NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
277260 | 2kf6 | 16172 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H VAL 3 H VAL 3 16.359 49.258 12.623 2 HA VAL 3 HA VAL 3 14.268 48.054 11.805 3 HB VAL 3 HB VAL 3 14.409 49.947 9.490 4 HG11 VAL 3 HG11 VAL 3 13.063 47.927 9.304 5 HG12 VAL 3 HG12 VAL 3 11.971 49.308 9.420 6 HG13 VAL 3 HG13 VAL 3 12.246 48.281 10.829 7 HG21 VAL 3 HG21 VAL 3 13.272 50.579 12.193 8 HG22 VAL 3 HG22 VAL 3 12.359 51.076 10.770 9 HG23 VAL 3 HG23 VAL 3 14.006 51.659 11.007 10 H ILE 4 H ILE 4 16.851 47.420 12.031 11 HA ILE 4 HA ILE 4 17.603 46.574 9.267 12 HB ILE 4 HB ILE 4 19.442 47.874 11.304 13 HG12 ILE 4 HG12 ILE 4 19.431 48.630 8.441 14 HG13 ILE 4 HG13 ILE 4 17.937 48.977 9.305 15 HG21 ILE 4 HG21 ILE 4 21.229 47.350 9.573 16 HG22 ILE 4 HG22 ILE 4 20.068 46.273 8.798 17 HG23 ILE 4 HG23 ILE 4 20.623 45.941 10.439 18 HD11 ILE 4 HD11 ILE 4 19.017 50.385 10.859 19 HD12 ILE 4 HD12 ILE 4 19.764 50.794 9.317 20 HD13 ILE 4 HD13 ILE 4 20.611 49.745 10.457 21 H ASN 5 H ASN 5 18.605 44.514 9.197 22 HA ASN 5 HA ASN 5 19.102 43.113 11.745 23 HB2 ASN 5 HB2 ASN 5 17.638 41.238 11.119 24 HB3 ASN 5 HB3 ASN 5 16.696 42.727 11.223 25 HD21 ASN 5 HD21 ASN 5 15.561 40.789 9.614 26 HD22 ASN 5 HD22 ASN 5 15.779 41.171 7.974 27 H THR 6 H THR 6 20.772 44.008 9.461 28 HA THR 6 HA THR 6 21.596 41.306 8.446 29 HB THR 6 HB THR 6 22.369 42.327 6.417 30 HG1 THR 6 HG1 THR 6 22.085 44.634 6.183 31 HG21 THR 6 HG21 THR 6 20.314 42.909 5.478 32 HG22 THR 6 HG22 THR 6 19.786 43.771 6.925 33 HG23 THR 6 HG23 THR 6 19.830 42.010 6.913 34 H PHE 7 H PHE 7 23.723 40.745 8.595 35 HA PHE 7 HA PHE 7 25.352 41.498 10.652 36 HB2 PHE 7 HB2 PHE 7 26.140 40.558 7.880 37 HB3 PHE 7 HB3 PHE 7 27.298 40.673 9.209 38 HD1 PHE 7 HD1 PHE 7 26.416 39.668 11.515 39 HD2 PHE 7 HD2 PHE 7 24.989 38.549 7.596 40 HE1 PHE 7 HE1 PHE 7 25.519 37.544 12.443 41 HE2 PHE 7 HE2 PHE 7 24.107 36.418 8.528 42 HZ PHE 7 HZ PHE 7 24.362 35.916 10.949 43 H ASP 8 H ASP 8 26.808 42.349 7.592 44 HA ASP 8 HA ASP 8 28.419 44.451 8.396 45 HB2 ASP 8 HB2 ASP 8 27.073 43.783 5.797 46 HB3 ASP 8 HB3 ASP 8 27.966 45.297 5.932 47 H GLY 9 H GLY 9 25.095 44.683 7.140 48 HA2 GLY 9 HA2 GLY 9 24.797 47.472 7.195 49 HA3 GLY 9 HA3 GLY 9 23.467 46.346 7.471 50 H VAL 10 H VAL 10 24.080 45.166 9.884 51 HA VAL 10 HA VAL 10 23.417 47.234 11.780 52 HB VAL 10 HB VAL 10 24.460 44.410 12.155 53 HG11 VAL 10 HG11 VAL 10 24.987 45.210 14.220 54 HG12 VAL 10 HG12 VAL 10 23.249 45.107 14.498 55 HG13 VAL 10 HG13 VAL 10 23.978 46.644 