 GLN 331 1HE2 GLN 31 -0.607 -14.035 -14.035 56 H ILE 332 H ILE 32 -3.750 -9.649 -9.649 57 HA ILE 332 HA ILE 32 -3.343 -11.001 -11.001 58 HB ILE 332 HB ILE 32 -5.180 -8.726 -8.726 59 1HG1 ILE 332 2HG1 ILE 32 -3.231 -8.279 -8.279 60 2HG1 ILE 332 1HG1 ILE 32 -2.454 -8.734 -8.734 61 1HG2 ILE 332 1HG2 ILE 32 -4.751 -10.131 -10.131 62 2HG2 ILE 332 3HG2 ILE 32 -5.577 -8.582 -8.582 63 3HG2 ILE 332 2HG2 ILE 32 -6.254 -10.027 -10.027 64 1HD1 ILE 332 1HD1 ILE 32 -4.652 -6.763 -6.763 65 2HD1 ILE 332 3HD1 ILE 32 -3.212 -6.188 -6.188 66 3HD1 ILE 332 2HD1 ILE 32 -3.084 -6.808 -6.808 67 H ARG 333 H ARG 33 -4.944 -12.372 -12.372 68 HA ARG 333 HA ARG 33 -7.015 -13.225 -13.225 69 1HB ARG 333 2HB ARG 33 -5.362 -14.973 -14.973 70 2HB ARG 333 1HB ARG 33 -5.754 -14.792 -14.792 71 1HG ARG 333 2HG ARG 33 -8.020 -15.542 -15.542 72 2HG ARG 333 1HG ARG 33 -7.793 -15.526 -15.526 73 1HD ARG 333 2HD ARG 33 -6.583 -17.479 -17.479 74 2HD ARG 333 1HD ARG 33 -5.879 -17.166 -17.166 75 HE ARG 333 HE ARG 33 -8.562 -18.350 -18.350 76 1HH1 ARG 333 1HH2 ARG 33 -9.358 -17.323 -17.323 77 2HH1 ARG 333 2HH2 ARG 33 -8.524 -18.139 -18.139 78 1HH2 ARG 333 2HH1 ARG 33 -6.044 -19.406 -19.406 79 2HH2 ARG 333 1HH1 ARG 33 -6.648 -19.320 -19.320 80 H GLY 334 H GLY 34 -8.582 -11.686 -11.686 81 1HA GLY 334 2HA GLY 34 -10.338 -12.538 -12.538 82 2HA GLY 334 1HA GLY 34 -9.298 -11.287 -11.287 83 H ARG 335 H ARG 35 -10.206 -9.309 -9.309 84 HA ARG 335 HA ARG 35 -11.082 -8.101 -8.101 85 1HB ARG 335 2HB ARG 35 -12.968 -9.839 -9.839 86 2HB ARG 335 1HB ARG 35 -13.449 -8.633 -8.633 87 1HG ARG 335 2HG ARG 35 -14.074 -7.095 -7.095 88 2HG ARG 335 1HG ARG 35 -12.872 -7.657 -7.657 89 1HD ARG 335 2HD ARG 35 -14.235 -9.761 -9.761 90 2HD ARG 335 1HD ARG 35 -15.485 -9.015 -9.015 91 HE ARG 335 HE ARG 35 -14.571 -7.742 -7.742 92 1HH1 ARG 335 2HH1 ARG 35 -16.368 -5.951 -5.951 93 2HH1 ARG 335 1HH1 ARG 35 -17.960 -6.626 -6.626 94 1HH2 ARG 335 1HH2 ARG 35 -16.887 -9.899 -9.899 95 2HH2 ARG 335 2HH2 ARG 35 -18.252 -8.862 -8.862 96 H GLU 336 H GLU 36 -11.707 -8.210 -8.210 97 HA GLU 336 HA GLU 36 -12.076 -5.334 -5.334 98 1HB GLU 336 2HB GLU 36 -11.336 -7.242 -7.242 99 2HB GLU 336 1HB GLU 36 -12.141 -5.680 -5.680 100 1HG GLU 336 2HG GLU 36 -13.272 -8.124 -8.124 101 2HG GLU 336 1HG GLU 36 -13.773 -7.516 -7.516 102 H ARG 337 H ARG 37 -9.447 -7.490 -7.490 103 HA ARG 337 HA ARG 37 -7.626 -5.488 -5.488 104 1HB ARG 337 2HB ARG 37 -7.120 -8.198 -8.198 105 2HB ARG 337 1HB ARG 37 -5.838 -7.181 -7.181 106 1HG ARG 337 2HG ARG 37 -7.082 -7.151 -7.151 107 2HG ARG 337 1HG ARG 37 -8.198 -8.336 -8.336 108 1HD ARG 337 2HD ARG 37 -5.207 -8.687 -8.687 109 2HD ARG 337 1HD ARG 37 -6.469 -9.500 -9.500 110 HE ARG 337 HE ARG 37 -6.063 -9.938 -9.938 111 1HH1 ARG 337 1HH2 ARG 37 -8.461 -10.802 -10.802 112 2HH1 ARG 337 2HH2 ARG 37 -8.108 -12.493 -12.493 113 1HH2 ARG 337 2HH1 ARG 37 -4.918 -12.191 -12.191 114 2HH2 ARG 337 1HH1 ARG 37 -6.103 -13.280 -13.280 115 H PHE 338 H PHE 38 -8.112 -6.955 -6.955 116 HA PHE 338 HA PHE 38 -6.096 -5.579 -5.579 117 1HB PHE 338 2HB PHE 38 -7.368 -7.340 -7.340 118 2HB PHE 338 1HB PHE 38 -8.865 -6.427 -6.427 119 HD1 PHE 338 HD1 PHE 38 -5.481 -5.213 -5.213 120 HD2 PHE 338 HD2 PHE 38 -9.539 -5.965 -5.965 121 HE1 PHE 338 HE1 PHE 38 -5.053 -4.087 -4.087 122 HE2 PHE 338 HE2 PHE 38 -9.111 -4.840 -4.840 123 HZ PHE 338 HZ PHE 38 -6.868 -3.901 -3.901 124 H GLU 339 H GLU 39 -9.366 -4.515 -4.515 125 HA GLU 339 HA GLU 39 -9.274 -2.047 -2.047 126 1HB GLU 339 2HB GLU 39 -10.904 -3.068 -3.068 127 2HB GLU 339 1HB GLU 39 -11.017 -1.373 -1.373 128 1HG GLU 339 2HG GLU 39 -11.086 -3.044 -3.044 129 2HG GLU 339 1HG GLU 39 -12.300 -3.589 -3.589 130 H MET 340 H MET 40 -8.437 -2.896 -2.896 131 HA MET 340 HA MET 40 -7.837 -0.335 -0.335 132 1HB MET 340 2HB MET 40 -6.705 -3.056 -3.056 133 2HB MET 340 1HB MET 40 -6.054 -1.627 -1.627 134 1HG MET 340 2HG MET 40 -8.159 -1.109 -1.109 135 2HG MET 340 1HG MET 40 -9.010 -2.260 -2.260 136 1HE MET 340 1HE MET 40 -5.792 -2.104 -2.104 137 2HE MET 340 3HE MET 40 -5.713 -3.588 -3.588 138 3HE MET 340 2HE MET 40 -5.528 -3.656 -3.656 139 H PHE 341 H PHE 41 -5.591 -2.620 -2.620 140 HA PHE 341 HA PHE 41 -3.347 -0.934 -0.934 141 1HB PHE 341 2HB PHE 41 -4.298 -3.220 -3.220 142 2HB PHE 341 1HB PHE 41 -2.753 -2.442 -2.442 143 HD1 PHE 341 HD1 PHE 41 -2.004 -1.839 -1.839 144 HD2 PHE 341 HD2 PHE 41 -3.702 -5.339 -5.339 145 HE1 PHE 341 HE1 PHE 41 -1.096 -3.245 -3.245 146 HE2 PHE 341 HE2 PHE 41 -2.793 -6.741 -6.741 147 HZ PHE 341 HZ PHE 41 -1.500 -5.692 -5.692 148 H ARG 342 H ARG 42 -6.116 -1.252 -1.252 149 HA ARG 342 HA ARG 42 -5.255 0.200 0.200 150 1HB ARG 342 2HB ARG 42 -7.703 -0.871 -0.871 151 2HB ARG 342 1HB ARG 42 -8.004 0.820 0.820 152 1HG ARG 342 2HG ARG 42 -6.844 0.390 0.390 153 2HG ARG 342 1HG ARG 42 -6.870 -1.327 -1.327 154 1HD ARG 342 2HD ARG 42 -8.829 -0.959 -0.959 155 2HD ARG 342 1HD ARG 42 -9.389 -1.053 -1.053 156 HE ARG 342 HE ARG 42 -8.953 1.648 1.648 157 1HH1 ARG 342 1HH2 ARG 42 -11.650 0.071 0.071 158 2HH1 ARG 342 2HH2 ARG 42 -12.442 0.743 0.743 159 1HH2 ARG 342 1HH1 ARG 42 -11.251 1.916 1.916 160 2HH2 ARG 342 2HH1 ARG 42 -9.549 2.145 2.145 161 H GLU 343 H GLU 43 -6.727 1.328 1.328 162 HA GLU 343 HA GLU 43 -6.856 4.100 4.100 163 1HB GLU 343 2HB GLU 43 -8.070 3.002 3.002 164 2HB GLU 343 1HB GLU 43 -6.536 3.054 3.054 165 1HG GLU 343 2HG GLU 43 -7.387 5.085 5.085 166 2HG GLU 343 1HG GLU 43 -6.603 5.602 5.602 167 H LEU 344 H LEU 44 -4.450 2.265 2.265 168 HA LEU 344 HA LEU 44 -2.687 4.406 4.406 169 1HB LEU 344 2HB LEU 44 -2.205 1.456 1.456 170 2HB LEU 344 1HB LEU 44 -0.883 2.552 2.552 171 HG LEU 344 HG LEU 44 -1.398 1.882 1.882 172 1HD1 LEU 344 3HD1 LEU 44 -2.003 4.379 4.379 173 2HD1 LEU 344 2HD1 LEU 44 -3.679 3.848 3.848 174 3HD1 LEU 344 1HD1 LEU 44 -2.577 3.570 3.570 175 1HD2 LEU 344 3HD2 LEU 44 -3.487 0.611 0.611 176 2HD2 LEU 344 2HD2 LEU 44 -3.243 0.676 0.676 177 3HD2 LEU 344 1HD2 LEU 44 -4.349 1.810 1.810 178 H ASN 345 H ASN 45 -2.805 2.272 2.272 179 HA ASN 345 HA ASN 45 -0.556 3.427 3.427 180 1HB ASN 345 2HB ASN 45 -2.565 1.430 1.430 181 2HB ASN 345 1HB ASN 45 -2.410 2.482 2.482 182 1HD2 ASN 345 2HD2 ASN 45 0.166 -0.239 -0.239 183 2HD2 ASN 345 1HD2 ASN 45 -1.524 -0.233 -0.233 184 H GLU 346 H GLU 46 -3.892 4.379 4.379 185 HA GLU 346 HA GLU 46 -4.032 6.068 6.068 186 1HB GLU 346 2HB GLU 46 -5.636 5.596 5.596 187 2HB GLU 346 1HB GLU 46 -5.753 7.237 7.237 188 1HG GLU 346 2HG GLU 46 -5.864 5.597 5.597 189 2HG GLU 346 1HG GLU 46 -6.862 4.769 4.769 190 H ALA 347 H ALA 47 -3.591 6.943 6.943 191 HA ALA 347 HA ALA 47 -2.931 9.682 9.682 192 1HB ALA 347 3HB ALA 47 -3.647 8.666 8.666 193 2HB ALA 347 2HB ALA 47 -1.968 8.155 8.155 194 3HB ALA 347 1HB ALA 47 -2.360 9.871 9.871 195 H LEU 348 H LEU 48 -0.847 6.877 6.877 196 HA LEU 348 HA LEU 48 1.645 8.154 8.154 197 1HB LEU 348 2HB LEU 48 0.962 5.427 5.427 198 2HB LEU 348 1HB LEU 48 2.571 5.975 5.975 199 HG LEU 348 HG LEU 48 0.257 5.972 5.972 200 1HD1 LEU 348 3HD1 LEU 48 1.226 3.675 3.675 201 2HD1 LEU 348 2HD1 LEU 48 2.231 3.810 3.810 202 3HD1 LEU 348 1HD1 LEU 48 0.474 3.751 3.751 203 1HD2 LEU 348 1HD2 LEU 48 3.112 6.619 6.619 204 2HD2 LEU 348 3HD2 LEU 48 1.846 7.061 7.061 205 3HD2 LEU 348 2HD2 LEU 48 2.649 5.496 5.496 206 H GLU 349 H GLU 49 -0.164 6.762 6.762 207 HA GLU 349 HA GLU 49 1.684 7.562 7.562 208 1HB GLU 349 2HB GLU 49 -1.241 6.867 6.867 209 2HB GLU 349 1HB GLU 49 -0.527 7.540 7.540 210 1HG GLU 349 2HG GLU 49 1.341 5.670 5.670 211 2HG GLU 349 1HG GLU 49 -0.108 4.890 4.890 212 H LEU 350 H LEU 50 -0.916 9.303 9.303 213 HA LEU 350 HA LEU 50 -0.858 11.538 11.538 214 1HB LEU 350 2HB LEU 50 -2.745 12.054 12.054 215 2HB LEU 350 1HB LEU 50 -2.474 10.657 10.657 216 HG LEU 350 HG LEU 50 -0.922 12.191 12.191 217 1HD1 LEU 350 2HD1 LEU 50 -1.708 13.925 13.925 218 2HD1 LEU 350 1HD1 LEU 50 -2.235 14.593 14.593 219 3HD1 LEU 350 3HD1 LEU 50 -0.541 14.181 14.181 220 1HD2 LEU 350 3HD2 LEU 50 -3.467 11.514 11.514 221 2HD2 LEU 350 2HD2 LEU 50 -2.697 12.722 12.722 222 3HD2 LEU 350 1HD2 LEU 50 -3.726 13.230 13.230 223 H LYS 351 H LYS 51 1.033 10.494 10.494 224 HA LYS 351 HA LYS 51 2.108 13.030 13.030 225 1HB LYS 351 2HB LYS 51 2.342 10.988 10.988 226 2HB LYS 351 1HB LYS 51 3.397 10.294 10.294 227 1HG LYS 351 2HG LYS 51 5.176 11.530 11.530 228 2HG LYS 351 1HG LYS 51 4.204 12.992 12.992 229 1HD LYS 351 2HD LYS 51 5.134 12.216 12.216 230 2HD LYS 351 1HD LYS 51 3.371 12.230 12.230 231 1HE LYS 351 2HE LYS 51 3.214 9.921 9.921 232 2HE LYS 351 1HE LYS 51 4.763 9.719 9.719 233 1HZ LYS 351 1HZ LYS 51 4.471 10.669 10.669 234 2HZ LYS 351 3HZ LYS 51 4.793 9.060 9.060 235 3HZ LYS 351 2HZ LYS 51 5.917 10.278 10.278 236 H ASP 352 H ASP 52 3.122 10.583 10.583 237 HA ASP 352 HA ASP 52 5.489 12.018 12.018 238 1HB ASP 352 2HB ASP 52 4.312 9.523 9.523 239 2HB ASP 352 1HB ASP 52 4.363 10.394 10.394 240 H ALA 353 H ALA 53 2.088 12.122 12.122 241 HA ALA 353 HA ALA 53 2.688 13.968 13.968 242 1HB ALA 353 1HB ALA 53 0.944 12.180 12.180 243 2HB ALA 353 3HB ALA 53 0.007 12.992 12.992 244 3HB ALA 353 2HB ALA 53 0.317 13.804 13.804 245 H GLN 354 H GLN 54 3.217 14.792 14.792 246 HA GLN 354 HA GLN 54 1.304 17.100 17.100 247 1HB GLN 354 2HB GLN 54 1.853 15.091 15.091 248 2HB GLN 354 1HB GLN 54 2.498 16.624 16.624 249 1HG GLN 354 2HG GLN 54 -0.057 17.073 17.073 250 2HG GLN 354 1HG GLN 54 -0.206 15.808 15.808 251 1HE2 GLN 354 2HE2 GLN 54 1.278 18.105 18.105 252 2HE2 GLN 354 1HE2 GLN 54 1.727 16.612 16.612 253 H ALA 355 HN ALA 55 3.121 17.985 17.985 254 HA ALA 355 HA ALA 55 4.891 19.613 19.613 255 1HB ALA 355 3HB ALA 55 6.201 17.516 17.516 256 2HB ALA 355 2HB ALA 55 6.117 17.584 17.584 257 3HB ALA 355 1HB ALA 55 6.998 18.827 18.827 258 1H GLY 325 1H GLY 25 -12.908 -16.689 -16.689 259 2H GLY 325 3H GLY 25 -13.528 -15.919 -15.919 260 3H GLY 325 2H GLY 25 -14.155 -15.546 -15.546 261 1HA GLY 325 2HA GLY 25 -12.721 -13.772 -13.772 262 2HA GLY 325 1HA GLY 25 -11.432 -14.929 -14.929 263 H GLU 326 H GLU 26 -11.786 -12.655 -12.655 264 HA GLU 326 HA GLU 26 -11.373 -14.237 -14.237 265 1HB GLU 326 2HB GLU 26 -12.303 -11.475 -11.475 266 2HB GLU 326 1HB GLU 26 -11.351 -11.684 -11.684 267 1HG GLU 326 2HG GLU 26 -13.590 -13.597 -13.597 268 2HG GLU 326 1HG GLU 26 -13.962 -12.006 -12.006 269 H TYR 327 H TYR 27 -9.589 -13.382 -13.382 270 HA TYR 327 HA TYR 27 -7.199 -12.782 -12.782 271 1HB TYR 327 2HB TYR 27 -7.689 -14.375 -14.375 272 2HB TYR 327 1HB TYR 27 -6.217 -13.405 -13.405 273 HD1 TYR 327 HD1 TYR 27 -8.024 -16.085 -16.085 274 HD2 TYR 327 HD2 TYR 27 -4.367 -13.855 -13.855 275 HE1 TYR 327 HE1 TYR 27 -6.897 -17.724 -17.724 276 HE2 TYR 327 HE2 TYR 27 -3.241 -15.492 -15.492 277 HH TYR 327 HH TYR 27 -3.976 -18.305 -18.305 278 H PHE 328 H PHE 28 -6.275 -10.795 -10.795 279 HA PHE 328 HA PHE 28 -6.916 -9.154 -9.154 280 1HB PHE 328 2HB PHE 28 -6.621 -8.195 -8.195 281 2HB PHE 328 1HB PHE 28 -6.898 -7.161 -7.161 282 HD1 PHE 328 HD2 PHE 28 -8.354 -10.066 -10.066 283 HD2 PHE 328 HD1 PHE 28 -9.085 -6.724 -6.724 284 HE1 PHE 328 HE2 PHE 28 -10.797 -10.444 -10.444 285 HE2 PHE 328 HE1 PHE 28 -11.528 -7.100 -7.100 286 HZ PHE 328 HZ PHE 28 -12.384 -8.961 -8.961 287 H THR 329 H THR 29 -5.231 -7.313 -7.313 288 HA THR 329 HA THR 29 -2.543 -8.264 -8.264 289 HB THR 329 HB THR 29 -2.503 -6.884 -6.884 290 HG1 THR 329 HG1 THR 29 -3.526 -8.480 -8.480 291 1HG2 THR 329 3HG2 THR 29 -0.805 -8.443 -8.443 292 2HG2 THR 329 2HG2 THR 29 -1.641 -9.712 -9.712 293 3HG2 THR 329 1HG2 THR 29 -0.834 -8.406 -8.406 294 H LEU 330 H LEU 30 -1.163 -6.657 -6.657 295 HA LEU 330 HA LEU 30 -2.162 -3.840 -3.840 296 1HB LEU 330 2HB LEU 30 -1.758 -5.329 -5.329 297 2HB LEU 330 1HB LEU 30 -0.241 -4.447 -4.447 298 HG LEU 330 HG LEU 30 -2.280 -2.588 -2.588 299 1HD1 LEU 330 1HD1 LEU 30 -3.392 -4.667 -4.667 300 2HD1 LEU 330 3HD1 LEU 30 -2.923 -3.527 -3.527 301 3HD1 LEU 330 2HD1 LEU 30 -4.003 -3.013 -3.013 302 1HD2 LEU 330 2HD2 LEU 30 -0.632 -3.077 -3.077 303 2HD2 LEU 330 1HD2 LEU 30 -0.131 -2.117 -2.117 304 3HD2 LEU 330 3HD2 LEU 30 -1.470 -1.573 -1.573 305 H GLN 331 H GLN 31 -0.914 -3.514 -3.514 306 HA GLN 331 HA GLN 31 1.944 -4.084 -4.084 307 1HB GLN 331 2HB GLN 31 0.308 -2.403 -2.403 308 2HB GLN 331 1HB GLN 31 1.943 -3.004 -3.004 309 1HG GLN 331 2HG GLN 31 1.241 -5.174 -5.174 310 2HG GLN 331 1HG GLN 31 -0.142 -5.004 -5.004 311 1HE2 GLN 331 2HE2 GLN 31 -0.731 -3.138 -3.138 312 2HE2 GLN 331 1HE2 GLN 31 0.665 -2.799 -2.799 313 H ILE 332 H ILE 32 3.232 -2.852 -2.852 314 HA ILE 332 HA ILE 32 2.604 0.049 0.049 315 HB ILE 332 HB ILE 32 4.401 -1.771 -1.771 316 1HG1 ILE 332 2HG1 ILE 32 2.216 -0.392 -0.392 317 2HG1 ILE 332 1HG1 ILE 32 1.624 -1.420 -1.420 318 1HG2 ILE 332 1HG2 ILE 32 3.753 1.180 1.180 319 2HG2 ILE 332 3HG2 ILE 32 4.509 0.234 0.234 320 3HG2 ILE 332 2HG2 ILE 32 5.342 0.457 0.457 321 1HD1 ILE 332 1HD1 ILE 32 3.733 -2.614 -2.614 322 2HD1 ILE 332 3HD1 ILE 32 2.177 -2.346 -2.346 323 3HD1 ILE 332 2HD1 ILE 32 2.271 -3.346 -3.346 324 H ARG 333 H ARG 33 4.195 1.596 1.596 325 HA ARG 333 HA ARG 33 6.501 0.519 0.519 326 1HB ARG 333 2HB ARG 33 4.913 1.851 1.851 327 2HB ARG 333 1HB ARG 33 5.106 3.205 3.205 328 1HG ARG 333 2HG ARG 33 7.443 3.431 3.431 329 2HG ARG 333 1HG ARG 33 7.401 1.949 1.949 330 1HD ARG 333 2HD ARG 33 6.326 2.953 2.953 331 2HD ARG 333 1HD ARG 33 5.434 4.064 4.064 332 HE ARG 333 HE ARG 33 8.221 4.463 4.463 333 1HH1 ARG 333 1HH2 ARG 33 8.703 5.897 5.897 334 2HH1 ARG 333 2HH2 ARG 33 7.784 7.362 7.362 335 1HH2 ARG 333 2HH1 ARG 33 5.613 6.184 6.184 336 2HH2 ARG 333 1HH1 ARG 33 6.032 7.525 7.525 337 H GLY 334 H GLY 34 7.877 0.364 0.364 338 1HA GLY 334 2HA GLY 34 9.475 2.635 2.635 339 2HA GLY 334 1HA GLY 34 8.303 2.478 2.478 340 H ARG 335 H ARG 35 9.095 1.345 1.345 341 HA ARG 335 HA ARG 35 10.157 -1.289 -1.289 342 1HB ARG 335 2HB ARG 35 12.063 0.267 0.267 343 2HB ARG 335 1HB ARG 35 12.345 0.621 0.621 344 1HG ARG 335 2HG ARG 35 13.065 -1.513 -1.513 345 2HG ARG 335 1HG ARG 35 12.023 -2.245 -2.245 346 1HD ARG 335 2HD ARG 35 13.515 -1.237 -1.237 347 2HD ARG 335 1HD ARG 35 14.610 -0.742 -0.742 348 HE ARG 335 HE ARG 35 13.905 -3.618 -3.618 349 1HH1 ARG 335 2HH1 ARG 35 15.541 -4.210 -4.210 350 2HH1 ARG 335 1HH1 ARG 35 17.174 -3.847 -3.847 351 1HH2 ARG 335 1HH2 ARG 35 16.269 -1.770 -1.770 352 2HH2 ARG 335 2HH2 ARG 35 17.586 -2.464 -2.464 353 H GLU 336 H GLU 36 10.392 1.735 1.735 354 HA GLU 336 HA GLU 36 10.588 0.343 0.343 355 1HB GLU 336 2HB GLU 36 9.708 3.203 3.203 356 2HB GLU 336 1HB GLU 36 10.391 2.531 2.531 357 1HG GLU 336 2HG GLU 36 11.823 2.770 2.770 358 2HG GLU 336 1HG GLU 36 12.112 3.772 3.772 359 H ARG 337 H ARG 37 7.961 2.310 2.310 360 HA ARG 337 HA ARG 37 5.957 1.723 1.723 361 1HB ARG 337 2HB ARG 37 5.743 2.118 2.118 362 2HB ARG 337 1HB ARG 37 4.346 2.046 2.046 363 1HG ARG 337 2HG ARG 37 5.361 3.928 3.928 364 2HG ARG 337 1HG ARG 37 6.604 4.064 4.064 365 1HD ARG 337 2HD ARG 37 3.616 4.378 4.378 366 2HD ARG 337 1HD ARG 37 4.814 5.673 5.673 367 HE ARG 337 HE ARG 37 4.769 3.457 3.457 368 1HH1 ARG 337 1HH2 ARG 37 6.982 5.662 5.662 369 2HH1 ARG 337 2HH2 ARG 37 6.717 6.678 6.678 370 1HH2 ARG 337 2HH1 ARG 37 3.679 5.218 5.218 371 2HH2 ARG 337 1HH1 ARG 37 4.845 6.426 6.426 372 H PHE 338 H PHE 38 6.838 -0.120 -0.120 373 HA PHE 338 HA PHE 38 4.923 -2.189 -2.189 374 1HB PHE 338 2HB PHE 38 6.414 -2.021 -2.021 375 2HB PHE 338 1HB PHE 38 7.827 -2.285 -2.285 376 HD1 PHE 338 HD1 PHE 38 4.515 -4.015 -4.015 377 HD2 PHE 338 HD2 PHE 38 8.715 -4.336 -4.336 378 HE1 PHE 338 HE1 PHE 38 4.272 -6.465 -6.465 379 HE2 PHE 338 HE2 PHE 38 8.472 -6.785 -6.785 380 HZ PHE 338 HZ PHE 38 6.249 -7.850 -7.850 381 H GLU 339 H GLU 39 8.017 -1.806 -1.806 382 HA GLU 339 HA GLU 39 7.939 -4.389 -4.389 383 1HB GLU 339 2HB GLU 39 9.379 -1.805 -1.805 384 2HB GLU 339 1HB GLU 39 9.447 -3.131 -3.131 385 1HG GLU 339 2HG GLU 39 9.879 -4.161 -4.161 386 2HG GLU 339 1HG GLU 39 10.996 -2.830 -2.830 387 H MET 340 H MET 40 6.831 -1.157 -1.157 388 HA MET 340 HA MET 40 5.963 -1.789 -1.789 389 1HB MET 340 2HB MET 40 4.953 0.144 0.144 390 2HB MET 340 1HB MET 40 4.138 -0.009 -0.009 391 1HG MET 340 2HG MET 40 6.094 0.648 0.648 392 2HG MET 340 1HG MET 40 7.115 0.464 0.464 393 1HE MET 340 1HE MET 40 3.737 1.834 1.834 394 2HE MET 340 3HE MET 40 3.645 3.442 3.442 395 3HE MET 340 2HE MET 40 3.614 2.006 2.006 396 H PHE 341 H PHE 41 4.010 -1.843 -1.843 397 HA PHE 341 HA PHE 41 1.701 -3.049 -3.049 398 1HB PHE 341 2HB PHE 41 2.886 -3.217 -3.217 399 2HB PHE 341 1HB PHE 41 1.298 -3.860 -3.860 400 HD1 PHE 341 HD1 PHE 41 0.353 -1.822 -1.822 401 HD2 PHE 341 HD2 PHE 41 2.403 -1.364 -1.364 402 HE1 PHE 341 HE1 PHE 41 -0.629 0.440 0.440 403 HE2 PHE 341 HE2 PHE 41 1.422 0.897 0.897 404 HZ PHE 341 HZ PHE 41 -0.095 1.800 1.800 405 H ARG 342 H ARG 42 4.767 -4.409 -4.409 406 HA ARG 342 HA ARG 42 4.013 -7.152 -7.152 407 1HB ARG 342 2HB ARG 42 6.415 -5.636 -5.636 408 2HB ARG 342 1HB ARG 42 6.647 -6.886 -6.886 409 1HG ARG 342 2HG ARG 42 5.757 -8.557 -8.557 410 2HG ARG 342 1HG ARG 42 5.835 -7.271 -7.271 411 1HD ARG 342 2HD ARG 42 7.898 -8.456 -8.456 412 2HD ARG 342 1HD ARG 42 8.283 -6.977 -6.977 413 HE ARG 342 HE ARG 42 7.738 -8.790 -8.790 414 1HH1 ARG 342 1HH2 ARG 42 10.490 -7.670 -7.670 415 2HH1 ARG 342 2HH2 ARG 42 11.389 -9.146 -9.146 416 1HH2 ARG 342 2HH1 ARG 42 8.580 -11.174 -11.174 417 2HH2 ARG 342 1HH1 ARG 42 10.306 -11.132 -11.132 418 H GLU 343 H GLU 43 5.091 -5.176 -5.176 419 HA GLU 343 HA GLU 43 5.125 -7.330 -7.330 420 1HB GLU 343 2HB GLU 43 6.184 -5.031 -5.031 421 2HB GLU 343 1HB GLU 43 4.566 -4.423 -4.423 422 1HG GLU 343 2HG GLU 43 5.211 -4.933 -4.933 423 2HG GLU 343 1HG GLU 43 4.570 -6.507 -6.507 424 H LEU 344 H LEU 44 2.629 -4.872 -4.872 425 HA LEU 344 HA LEU 44 0.700 -5.722 -5.722 426 1HB LEU 344 2HB LEU 44 0.408 -4.512 -4.512 427 2HB LEU 344 1HB LEU 44 -0.986 -4.864 -4.864 428 HG LEU 344 HG LEU 44 -0.625 -2.681 -2.681 429 1HD1 LEU 344 3HD1 LEU 44 -0.146 -4.277 -4.277 430 2HD1 LEU 344 2HD1 LEU 44 1.538 -3.796 -3.796 431 3HD1 LEU 344 1HD1 LEU 44 0.316 -2.583 -2.583 432 1HD2 LEU 344 3HD2 LEU 44 1.651 -2.919 -2.919 433 2HD2 LEU 344 2HD2 LEU 44 1.221 -1.481 -1.481 434 3HD2 LEU 344 1HD2 LEU 44 2.325 -2.673 -2.673 435 H ASN 345 H ASN 45 1.265 -6.868 -6.868 436 HA ASN 345 HA ASN 45 -0.881 -8.768 -8.768 437 1HB ASN 345 2HB ASN 45 1.335 -8.002 -8.002 438 2HB ASN 345 1HB ASN 45 1.207 -9.759 -9.759 439 1HD2 ASN 345 2HD2 ASN 45 -1.078 -8.431 -8.431 440 2HD2 ASN 345 1HD2 ASN 45 0.580 -8.273 -8.273 441 H GLU 346 H GLU 46 2.349 -8.857 -8.857 442 HA GLU 346 HA GLU 46 2.612 -11.709 -11.709 443 1HB GLU 346 2HB GLU 46 3.971 -9.330 -9.330 444 2HB GLU 346 1HB GLU 46 4.059 -10.762 -10.762 445 1HG GLU 346 2HG GLU 46 4.514 -11.730 -11.730 446 2HG GLU 346 1HG GLU 46 5.421 -10.219 -10.219 447 H ALA 347 H ALA 47 1.836 -9.355 -9.355 448 HA ALA 347 HA ALA 47 1.013 -11.341 -11.341 449 1HB ALA 347 3HB ALA 47 1.559 -8.863 -8.863 450 2HB ALA 347 2HB ALA 47 -0.096 -8.533 -8.533 451 3HB ALA 347 1HB ALA 47 0.206 -9.543 -9.543 452 H LEU 348 H LEU 48 -0.956 -9.277 -9.277 453 HA LEU 348 HA LEU 48 -3.500 -10.194 -10.194 454 1HB LEU 348 2HB LEU 48 -2.514 -9.606 -9.606 455 2HB LEU 348 1HB LEU 48 -4.199 -9.626 -9.626 456 HG LEU 348 HG LEU 48 -2.151 -7.851 -7.851 457 1HD1 LEU 348 3HD1 LEU 48 -2.809 -7.633 -7.633 458 2HD1 LEU 348 2HD1 LEU 48 -4.000 -6.583 -6.583 459 3HD1 LEU 348 1HD1 LEU 48 -2.279 -6.296 -6.296 460 1HD2 LEU 348 1HD2 LEU 48 -5.031 -8.369 -8.369 461 2HD2 LEU 348 3HD2 LEU 48 -3.951 -7.580 -7.580 462 3HD2 LEU 348 2HD2 LEU 48 -4.652 -6.656 -6.656 463 H GLU 349 H GLU 49 -1.318 -11.638 -11.638 464 HA GLU 349 HA GLU 49 -3.017 -13.840 -13.840 465 1HB GLU 349 2HB GLU 49 -0.072 -13.302 -13.302 466 2HB GLU 349 1HB GLU 49 -0.675 -14.931 -14.931 467 1HG GLU 349 2HG GLU 49 -2.470 -13.493 -13.493 468 2HG GLU 349 1HG GLU 49 -1.055 -12.450 -12.450 469 H LEU 350 H LEU 50 -0.666 -13.327 -13.327 470 HA LEU 350 HA LEU 50 -0.681 -16.067 -16.067 471 1HB LEU 350 2HB LEU 50 1.018 -15.303 -15.303 472 2HB LEU 350 1HB LEU 50 0.740 -13.700 -13.700 473 HG LEU 350 HG LEU 50 -1.045 -13.413 -13.413 474 1HD1 LEU 350 2HD1 LEU 50 -0.207 -16.128 -16.128 475 2HD1 LEU 350 1HD1 LEU 50 0.117 -15.147 -15.147 476 3HD1 LEU 350 3HD1 LEU 50 -1.513 -15.222 -15.222 477 1HD2 LEU 350 3HD2 LEU 50 1.470 -12.627 -12.627 478 2HD2 LEU 350 2HD2 LEU 50 0.538 -12.496 -12.496 479 3HD2 LEU 350 1HD2 LEU 50 1.664 -13.835 -13.835 480 H LYS 351 H LYS 51 -2.814 -13.369 -13.369 481 HA LYS 351 HA LYS 51 -4.092 -14.180 -14.180 482 1HB LYS 351 2HB LYS 51 -4.365 -11.915 -11.915 483 2HB LYS 351 1HB LYS 51 -5.231 -12.614 -12.614 484 1HG LYS 351 2HG LYS 51 -7.146 -12.851 -12.851 485 2HG LYS 351 1HG LYS 51 -6.291 -13.456 -13.456 486 1HD LYS 351 2HD LYS 51 -7.407 -11.272 -11.272 487 2HD LYS 351 1HD LYS 51 -5.657 -11.182 -11.182 488 1HE LYS 351 2HE LYS 51 -5.360 -9.921 -9.921 489 2HE LYS 351 1HE LYS 51 -6.797 -10.581 -10.581 490 1HZ LYS 351 1HZ LYS 51 -6.856 -8.751 -8.751 491 2HZ LYS 351 3HZ LYS 51 -7.046 -8.249 -8.249 492 3HZ LYS 351 2HZ LYS 51 -8.187 -9.292 -9.292 493 H ASP 352 H ASP 52 -4.720 -14.868 -14.868 494 HA ASP 352 HA ASP 52 -7.077 -16.463 -16.463 495 1HB ASP 352 2HB ASP 52 -5.717 -15.494 -15.494 496 2HB ASP 352 1HB ASP 52 -5.653 -17.252 -17.252 497 H ALA 353 H ALA 53 -3.637 -17.067 -17.067 498 HA ALA 353 HA ALA 53 -4.081 -19.997 -19.997 499 1HB ALA 353 1HB ALA 53 -2.237 -19.089 -19.089 500 2HB ALA 353 3HB ALA 53 -1.472 -18.452 -18.452 501 3HB ALA 353 2HB ALA 53 -1.665 -20.192 -20.192 502 H GLN 354 H GLN 54 -4.933 -18.138 -18.138 503 HA GLN 354 HA GLN 54 -3.205 -19.232 -19.232 504 1HB GLN 354 2HB GLN 54 -3.758 -16.510 -16.510 505 2HB GLN 354 1HB GLN 54 -4.620 -16.898 -16.898 506 1HG GLN 354 2HG GLN 54 -2.050 -18.126 -18.126 507 2HG GLN 354 1HG GLN 54 -1.824 -16.448 -16.448 508 1HE2 GLN 354 2HE2 GLN 54 -3.767 -15.393 -15.393 509 2HE2 GLN 354 1HE2 GLN 54 -4.022 -15.248 -15.248 510 H ALA 355 HN ALA 55 -4.887 -21.019 -21.019 511 HA ALA 355 HA ALA 55 -6.922 -20.640 -20.640 512 1HB ALA 355 3HB ALA 55 -8.076 -19.670 -19.670 513 2HB ALA 355 2HB ALA 55 -7.809 -21.170 -21.170 514 3HB ALA 355 1HB ALA 55 -8.856 -21.160 -21.160 515 1H GLY 325 1H GLY 25 10.756 -2.822 -2.822 516 2H GLY 325 3H GLY 25 11.372 -3.548 -3.548 517 3H GLY 325 2H GLY 25 12.002 -2.063 -2.063 518 1HA GLY 325 2HA GLY 25 10.566 -1.644 -1.644 519 2HA GLY 325 1HA GLY 25 9.276 -2.557 -2.557 520 H GLU 326 H GLU 26 9.641 0.403 0.403 521 HA GLU 326 HA GLU 26 9.231 1.615 1.615 522 1HB GLU 326 2HB GLU 26 10.165 2.624 2.624 523 2HB GLU 326 1HB GLU 26 9.212 3.739 3.739 524 1HG GLU 326 2HG GLU 26 11.447 2.202 2.202 525 2HG GLU 326 1HG GLU 26 11.825 3.629 3.629 526 H TYR 327 H TYR 27 7.453 3.311 3.311 527 HA TYR 327 HA TYR 27 5.058 2.247 2.247 528 1HB TYR 327 2HB TYR 27 5.552 3.395 3.395 529 2HB TYR 327 1HB TYR 27 4.084 3.975 3.975 530 HD1 TYR 327 HD1 TYR 27 5.871 0.984 0.984 531 HD2 TYR 327 HD2 TYR 27 2.223 2.495 2.495 532 HE1 TYR 327 HE1 TYR 27 4.732 -1.153 -1.153 533 HE2 TYR 327 HE2 TYR 27 1.087 0.358 0.358 534 HH TYR 327 HH TYR 27 1.812 -1.637 -1.637 535 H PHE 328 H PHE 28 4.142 3.489 3.489 536 HA PHE 328 HA PHE 28 4.808 6.407 6.407 537 1HB PHE 328 2HB PHE 28 4.470 4.546 4.546 538 2HB PHE 328 1HB PHE 28 4.756 6.284 6.284 539 HD1 PHE 328 HD2 PHE 28 6.207 3.130 3.130 540 HD2 PHE 328 HD1 PHE 28 6.948 7.134 7.134 541 HE1 PHE 328 HE2 PHE 28 8.649 2.745 2.745 542 HE2 PHE 328 HE1 PHE 28 9.390 6.750 6.750 543 HZ PHE 328 HZ PHE 28 10.241 4.556 4.556 544 H THR 329 H THR 29 3.118 7.591 7.591 545 HA THR 329 HA THR 29 0.424 6.362 6.362 546 HB THR 329 HB THR 29 0.513 9.285 9.285 547 HG1 THR 329 HG1 THR 29 1.520 9.286 9.286 548 1HG2 THR 329 3HG2 THR 29 -1.312 7.378 7.378 549 2HG2 THR 329 2HG2 THR 29 -0.551 7.419 7.419 550 3HG2 THR 329 1HG2 THR 29 -1.271 8.882 8.882 551 H LEU 330 H LEU 30 -0.901 6.595 6.595 552 HA LEU 330 HA LEU 30 0.056 8.374 8.374 553 1HB LEU 330 2HB LEU 30 -0.304 5.647 5.647 554 2HB