14.032 56 HG21 VAL 10 HG21 VAL 10 21.697 45.613 12.578 57 HG22 VAL 10 HG22 VAL 10 22.131 43.907 12.697 58 HG23 VAL 10 HG23 VAL 10 22.181 44.721 11.132 59 H ALA 11 H ALA 11 26.455 45.484 11.077 60 HA ALA 11 HA ALA 11 28.104 46.605 13.088 61 HB1 ALA 11 HB1 ALA 11 29.819 46.290 10.993 62 HB2 ALA 11 HB2 ALA 11 28.455 45.319 10.454 63 HB3 ALA 11 HB3 ALA 11 29.243 44.955 11.986 64 H ASP 12 H ASP 12 27.726 47.688 9.694 65 HA ASP 12 HA ASP 12 29.289 50.025 9.846 66 HB2 ASP 12 HB2 ASP 12 26.980 49.134 8.186 67 HB3 ASP 12 HB3 ASP 12 27.396 50.849 8.151 68 H TYR 13 H TYR 13 25.826 49.614 10.457 69 HA TYR 13 HA TYR 13 25.138 52.229 11.174 70 HB2 TYR 13 HB2 TYR 13 23.733 50.004 11.045 71 HB3 TYR 13 HB3 TYR 13 24.126 49.894 12.758 72 HD1 TYR 13 HD1 TYR 13 22.424 51.937 10.181 73 HD2 TYR 13 HD2 TYR 13 23.135 51.337 14.373 74 HE1 TYR 13 HE1 TYR 13 20.590 53.523 10.716 75 HE2 TYR 13 HE2 TYR 13 21.299 52.908 14.915 76 HH TYR 13 HH TYR 13 18.960 53.684 13.181 77 H LEU 14 H LEU 14 26.303 49.636 13.285 78 HA LEU 14 HA LEU 14 26.481 51.310 15.612 79 HB2 LEU 14 HB2 LEU 14 27.555 48.581 14.913 80 HB3 LEU 14 HB3 LEU 14 27.883 49.331 16.475 81 HG LEU 14 HG LEU 14 25.101 48.947 15.339 82 HD11 LEU 14 HD11 LEU 14 26.371 46.800 15.880 83 HD12 LEU 14 HD12 LEU 14 24.852 47.027 16.748 84 HD13 LEU 14 HD13 LEU 14 26.383 47.331 17.565 85 HD21 LEU 14 HD21 LEU 14 26.181 50.438 17.572 86 HD22 LEU 14 HD22 LEU 14 25.122 49.158 18.169 87 HD23 LEU 14 HD23 LEU 14 24.510 50.346 17.016 88 H GLN 15 H GLN 15 29.019 50.155 13.318 89 HA GLN 15 HA GLN 15 31.176 51.459 14.696 90 HB2 GLN 15 HB2 GLN 15 30.772 50.732 11.804 91 HB3 GLN 15 HB3 GLN 15 32.292 51.389 12.417 92 HG2 GLN 15 HG2 GLN 15 31.761 49.330 14.202 93 HG3 GLN 15 HG3 GLN 15 31.186 48.676 12.666 94 HE21 GLN 15 HE21 GLN 15 33.580 47.778 14.108 95 HE22 GLN 15 HE22 GLN 15 34.896 48.075 13.078 96 H THR 16 H THR 16 28.689 52.787 12.609 97 HA THR 16 HA THR 16 30.215 55.357 12.353 98 HB THR 16 HB THR 16 27.533 54.718 11.080 99 HG1 THR 16 HG1 THR 16 28.964 53.127 10.405 100 HG21 THR 16 HG21 THR 16 27.998 57.020 10.905 101 HG22 THR 16 HG22 THR 16 28.542 56.346 9.367 102 HG23 THR 16 HG23 THR 16 29.719 56.750 10.612 103 H TYR 17 H TYR 17 26.942 54.241 13.350 104 HA TYR 17 HA TYR 17 26.493 56.880 14.662 105 HB2 TYR 17 HB2 TYR 17 24.575 54.584 14.141 106 HB3 TYR 17 HB3 TYR 17 24.148 56.194 14.711 107 HD1 TYR 17 HD1 TYR 17 24.664 58.188 13.238 108 HD2 TYR 17 HD2 TYR 17 24.789 54.135 11.783 109 HE1 TYR 17 HE1 TYR 17 24.462 59.017 10.914 110 HE2 TYR 17 HE2 TYR 17 