LEU 330 1HB LEU 30 -1.848 6.237 6.237 555 HG LEU 330 HG LEU 30 0.107 7.823 7.823 556 1HD1 LEU 330 1HD1 LEU 30 1.367 5.502 5.502 557 2HD1 LEU 330 3HD1 LEU 30 0.891 5.113 5.113 558 3HD1 LEU 330 2HD1 LEU 30 1.902 6.524 6.524 559 1HD2 LEU 330 2HD2 LEU 30 -1.510 5.432 5.432 560 2HD2 LEU 330 1HD2 LEU 30 -1.986 7.127 7.127 561 3HD2 LEU 330 3HD2 LEU 30 -0.659 6.529 6.529 562 H GLN 331 H GLN 31 -1.187 10.182 10.182 563 HA GLN 331 HA GLN 31 -4.053 9.876 9.876 564 1HB GLN 331 2HB GLN 31 -2.391 12.391 12.391 565 2HB GLN 331 1HB GLN 31 -4.034 12.312 12.312 566 1HG GLN 331 2HG GLN 31 -3.364 11.404 11.404 567 2HG GLN 331 1HG GLN 31 -1.983 10.572 10.572 568 1HE2 GLN 331 2HE2 GLN 31 -1.362 14.606 14.606 569 2HE2 GLN 331 1HE2 GLN 31 -2.760 14.044 14.044 570 H ILE 332 H ILE 32 -5.352 9.502 9.502 571 HA ILE 332 HA ILE 32 -4.703 10.857 10.857 572 HB ILE 332 HB ILE 32 -6.511 8.497 8.497 573 1HG1 ILE 332 2HG1 ILE 32 -4.325 8.128 8.128 574 2HG1 ILE 332 1HG1 ILE 32 -3.734 8.649 8.649 575 1HG2 ILE 332 1HG2 ILE 32 -5.859 9.927 9.927 576 2HG2 ILE 332 3HG2 ILE 32 -6.615 8.335 8.335 577 3HG2 ILE 332 2HG2 ILE 32 -7.448 9.739 9.739 578 1HD1 ILE 332 1HD1 ILE 32 -5.842 6.564 6.564 579 2HD1 ILE 332 3HD1 ILE 32 -4.283 6.058 6.058 580 3HD1 ILE 332 2HD1 ILE 32 -4.385 6.716 6.716 581 H ARG 333 H ARG 33 -6.292 12.141 12.141 582 HA ARG 333 HA ARG 33 -8.598 12.872 12.872 583 1HB ARG 333 2HB ARG 33 -6.997 14.713 14.713 584 2HB ARG 333 1HB ARG 33 -7.200 14.531 14.531 585 1HG ARG 333 2HG ARG 33 -9.533 15.146 15.146 586 2HG ARG 333 1HG ARG 33 -9.483 15.123 15.123 587 1HD ARG 333 2HD ARG 33 -8.405 17.144 17.144 588 2HD ARG 333 1HD ARG 33 -7.514 16.886 16.886 589 HE ARG 333 HE ARG 33 -10.298 17.912 17.912 590 1HH1 ARG 333 1HH2 ARG 33 -10.786 16.876 16.876 591 2HH1 ARG 333 2HH2 ARG 33 -9.864 17.748 17.748 592 1HH2 ARG 333 2HH1 ARG 33 -7.687 19.114 19.114 593 2HH2 ARG 333 1HH1 ARG 33 -8.109 19.013 19.013 594 H GLY 334 H GLY 34 -9.985 11.250 11.250 595 1HA GLY 334 2HA GLY 34 -11.579 12.034 12.034 596 2HA GLY 334 1HA GLY 34 -10.414 10.851 10.851 597 H ARG 335 H ARG 35 -11.213 8.817 8.817 598 HA ARG 335 HA ARG 35 -12.279 7.543 7.543 599 1HB ARG 335 2HB ARG 35 -14.178 9.187 9.187 600 2HB ARG 335 1HB ARG 35 -14.466 7.963 7.963 601 1HG ARG 335 2HG ARG 35 -15.188 6.395 6.395 602 2HG ARG 335 1HG ARG 35 -14.144 7.006 7.006 603 1HD ARG 335 2HD ARG 35 -15.627 9.039 9.039 604 2HD ARG 335 1HD ARG 35 -16.727 8.240 8.240 605 HE ARG 335 HE ARG 35 -16.025 7.004 7.004 606 1HH1 ARG 335 2HH1 ARG 35 -17.667 5.111 5.111 607 2HH1 ARG 335 1HH1 ARG 35 -19.298 5.692 5.692 608 1HH2 ARG 335 1HH2 ARG 35 -18.382 9.024 9.024 609 2HH2 ARG 335 2HH2 ARG 35 -19.703 7.908 7.908 610 H GLU 336 H GLU 36 -12.526 7.642 7.642 611 HA GLU 336 HA GLU 36 -12.721 4.757 4.757 612 1HB GLU 336 2HB GLU 36 -11.829 6.727 6.727 613 2HB GLU 336 1HB GLU 36 -12.522 5.124 5.124 614 1HG GLU 336 2HG GLU 36 -13.940 7.488 7.488 615 2HG GLU 336 1HG GLU 36 -14.232 6.856 6.856 616 H ARG 337 H ARG 37 -10.089 7.045 7.045 617 HA ARG 337 HA ARG 37 -8.087 5.153 5.153 618 1HB ARG 337 2HB ARG 37 -7.872 7.872 7.872 619 2HB ARG 337 1HB ARG 37 -6.475 6.932 6.932 620 1HG ARG 337 2HG ARG 37 -7.484 6.863 6.863 621 2HG ARG 337 1HG ARG 37 -8.719 7.987 7.987 622 1HD ARG 337 2HD ARG 37 -5.729 8.478 8.478 623 2HD ARG 337 1HD ARG 37 -6.908 9.227 9.227 624 HE ARG 337 HE ARG 37 -6.872 9.692 9.692 625 1HH1 ARG 337 1HH2 ARG 37 -9.085 10.423 10.423 626 2HH1 ARG 337 2HH2 ARG 37 -8.815 12.132 12.132 627 1HH2 ARG 337 2HH1 ARG 37 -5.781 12.004 12.004 628 2HH2 ARG 337 1HH1 ARG 37 -6.944 13.027 13.027 629 H PHE 338 H PHE 38 -8.991 6.581 6.581 630 HA PHE 338 HA PHE 38 -7.079 5.306 5.306 631 1HB PHE 338 2HB PHE 38 -8.565 6.985 6.985 632 2HB PHE 338 1HB PHE 38 -9.976 5.986 5.986 633 HD1 PHE 338 HD1 PHE 38 -6.664 4.958 4.958 634 HD2 PHE 338 HD2 PHE 38 -10.861 5.486 5.486 635 HE1 PHE 338 HE1 PHE 38 -6.414 3.850 3.850 636 HE2 PHE 338 HE2 PHE 38 -10.610 4.376 4.376 637 HZ PHE 338 HZ PHE 38 -8.385 3.560 3.560 638 H GLU 339 H GLU 39 -10.167 4.063 4.063 639 HA GLU 339 HA GLU 39 -10.089 1.584 1.584 640 1HB GLU 339 2HB GLU 39 -11.517 2.540 2.540 641 2HB GLU 339 1HB GLU 39 -11.595 0.839 0.839 642 1HG GLU 339 2HG GLU 39 -12.025 2.494 2.494 643 2HG GLU 339 1HG GLU 39 -13.137 2.975 2.975 644 H MET 340 H MET 40 -8.971 2.512 2.512 645 HA MET 340 HA MET 40 -8.104 -0.012 -0.012 646 1HB MET 340 2HB MET 40 -7.089 2.790 2.790 647 2HB MET 340 1HB MET 40 -6.273 1.406 1.406 648 1HG MET 340 2HG MET 40 -8.226 0.765 0.765 649 2HG MET 340 1HG MET 40 -9.249 1.853 1.853 650 1HE MET 340 1HE MET 40 -5.870 1.870 1.870 651 2HE MET 340 3HE MET 40 -5.779 3.355 3.355 652 3HE MET 340 2HE MET 40 -5.740 3.434 3.434 653 H PHE 341 H PHE 41 -6.163 2.455 2.455 654 HA PHE 341 HA PHE 41 -3.855 0.854 0.854 655 1HB PHE 341 2HB PHE 41 -5.029 3.091 3.091 656 2HB PHE 341 1HB PHE 41 -3.445 2.378 2.378 657 HD1 PHE 341 HD1 PHE 41 -2.501 1.868 1.868 658 HD2 PHE 341 HD2 PHE 41 -4.526 5.265 5.265 659 HE1 PHE 341 HE1 PHE 41 -1.507 3.318 3.318 660 HE2 PHE 341 HE2 PHE 41 -3.530 6.719 6.719 661 HZ PHE 341 HZ PHE 41 -2.019 5.748 5.748 662 H ARG 342 H ARG 42 -6.921 0.941 0.941 663 HA ARG 342 HA ARG 42 -6.168 -0.438 -0.438 664 1HB ARG 342 2HB ARG 42 -8.569 0.480 0.480 665 2HB ARG 342 1HB ARG 42 -8.800 -1.226 -1.226 666 1HG ARG 342 2HG ARG 42 -7.906 -0.723 -0.723 667 2HG ARG 342 1HG ARG 42 -7.979 0.989 0.989 668 1HD ARG 342 2HD ARG 42 -10.042 0.509 0.509 669 2HD ARG 342 1HD ARG 42 -10.428 0.591 0.591 670 HE ARG 342 HE ARG 42 -9.891 -2.088 -2.088 671 1HH1 ARG 342 1HH2 ARG 42 -12.639 -0.658 -0.658 672 2HH1 ARG 342 2HH2 ARG 42 -13.540 -1.379 -1.379 673 1HH2 ARG 342 2HH1 ARG 42 -10.734 -2.632 -2.632 674 2HH2 ARG 342 1HH1 ARG 42 -12.460 -2.497 -2.497 675 H GLU 343 H GLU 43 -7.249 -1.637 -1.637 676 HA GLU 343 HA GLU 43 -7.289 -4.411 -4.411 677 1HB GLU 343 2HB GLU 43 -8.342 -3.367 -3.367 678 2HB GLU 343 1HB GLU 43 -6.722 -3.328 -3.328 679 1HG GLU 343 2HG GLU 43 -7.383 -5.398 -5.398 680 2HG GLU 343 1HG GLU 43 -6.738 -5.883 -5.883 681 H LEU 344 H LEU 44 -4.801 -2.427 -2.427 682 HA LEU 344 HA LEU 44 -2.865 -4.459 -4.459 683 1HB LEU 344 2HB LEU 44 -2.617 -1.484 -1.484 684 2HB LEU 344 1HB LEU 44 -1.197 -2.498 -2.498 685 HG LEU 344 HG LEU 44 -1.502 -1.885 -1.885 686 1HD1 LEU 344 3HD1 LEU 44 -2.015 -4.396 -4.396 687 2HD1 LEU 344 2HD1 LEU 44 -3.699 -3.951 -3.951 688 3HD1 LEU 344 1HD1 LEU 44 -2.484 -3.623 -3.623 689 1HD2 LEU 344 3HD2 LEU 44 -3.767 -0.698 -0.698 690 2HD2 LEU 344 2HD2 LEU 44 -3.319 -0.757 -0.757 691 3HD2 LEU 344 1HD2 LEU 44 -4.458 -1.937 -1.937 692 H ASN 345 H ASN 45 -3.434 -2.341 -2.341 693 HA ASN 345 HA ASN 45 -1.270 -3.371 -3.371 694 1HB ASN 345 2HB ASN 45 -3.421 -1.482 -1.482 695 2HB ASN 345 1HB ASN 45 -3.363 -2.534 -2.534 696 1HD2 ASN 345 2HD2 ASN 45 -0.958 0.308 0.308 697 2HD2 ASN 345 1HD2 ASN 45 -2.625 0.215 0.215 698 H GLU 346 H GLU 46 -4.502 -4.516 -4.516 699 HA GLU 346 HA GLU 46 -4.770 -6.246 -6.246 700 1HB GLU 346 2HB GLU 46 -6.133 -5.848 -5.848 701 2HB GLU 346 1HB GLU 46 -6.224 -7.494 -7.494 702 1HG GLU 346 2HG GLU 46 -6.668 -5.875 -5.875 703 2HG GLU 346 1HG GLU 46 -7.571 -5.089 -5.089 704 H ALA 347 H ALA 47 -3.994 -7.103 -7.103 705 HA ALA 347 HA ALA 47 -3.191 -9.770 -9.770 706 1HB ALA 347 3HB ALA 47 -3.752 -8.760 -8.760 707 2HB ALA 347 2HB ALA 47 -2.101 -8.141 -8.141 708 3HB ALA 347 1HB ALA 47 -2.390 -9.879 -9.879 709 H LEU 348 H LEU 48 -1.216 -6.827 -6.827 710 HA LEU 348 HA LEU 48 1.325 -7.948 -7.948 711 1HB LEU 348 2HB LEU 48 0.356 -5.276 -5.276 712 2HB LEU 348 1HB LEU 48 2.039 -5.731 -5.731 713 HG LEU 348 HG LEU 48 -0.011 -5.853 -5.853 714 1HD1 LEU 348 3HD1 LEU 48 0.662 -3.509 -3.509 715 2HD1 LEU 348 2HD1 LEU 48 1.846 -3.574 -3.574 716 3HD1 LEU 348 1HD1 LEU 48 0.123 -3.619 -3.619 717 1HD2 LEU 348 1HD2 LEU 48 2.867 -6.315 -6.315 718 2HD2 LEU 348 3HD2 LEU 48 1.783 -6.839 -6.839 719 3HD2 LEU 348 2HD2 LEU 48 2.489 -5.224 -5.224 720 H GLU 349 H GLU 49 -0.849 -6.690 -6.690 721 HA GLU 349 HA GLU 49 0.841 -7.377 -7.377 722 1HB GLU 349 2HB GLU 49 -2.102 -6.876 -6.876 723 2HB GLU 349 1HB GLU 49 -1.501 -7.524 -7.524 724 1HG GLU 349 2HG GLU 49 0.301 -5.541 -5.541 725 2HG GLU 349 1HG GLU 49 -1.113 -4.838 -4.838 726 H LEU 350 H LEU 50 -1.508 -9.244 -9.244 727 HA LEU 350 HA LEU 50 -1.505 -11.514 -11.514 728 1HB LEU 350 2HB LEU 50 -3.202 -12.152 -12.152 729 2HB LEU 350 1HB LEU 50 -2.921 -10.713 -10.713 730 HG LEU 350 HG LEU 50 -1.140 -12.074 -12.074 731 1HD1 LEU 350 2HD1 LEU 50 -1.976 -13.964 -13.964 732 2HD1 LEU 350 1HD1 LEU 50 -2.303 -14.621 -14.621 733 3HD1 LEU 350 3HD1 LEU 50 -0.672 -14.105 -14.105 734 1HD2 LEU 350 3HD2 LEU 50 -3.664 -11.613 -11.613 735 2HD2 LEU 350 2HD2 LEU 50 -2.726 -12.776 -12.776 736 3HD2 LEU 350 1HD2 LEU 50 -3.845 -13.340 -13.340 737 H LYS 351 H LYS 51 0.636 -10.359 -10.359 738 HA LYS 351 HA LYS 51 1.913 -12.851 -12.851 739 1HB LYS 351 2HB LYS 51 2.188 -10.791 -10.791 740 2HB LYS 351 1HB LYS 51 3.058 -10.040 -10.040 741 1HG LYS 351 2HG LYS 51 4.969 -11.166 -11.166 742 2HG LYS 351 1HG LYS 51 4.108 -12.681 -12.681 743 1HD LYS 351 2HD LYS 51 5.222 -11.838 -11.838 744 2HD LYS 351 1HD LYS 51 3.470 -11.949 -11.949 745 1HE LYS 351 2HE LYS 51 3.183 -9.653 -9.653 746 2HE LYS 351 1HE LYS 51 4.620 -9.372 -9.372 747 1HZ LYS 351 1HZ LYS 51 4.679 -10.306 -10.306 748 2HZ LYS 351 3HZ LYS 51 4.875 -8.689 -8.689 749 3HZ LYS 351 2HZ LYS 51 6.011 -9.856 -9.856 750 H ASP 352 H ASP 52 2.536 -10.378 -10.378 751 HA ASP 352 HA ASP 52 4.890 -11.688 -11.688 752 1HB ASP 352 2HB ASP 52 3.532 -9.257 -9.257 753 2HB ASP 352 1HB ASP 52 3.473 -10.117 -10.117 754 H ALA 353 H ALA 53 1.449 -12.037 -12.037 755 HA ALA 353 HA ALA 53 1.884 -13.797 -13.797 756 1HB ALA 353 1HB ALA 53 0.045 -12.087 -12.087 757 2HB ALA 353 3HB ALA 53 -0.720 -12.950 -12.950 758 3HB ALA 353 2HB ALA 53 -0.534 -13.736 -13.736 759 H GLN 354 H GLN 54 2.742 -14.572 -14.572 760 HA GLN 354 HA GLN 54 1.004 -16.988 -16.988 761 1HB GLN 354 2HB GLN 54 1.558 -14.974 -14.974 762 2HB GLN 354 1HB GLN 54 2.418 -16.431 -16.431 763 1HG GLN 354 2HG GLN 54 -0.152 -17.227 -17.227 764 2HG GLN 354 1HG GLN 54 -0.383 -15.888 -15.888 765 1HE2 GLN 354 2HE2 GLN 54 1.553 -17.825 -17.825 766 2HE2 GLN 354 1HE2 GLN 54 1.812 -16.356 -16.356 767 H ALA 355 HN ALA 55 2.683 -17.790 -17.790 768 HA ALA 355 HA ALA 55 4.714 -19.296 -19.296 769 1HB ALA 355 3HB ALA 55 5.872 -17.123 -17.123 770 2HB ALA 355 2HB ALA 55 5.608 -17.209 -17.209 771 3HB ALA 355 1HB ALA 55 6.650 -18.389 -18.389 772 1H GLY 325 1H GLY 25 -14.561 15.979 15.979 773 2H GLY 325 3H GLY 25 -14.986 15.175 15.175 774 3H GLY 325 2H GLY 25 -15.752 14.770 14.770 775 1HA GLY 325 2HA GLY 25 -14.159 13.077 13.077 776 2HA GLY 325 1HA GLY 25 -12.906 14.304 14.304 777 H GLU 326 H GLU 26 -13.358 12.008 12.008 778 HA GLU 326 HA GLU 26 -13.302 13.605 13.605 779 1HB GLU 326 2HB GLU 26 -14.017 10.801 10.801 780 2HB GLU 326 1HB GLU 26 -13.236 11.050 11.050 781 1HG GLU 326 2HG GLU 26 -15.500 12.846 12.846 782 2HG GLU 326 1HG GLU 26 -15.854 11.237 11.237 783 H TYR 327 H TYR 27 -11.639 12.844 12.844 784 HA TYR 327 HA TYR 27 -9.054 12.373 12.373 785 1HB TYR 327 2HB TYR 27 -9.885 13.944 13.944 786 2HB TYR 327 1HB TYR 27 -8.378 13.052 13.052 787 HD1 TYR 327 HD1 TYR 27 -10.114 15.630 15.630 788 HD2 TYR 327 HD2 TYR 27 -6.400 13.594 13.594 789 HE1 TYR 327 HE1 TYR 27 -8.921 17.321 17.321 790 HE2 TYR 327 HE2 TYR 27 -5.209 15.284 15.284 791 HH TYR 327 HH TYR 27 -6.035 18.057 18.057 792 H PHE 328 H PHE 28 -8.054 10.434 10.434 793 HA PHE 328 HA PHE 28 -8.877 8.770 8.770 794 1HB PHE 328 2HB PHE 28 -8.188 7.837 7.837 795 2HB PHE 328 1HB PHE 28 -8.561 6.781 6.781 796 HD1 PHE 328 HD2 PHE 28 -9.965 9.600 9.600 797 HD2 PHE 328 HD1 PHE 28 -10.789 6.222 6.222 798 HE1 PHE 328 HE2 PHE 28 -12.389 9.840 9.840 799 HE2 PHE 328 HE1 PHE 28 -13.212 6.461 6.461 800 HZ PHE 328 HZ PHE 28 -14.011 8.270 8.270 801 H THR 329 H THR 29 -7.112 6.976 6.976 802 HA THR 329 HA THR 29 -4.409 