24.589 54.976 9.446 111 HH TYR 17 HH TYR 17 25.251 57.721 8.408 112 H HIS 18 H HIS 18 27.336 53.634 15.474 113 HA HIS 18 HA HIS 18 27.624 52.563 17.541 114 HB2 HIS 18 HB2 HIS 18 27.320 55.406 18.527 115 HB3 HIS 18 HB3 HIS 18 27.796 54.050 19.542 116 HD1 HIS 18 HD1 HIS 18 29.185 53.173 16.459 117 HD2 HIS 18 HD2 HIS 18 30.261 56.036 19.324 118 HE1 HIS 18 HE1 HIS 18 31.634 53.730 16.060 119 H LYS 19 H LYS 19 24.773 54.568 17.140 120 HA LYS 19 HA LYS 19 23.398 53.474 19.445 121 HB2 LYS 19 HB2 LYS 19 22.251 55.364 18.916 122 HB3 LYS 19 HB3 LYS 19 22.773 55.315 17.232 123 HG2 LYS 19 HG2 LYS 19 21.086 53.552 16.767 124 HG3 LYS 19 HG3 LYS 19 20.577 53.600 18.449 125 HD2 LYS 19 HD2 LYS 19 18.999 54.955 17.337 126 HD3 LYS 19 HD3 LYS 19 20.124 56.112 18.048 127 HE2 LYS 19 HE2 LYS 19 20.372 56.973 15.989 128 HE3 LYS 19 HE3 LYS 19 21.256 55.507 15.575 129 HZ1 LYS 19 HZ1 LYS 19 19.618 54.860 14.225 130 HZ2 LYS 19 HZ2 LYS 19 18.865 56.371 14.501 131 HZ3 LYS 19 HZ3 LYS 19 18.435 55.023 15.468 132 H LEU 20 H LEU 20 22.546 51.523 19.616 133 HA LEU 20 HA LEU 20 22.653 49.452 17.746 134 HB2 LEU 20 HB2 LEU 20 21.172 49.986 20.229 135 HB3 LEU 20 HB3 LEU 20 20.351 48.859 19.154 136 HG LEU 20 HG LEU 20 23.282 48.525 19.625 137 HD11 LEU 20 HD11 LEU 20 21.171 47.405 21.484 138 HD12 LEU 20 HD12 LEU 20 22.130 48.835 21.859 139 HD13 LEU 20 HD13 LEU 20 22.920 47.276 21.645 140 HD21 LEU 20 HD21 LEU 20 21.056 47.076 18.463 141 HD22 LEU 20 HD22 LEU 20 21.890 46.095 19.675 142 HD23 LEU 20 HD23 LEU 20 22.786 46.776 18.314 143 HA PRO 21 HA PRO 21 20.030 50.687 14.375 144 HB2 PRO 21 HB2 PRO 21 19.183 47.839 14.459 145 HB3 PRO 21 HB3 PRO 21 19.801 48.793 13.100 146 HG2 PRO 21 HG2 PRO 21 21.260 46.956 14.549 147 HG3 PRO 21 HG3 PRO 21 21.944 48.247 13.548 148 HD2 PRO 21 HD2 PRO 21 22.027 47.976 16.426 149 HD3 PRO 21 HD3 PRO 21 22.774 49.234 15.419 150 H ASP 22 H ASP 22 18.041 51.577 14.429 151 HA ASP 22 HA ASP 22 16.294 51.373 16.675 152 HB2 ASP 22 HB2 ASP 22 15.260 52.315 14.031 153 HB3 ASP 22 HB3 ASP 22 15.114 53.068 15.622 154 H ASN 23 H ASN 23 16.085 49.025 16.768 155 HA ASN 23 HA ASN 23 13.574 48.017 15.997 156 HB2 ASN 23 HB2 ASN 23 14.280 46.441 14.149 157 HB3 ASN 23 HB3 ASN 23 14.266 48.137 13.694 158 HD21 ASN 23 HD21 ASN 23 16.394 45.428 14.520 159 HD22 ASN 23 HD22 ASN 23 17.811 46.134 13.909 160 H TYR 24 H TYR 24 16.169 47.812 17.824 161 HA TYR 24 HA TYR 24 16.111 44.830 18.143 162 HB2 TYR 24 HB2 TYR 24 18.233 46.893 18.496 163 HB3 TYR 24 HB3 TYR 24 18.295 45.455 19.515 164 HD1 TYR 24 HD1 TYR 24 18.053 43.177 18.330 165 HD2 TYR 24 HD2 TYR 24 19.023 46.818 16.315 166 HE1 TYR 24 HE1 TYR 24 18.949 41.875 16.424 167 HE2 TYR 24 HE2 TYR 24 19.927 45.526 14.404 168 HH TYR 24 HH TYR 24 19.810 41.958 14.386 169 H ILE 25 H ILE 25 16.426 44.029 20.393 170 HA ILE 25 HA ILE 25 15.655 45.895 22.545 171 HB ILE 25 HB ILE 25 13.923 43.632 22.894 172 HG12 ILE 25 HG12 ILE 25 13.372 45.015 20.259 173 HG13 ILE 25 HG13 ILE 25 14.240 43.480 20.341 174 HG21 ILE 25 HG21 ILE 25 12.192 45.535 22.493 175 HG22 ILE 25 HG22 ILE 25 13.604 46.587 22.346 176 HG23 ILE 25 HG23 ILE 25 13.319 45.697 23.841 177 HD11 ILE 25 HD11 ILE 25 11.397 44.084 21.107 178 HD12 ILE 25 HD12 ILE 25 12.247 42.750 21.892 179 HD13 ILE 25 HD13 ILE 25 12.029 42.748 20.143 180 H THR 26 H THR 26 16.135 45.049 24.673 181 HA THR 26 HA THR 26 18.270 43.030 24.692 182 HB THR 26 HB THR 26 18.202 43.338 27.135 183 HG1 THR 26 HG1 THR 26 15.936 44.972 26.624 184 HG21 THR 26 HG21 THR 26 18.054 46.035 27.001 185 HG22 THR 26 HG22 THR 26 18.153 45.667 25.277 186 HG23 THR 26 HG23 THR 26 19.429 45.121 26.371 187 H LYS 27 H LYS 27 18.113 40.904 25.633 188 HA LYS 27 HA LYS 27 15.841 39.345 25.088 189 HB2 LYS 27 HB2 LYS 27 18.320 39.046 26.604 190 HB3 LYS 27 HB3 LYS 27 16.997 38.186 27.389 191 HG2 LYS 27 HG2 LYS 27 17.186 36.535 25.864 192 HG3 LYS 27 HG3 LYS 27 16.766 37.675 24.588 193 HD2 LYS 27 HD2 LYS 27 19.548 37.815 25.591 194 HD3 LYS 27 HD3 LYS 27 19.155 36.363 24.692 195 HE2 LYS 27 HE2 LYS 27 18.553 37.592 22.736 196 HE3 LYS 27 HE3 LYS 27 18.482 39.116 23.633 197 HZ1 LYS 27 HZ1 LYS 27 20.605 38.445 22.201 198 HZ2 LYS 27 HZ2 LYS 27 21.017 37.645 23.659 199 HZ3 LYS 27 HZ3 LYS 27 20.742 39.337 23.662 200 H SER 28 H SER 28 16.755 40.783 28.241 201 HA SER 28 HA SER 28 14.552 40.104 29.807 202 HB2 SER 28 HB2 SER 28 16.309 41.346 30.819 203 HB3 SER 28 HB3 SER 28 16.144 42.669 29.669 204 HG SER 28 HG SER 28 14.482 43.419 30.768 205 H GLU 29 H GLU 29 14.712 43.220 27.967 206 HA GLU 29 HA GLU 29 12.046 44.033 28.313 207 HB2 GLU 29 HB2 GLU 29 13.919 44.298 25.933 208 HB3 GLU 29 HB3 GLU 29 12.379 45.149 26.046 209 HG2 GLU 29 HG2 GLU 29 13.106 46.477 27.832 210 HG3 GLU 29 HG3 GLU 29 14.392 45.368 28.295 211 H ALA 30 H ALA 30 13.380 42.145 25.514 212 HA ALA 30 HA ALA 30 10.939 41.577 24.220 213 HB1 ALA 30 HB1 ALA 30 13.564 40.142 24.430 214 HB2 ALA 30 HB2 ALA 30 12.781 40.833 23.010 215 HB3 ALA 30 HB3 ALA 30 12.204 39.308 23.673 216 H GLN 31 H GLN 31 12.579 39.619 26.715 217 HA GLN 31 HA GLN 31 10.544 37.619 26.956 218 HB2 