8.124 8.124 803 HB THR 329 HB THR 29 -4.686 6.775 6.775 804 HG1 THR 329 HG1 THR 29 -5.883 8.340 8.340 805 1HG2 THR 329 3HG2 THR 29 -2.819 8.310 8.310 806 2HG2 THR 329 2HG2 THR 29 -3.739 9.578 9.578 807 3HG2 THR 329 1HG2 THR 29 -3.037 8.261 8.261 808 H LEU 330 H LEU 30 -2.925 6.620 6.620 809 HA LEU 330 HA LEU 30 -3.735 3.744 3.744 810 1HB LEU 330 2HB LEU 30 -3.215 5.211 5.211 811 2HB LEU 330 1HB LEU 30 -1.652 4.464 4.464 812 HG LEU 330 HG LEU 30 -3.545 2.431 2.431 813 1HD1 LEU 330 1HD1 LEU 30 -4.763 4.350 4.350 814 2HD1 LEU 330 3HD1 LEU 30 -4.098 3.215 3.215 815 3HD1 LEU 330 2HD1 LEU 30 -5.210 2.646 2.646 816 1HD2 LEU 330 2HD2 LEU 30 -1.714 3.072 3.072 817 2HD2 LEU 330 1HD2 LEU 30 -1.321 2.088 2.088 818 3HD2 LEU 330 3HD2 LEU 30 -2.503 1.511 1.511 819 H GLN 331 H GLN 31 -2.683 3.456 3.456 820 HA GLN 331 HA GLN 31 0.129 4.188 4.188 821 1HB GLN 331 2HB GLN 31 -1.621 2.426 2.426 822 2HB GLN 331 1HB GLN 31 -0.052 3.097 3.097 823 1HG GLN 331 2HG GLN 31 -0.881 5.230 5.230 824 2HG GLN 331 1HG GLN 31 -2.133 5.009 5.009 825 1HE2 GLN 331 2HE2 GLN 31 -3.014 3.095 3.095 826 2HE2 GLN 331 1HE2 GLN 31 -1.514 2.828 2.828 827 H ILE 332 H ILE 32 1.622 3.029 3.029 828 HA ILE 332 HA ILE 32 1.173 0.099 0.099 829 HB ILE 332 HB ILE 32 3.035 2.010 2.010 830 1HG1 ILE 332 2HG1 ILE 32 1.089 0.506 0.506 831 2HG1 ILE 332 1HG1 ILE 32 0.305 1.499 1.499 832 1HG2 ILE 332 1HG2 ILE 32 2.585 -0.976 -0.976 833 2HG2 ILE 332 3HG2 ILE 32 3.421 0.010 0.010 834 3HG2 ILE 332 2HG2 ILE 32 4.092 -0.164 -0.164 835 1HD1 ILE 332 1HD1 ILE 32 2.512 2.802 2.802 836 2HD1 ILE 332 3HD1 ILE 32 1.055 2.457 2.457 837 3HD1 ILE 332 2HD1 ILE 32 0.958 3.460 3.460 838 H ARG 333 H ARG 33 2.780 -1.371 -1.371 839 HA ARG 333 HA ARG 33 4.846 -0.179 -0.179 840 1HB ARG 333 2HB ARG 33 3.197 -1.595 -1.595 841 2HB ARG 333 1HB ARG 33 3.582 -2.936 -2.936 842 1HG ARG 333 2HG ARG 33 5.851 -3.038 -3.038 843 2HG ARG 333 1HG ARG 33 5.630 -1.559 -1.559 844 1HD ARG 333 2HD ARG 33 4.424 -2.615 -2.615 845 2HD ARG 333 1HD ARG 33 3.714 -3.776 -3.776 846 HE ARG 333 HE ARG 33 6.400 -4.016 -4.016 847 1HH1 ARG 333 1HH2 ARG 33 7.192 -5.423 -5.423 848 2HH1 ARG 333 2HH2 ARG 33 6.353 -6.940 -6.940 849 1HH2 ARG 333 2HH1 ARG 33 3.876 -5.882 -5.882 850 2HH2 ARG 333 1HH1 ARG 33 4.476 -7.199 -7.199 851 H GLY 334 H GLY 34 6.415 0.051 0.051 852 1HA GLY 334 2HA GLY 34 8.183 -2.125 -2.125 853 2HA GLY 334 1HA GLY 34 7.155 -2.041 -2.041 854 H ARG 335 H ARG 35 8.071 -0.874 -0.874 855 HA ARG 335 HA ARG 35 8.952 1.819 1.819 856 1HB ARG 335 2HB ARG 35 10.829 0.377 0.377 857 2HB ARG 335 1HB ARG 35 11.307 0.026 0.026 858 1HG ARG 335 2HG ARG 35 11.958 2.191 2.191 859 2HG ARG 335 1HG ARG 35 10.755 2.876 2.876 860 1HD ARG 335 2HD ARG 35 12.100 1.952 1.952 861 2HD ARG 335 1HD ARG 35 13.354 1.520 1.520 862 HE ARG 335 HE ARG 35 12.451 4.351 4.351 863 1HH1 ARG 335 2HH1 ARG 35 14.241 5.030 5.030 864 2HH1 ARG 335 1HH1 ARG 35 15.835 4.756 4.756 865 1HH2 ARG 335 1HH2 ARG 35 14.772 2.639 2.639 866 2HH2 ARG 335 2HH2 ARG 35 16.135 3.403 3.403 867 H GLU 336 H GLU 36 9.560 -1.187 -1.187 868 HA GLU 336 HA GLU 36 9.945 0.214 0.214 869 1HB GLU 336 2HB GLU 36 9.162 -2.687 -2.687 870 2HB GLU 336 1HB GLU 36 9.962 -1.980 -1.980 871 1HG GLU 336 2HG GLU 36 11.117 -2.145 -2.145 872 2HG GLU 336 1HG GLU 36 11.605 -3.132 -3.132 873 H ARG 337 H ARG 37 7.285 -1.897 -1.897 874 HA ARG 337 HA ARG 37 5.463 -1.411 -1.411 875 1HB ARG 337 2HB ARG 37 4.961 -1.820 -1.820 876 2HB ARG 337 1HB ARG 37 3.679 -1.813 -1.813 877 1HG ARG 337 2HG ARG 37 4.921 -3.642 -3.642 878 2HG ARG 337 1HG ARG 37 6.026 -3.723 -3.723 879 1HD ARG 337 2HD ARG 37 3.028 -4.165 -4.165 880 2HD ARG 337 1HD ARG 37 4.267 -5.410 -5.410 881 HE ARG 337 HE ARG 37 3.906 -3.202 -3.202 882 1HH1 ARG 337 1HH2 ARG 37 6.283 -5.290 -5.290 883 2HH1 ARG 337 2HH2 ARG 37 5.921 -6.318 -6.318 884 1HH2 ARG 337 2HH1 ARG 37 2.744 -5.015 -5.015 885 2HH2 ARG 337 1HH1 ARG 37 3.919 -6.162 -6.162 886 H PHE 338 H PHE 38 5.956 0.473 0.473 887 HA PHE 338 HA PHE 38 3.954 2.418 2.418 888 1HB PHE 338 2HB PHE 38 5.239 2.346 2.346 889 2HB PHE 338 1HB PHE 38 6.732 2.693 2.693 890 HD1 PHE 338 HD1 PHE 38 3.351 4.220 4.220 891 HD2 PHE 338 HD2 PHE 38 7.415 4.797 4.797 892 HE1 PHE 338 HE1 PHE 38 2.932 6.653 6.653 893 HE2 PHE 338 HE2 PHE 38 6.993 7.229 7.229 894 HZ PHE 338 HZ PHE 38 4.752 8.156 8.156 895 H GLU 339 H GLU 39 7.218 2.226 2.226 896 HA GLU 339 HA GLU 39 7.136 4.801 4.801 897 1HB GLU 339 2HB GLU 39 8.759 2.296 2.296 898 2HB GLU 339 1HB GLU 39 8.880 3.624 3.624 899 1HG GLU 339 2HG GLU 39 8.978 4.672 4.672 900 2HG GLU 339 1HG GLU 39 10.192 3.405 3.405 901 H MET 340 H MET 40 6.307 1.513 1.513 902 HA MET 340 HA MET 40 5.688 2.101 2.101 903 1HB MET 340 2HB MET 40 4.563 0.115 0.115 904 2HB MET 340 1HB MET 40 3.906 0.230 0.230 905 1HG MET 340 2HG MET 40 6.003 -0.327 -0.327 906 2HG MET 340 1HG MET 40 6.867 -0.083 -0.083 907 1HE MET 340 1HE MET 40 3.684 -1.637 -1.637 908 2HE MET 340 3HE MET 40 3.602 -3.251 -3.251 909 3HE MET 340 2HE MET 40 3.374 -1.821 -1.821 910 H PHE 341 H PHE 41 3.433 2.059 2.059 911 HA PHE 341 HA PHE 41 1.197 3.143 3.143 912 1HB PHE 341 2HB PHE 41 2.061 3.367 3.367 913 2HB PHE 341 1HB PHE 41 0.498 3.930 3.930 914 HD1 PHE 341 HD1 PHE 41 -0.118 1.856 1.856 915 HD2 PHE 341 HD2 PHE 41 1.521 1.488 1.488 916 HE1 PHE 341 HE1 PHE 41 -1.003 -0.449 -0.449 917 HE2 PHE 341 HE2 PHE 41 0.633 -0.823 -0.823 918 HZ PHE 341 HZ PHE 41 -0.632 -1.792 -1.792 919 H ARG 342 H ARG 42 4.067 4.661 4.661 920 HA ARG 342 HA ARG 42 3.145 7.360 7.360 921 1HB ARG 342 2HB ARG 42 5.606 5.978 5.978 922 2HB ARG 342 1HB ARG 42 5.891 7.251 7.251 923 1HG ARG 342 2HG ARG 42 4.731 8.851 8.851 924 2HG ARG 342 1HG ARG 42 4.753 7.562 7.562 925 1HD ARG 342 2HD ARG 42 6.711 8.866 8.866 926 2HD ARG 342 1HD ARG 42 7.269 7.409 7.409 927 HE ARG 342 HE ARG 42 6.843 9.188 9.188 928 1HH1 ARG 342 1HH2 ARG 42 9.534 8.218 8.218 929 2HH1 ARG 342 2HH2 ARG 42 10.335 9.742 9.742 930 1HH2 ARG 342 2HH1 ARG 42 7.451 11.613 11.613 931 2HH2 ARG 342 1HH1 ARG 42 9.154 11.666 11.666 932 H GLU 343 H GLU 43 4.620 5.443 5.443 933 HA GLU 343 HA GLU 43 4.735 7.595 7.595 934 1HB GLU 343 2HB GLU 43 5.941 5.359 5.359 935 2HB GLU 343 1HB GLU 43 4.405 4.661 4.661 936 1HG GLU 343 2HG GLU 43 5.248 5.195 5.195 937 2HG GLU 343 1HG GLU 43 4.472 6.734 6.734 938 H LEU 344 H LEU 44 2.318 5.001 5.001 939 HA LEU 344 HA LEU 44 0.551 5.735 5.735 940 1HB LEU 344 2HB LEU 44 0.098 4.479 4.479 941 2HB LEU 344 1HB LEU 44 -1.251 4.817 4.817 942 HG LEU 344 HG LEU 44 -0.824 2.690 2.690 943 1HD1 LEU 344 3HD1 LEU 44 -0.161 4.290 4.290 944 2HD1 LEU 344 2HD1 LEU 44 1.507 3.884 3.884 945 3HD1 LEU 344 1HD1 LEU 44 0.396 2.624 2.624 946 1HD2 LEU 344 3HD2 LEU 44 1.292 2.838 2.838 947 2HD2 LEU 344 2HD2 LEU 44 0.936 1.442 1.442 948 3HD2 LEU 344 1HD2 LEU 44 2.119 2.639 2.639 949 H ASN 345 H ASN 45 0.694 6.924 6.924 950 HA ASN 345 HA ASN 45 -1.550 8.695 8.695 951 1HB ASN 345 2HB ASN 45 0.451 8.033 8.033 952 2HB ASN 345 1HB ASN 45 0.297 9.787 9.787 953 1HD2 ASN 345 2HD2 ASN 45 -2.303 8.471 8.471 954 2HD2 ASN 345 1HD2 ASN 45 -0.611 8.358 8.358 955 H GLU 346 H GLU 46 1.790 8.961 8.961 956 HA GLU 346 HA GLU 46 1.919 11.826 11.826 957 1HB GLU 346 2HB GLU 46 3.519 9.527 9.527 958 2HB GLU 346 1HB GLU 46 3.637 10.964 10.964 959 1HG GLU 346 2HG GLU 46 3.757 11.956 11.956 960 2HG GLU 346 1HG GLU 46 4.742 10.494 10.494 961 H ALA 347 H ALA 47 1.551 9.433 9.433 962 HA ALA 347 HA ALA 47 0.833 11.368 11.368 963 1HB ALA 347 3HB ALA 47 1.549 8.922 8.922 964 2HB ALA 347 2HB ALA 47 -0.131 8.506 8.506 965 3HB ALA 347 1HB ALA 47 0.261 9.525 9.525 966 H LEU 348 H LEU 48 -1.246 9.206 9.206 967 HA LEU 348 HA LEU 48 -3.743 9.991 9.991 968 1HB LEU 348 2HB LEU 48 -3.032 9.452 9.452 969 2HB LEU 348 1HB LEU 48 -4.651 9.382 9.382 970 HG LEU 348 HG LEU 48 -2.381 7.718 7.718 971 1HD1 LEU 348 3HD1 LEU 48 -3.321 7.467 7.467 972 2HD1 LEU 348 2HD1 LEU 48 -4.354 6.348 6.348 973 3HD1 LEU 348 1HD1 LEU 48 -2.600 6.165 6.165 974 1HD2 LEU 348 1HD2 LEU 48 -5.248 8.080 8.080 975 2HD2 LEU 348 3HD2 LEU 48 -4.008 7.355 7.355 976 3HD2 LEU 348 2HD2 LEU 48 -4.795 6.390 6.390 977 H GLU 349 H GLU 49 -1.914 11.543 11.543 978 HA GLU 349 HA GLU 49 -3.786 13.651 13.651 979 1HB GLU 349 2HB GLU 49 -0.858 13.274 13.274 980 2HB GLU 349 1HB GLU 49 -1.576 14.869 14.869 981 1HG GLU 349 2HG GLU 49 -3.434 13.336 13.336 982 2HG GLU 349 1HG GLU 49 -1.987 12.373 12.373 983 H LEU 350 H LEU 50 -1.152 13.274 13.274 984 HA LEU 350 HA LEU 50 -1.215 16.011 16.011 985 1HB LEU 350 2HB LEU 50 0.635 15.339 15.339 986 2HB LEU 350 1HB LEU 50 0.390 13.733 13.733 987 HG LEU 350 HG LEU 50 -1.197 13.316 13.316 988 1HD1 LEU 350 2HD1 LEU 50 -0.502 16.065 16.065 989 2HD1 LEU 350 1HD1 LEU 50 0.088 15.100 15.100 990 3HD1 LEU 350 3HD1 LEU 50 -1.619 15.054 15.054 991 1HD2 LEU 350 3HD2 LEU 50 1.329 12.651 12.651 992 2HD2 LEU 350 2HD2 LEU 50 0.570 12.491 12.491 993 3HD2 LEU 350 1HD2 LEU 50 1.601 13.879 13.879 994 H LYS 351 H LYS 51 -3.150 13.201 13.201 995 HA LYS 351 HA LYS 51 -4.215 13.951 13.951 996 1HB LYS 351 2HB LYS 51 -4.459 11.670 11.670 997 2HB LYS 351 1HB LYS 51 -5.508 12.318 12.318 998 1HG LYS 351 2HG LYS 51 -7.292 12.448 12.448 999 2HG LYS 351 1HG LYS 51 -6.320 13.099 13.099 1000 1HD LYS 351 2HD LYS 51 -7.260 10.854 10.854 1001 2HD LYS 351 1HD LYS 51 -5.496 10.862 10.862 1002 1HE LYS 351 2HE LYS 51 -5.342 9.620 9.620 1003 2HE LYS 351 1HE LYS 51 -6.889 10.202 10.202 1004 1HZ LYS 351 1HZ LYS 51 -6.597 8.370 8.370 1005 2HZ LYS 351 3HZ LYS 51 -6.933 7.859 7.859 1006 3HZ LYS 351 2HZ LYS 51 -8.046 8.841 8.841 1007 H ASP 352 H ASP 52 -5.228 14.610 14.610 1008 HA ASP 352 HA ASP 52 -7.604 16.068 16.068 1009 1HB ASP 352 2HB ASP 52 -6.444 15.176 15.176 1010 2HB ASP 352 1HB ASP 52 -6.495 16.935 16.935 1011 H ALA 353 H ALA 53 -4.217 16.853 16.853 1012 HA ALA 353 HA ALA 53 -4.794 19.757 19.757 1013 1HB ALA 353 1HB ALA 53 -3.074 18.943 18.943 1014 2HB ALA 353 3HB ALA 53 -2.120 18.350 18.350 1015 3HB ALA 353 2HB ALA 53 -2.426 20.078 20.078 1016 H GLN 354 H GLN 54 -5.302 17.857 17.857 1017 HA GLN 354 HA GLN 54 -3.406 19.051 19.051 1018 1HB GLN 354 2HB GLN 54 -3.852 16.299 16.299 1019 2HB GLN 354 1HB GLN 54 -4.581 16.629 16.629 1020 1HG GLN 354 2HG GLN 54 -2.089 18.008 18.008 1021 2HG GLN 354 1HG GLN 54 -1.799 16.366 16.366 1022 1HE2 GLN 354 2HE2 GLN 54 -3.351 15.086 15.086 1023 2HE2 GLN 354 1HE2 GLN 54 -3.777 14.984 14.984 1024 H ALA 355 HN ALA 55 -5.207 20.733 20.733 1025 HA ALA 355 HA ALA 55 -6.987 20.238 20.238 1026 1HB ALA 355 3HB ALA 55 -8.291 19.205 19.205 1027 2HB ALA 355 2HB ALA 55 -8.201 20.715 20.715 1028 3HB ALA 355 1HB ALA 55 -9.088 20.653 20.653 Start of MODEL 19 1 1H GLY 325 3H GLY 25 13.224 2.506 2.506 2 2H GLY 325 2H GLY 25 11.673 3.061 3.061 3 3H GLY 325 1H GLY 25 12.941 3.159 3.159 4 1HA GLY 325 2HA GLY 25 13.035 0.813 0.813 5 2HA GLY 325 1HA GLY 25 11.352 1.313 1.313 6 H GLU 326 H GLU 26 10.787 -0.898 -0.898 7 HA GLU 326 HA GLU 26 10.813 -1.157 -1.157 8 1HB GLU 326 2HB GLU 26 12.314 -2.769 -2.769 9 2HB GLU 326 1HB GLU 26 10.836 -3.708 -3.708 10 1HG GLU 326 2HG GLU 26 11.047 -3.612 -3.612 11 2HG GLU 326 1HG GLU 26 12.408 -2.496 -2.496 12 H TYR 327 H TYR 27 9.291 -3.457 -3.457 13 HA TYR 327 HA TYR 27 6.684 -2.466 -2.466 14 1HB TYR 327 2HB TYR 27 7.509 -4.245 -4.245 15 2HB TYR 327 1HB TYR 27 5.862 -4.324 -4.324 16 HD1 TYR 327 HD1 TYR 27 8.422 -2.008 -2.008 17 HD2 TYR 327 HD2 TYR 27 4.268 -2.641 -2.641 18 HE1 TYR 327 HE1 TYR 27 7.838 0.038 0.038 19 HE2 TYR 327 HE2 TYR 27 3.684 -0.594 -0.594 20 HH TYR 327 HH TYR 27 5.469 0.790 0.790 21 H PHE 328 H PHE 28 6.028 -3.398 -3.398 22 HA PHE 328 HA PHE 28 6.774 -6.263 -6.263 23 1HB PHE 328 2HB PHE 28 6.252 -3.984 -3.984 24 2HB PHE 328 1HB PHE 28 6.225 -5.667 -5.667 25 HD1 PHE 328 HD2 PHE 28 8.318 -7.064 -7.064 26 HD2 PHE 328 HD1 PHE 28 8.266 -2.896 -2.896 27 HE1 PHE 328 HE2 PHE 28 10.794 -7.064 -7.064 28 HE2 PHE 328 HE1 PHE 28 10.743 -2.898 -2.898 29 HZ PHE 328 HZ PHE 28 12.007 -4.982 -4.982 30 H THR 329 H THR 29 5.117 -7.719 -7.719 31 HA THR 329 HA THR 29 2.343 -6.649 -6.649 32 HB THR 329 HB THR 29 2.683 -9.539 -9.539 33 HG1 THR 329 HG1 THR 29 4.496 -9.420 -9.420 34 1HG2 THR 329 2HG2 THR 29 0.923 -7.649 -7.649 35 2HG2 THR 329 1HG2 THR 29 1.840 -8.024 -8.024 36 3HG2 THR 329 3HG2 THR 29 1.006 -9.310 -9.310 37 H LEU 330 H LEU 30 1.306 -6.470 -6.470 38 HA LEU 330 HA LEU 30 1.993 -8.399 -8.399 39 1HB LEU 330 2HB LEU 30 1.154 -5.635 -5.635 40 2HB LEU 330 1HB LEU 30 -0.030 -6.575 -6.575 41 HG LEU 330 HG LEU 30 2.937 -6.862 -6.862 42 1HD1 LEU 330 2HD1 LEU 30 1.213 -4.595 -4.595 43 2HD1 LEU 330 1HD1 LEU 30 1.862 -5.344 -5.344 44 3HD1 LEU 330 3HD1 LEU 30 2.957 -4.761 -4.761 45 1HD2 LEU 330 1HD2 LEU 30 0.415 -7.436 -7.436 46 2HD2 LEU 330 3HD2 LEU 30 1.569 -8.611 -8.611 47 3HD2 LEU 330 2HD2 LEU 30 2.038 -7.534 -7.534 48 H GLN 331 H GLN 31 0.923 -10.263 -10.263 49 HA GLN 331 HA GLN 31 -1.914 -10.042 -10.042 50 1HB GLN 331 2HB GLN 31 0.115 -12.272 -12.272 51 2HB GLN 331 1HB GLN 31 -1.600 -12.628 -12.628 52 1HG GLN 331 2HG GLN 31 -1.758 -11.314 -11.314 53 2HG GLN 331 1HG GLN 31 -0.138 -10.652 -10.652 54 1HE2 GLN 331 2HE2 GLN 31 1.520 -13.610 -13.610 55 2HE2 GLN 331 1HE2 GLN 31 1.708 -12.229 -12.229 56 H ILE 332 H ILE 32 -3.341 -9.884 -9.884 57 HA ILE 332 HA ILE 32 -2.799 -11.465 -11.465 58 HB ILE 332 HB ILE 32 -4.367 -8.915 -8.915 59 1HG1 ILE 332 2HG1 ILE 32 -2.352 -9.150 -9.150 60 2HG1 ILE 332 1HG1 ILE 32 -1.700 -9.303 -9.303 61 1HG2 ILE 332 3HG2 ILE 32 -4.365 -10.866 -10.866 62 2HG2 ILE 332 2HG2 ILE 32 -4.564 -9.144 -9.144 63 3HG2 ILE 332 1HG2 ILE 32 -5.719 -9.984 -9.984 64 1HD1 ILE 332 1HD1 ILE 32 -2.879 -7.188 -7.188 65 2HD1 ILE 332 3HD1 ILE 32 -3.392 -7.016 -7.016 66 3HD1 ILE 332 2HD1 ILE 32 -1.677 -6.951 -6.951 67 H ARG 333 H ARG 33 -4.063 -13.232 -13.232 68 HA ARG 333 HA ARG 33 -6.450 -13.592 -13.592 69 1HB ARG 333 2HB ARG 33 -4.638 -15.324 -15.324 70 2HB ARG 333 1HB ARG 33 -6.008 -15.470 -15.470 71 1HG ARG 333 2HG ARG 33 -7.501 -15.985 -15.985 72 2HG ARG 333 1HG ARG 33 -6.197 -15.723 -15.723 73 1HD ARG 333 2HD ARG 33 -6.453 -17.933 -17.933 74 2HD ARG 333 1HD ARG 33 -6.296 -18.082 -18.082 75 HE ARG 333 HE ARG 33 -3.941 -17.059 -17.059 76 1HH1 ARG 333 2HH1 ARG 33 -5.139 -19.891 -19.891 77 2HH1 ARG 333 1HH1 ARG 33 -3.982 -20.084 -20.084 78 1HH2 ARG 333 1HH2 ARG 33 -2.671 -16.893 -16.893 79 2HH2 ARG 333 2HH2 ARG 33 -2.585 -18.389 -18.389 80 H GLY 334 H GLY 34 -7.950 -12.027 -12.027 81 1HA GLY 334 2HA GLY 34 -9.609 -12.716 -12.716 82 2HA GLY 334 1HA GLY 34 -8.500 -11.451 -11.451 83 H ARG 335 H ARG 35 -9.656 -9.578 -9.578 84 HA ARG 335 HA ARG 35 -10.445 -8.322 -8.322 85 1HB ARG 335 2HB ARG 35 -12.226 -10.129 -10.129 86 2HB ARG 335 1HB ARG 35 -12.821 -9.321 -9.321 87 1HG ARG 335 2HG ARG 35 -13.710 -7.583 -7.583 88 2HG ARG 335 1HG ARG 35 -12.366 -7.542 -7.542 89 1HD ARG 335 2HD ARG 35 -13.481 -9.915 -9.915 90 2HD ARG 335 1HD ARG 35 -14.917 -9.051 -9.051 91 HE ARG 335 HE ARG 35 -13.229 -7.528 -7.528 92 1HH1 ARG 335 1HH2 ARG 35 -15.067 -10.324 -10.324 93 2HH1 ARG 335 2HH2 ARG 35 -16.158 -9.702 -9.702 94 1HH2 ARG 335 2HH1 ARG 35 -14.973 -6.453 -6.453 95 2HH2 ARG 335 1HH1 ARG 35 -16.105 -7.512 -7.512 96 H GLU 336 H GLU 36 -11.856 -8.552 -8.552 97 HA GLU 336 HA GLU 36 -12.209 -5.735 -5.735 98 1HB GLU 336 2HB GLU 36 -12.106 -6.374 -6.374 99 2HB GLU 336 1HB GLU 36 -13.426 -7.005 -7.005 100 1HG GLU 336 2HG GLU 36 -12.426 -9.145 -9.145 101 2HG GLU 336 1HG GLU 36 -10.854 -8.546 -8.546 102 H ARG 337 H ARG 37 -9.478 -7.850 -7.850 103 HA ARG 337 HA ARG 37 -7.996 -5.689 -5.689 104 1HB ARG 337 2HB ARG 37 -7.535 -8.525 -8.525 105 2HB ARG 337 1HB ARG 37 -6.089 -7.524 -7.524 106 1HG ARG 337 2HG ARG 37 -6.309 -6.731 -6.731 107 2HG ARG 337 1HG ARG 37 -7.921 -7.428 -7.428 108 1HD ARG 337 2HD ARG 37 -5.467 -9.120 -9.120 109 2HD ARG 337 1HD ARG 37 -6.030 -8.742 -8.742 110 HE ARG 337 HE ARG 37 -7.944 -10.133 -10.133 111 1HH1 ARG 337 1HH2 ARG 37 -9.094 -9.809 -9.809 112 2HH1 ARG 337 2HH2 ARG 37 -8.465 -11.067 -11.067 113 1HH2 ARG 337 2HH1 ARG 37 -5.770 -11.749 -11.749 114 2HH2 ARG 337 1HH1 ARG 37 -6.586 -12.165 -12.165 115 H PHE 338 H PHE 38 -8.474 -6.819 -6.819 116 HA PHE 338 HA PHE 38 -6.142 -5.598 -5.598 117 1HB PHE 338 2HB PHE 38 -7.691 -7.331 -7.331 118 2HB PHE 338 1HB PHE 38 -8.811 -6.000 -6.000 119 HD1 PHE 338 HD2 PHE 38 -5.222 -6.960 -6.960 120 HD2 PHE 338 HD1 PHE 38 -8.576 -4.690 -4.690 121 HE1 PHE 338 HE2 PHE 38 -3.924 -6.306 -6.306 122 HE2 PHE 338 HE1 PHE 38 -7.277 -4.036 -4.036 123 HZ PHE 338 HZ PHE 38 -4.950 -4.843 -4.843 124 H GLU 339 H GLU 39 -9.358 -4.443 -4.443 125 HA GLU 339 HA GLU 39 -9.124 -1.921 -1.921 126 1HB GLU 339 2HB GLU 39 -10.827 -2.430 -2.430 127 2HB GLU 339 1HB GLU 39 -11.132 -1.303 -1.303 128 1HG GLU 339 2HG GLU 39 -11.276 -3.282 -3.282 129 2HG GLU 339 1HG GLU 39 -11.188 -4.328 -4.328 130 H MET 340 H MET 40 -8.691 -2.874 -2.874 131 HA MET 340 HA MET 40 -8.006 -0.417 -0.417 132 1HB MET 340 2HB MET 40 -7.109 -3.213 -3.213 133 2HB MET 340 1HB MET 40 -6.330 -1.880 -1.880 134 1HG MET 340 2HG MET 40 -8.887 -1.147 -1.147 135 2HG MET 340 1HG MET 40 -9.125 -2.888 -2.888 136 1HE MET 340 2HE MET 40 -6.957 -4.351 -4.351 137 2HE MET 340 1HE MET 40 -5.731 -3.089 -3.089 138 3HE MET 340 3HE MET 40 -6.182 -3.980 -3.980 139 H PHE 341 H PHE 41 -5.750 -2.725 -2.725 140 HA PHE 341 HA PHE 41 -3.470 -1.040 -1.040 141 1HB PHE 341 2HB PHE 41 -4.251 -3.461 -3.461 142 2HB PHE 341 1HB PHE 41 -2.746 -2.629 -2.629 143 HD1 PHE 341 HD2 PHE 41 -1.883 -1.740 -1.740 144 HD2 PHE 341 HD1 PHE 41 -3.687 -5.433 -5.433 145 HE1 PHE 341 HE2 PHE 41 -0.877 -2.898 -2.898 146 HE2 PHE 341 HE1 PHE 41 -2.694 -6.587 -6.587 147 HZ PHE 341 HZ PHE 41 -1.305 -5.322 -5.322 148 H ARG 342 H ARG 42 -5.976 -1.496 -1.496 149 HA ARG 342 HA ARG 42 -4.838 -0.063 -0.063 150 1HB ARG 342 2HB ARG 42 -7.525 -0.952 -0.952 151 2HB ARG 342 1HB ARG 42 -7.531 0.526 0.526 152 1HG ARG 342 2HG ARG 42 -5.740 -0.893 -0.893 153 2HG ARG 342 1HG ARG 42 -6.687 -2.226 -2.226 154 1HD ARG 342 2HD ARG 42 -8.310 -1.829 -1.829 155 2HD ARG 342 1HD ARG 42 -8.506 -0.196 -0.196 156 HE ARG 342 HE ARG 42 -6.441 0.273 0.273 157 1HH1 ARG 342 1HH2 ARG 42 -5.944 -1.421 -1.421 158 2HH1 ARG 342 2HH2 ARG 42 -7.275 -1.503 -1.503 159 1HH2 ARG 342 2HH1 ARG 42 -9.526 -0.023 -0.023 160 2HH2 ARG 342 1HH1 ARG 42 -9.301 -0.712 -0.712 161 H GLU 343 H GLU 43 -6.455 1.058 1.058 162 HA GLU 343 HA GLU 43 -6.704 3.811 3.811 163 1HB GLU 343 2HB GLU 43 -8.103 2.779 2.779 164 2HB GLU 343 1HB GLU 43 -6.667 2.775 2.775 165 1HG GLU 343 2HG GLU 43 -7.648 4.804 4.804 166 2HG GLU 343 1HG GLU 43 -6.533 5.316 5.316 167 H LEU 344 H LEU 44 -4.501 2.172 2.172 168 HA LEU 344 HA LEU 44 -2.851 4.397 4.397 169 1HB LEU 344 2HB LEU 44 -2.188 1.446 1.446 170 2HB LEU 344 1HB LEU 44 -1.049 2.648 2.648 171 HG LEU 344 HG LEU 44 -2.014 1.906 1.906 172 1HD1 LEU 344 3HD1 LEU 44 -2.377 4.431 4.431 173 2HD1 LEU 344 2HD1 LEU 44 -4.082 3.993 3.993 174 3HD1 LEU 344 1HD1 LEU 44 -3.239 3.711 3.711 175 1HD2 LEU 344 2HD2 LEU 44 -3.845 0.695 0.695 176 2HD2 LEU 344 1HD2 LEU 44 -4.072 0.901 0.901 177 3HD2 LEU 344 3HD2 LEU 44 -4.843 2.016 2.016 178 H ASN 345 H ASN 45 -2.767 2.147 2.147 179 HA ASN 345 HA ASN 45 -0.331 3.246 3.246 180 1HB ASN 345 2HB ASN 45 -2.261 1.133 1.133 181 2HB ASN 345 1HB ASN 45 -1.704 1.989 1.989 182 1HD2 ASN 345 2HD2 ASN 45 0.706 -0.746 -0.746 183 2HD2 ASN 345 1HD2 ASN 45 -0.975 -0.680 -0.680 184 H GLU 346 H GLU 46 -3.733 3.987 3.987 185 HA GLU 346 HA GLU 46 -3.670 5.495 5.495 186 1HB GLU 346 2HB GLU 46 -5.566 5.074 5.074 187 2HB GLU 346 1HB GLU 46 -5.720 6.622 6.622 188 1HG GLU 346 2HG GLU 46 -5.698 5.300 5.300 189 2HG GLU 346 1HG GLU 46 -5.897 3.851 3.851 190 H ALA 347 H ALA 47 -3.371 6.426 6.426 191 HA ALA 347 HA ALA 47 -3.086 9.244 9.244 192 1HB ALA 347 3HB ALA 47 -2.256 7.552 7.552 193 2HB ALA 347 2HB ALA 47 -2.120 9.310 9.310 194 3HB ALA 347 1HB ALA 47 -3.706 8.546 8.546 195 H LEU 348 H LEU 48 -0.678 6.687 6.687 196 HA LEU 348 HA LEU 48 1.640 8.287 8.287 197 1HB LEU 348 2HB LEU 48 1.264 5.428 5.428 198 2HB LEU 348 1HB LEU 48 2.814 6.201 6.201 199 HG LEU 348 HG LEU 48 0.623 5.972 5.972 200 1HD1 LEU 348 3HD1 LEU 48 2.720 4.025 4.025 201 2HD1 LEU 348 2HD1 LEU 48 2.389 4.170 4.170 202 3HD1 LEU 348 1HD1 LEU 48 1.095 3.721 3.721 203 1HD2 LEU 348 3HD2 LEU 48 2.847 7.550 7.550 204 2HD2 LEU 348 2HD2 LEU 48 2.123 6.930 6.930 205 3HD2 LEU 348 1HD2 LEU 48 3.496 6.096 6.096 206 H GLU 349 H GLU 49 -0.164 6.585 6.585 207 HA GLU 349 HA GLU 49 1.464 7.454 7.454 208 1HB GLU 349 2HB GLU 49 -0.213 5.630 5.630 209 2HB GLU 349 1HB GLU 49 -1.504 6.814 6.814 210 1HG GLU 349 2HG GLU 49 -0.936 7.922 7.922 211 2HG GLU 349 1HG GLU 49 0.564 7.006 7.006 212 H LEU 350 H LEU 50 -1.168 8.973 8.973 213 HA LEU 350 HA LEU 50 -1.597 11.110 11.110 214 1HB LEU 350 2HB LEU 50 -3.211 11.728 11.728 215 2HB LEU 350 1HB LEU 50 -2.843 10.211 10.211 216 HG LEU 350 HG LEU 50 -0.953 11.718 11.718 217 1HD1 LEU 350 1HD1 LEU 50 -2.735 13.563 13.563 218 2HD1 LEU 350 3HD1 LEU 50 -2.618 13.894 13.894 219 3HD1 LEU 350 2HD1 LEU 50 -1.159 13.857 13.857 220 1HD2 LEU 350 2HD2 LEU 50 -3.793 11.159 11.159 221 2HD2 LEU 350 1HD2 LEU 50 -2.343 10.797 10.797 222 3HD2 LEU 350 3HD2 LEU 50 -3.029 12.421 12.421 223 H LYS 351 H LYS 51 0.735 10.456 10.456 224 HA LYS 351 HA LYS 51 1.739 13.119 13.119 225 1HB LYS 351 2HB LYS 51 2.312 11.302 11.302 226 2HB LYS 351 1HB LYS 51 3.171 10.463 10.463 227 1HG LYS 351 2HG LYS 51 4.989 11.578 11.578 228 2HG LYS 351 1HG LYS 51 4.333 12.935 12.935 229 1HD LYS 351 2HD LYS 51 2.895 13.232 13.232 230 2HD LYS 351 1HD LYS 51 4.318 12.452 12.452 231 1HE LYS 351 2HE LYS 51 5.609 14.210 14.210 232 2HE LYS 351 1HE LYS 51 4.092 15.100 15.100 233 1HZ LYS 351 3HZ LYS 51 4.446 14.366 14.366 234 2HZ LYS 351 2HZ LYS 51 6.068 14.504 14.504 235 3HZ LYS 351 1HZ LYS 51 5.018 15.832 15.832 236 H ASP 352 H ASP 52 2.573 10.484 10.484 237 HA ASP 352 HA ASP 52 4.777 11.761 11.761 238 1HB ASP 352 2HB ASP 52 4.212 9.362 9.362 239 2HB ASP 352 1HB ASP 52 2.766 9.837 9.837 240 H ALA 353 H ALA 53 1.277 11.876 11.876 241 HA ALA 353 HA ALA 53 1.555 13.600 13.600 242 1HB ALA 353 2HB ALA 53 -0.723 12.647 12.647 243 2HB ALA 353 1HB ALA 53 -0.982 14.004 14.004 244 3HB ALA 353 3HB ALA 53 -0.467 12.443 12.443 245 H GLN 354 H GLN 54 1.668 14.093 14.093 246 HA GLN 354 HA GLN 54 0.652 16.793 16.793 247 1HB GLN 354 2HB GLN 54 2.068 14.909 14.909 248 2HB GLN 354 1HB GLN 54 2.509 16.596 16.596 249 1HG GLN 354 2HG GLN 54 -0.324 16.428 16.428 250 2HG GLN 354 1HG GLN 54 0.145 15.270 15.270 251 1HE2 GLN 354 2HE2 GLN 54 -0.122 18.141 18.141 252 2HE2 GLN 354 1HE2 GLN 54 -0.940 16.753 16.753 253 H ALA 355 HN ALA 55 1.583 18.221 18.221 254 HA ALA 355 HA ALA 55 4.199 19.253 19.253 255 1HB ALA 355 3HB ALA 55 3.928 17.389 17.389 256 2HB ALA 355 2HB ALA 55 5.213 18.590 18.590 257 3HB ALA 355 1HB ALA 55 5.096 17.296 17.296 258 1H GLY 325 3H GLY 25 -13.548 -15.512 -15.512 259 2H GLY 325 2H GLY 25 -12.097 -15.359 -15.359 260 3H GLY 325 1H GLY 25 -13.497 -14.554 -14.554 261 1HA GLY 325 2HA GLY 25 -13.470 -13.084 -13.084 262 2HA GLY 325 1HA GLY 25 -11.856 -13.091 -13.091 263 H GLU 326 H GLU 26 -11.067 -12.417 -12.417 264 HA GLU 326 HA GLU 26 -10.721 -14.781 -14.781 265 1HB GLU 326 2HB GLU 26 -12.305 -12.616 -12.616 266 2HB GLU 326 1HB GLU 26 -10.757 -12.187 -12.187 267 1HG GLU 326 2HG GLU 26 -10.679 -14.278 -14.278 268 2HG GLU 326 1HG GLU 26 -12.118 -14.866 -14.866 269 H TYR 327 H TYR 27 -9.034 -13.610 -13.610 270 HA TYR 327 HA TYR 27 -6.637 -13.081 -13.081 271 1HB TYR 327 2HB TYR 27 -7.072 -14.096 -14.096 272 2HB TYR 327 1HB TYR 27 -5.508 -13.427 -13.427 273 HD1 TYR 327 HD1 TYR 27 -8.044 -16.009 -16.009 274 HD2 TYR 327 HD2 TYR 27 -3.986 -14.671 -14.671 275 HE1 TYR 327 HE1 TYR 27 -7.458 -18.149 -18.149 276 HE2 TYR 327 HE2 TYR 27 -3.401 -16.810 -16.810 277 HH TYR 327 HH TYR 27 -4.997 -19.484 -19.484 278 H PHE 328 H PHE 28 -6.135 -10.962 -10.962 279 HA PHE 328 HA PHE 28 -6.773 -9.083 -9.083 280 1HB PHE 328 2HB PHE 28 -6.622 -8.689 -8.689 281 2HB PHE 328 1HB PHE 28 -6.550 -7.327 -7.327 282 HD1 PHE 328 HD2 PHE 28 -8.398 -7.686 -7.686 283 HD2 PHE 328 HD1 PHE 28 -8.734 -9.052 -9.052 284 HE1 PHE 328 HE2 PHE 28 -10.868 -7.733 -7.733 285 HE2 PHE 328 HE1 PHE 28 -11.203 -9.100 -9.100 286 HZ PHE 328 HZ PHE 28 -12.271 -8.440 -8.440 287 H THR 329 H THR 29 -5.062 -8.066 -8.066 288 HA THR 329 HA THR 29 -2.362 -8.588 -8.588 289 HB THR 329 HB THR 29 -2.382 -7.201 -7.201 290 HG1 THR 329 HG1 THR 29 -4.151 -8.161 -8.161 291 1HG2 THR 329 2HG2 THR 29 -0.780 -8.959 -8.959 292 2HG2 THR 329 1HG2 THR 29 -1.564 -10.033 -10.033 293 3HG2 THR 329 3HG2 THR 29 -0.664 -8.628 -8.628 294 H LEU 330 H LEU 30 -1.421 -7.003 -7.003 295 HA LEU 330 HA LEU 30 -2.357 -4.198 -4.198 296 1HB LEU 330 2HB LEU 30 -1.701 -5.801 -5.801 297 2HB LEU 330 1HB LEU 30 -0.552 -4.466 -4.466 298 HG LEU 330 HG LEU 30 -3.532 -4.051 -4.051 299 1HD1 LEU 330 2HD1 LEU 30 -1.954 -4.699 -4.699 300 2HD1 LEU 330 1HD1 LEU 30 -2.724 -3.119 -3.119 301 3HD1 LEU 330 3HD1 LEU 30 -3.703 -4.552 -4.552 302 1HD2 LEU 330 1HD2 LEU 30 -1.169 -2.253 -2.253 303 2HD2 LEU 330 3HD2 LEU 30 -2.154 -2.224 -2.224 304 3HD2 LEU 330 2HD2 LEU 30 -2.853 -1.734 -1.734 305 H GLN 331 H GLN 31 -1.022 -4.141 -4.141 306 HA GLN 331 HA GLN 31 1.850 -4.460 -4.460 307 1HB GLN 331 2HB GLN 31 -0.036 -3.325 -3.325 308 2HB GLN 331 1HB GLN 31 1.711 -3.149 -3.149 309 1HG GLN 331 2HG GLN 31 2.041 -5.521 -5.521 310 2HG GLN 331 1HG GLN 31 0.383 -5.817 -5.817 311 1HE2 GLN 331 2HE2 GLN 31 -1.011 -5.292 -5.292 312 2HE2 GLN 331 1HE2 GLN 31 -1.369 -5.246 -5.246 313 H ILE 332 H ILE 32 3.049 -3.058 -3.058 314 HA ILE 332 HA ILE 32 2.286 -0.171 -0.171 315 HB ILE 332 HB ILE 32 3.751 -1.829 -1.829 316 1HG1 ILE 332 2HG1 ILE 32 1.520 -0.065 -0.065 317 2HG1 ILE 332 1HG1 ILE 32 1.060 -1.340 -1.340 318 1HG2 ILE 332 3HG2 ILE 32 3.582 1.141 1.141 319 2HG2 ILE 332 2HG2 ILE 32 3.634 0.500 0.500 320 3HG2 ILE 332 1HG2 ILE 32 4.957 0.168 0.168 321 1HD1 ILE 332 1HD1 ILE 32 2.104 -3.024 -3.024 322 2HD1 ILE 332 3HD1 ILE 32 2.508 -1.735 -1.735 323 3HD1 ILE 332 2HD1 ILE 32 0.820 -2.131 -2.131 324 H ARG 333 H ARG 33 3.647 1.098 1.098 325 HA ARG 333 HA ARG 33 6.202 0.012 0.012 326 1HB ARG 333 2HB ARG 33 4.388 1.755 1.755 327 2HB ARG 333 1HB ARG 33 5.608 2.871 2.871 328 1HG ARG 333 2HG ARG 33 7.362 1.679 1.679 329 2HG ARG 333 1HG ARG 33 6.194 0.482 0.482 330 1HD ARG 333 2HD ARG 33 6.360 3.407 3.407 331 2HD ARG 333 1HD ARG 33 6.424 2.007 2.007 332 HE ARG 333 HE ARG 33 3.973 1.639 1.639 333 1HH1 ARG 333 2HH1 ARG 33 5.213 4.240 4.240 334 2HH1 ARG 333 1HH1 ARG 33 3.930 5.342 5.342 335 1HH2 ARG 333 1HH2 ARG 33 2.456 3.251 3.251 336 2HH2 ARG 333 2HH2 ARG 33 2.369 4.782 4.782 337 H GLY 334 H GLY 34 7.433 -0.130 -0.130 338 1HA GLY 334 2HA GLY 34 8.955 2.187 2.187 339 2HA GLY 334 1HA GLY 34 7.731 1.929 1.929 340 H ARG 335 H ARG 35 8.740 0.969 0.969 341 HA ARG 335 HA ARG 35 9.704 -1.701 -1.701 342 1HB ARG 335 2HB ARG 35 11.574 -0.506 -0.506 343 2HB ARG 335 1HB ARG 35 11.949 0.312 0.312 344 1HG ARG 335 2HG ARG 35 12.851 -1.558 -1.558 345 2HG ARG 335 1HG ARG 35 11.648 -2.622 -2.622 346 1HD ARG 335 2HD ARG 35 12.984 -1.845 -1.845 347 2HD ARG 335 1HD ARG 35 14.290 -1.758 -1.758 348 HE ARG 335 HE ARG 35 12.739 -4.245 -4.245 349 1HH1 ARG 335 1HH2 ARG 35 14.772 -2.840 -2.840 350 2HH1 ARG 335 2HH2 ARG 35 15.953 -4.108 -4.108 351 1HH2 ARG 335 2HH1 ARG 35 14.539 -5.758 -5.758 352 2HH2 ARG 335 1HH1 ARG 35 15.821 -5.759 -5.759 353 H GLU 336 H GLU 36 10.744 1.277 1.277 354 HA GLU 336 HA GLU 36 10.900 0.044 0.044 355 1HB GLU 336 2HB GLU 36 10.495 2.512 2.512 356 2HB GLU 336 1HB GLU 36 11.968 2.120 2.120 357 1HG GLU 336 2HG GLU 36 11.132 3.038 3.038 358 2HG GLU 336 1HG GLU 36 9.473 3.056 3.056 359 H ARG 337 H ARG 37 8.199 1.702 1.702 360 HA ARG 337 HA ARG 37 6.434 1.480 1.480 361 1HB ARG 337 2HB ARG 37 6.257 2.424 2.424 362 2HB ARG 337 1HB ARG 37 4.769 1.684 1.684 363 1HG ARG 337 2HG ARG 37 4.677 3.182 3.182 364 2HG ARG 337 1HG ARG 37 6.299 3.789 3.789 365 1HD ARG 337 2HD ARG 37 4.058 4.052 4.052 366 2HD ARG 337 1HD ARG 37 4.345 5.268 5.268 367 HE ARG 337 HE ARG 37 6.403 5.850 5.850 368 1HH1 ARG 337 1HH2 ARG 37 7.823 3.664 3.664 369 2HH1 ARG 337 2HH2 ARG 37 7.418 3.471 3.471 370 1HH2 ARG 337 2HH1 ARG 37 4.546 5.405 5.405 371 2HH2 ARG 337 1HH1 ARG 37 5.562 4.457 4.457 372 H PHE 338 H PHE 38 7.350 -0.621 -0.621 373 HA PHE 338 HA PHE 38 5.100 -2.432 -2.432 374 1HB PHE 338 2HB PHE 38 6.884 -2.286 -2.286 375 2HB PHE 338 1HB PHE 38 7.938 -3.181 -3.181 376 HD1 PHE 338 HD2 PHE 38 4.509 -3.311 -3.311 377 HD2 PHE 338 HD1 PHE 38 7.854 -5.521 -5.521 378 HE1 PHE 338 HE2 PHE 38 3.423 -5.433 -5.433 379 HE2 PHE 338 HE1 PHE 38 6.768 -7.643 -7.643 380 HZ PHE 338 HZ PHE 38 4.553 -7.599 -7.599 381 H GLU 339 H GLU 39 8.095 -2.084 -2.084 382 HA GLU 339 HA GLU 39 7.890 -4.644 -4.644 383 1HB GLU 339 2HB GLU 39 9.321 -2.198 -2.198 384 2HB GLU 339 1HB GLU 39 9.715 -3.895 -3.895 385 1HG GLU 339 2HG GLU 39 10.156 -4.109 -4.109 386 2HG GLU 339 1HG GLU 39 9.982 -2.357 -2.357 387 H MET 340 H MET 40 7.152 -1.279 -1.279 388 HA MET 340 HA MET 40 6.179 -1.724 -1.724 389 1HB MET 340 2HB MET 40 5.411 0.201 0.201 390 2HB MET 340 1HB MET 40 4.457 0.149 0.149 391 1HG MET 340 2HG MET 40 6.911 0.202 0.202 392 2HG MET 340 1HG MET 40 7.268 1.042 1.042 393 1HE MET 340 2HE MET 40 5.162 2.588 2.588 394 2HE MET 340 1HE MET 40 3.835 1.864 1.864 395 3HE MET 340 3HE MET 40 4.168 3.596 3.596 396 H PHE 341 H PHE 41 4.230 -1.756 -1.756 397 HA PHE 341 HA PHE 41 1.853 -2.767 -2.767 398 1HB PHE 341 2HB PHE 41 2.905 -2.772 -2.772 399 2HB PHE 341 1HB PHE 41 1.371 -3.542 -3.542 400 HD1 PHE 341 HD2 PHE 41 0.267 -1.804 -1.804 401 HD2 PHE 341 HD1 PHE 41 2.383 -0.781 -0.781 402 HE1 PHE 341 HE2 PHE 41 -0.852 0.406 0.406 403 HE2 PHE 341 HE1 PHE 41 1.264 1.431 1.431 404 HZ PHE 341 HZ PHE 41 -0.353 2.025 2.025 405 H ARG 342 H ARG 42 4.720 -4.342 -4.342 406 HA ARG 342 HA ARG 42 3.684 -6.988 -6.988 407 1HB ARG 342 2HB ARG 42 6.326 -5.711 -5.711 408 2HB ARG 342 1HB ARG 42 6.337 -7.312 -7.312 409 1HG ARG 342 2HG ARG 42 4.822 -7.862 -7.862 410 2HG ARG 342 1HG ARG 42 5.768 -6.530 -6.530 411 1HD ARG 342 2HD ARG 42 7.529 -7.899 -7.899 412 2HD ARG 342 1HD ARG 42 7.540 -8.227 -8.227 413 HE ARG 342 HE ARG 42 5.653 -9.954 -9.954 414 1HH1 ARG 342 1HH2 ARG 42 5.495 -10.667 -10.667 415 2HH1 ARG 342 2HH2 ARG 42 6.949 -11.466 -11.466 416 1HH2 ARG 342 2HH1 ARG 42 8.824 -10.287 -10.287 417 2HH2 ARG 342 1HH1 ARG 42 8.834 -11.251 -11.251 418 H GLU 343 H GLU 43 4.872 -5.067 -5.067 419 HA GLU 343 HA GLU 43 5.050 -7.297 -7.297 420 1HB GLU 343 2HB GLU 43 6.292 -5.124 -5.124 421 2HB GLU 343 1HB GLU 43 4.751 -4.349 -4.349 422 1HG GLU 343 2HG GLU 43 5.518 -4.886 -4.886 423 2HG GLU 343 1HG GLU 43 4.528 -6.296 -6.296 424 H LEU 344 H LEU 44 2.692 -4.612 -4.612 425 HA LEU 344 HA LEU 44 0.857 -5.472 -5.472 426 1HB LEU 344 2HB LEU 44 0.375 -4.082 -4.082 427 2HB LEU 344 1HB LEU 44 -0.882 -4.312 -4.312 428 HG LEU 344 HG LEU 44 -0.130 -2.184 -2.184 429 1HD1 LEU 344 3HD1 LEU 44 0.252 -3.932 -3.932 430 2HD1 LEU 344 2HD1 LEU 44 1.965 -3.686 -3.686 431 3HD1 LEU 344 1HD1 LEU 44 0.964 -2.329 -2.329 432 1HD2 LEU 344 2HD2 LEU 44 1.844 -2.632 -2.632 433 2HD2 LEU 344 1HD2 LEU 44 1.931 -1.309 -1.309 434 3HD2 LEU 344 3HD2 LEU 44 2.779 -2.823 -2.823 435 H ASN 345 H ASN 45 1.224 -6.494 -6.494 436 HA ASN 345 HA ASN 45 -1.105 -8.223 -8.223 437 1HB ASN 345 2HB ASN 45 1.034 -7.500 -7.500 438 2HB ASN 345 1HB ASN 45 0.563 -9.196 -9.196 439 1HD2 ASN 345 2HD2 ASN 45 -1.783 -6.532 -6.532 440 2HD2 ASN 345 1HD2 ASN 45 -0.143 -6.300 -6.300 441 H GLU 346 H GLU 46 2.239 -8.535 -8.535 442 HA GLU 346 HA GLU 46 2.364 -11.416 -11.416 443 1HB GLU 346 2HB GLU 46 4.011 -9.190 -9.190 444 2HB GLU 346 1HB GLU 46 4.161 -10.706 -10.706 445 1HG GLU 346 2HG GLU 46 4.473 -11.843 -11.843 446 2HG GLU 346 1HG GLU 46 4.656 -10.225 -10.225 447 H ALA 347 H ALA 47 1.635 -9.037 -9.037 448 HA ALA 347 HA ALA 47 1.233 -11.007 -11.007 449 1HB ALA 347 3HB ALA 47 0.229 -8.164 -8.164 450 2HB ALA 347 2HB ALA 47 -0.018 -9.137 -9.137 451 3HB ALA 347 1HB ALA 47 1.616 -8.712 -8.712 452 H LEU 348 H LEU 48 -1.104 -9.191 -9.191 453 HA LEU 348 HA LEU 48 -3.469 -10.392 -10.392 454 1HB LEU 348 2HB LEU 48 -2.800 -9.637 -9.637 455 2HB LEU 348 1HB LEU 48 -4.424 -9.880 -9.880 456 HG LEU 348 HG LEU 48 -2.491 -7.860 -7.860 457 1HD1 LEU 348 3HD1 LEU 48 -4.324 -7.710 -7.710 458 2HD1 LEU 348 2HD1 LEU 48 -4.271 -6.317 -6.317 459 3HD1 LEU 348 1HD1 LEU 48 -2.797 -6.877 -6.877 460 1HD2 LEU 348 3HD2 LEU 48 -4.786 -8.913 -8.913 461 2HD2 LEU 348 2HD2 LEU 48 -4.205 -7.286 -7.286 462 3HD2 LEU 348 1HD2 LEU 48 -5.430 -7.532 -7.532 463 H GLU 349 H GLU 49 -1.260 -11.517 -11.517 464 HA GLU 349 HA GLU 49 -2.714 -13.903 -13.903 465 1HB GLU 349 2HB GLU 49 -0.910 -12.994 -12.994 466 2HB GLU 349 1HB GLU 49 0.271 -13.375 -13.375 467 1HG GLU 349 2HG GLU 49 -0.136 -15.732 -15.732 468 2HG GLU 349 1HG GLU 49 -1.542 -15.455 -15.455 469 H LEU 350 H LEU 50 -0.378 -13.081 -13.081 470 HA LEU 350 HA LEU 50 0.127 -15.763 -15.763 471 1HB LEU 350 2HB LEU 50 1.489 -14.744 -14.744 472 2HB LEU 350 1HB LEU 50 1.130 -13.270 -13.270 473 HG LEU 350 HG LEU 50 -0.994 -13.250 -13.250 474 1HD1 LEU 350 1HD1 LEU 50 0.818 -15.277 -15.277 475 2HD1 LEU 350 3HD1 LEU 50 0.465 -14.002 -14.002 476 3HD1 LEU 350 2HD1 LEU 50 -0.853 -14.922 -14.922 477 1HD2 LEU 350 2HD2 LEU 50 1.784 -12.222 -12.222 478 2HD2 LEU 350 1HD2 LEU 50 0.255 -11.342 -11.342 479 3HD2 LEU 350 3HD2 LEU 50 0.795 -12.125 -12.125 480 H LYS 351 H LYS 51 -2.451 -13.464 -13.464 481 HA LYS 351 HA LYS 51 -3.658 -14.685 -14.685 482 1HB LYS 351 2HB LYS 51 -4.301 -12.433 -12.433 483 2HB LYS 351 1HB LYS 51 -4.943 -13.128 -13.128 484 1HG LYS 351 2HG LYS 51 -6.910 -13.170 -13.170 485 2HG LYS 351 1HG LYS 51 -6.242 -14.630 -14.630 486 1HD LYS 351 2HD LYS 51 -5.102 -12.814 -12.814 487 2HD LYS 351 1HD LYS 51 -6.537 -11.898 -11.898 488 1HE LYS 351 2HE LYS 51 -7.765 -14.187 -14.187 489 2HE LYS 351 1HE LYS 51 -6.337 -14.469 -14.469 490 1HZ LYS 351 3HZ LYS 51 -6.930 -11.967 -11.967 491 2HZ LYS 351 2HZ LYS 51 -8.489 -12.553 -12.553 492 3HZ LYS 351 1HZ LYS 51 -7.520 -13.321 -13.321 493 H ASP 352 H ASP 52 -4.092 -15.169 -15.169 494 HA ASP 352 HA ASP 52 -6.197 -17.075 -17.075 495 1HB ASP 352 2HB ASP 52 -5.447 -16.013 -16.013 496 2HB ASP 352 1HB ASP 52 -3.940 -16.926 -16.926 497 H ALA 353 H ALA 53 -2.666 -17.455 -17.455 498 HA ALA 353 HA ALA 53 -2.791 -20.355 -20.355 499 1HB ALA 353 2HB ALA 53 -0.660 -18.273 -18.273 500 2HB ALA 353 1HB ALA 53 -0.369 -19.907 -19.907 501 3HB ALA 353 3HB ALA 53 -0.707 -19.637 -19.637 502 H GLN 354 H GLN 54 -3.307 -17.779 -17.779 503 HA GLN 354 HA GLN 54 -2.490 -19.100 -19.100 504 1HB GLN 354 2HB GLN 54 -3.940 -16.662 -16.662 505 2HB GLN 354 1HB GLN 54 -4.540 -17.395 -17.395 506 1HG GLN 354 2HG GLN 54 -1.690 -17.514 -17.514 507 2HG GLN 354 1HG GLN 54 -2.149 -15.869 -15.869 508 1HE2 GLN 354 2HE2 GLN 54 -2.431 -15.449 -15.449 509 2HE2 GLN 354 1HE2 GLN 54 -1.427 -15.176 -15.176 510 H ALA 355 HN ALA 55 -3.342 -21.127 -21.127 511 HA ALA 355 HA ALA 55 -6.065 -21.398 -21.398 512 1HB ALA 355 3HB ALA 55 -5.394 -22.367 -22.367 513 2HB ALA 355 2HB ALA 55 -6.766 -22.984 -22.984 514 3HB ALA 355 1HB ALA 55 -6.696 -21.278 -21.278 515 1H GLY 325 3H GLY 25 11.513 -1.605 -1.605 516 2H GLY 325 2H GLY 25 10.065 -2.267 -2.267 517 3H GLY 325 1H GLY 25 11.460 -2.261 -2.261 518 1HA GLY 325 2HA GLY 25 11.409 0.087 0.087 519 2HA GLY 325 1HA GLY 25 9.799 -0.531 -0.531 520 H GLU 326 H GLU 26 8.995 1.628 1.628 521 HA GLU 326 HA GLU 26 8.673 1.853 1.853 522 1HB GLU 326 2HB GLU 26 10.228 3.591 3.591 523 2HB GLU 326 1HB GLU 26 8.671 4.418 4.418 524 1HG GLU 326 2HG GLU 26 8.609 4.311 4.311 525 2HG GLU 326 1HG GLU 26 10.057 3.303 3.303 526 H TYR 327 H TYR 27 6.970 4.058 4.058 527 HA TYR 327 HA TYR 27 4.578 2.885 2.885 528 1HB TYR 327 2HB TYR 27 5.000 4.689 4.689 529 2HB TYR 327 1HB TYR 27 3.434 4.651 4.651 530 HD1 TYR 327 HD1 TYR 27 5.991 2.518 2.518 531 HD2 TYR 327 HD2 TYR 27 1.926 2.842 2.842 532 HE1 TYR 327 HE1 TYR 27 5.428 0.418 0.418 533 HE2 TYR 327 HE2 TYR 27 1.363 0.742 0.742 534 HH TYR 327 HH TYR 27 2.968 -0.522 -0.522 535 H PHE 328 H PHE 28 4.070 3.795 3.795 536 HA PHE 328 HA PHE 28 4.662 6.702 6.702 537 1HB PHE 328 2HB PHE 28 4.520 4.399 4.399 538 2HB PHE 328 1HB PHE 28 4.429 6.077 6.077 539 HD1 PHE 328 HD2 PHE 28 6.268 7.617 7.617 540 HD2 PHE 328 HD1 PHE 28 6.639 3.468 3.468 541 HE1 PHE 328 HE2 PHE 28 8.736 7.800 7.800 542 HE2 PHE 328 HE1 PHE 28 9.107 3.650 3.650 543 HZ PHE 328 HZ PHE 28 10.156 5.817 5.817 544 H THR 329 H THR 29 2.943 8.046 8.046 545 HA THR 329 HA THR 29 0.250 6.791 6.791 546 HB THR 329 HB THR 29 0.325 9.701 9.701 547 HG1 THR 329 HG1 THR 29 2.042 9.714 9.714 548 1HG2 THR 329 2HG2 THR 29 -1.331 7.639 7.639 549 2HG2 THR 329 1HG2 THR 29 -0.576 8.054 8.054 550 3HG2 THR 329 3HG2 THR 29 -1.447 9.284 9.284 551 H LEU 330 H LEU 30 -0.622 6.594 6.594 552 HA LEU 330 HA LEU 30 0.212 8.495 8.495 553 1HB LEU 330 2HB LEU 30 -0.412 5.694 5.694 554 2HB LEU 330 1HB LEU 30 -1.571 6.507 6.507 555 HG LEU 330 HG LEU 30 1.399 7.031 7.031 556 1HD1 LEU 330 2HD1 LEU 30 -0.098 4.653 4.653 557 2HD1 LEU 330 1HD1 LEU 30 0.656 5.434 5.434 558 3HD1 LEU 330 3HD1 LEU 30 1.643 4.931 4.931 559 1HD2 LEU 330 1HD2 LEU 30 -0.985 7.440 7.440 560 2HD2 LEU 330 3HD2 LEU 30 0.001 8.691 8.691 561 3HD2 LEU 330 2HD2 LEU 30 0.687 7.671 7.671 562 H GLN 331 H GLN 31 -1.113 10.226 10.226 563 HA GLN 331 HA GLN 31 -3.994 9.875 9.875 564 1HB GLN 331 2HB GLN 31 -2.124 12.231 12.231 565 2HB GLN 331 1HB GLN 31 -3.873 12.468 12.468 566 1HG GLN 331 2HG GLN 31 -4.177 11.156 11.156 567 2HG GLN 331 1HG GLN 31 -2.507 10.588 10.588 568 1HE2 GLN 331 2HE2 GLN 31 -1.167 13.631 13.631 569 2HE2 GLN 331 1HE2 GLN 31 -0.788 12.271 12.271 570 H ILE 332 H ILE 32 -5.210 9.635 9.635 571 HA ILE 332 HA ILE 32 -4.455 11.224 11.224 572 HB ILE 332 HB ILE 32 -5.893 8.575 8.575 573 1HG1 ILE 332 2HG1 ILE 32 -3.675 8.931 8.931 574 2HG1 ILE 332 1HG1 ILE 32 -3.214 9.161 9.161 575 1HG2 ILE 332 3HG2 ILE 32 -5.762 10.530 10.530 576 2HG2 ILE 332 2HG2 ILE 32 -5.806 8.799 8.799 577 3HG2 ILE 332 1HG2 ILE 32 -7.125 9.556 9.556 578 1HD1 ILE 332 1HD1 ILE 32 -4.277 6.980 6.980 579 2HD1 ILE 332 3HD1 ILE 32 -4.634 6.742 6.742 580 3HD1 ILE 332 2HD1 ILE 32 -2.960 6.804 6.804 581 H ARG 333 H ARG 33 -5.819 12.896 12.896 582 HA ARG 333 HA ARG 33 -8.388 13.068 13.068 583 1HB ARG 333 2HB ARG 33 -6.600 14.944 14.944 584 2HB ARG 333 1HB ARG 33 -7.836 15.013 15.013 585 1HG ARG 333 2HG ARG 33 -9.576 15.369 15.369 586 2HG ARG 333 1HG ARG 33 -8.396 15.193 15.193 587 1HD ARG 333 2HD ARG 33 -8.593 17.409 17.409 588 2HD ARG 333 1HD ARG 33 -8.657 17.542 17.542 589 HE ARG 333 HE ARG 33 -6.198 16.724 16.724 590 1HH1 ARG 333 2HH1 ARG 33 -7.461 19.464 19.464 591 2HH1 ARG 333 1HH1 ARG 33 -6.185 19.753 19.753 592 1HH2 ARG 333 1HH2 ARG 33 -4.687 16.667 16.667 593 2HH2 ARG 333 2HH2 ARG 33 -4.616 18.170 18.170 594 H GLY 334 H GLY 34 -9.627 11.362 11.362 595 1HA GLY 334 2HA GLY 34 -11.150 12.001 12.001 596 2HA GLY 334 1HA GLY 34 -9.914 10.826 10.826 597 H ARG 335 H ARG 35 -10.917 8.869 8.869 598 HA ARG 335 HA ARG 35 -11.856 7.528 7.528 599 1HB ARG 335 2HB ARG 35 -13.740 9.204 9.204 600 2HB ARG 335 1HB ARG 35 -14.119 8.373 8.373 601 1HG ARG 335 2HG ARG 35 -14.995 6.558 6.558 602 2HG ARG 335 1HG ARG 35 -13.790 6.611 6.611 603 1HD ARG 335 2HD ARG 35 -15.150 8.887 8.887 604 2HD ARG 335 1HD ARG 35 -16.447 7.923 7.923 605 HE ARG 335 HE ARG 35 -14.873 6.515 6.515 606 1HH1 ARG 335 1HH2 ARG 35 -16.929 9.168 9.168 607 2HH1 ARG 335 2HH2 ARG 35 -18.100 8.461 8.461 608 1HH2 ARG 335 2HH1 ARG 35 -16.660 5.307 5.307 609 2HH2 ARG 335 1HH1 ARG 35 -17.948 6.275 6.275 610 H GLU 336 H GLU 36 -12.922 7.697 7.697 611 HA GLU 336 HA GLU 36 -13.056 4.875 4.875 612 1HB GLU 336 2HB GLU 36 -12.664 5.551 5.551 613 2HB GLU 336 1HB GLU 36 -14.139 6.074 6.074 614 1HG GLU 336 2HG GLU 36 -13.316 8.276 8.276 615 2HG GLU 336 1HG GLU 36 -11.656 7.792 7.792 616 H ARG 337 H ARG 37 -10.377 7.166 7.166 617 HA ARG 337 HA ARG 37 -8.602 5.134 5.134 618 1HB ARG 337 2HB ARG 37 -8.437 7.987 7.987 619 2HB ARG 337 1HB ARG 37 -6.945 7.094 7.094 620 1HG ARG 337 2HG ARG 37 -6.843 6.325 6.325 621 2HG ARG 337 1HG ARG 37 -8.470 6.918 6.918 622 1HD ARG 337 2HD ARG 37 -6.240 8.764 8.764 623 2HD ARG 337 1HD ARG 37 -6.532 8.378 8.378 624 HE ARG 337 HE ARG 37 -8.599 9.595 9.595 625 1HH1 ARG 337 1HH2 ARG 37 -10.007 9.167 9.167 626 2HH1 ARG 337 2HH2 ARG 37 -9.606 10.471 10.471 627 1HH2 ARG 337 2HH1 ARG 37 -6.749 11.374 11.374 628 2HH2 ARG 337 1HH1 ARG 37 -7.761 11.720 11.720 629 H PHE 338 H PHE 38 -9.520 6.193 6.193 630 HA PHE 338 HA PHE 38 -7.245 5.136 5.136 631 1HB PHE 338 2HB PHE 38 -9.023 6.742 6.742 632 2HB PHE 338 1HB PHE 38 -10.073 5.333 5.333 633 HD1 PHE 338 HD2 PHE 38 -6.646 6.547 6.547 634 HD2 PHE 338 HD1 PHE 38 -9.965 4.025 4.025 635 HE1 PHE 338 HE2 PHE 38 -5.544 5.978 5.978 636 HE2 PHE 338 HE1 PHE 38 -8.864 3.456 3.456 637 HZ PHE 338 HZ PHE 38 -6.654 4.432 4.432 638 H GLU 339 H GLU 39 -10.236 3.759 3.759 639 HA GLU 339 HA GLU 39 -9.996 1.241 1.241 640 1HB GLU 339 2HB GLU 39 -11.443 1.661 1.661 641 2HB GLU 339 1HB GLU 39 -11.821 0.507 0.507 642 1HG GLU 339 2HG GLU 39 -12.275 2.471 2.471 643 2HG GLU 339 1HG GLU 39 -12.114 3.520 3.520 644 H MET 340 H MET 40 -9.277 2.261 2.261 645 HA MET 340 HA MET 40 -8.282 -0.142 -0.142 646 1HB MET 340 2HB MET 40 -7.547 2.737 2.737 647 2HB MET 340 1HB MET 40 -6.580 1.472 1.472 648 1HG MET 340 2HG MET 40 -9.025 0.554 0.554 649 2HG MET 340 1HG MET 40 -9.400 2.274 2.274 650 1HE MET 340 2HE MET 40 -7.306 3.926 3.926 651 2HE MET 340 1HE MET 40 -5.968 2.784 2.784 652 3HE MET 340 3HE MET 40 -6.318 3.600 3.600 653 H PHE 341 H PHE 41 -6.370 2.380 2.380 654 HA PHE 341 HA PHE 41 -3.974 0.829 0.829 655 1HB PHE 341 2HB PHE 41 -5.038 3.196 3.196 656 2HB PHE 341 1HB PHE 41 -3.496 2.448 2.448 657 HD1 PHE 341 HD2 PHE 41 -2.402 1.650 1.650 658 HD2 PHE 341 HD1 PHE 41 -4.535 5.221 5.221 659 HE1 PHE 341 HE2 PHE 41 -1.304 2.857 2.857 660 HE2 PHE 341 HE1 PHE 41 -3.431 6.436 6.436 661 HZ PHE 341 HZ PHE 41 -1.815 5.255 5.255 662 H ARG 342 H ARG 42 -6.838 1.009 1.009 663 HA ARG 342 HA ARG 42 -5.777 -0.310 -0.310 664 1HB ARG 342 2HB ARG 42 -8.432 0.369 0.369 665 2HB ARG 342 1HB ARG 42 -8.417 -1.107 -1.107 666 1HG ARG 342 2HG ARG 42 -6.906 0.436 0.436 667 2HG ARG 342 1HG ARG 42 -7.862 1.702 1.702 668 1HD ARG 342 2HD ARG 42 -9.609 1.194 1.194 669 2HD ARG 342 1HD ARG 42 -9.624 -0.445 -0.445 670 HE ARG 342 HE ARG 42 -7.715 -0.775 -0.775 671 1HH1 ARG 342 1HH2 ARG 42 -7.566 0.930 0.930 672 2HH1 ARG 342 2HH2 ARG 42 -9.015 0.901 0.901 673 1HH2 ARG 342 2HH1 ARG 42 -10.888 -0.722 -0.722 674 2HH2 ARG 342 1HH1 ARG 42 -10.894 -0.034 -0.034 675 H GLU 343 H GLU 43 -6.945 -1.517 -1.517 676 HA GLU 343 HA GLU 43 -7.102 -4.292 -4.292 677 1HB GLU 343 2HB GLU 43 -8.340 -3.345 -3.345 678 2HB GLU 343 1HB GLU 43 -6.793 -3.251 -3.251 679 1HG GLU 343 2HG GLU 43 -7.579 -5.337 -5.337 680 2HG GLU 343 1HG GLU 43 -6.576 -5.773 -5.773 681 H LEU 344 H LEU 44 -4.770 -2.488 -2.488 682 HA LEU 344 HA LEU 44 -2.905 -4.580 -4.580 683 1HB LEU 344 2HB LEU 44 -2.481 -1.592 -1.592 684 2HB LEU 344 1HB LEU 44 -1.202 -2.709 -2.709 685 HG LEU 344 HG LEU 44 -1.988 -2.035 -2.035 686 1HD1 LEU 344 3HD1 LEU 44 -2.315 -4.584 -4.584 687 2HD1 LEU 344 2HD1 LEU 44 -4.035 -4.200 -4.200 688 3HD1 LEU 344 1HD1 LEU 44 -3.004 -3.894 -3.894 689 1HD2 LEU 344 2HD2 LEU 44 -4.035 -0.922 -0.922 690 2HD2 LEU 344 1HD2 LEU 44 -4.049 -1.114 -1.114 691 3HD2 LEU 344 3HD2 LEU 44 -4.893 -2.279 -2.279 692 H ASN 345 H ASN 45 -3.295 -2.303 -2.303 693 HA ASN 345 HA ASN 45 -0.945 -3.236 -3.236 694 1HB ASN 345 2HB ASN 45 -3.090 -1.282 -1.282 695 2HB ASN 345 1HB ASN 45 -2.627 -2.112 -2.112 696 1HD2 ASN 345 2HD2 ASN 45 -0.277 0.812 0.812 697 2HD2 ASN 345 1HD2 ASN 45 -1.913 0.626 0.626 698 H GLU 346 H GLU 46 -4.273 -4.236 -4.236 699 HA GLU 346 HA GLU 46 -4.366 -5.763 -5.763 700 1HB GLU 346 2HB GLU 46 -6.037 -5.447 -5.447 701 2HB GLU 346 1HB GLU 46 -6.164 -7.015 -7.015 702 1HG GLU 346 2HG GLU 46 -6.478 -5.730 -5.730 703 2HG GLU 346 1HG GLU 46 -6.677 -4.284 -4.284 704 H ALA 347 H ALA 47 -3.650 -6.609 -6.609 705 HA ALA 347 HA ALA 47 -3.224 -9.402 -9.402 706 1HB ALA 347 3HB ALA 47 -2.286 -7.607 -7.607 707 2HB ALA 347 2HB ALA 47 -2.017 -9.350 -9.350 708 3HB ALA 347 1HB ALA 47 -3.660 -8.713 -8.713 709 H LEU 348 H LEU 48 -0.938 -6.670 -6.670 710 HA LEU 348 HA LEU 48 1.450 -8.106 -8.106 711 1HB LEU 348 2HB LEU 48 0.770 -5.289 -5.289 712 2HB LEU 348 1HB LEU 48 2.397 -5.955 -5.955 713 HG LEU 348 HG LEU 48 0.452 -5.856 -5.856 714 1HD1 LEU 348 3HD1 LEU 48 2.305 -3.788 -3.788 715 2HD1 LEU 348 2HD1 LEU 48 2.183 -3.937 -3.937 716 3HD1 LEU 348 1HD1 LEU 48 0.746 -3.582 -3.582 717 1HD2 LEU 348 3HD2 LEU 48 2.759 -7.285 -7.285 718 2HD2 LEU 348 2HD2 LEU 48 2.167 -6.713 -6.713 719 3HD2 LEU 348 1HD2 LEU 48 3.390 -5.788 -5.788 720 H GLU 349 H GLU 49 -0.768 -6.584 -6.584 721 HA GLU 349 HA GLU 49 0.703 -7.323 -7.323 722 1HB GLU 349 2HB GLU 49 -1.123 -5.647 -5.647 723 2HB GLU 349 1HB GLU 49 -2.288 -6.921 -6.921 724 1HG GLU 349 2HG GLU 49 -1.867 -8.017 -8.017 725 2HG GLU 349 1HG GLU 49 -0.468 -6.993 -6.993 726 H LEU 350 H LEU 50 -1.607 -9.011 -9.011 727 HA LEU 350 HA LEU 50 -2.086 -11.212 -11.212 728 1HB LEU 350 2HB LEU 50 -3.447 -11.949 -11.949 729 2HB LEU 350 1HB LEU 50 -3.106 -10.404 -10.404 730 HG LEU 350 HG LEU 50 -0.971 -11.757 -11.757 731 1HD1 LEU 350 1HD1 LEU 50 -2.790 -13.763 -13.763 732 2HD1 LEU 350 3HD1 LEU 50 -2.420 -14.053 -14.053 733 3HD1 LEU 350 2HD1 LEU 50 -1.115 -13.937 -13.937 734 1HD2 LEU 350 2HD2 LEU 50 -3.751 -11.408 -11.408 735 2HD2 LEU 350 1HD2 LEU 50 -2.226 -10.886 -10.886 736 3HD2 LEU 350 3HD2 LEU 50 -2.747 -12.563 -12.563 737 H LYS 351 H LYS 51 0.471 -10.391 -10.391 738 HA LYS 351 HA LYS 51 1.697 -12.971 -12.971 739 1HB LYS 351 2HB LYS 51 2.318 -11.096 -11.096 740 2HB LYS 351 1HB LYS 51 2.956 -10.208 -10.208 741 1HG LYS 351 2HG LYS 51 4.932 -11.175 -11.175 742 2HG LYS 351 1HG LYS 51 4.279 -12.587 -12.587 743 1HD LYS 351 2HD LYS 51 3.135 -12.968 -12.968 744 2HD LYS 351 1HD LYS 51 4.564 -12.073 -12.073 745 1HE LYS 351 2HE LYS 51 5.808 -13.748 -13.748 746 2HE LYS 351 1HE LYS 51 4.386 -14.748 -14.748 747 1HZ LYS 351 3HZ LYS 51 4.957 -13.959 -13.959 748 2HZ LYS 351 2HZ LYS 51 6.522 -13.977 -13.977 749 3HZ LYS 351 1HZ LYS 51 5.569 -15.384 -15.384 750 H ASP 352 H ASP 52 2.105 -10.299 -10.299 751 HA ASP 352 HA ASP 52 4.236 -11.438 -11.438 752 1HB ASP 352 2HB ASP 52 3.466 -9.091 -9.091 753 2HB ASP 352 1HB ASP 52 1.967 -9.674 -9.674 754 H ALA 353 H ALA 53 0.711 -11.817 -11.817 755 HA ALA 353 HA ALA 53 0.861 -13.527 -13.527 756 1HB ALA 353 2HB ALA 53 -1.284 -12.722 -12.722 757 2HB ALA 353 1HB ALA 53 -1.561 -14.110 -14.110 758 3HB ALA 353 3HB ALA 53 -1.234 -12.522 -12.522 759 H GLN 354 H GLN 54 1.374 -13.983 -13.983 760 HA GLN 354 HA GLN 54 0.572 -16.747 -16.747 761 1HB GLN 354 2HB GLN 54 1.979 -14.782 -14.782 762 2HB GLN 354 1HB GLN 54 2.608 -16.420 -16.420 763 1HG GLN 354 2HG GLN 54 -0.227 -16.618 -16.618 764 2HG GLN 354 1HG GLN 54 0.167 -15.321 -15.321 765 1HE2 GLN 354 2HE2 GLN 54 0.513 -18.004 -18.004 766 2HE2 GLN 354 1HE2 GLN 54 -0.522 -16.769 -16.769 767 H ALA 355 HN ALA 55 1.450 -18.130 -18.130 768 HA ALA 355 HA ALA 55 4.181 -18.948 -18.948 769 1HB ALA 355 3HB ALA 55 3.505 -17.131 -17.131 770 2HB ALA 355 2HB ALA 55 4.886 -18.227 -18.227 771 3HB ALA 355 1HB ALA 55 4.800 -16.936 -16.936 772 1H GLY 325 3H GLY 25 -15.427 14.453 14.453 773 2H GLY 325 2H GLY 25 -13.882 14.408 14.408 774 3H GLY 325 1H GLY 25 -15.153 13.503 13.503 775 1HA GLY 325 2HA GLY 25 -15.223 12.037 12.037 776 2HA GLY 325 1HA GLY 25 -13.545 12.163 12.163 777 H GLU 326 H GLU 26 -12.955 11.544 11.544 778 HA GLU 326 HA GLU 26 -12.985 13.922 13.922 779 1HB GLU 326 2HB GLU 26 -14.464 11.647 11.647 780 2HB GLU 326 1HB GLU 26 -12.975 11.330 11.330 781 1HG GLU 326 2HG GLU 26 -13.183 13.418 13.418 782 2HG GLU 326 1HG GLU 26 -14.561 13.903 13.903 783 H TYR 327 H TYR 27 -11.432 12.840 12.840 784 HA TYR 327 HA TYR 27 -8.836 12.513 12.513 785 1HB TYR 327 2HB TYR 27 -9.634 13.501 13.501 786 2HB TYR 327 1HB TYR 27 -7.987 12.941 12.941 787 HD1 TYR 327 HD1 TYR 27 -10.583 15.337 15.337 788 HD2 TYR 327 HD2 TYR 27 -6.418 14.284 14.284 789 HE1 TYR 327 HE1 TYR 27 -10.031 17.508 17.508 790 HE2 TYR 327 HE2 TYR 27 -5.866 16.455 16.455 791 HH TYR 327 HH TYR 27 -7.657 19.012 19.012 792 H PHE 328 H PHE 28 -8.171 10.433 10.433 793 HA PHE 328 HA PHE 28 -8.890 8.510 8.510 794 1HB PHE 328 2HB PHE 28 -8.382 8.124 8.124 795 2HB PHE 328 1HB PHE 28 -8.338 6.774 6.774 796 HD1 PHE 328 HD2 PHE 28 -10.419 7.001 7.001 797 HD2 PHE 328 HD1 PHE 28 -10.403 8.339 8.339 798 HE1 PHE 328 HE2 PHE 28 -12.895 6.876 6.876 799 HE2 PHE 328 HE1 PHE 28 -12.879 8.214 8.214 800 HZ PHE 328 HZ PHE 28 -14.126 7.483 7.483 801 H THR 329 H THR 29 -7.226 7.594 7.594 802 HA THR 329 HA THR 29 -4.470 8.367 8.367 803 HB THR 329 HB THR 29 -4.746 6.977 6.977 804 HG1 THR 329 HG1 THR 29 -6.590 7.881 7.881 805 1HG2 THR 329 2HG2 THR 29 -3.057 8.803 8.803 806 2HG2 THR 329 1HG2 THR 29 -4.007 9.826 9.826 807 3HG2 THR 329 3HG2 THR 29 -3.117 8.448 8.448 808 H LEU 330 H LEU 30 -3.367 6.856 6.856 809 HA LEU 330 HA LEU 30 -4.061 3.987 3.987 810 1HB LEU 330 2HB LEU 30 -3.275 5.585 5.585 811 2HB LEU 330 1HB LEU 30 -2.058 4.334 4.334 812 HG LEU 330 HG LEU 30 -5.012 3.707 3.707 813 1HD1 LEU 330 2HD1 LEU 30 -3.288 4.430 4.430 814 2HD1 LEU 330 1HD1 LEU 30 -3.931 2.796 2.796 815 3HD1 LEU 330 3HD1 LEU 30 -5.031 4.161 4.161 816 1HD2 LEU 330 1HD2 LEU 30 -2.467 2.096 2.096 817 2HD2 LEU 330 3HD2 LEU 30 -3.606 1.996 1.996 818 3HD2 LEU 330 2HD2 LEU 30 -4.084 1.442 1.442 819 H GLN 331 H GLN 31 -2.962 3.953 3.953 820 HA GLN 331 HA GLN 31 -0.109 4.505 4.505 821 1HB GLN 331 2HB GLN 31 -2.123 3.251 3.251 822 2HB GLN 331 1HB GLN 31 -0.401 3.210 3.210 823 1HG GLN 331 2HG GLN 31 -0.252 5.604 5.604 824 2HG GLN 331 1HG GLN 31 -1.868 5.764 5.764 825 1HE2 GLN 331 2HE2 GLN 31 -3.536 5.149 5.149 826 2HE2 GLN 331 1HE2 GLN 31 -3.720 5.075 5.075 827 H ILE 332 H ILE 32 1.317 3.203 3.203 828 HA ILE 332 HA ILE 32 0.749 0.269 0.269 829 HB ILE 332 HB ILE 32 2.304 2.030 2.030 830 1HG1 ILE 332 2HG1 ILE 32 0.305 0.090 0.090 831 2HG1 ILE 332 1HG1 ILE 32 -0.362 1.351 1.351 832 1HG2 ILE 332 3HG2 ILE 32 2.324 -0.944 -0.944 833 2HG2 ILE 332 2HG2 ILE 32 2.503 -0.300 -0.300 834 3HG2 ILE 332 1HG2 ILE 32 3.666 0.135 0.135 835 1HD1 ILE 332 1HD1 ILE 32 0.762 3.067 3.067 836 2HD1 ILE 332 3HD1 ILE 32 1.324 1.783 1.783 837 3HD1 ILE 332 2HD1 ILE 32 -0.403 2.106 2.106 838 H ARG 333 H ARG 33 2.037 -0.883 -0.883 839 HA ARG 333 HA ARG 33 4.413 0.353 0.353 840 1HB ARG 333 2HB ARG 33 2.624 -1.518 -1.518 841 2HB ARG 333 1HB ARG 33 3.984 -2.537 -2.537 842 1HG ARG 333 2HG ARG 33 5.505 -1.217 -1.217 843 2HG ARG 333 1HG ARG 33 4.201 -0.105 -0.105 844 1HD ARG 333 2HD ARG 33 4.496 -3.007 -3.007 845 2HD ARG 333 1HD ARG 33 4.347 -1.601 -1.601 846 HE ARG 333 HE ARG 33 1.971 -1.414 -1.414 847 1HH1 ARG 333 2HH1 ARG 33 3.212 -3.922 -3.922 848 2HH1 ARG 333 1HH1 ARG 33 2.059 -5.112 -5.112 849 1HH2 ARG 333 1HH2 ARG 33 0.704 -3.131 -3.131 850 2HH2 ARG 333 2HH2 ARG 33 0.640 -4.665 -4.665 851 H GLY 334 H GLY 34 5.856 0.588 0.588 852 1HA GLY 334 2HA GLY 34 7.591 -1.610 -1.610 853 2HA GLY 334 1HA GLY 34 6.493 -1.433 -1.433 854 H ARG 335 H ARG 35 7.630 -0.409 -0.409 855 HA ARG 335 HA ARG 35 8.373 2.326 2.326 856 1HB ARG 335 2HB ARG 35 10.178 1.276 1.276 857 2HB ARG 335 1HB ARG 35 10.773 0.480 0.480 858 1HG ARG 335 2HG ARG 35 11.632 2.409 2.409 859 2HG ARG 335 1HG ARG 35 10.286 3.385 3.385 860 1HD ARG 335 2HD ARG 35 11.433 2.707 2.707 861 2HD ARG 335 1HD ARG 35 12.858 2.720 2.720 862 HE ARG 335 HE ARG 35 11.144 5.084 5.084 863 1HH1 ARG 335 1HH2 ARG 35 13.015 3.833 3.833 864 2HH1 ARG 335 2HH2 ARG 35 14.098 5.180 5.180 865 1HH2 ARG 335 2HH1 ARG 35 12.872 6.721 6.721 866 2HH2 ARG 335 1HH1 ARG 35 14.017 6.816 6.816 867 H GLU 336 H GLU 36 9.812 -0.568 -0.568 868 HA GLU 336 HA GLU 36 10.161 0.673 0.673 869 1HB GLU 336 2HB GLU 36 10.020 -1.817 -1.817 870 2HB GLU 336 1HB GLU 36 11.355 -1.325 -1.325 871 1HG GLU 336 2HG GLU 36 10.366 -2.301 -2.301 872 2HG GLU 336 1HG GLU 36 8.788 -2.433 -2.433 873 H ARG 337 H ARG 37 7.422 -1.175 -1.175 874 HA ARG 337 HA ARG 37 5.909 -1.083 -1.083 875 1HB ARG 337 2HB ARG 37 5.493 -2.046 -2.046 876 2HB ARG 337 1HB ARG 37 4.032 -1.401 -1.401 877 1HG ARG 337 2HG ARG 37 4.238 -2.894 -2.894 878 2HG ARG 337 1HG ARG 37 5.851 -3.397 -3.397 879 1HD ARG 337 2HD ARG 37 3.425 -3.811 -3.811 880 2HD ARG 337 1HD ARG 37 3.933 -5.004 -5.004 881 HE ARG 337 HE ARG 37 5.890 -5.444 -5.444 882 1HH1 ARG 337 1HH2 ARG 37 7.049 -3.161 -3.161 883 2HH1 ARG 337 2HH2 ARG 37 6.451 -2.996 -2.996 884 1HH2 ARG 337 2HH1 ARG 37 3.761 -5.126 -5.126 885 2HH2 ARG 337 1HH1 ARG 37 4.590 -4.108 -4.108 886 H PHE 338 H PHE 38 6.384 1.075 1.075 887 HA PHE 338 HA PHE 38 4.034 2.698 2.698 888 1HB PHE 338 2HB PHE 38 5.598 2.701 2.701 889 2HB PHE 338 1HB PHE 38 6.704 3.666 3.666 890 HD1 PHE 338 HD2 PHE 38 3.126 3.554 3.554 891 HD2 PHE 338 HD1 PHE 38 6.455 5.993 5.993 892 HE1 PHE 338 HE2 PHE 38 1.825 5.594 5.594 893 HE2 PHE 338 HE1 PHE 38 5.154 8.034 8.034 894 HZ PHE 338 HZ PHE 38 2.838 7.835 7.835 895 H GLU 339 H GLU 39 7.227 2.598 2.598 896 HA GLU 339 HA GLU 39 6.984 5.134 5.134 897 1HB GLU 339 2HB GLU 39 8.691 2.798 2.798 898 2HB GLU 339 1HB GLU 39 8.990 4.520 4.520 899 1HG GLU 339 2HG GLU 39 9.145 4.764 4.764 900 2HG GLU 339 1HG GLU 39 9.082 3.004 3.004 901 H MET 340 H MET 40 6.590 1.724 1.724 902 HA MET 340 HA MET 40 5.871 2.103 2.103 903 1HB MET 340 2HB MET 40 5.008 0.126 0.126 904 2HB MET 340 1HB MET 40 4.218 0.114 0.114 905 1HG MET 340 2HG MET 40 6.776 0.232 0.232 906 2HG MET 340 1HG MET 40 7.021 -0.589 -0.589 907 1HE MET 340 2HE MET 40 4.942 -2.270 -2.270 908 2HE MET 340 1HE MET 40 3.668 -1.648 -1.648 909 3HE MET 340 3HE MET 40 4.144 -3.349 -3.349 910 H PHE 341 H PHE 41 3.624 2.015 2.015 911 HA PHE 341 HA PHE 41 1.329 2.848 2.848 912 1HB PHE 341 2HB PHE 41 2.059 2.924 2.924 913 2HB PHE 341 1HB PHE 41 0.529 3.585 3.585 914 HD1 PHE 341 HD2 PHE 41 -0.199 1.788 1.788 915 HD2 PHE 341 HD1 PHE 41 1.548 0.890 0.890 916 HE1 PHE 341 HE2 PHE 41 -1.147 -0.493 -0.493 917 HE2 PHE 341 HE1 PHE 41 0.595 -1.398 -1.398 918 HZ PHE 341 HZ PHE 41 -0.754 -2.091 -2.091 919 H ARG 342 H ARG 42 3.925 4.630 4.630 920 HA ARG 342 HA ARG 42 2.693 7.207 7.207 921 1HB ARG 342 2HB ARG 42 5.403 6.112 6.112 922 2HB ARG 342 1HB ARG 42 5.372 7.718 7.718 923 1HG ARG 342 2HG ARG 42 3.590 8.128 8.128 924 2HG ARG 342 1HG ARG 42 4.550 6.860 6.860 925 1HD ARG 342 2HD ARG 42 6.157 8.358 8.358 926 2HD ARG 342 1HD ARG 42 6.352 8.694 8.694 927 HE ARG 342 HE ARG 42 4.267 10.270 10.270 928 1HH1 ARG 342 1HH2 ARG 42 3.790 10.974 10.974 929 2HH1 ARG 342 2HH2 ARG 42 5.119 11.881 11.881 930 1HH2 ARG 342 2HH1 ARG 42 7.355 10.839 10.839 931 2HH2 ARG 342 1HH1 ARG 42 7.136 11.804 11.804 932 H GLU 343 H GLU 43 4.285 5.342 5.342 933 HA GLU 343 HA GLU 43 4.509 7.575 7.575 934 1HB GLU 343 2HB GLU 43 5.917 5.492 5.492 935 2HB GLU 343 1HB GLU 43 4.482 4.615 4.615 936 1HG GLU 343 2HG GLU 43 5.444 5.205 5.205 937 2HG GLU 343 1HG GLU 43 4.318 6.539 6.539 938 H LEU 344 H LEU 44 2.319 4.741 4.741 939 HA LEU 344 HA LEU 44 0.645 5.456 5.456 940 1HB LEU 344 2HB LEU 44 0.025 4.027 4.027 941 2HB LEU 344 1HB LEU 44 -1.144 4.181 4.181 942 HG LEU 344 HG LEU 44 -0.209 2.114 2.114 943 1HD1 LEU 344 3HD1 LEU 44 0.204 3.907 3.907 944 2HD1 LEU 344 2HD1 LEU 44 1.903 3.759 3.759 945 3HD1 LEU 344 1HD1 LEU 44 1.029 2.352 2.352 946 1HD2 LEU 344 2HD2 LEU 44 1.624 2.693 2.693 947 2HD2 LEU 344 1HD2 LEU 44 1.822 1.350 1.350 948 3HD2 LEU 344 3HD2 LEU 44 2.633 2.886 2.886 949 H ASN 345 H ASN 45 0.581 6.511 6.511 950 HA ASN 345 HA ASN 45 -1.856 8.060 8.060 951 1HB ASN 345 2HB ASN 45 0.100 7.482 7.482 952 2HB ASN 345 1HB ASN 45 -0.481 9.146 9.146 953 1HD2 ASN 345 2HD2 ASN 45 -2.845 6.355 6.355 954 2HD2 ASN 345 1HD2 ASN 45 -1.163 6.216 6.216 955 H GLU 346 H GLU 46 1.530 8.608 8.608 956 HA GLU 346 HA GLU 46 1.441 11.494 11.494 957 1HB GLU 346 2HB GLU 46 3.353 9.395 9.395 958 2HB GLU 346 1HB GLU 46 3.485 10.921 10.921 959 1HG GLU 346 2HG GLU 46 3.470 12.076 12.076 960 2HG GLU 346 1HG GLU 46 3.689 10.476 10.476 961 H ALA 347 H ALA 47 1.174 9.066 9.066 962 HA ALA 347 HA ALA 47 0.848 10.996 10.996 963 1HB ALA 347 3HB ALA 47 0.019 8.089 8.089 964 2HB ALA 347 2HB ALA 47 -0.138 9.040 9.040 965 3HB ALA 347 1HB ALA 47 1.457 8.732 8.732 966 H LEU 348 H LEU 48 -1.549 9.021 9.021 967 HA LEU 348 HA LEU 48 -3.880 10.049 10.049 968 1HB LEU 348 2HB LEU 48 -3.468 9.332 9.332 969 2HB LEU 348 1HB LEU 48 -5.028 9.464 9.464 970 HG LEU 348 HG LEU 48 -2.847 7.586 7.586 971 1HD1 LEU 348 3HD1 LEU 48 -4.936 7.292 7.292 972 2HD1 LEU 348 2HD1 LEU 48 -4.618 5.908 5.908 973 3HD1 LEU 348 1HD1 LEU 48 -3.315 6.600 6.600 974 1HD2 LEU 348 3HD2 LEU 48 -5.083 8.483 8.483 975 2HD2 LEU 348 2HD2 LEU 48 -4.354 6.903 6.903 976 3HD2 LEU 348 1HD2 LEU 48 -5.721 7.057 7.057 977 H GLU 349 H GLU 49 -2.044 11.325 11.325 978 HA GLU 349 HA GLU 49 -3.723 13.597 13.597 979 1HB GLU 349 2HB GLU 49 -2.021 12.830 12.830 980 2HB GLU 349 1HB GLU 49 -0.745 13.291 13.291 981 1HG GLU 349 2HG GLU 49 -1.337 15.613 15.613 982 2HG GLU 349 1HG GLU 49 -2.824 15.240 15.240 983 H LEU 350 H LEU 50 -1.082 12.957 12.957 984 HA LEU 350 HA LEU 50 -0.675 15.670 15.670 985 1HB LEU 350 2HB LEU 50 0.900 14.747 14.747 986 2HB LEU 350 1HB LEU 50 0.557 13.253 13.253 987 HG LEU 350 HG LEU 50 -1.387 13.079 13.079 988 1HD1 LEU 350 1HD1 LEU 50 0.407 15.205 15.205 989 2HD1 LEU 350 3HD1 LEU 50 0.231 13.903 13.903 990 3HD1 LEU 350 2HD1 LEU 50 -1.194 14.761 14.761 991 1HD2 LEU 350 2HD2 LEU 50 1.460 12.234 12.234 992 2HD2 LEU 350 1HD2 LEU 50 -0.003 11.256 11.256 993 3HD2 LEU 350 3HD2 LEU 50 0.638 12.073 12.073 994 H LYS 351 H LYS 51 -3.019 13.201 13.201 995 HA LYS 351 HA LYS 51 -4.049 14.340 14.340 996 1HB LYS 351 2HB LYS 51 -4.605 12.046 12.046 997 2HB LYS 351 1HB LYS 51 -5.453 12.681 12.681 998 1HG LYS 351 2HG LYS 51 -7.287 12.590 12.590 999 2HG LYS 351 1HG LYS 51 -6.649 14.091 14.091 1000 1HD LYS 351 2HD LYS 51 -5.218 12.355 12.355 1001 2HD LYS 351 1HD LYS 51 -6.628 11.344 11.344 1002 1HE LYS 351 2HE LYS 51 -7.950 13.534 13.534 1003 2HE LYS 351 1HE LYS 51 -6.446 13.921 13.921 1004 1HZ LYS 351 3HZ LYS 51 -6.775 11.380 11.380 1005 2HZ LYS 351 2HZ LYS 51 -8.401 11.853 11.853 1006 3HZ LYS 351 1HZ LYS 51 -7.366 12.688 12.688 1007 H ASP 352 H ASP 52 -4.893 14.787 14.787 1008 HA ASP 352 HA ASP 52 -7.105 16.536 16.536 1009 1HB ASP 352 2HB ASP 52 -6.516 15.529 15.529 1010 2HB ASP 352 1HB ASP 52 -5.076 16.545 16.545 1011 H ALA 353 H ALA 53 -3.615 17.161 17.161 1012 HA ALA 353 HA ALA 53 -3.924 20.049 20.049 1013 1HB ALA 353 2HB ALA 53 -1.625 18.121 18.121 1014 2HB ALA 353 1HB ALA 53 -1.384 19.773 19.773 1015 3HB ALA 353 3HB ALA 53 -1.889 19.475 19.475 1016 H GLN 354 H GLN 54 -4.003 17.446 17.446 1017 HA GLN 354 HA GLN 54 -3.015 18.836 18.836 1018 1HB GLN 354 2HB GLN 54 -4.330 16.285 16.285 1019 2HB GLN 354 1HB GLN 54 -4.843 16.977 16.977 1020 1HG GLN 354 2HG GLN 54 -2.036 17.360 17.360 1021 2HG GLN 354 1HG GLN 54 -2.351 15.692 15.692 1022 1HE2 GLN 354 2HE2 GLN 54 -2.312 15.087 15.087 1023 2HE2 GLN 354 1HE2 GLN 54 -1.415 14.956 14.956 1024 H ALA 355 HN ALA 55 -3.978 20.789 20.789 1025 HA ALA 355 HA ALA 55 -6.608 20.848 20.848 1026 1HB ALA 355 3HB ALA 55 -6.319 21.863 21.863 1027 2HB ALA 355 2HB ALA 55 -7.622 22.380 22.380 1028 3HB ALA 355 1HB ALA 55 -7.479 20.684 20.684
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