GLN 31 HB2 GLN 31 12.592 38.596 28.971 219 HB3 GLN 31 HB3 GLN 31 11.631 37.129 29.155 220 HG2 GLN 31 HG2 GLN 31 12.628 36.132 27.206 221 HG3 GLN 31 HG3 GLN 31 13.409 37.648 26.761 222 HE21 GLN 31 HE21 GLN 31 13.541 34.921 28.998 223 HE22 GLN 31 HE22 GLN 31 15.083 35.272 29.611 224 H ALA 32 H ALA 32 11.145 40.556 28.949 225 HA ALA 32 HA ALA 32 8.853 40.116 30.646 226 HB1 ALA 32 HB1 ALA 32 10.211 41.614 31.691 227 HB2 ALA 32 HB2 ALA 32 9.286 42.805 30.777 228 HB3 ALA 32 HB3 ALA 32 10.832 42.230 30.161 229 H LEU 33 H LEU 33 9.243 41.737 27.539 230 HA LEU 33 HA LEU 33 6.699 43.110 27.602 231 HB2 LEU 33 HB2 LEU 33 8.697 42.402 25.471 232 HB3 LEU 33 HB3 LEU 33 7.090 42.926 24.974 233 HG LEU 33 HG LEU 33 8.435 44.571 27.064 234 HD11 LEU 33 HD11 LEU 33 10.349 44.734 25.843 235 HD12 LEU 33 HD12 LEU 33 9.392 45.774 24.796 236 HD13 LEU 33 HD13 LEU 33 9.598 44.069 24.393 237 HD21 LEU 33 HD21 LEU 33 6.137 44.953 25.920 238 HD22 LEU 33 HD22 LEU 33 7.074 45.471 24.518 239 HD23 LEU 33 HD23 LEU 33 7.221 46.337 26.046 240 H GLY 34 H GLY 34 7.617 39.812 27.165 241 HA2 GLY 34 HA2 GLY 34 5.528 38.319 27.468 242 HA3 GLY 34 HA3 GLY 34 4.889 39.170 26.067 243 H TRP 35 H TRP 35 8.151 38.871 25.490 244 HA TRP 35 HA TRP 35 7.788 36.906 23.426 245 HB2 TRP 35 HB2 TRP 35 9.636 38.559 23.413 246 HB3 TRP 35 HB3 TRP 35 10.355 37.752 24.808 247 HD1 TRP 35 HD1 TRP 35 8.852 36.212 21.594 248 HE1 TRP 35 HE1 TRP 35 10.628 34.661 20.556 249 HE3 TRP 35 HE3 TRP 35 12.719 37.008 24.825 250 HZ2 TRP 35 HZ2 TRP 35 13.333 33.857 21.031 251 HZ3 TRP 35 HZ3 TRP 35 14.880 35.830 24.527 252 HH2 TRP 35 HH2 TRP 35 15.190 34.254 22.632 253 H VAL 36 H VAL 36 7.292 34.783 23.855 254 HA VAL 36 HA VAL 36 8.679 33.456 26.183 255 HB VAL 36 HB VAL 36 5.884 33.113 25.070 256 HG11 VAL 36 HG11 VAL 36 6.749 30.892 25.538 257 HG12 VAL 36 HG12 VAL 36 5.663 31.353 26.849 258 HG13 VAL 36 HG13 VAL 36 7.409 31.434 27.081 259 HG21 VAL 36 HG21 VAL 36 7.063 33.979 27.721 260 HG22 VAL 36 HG22 VAL 36 5.362 33.559 27.526 261 HG23 VAL 36 HG23 VAL 36 6.041 34.924 26.640 262 H ALA 37 H ALA 37 9.608 31.425 25.809 263 HA ALA 37 HA ALA 37 10.376 30.696 23.157 264 HB1 ALA 37 HB1 ALA 37 11.030 28.480 24.256 265 HB2 ALA 37 HB2 ALA 37 10.406 29.151 25.761 266 HB3 ALA 37 HB3 ALA 37 11.764 29.929 24.942 267 H SER 38 H SER 38 7.868 29.230 25.286 268 HA SER 38 HA SER 38 7.062 27.392 23.152 269 HB2 SER 38 HB2 SER 38 5.522 26.514 24.694 270 HB3 SER 38 HB3 SER 38 6.841 27.070 25.724 271 HG SER 38 HG SER 38 4.469 28.518 25.072 272 H LYS 39 H LYS 39 7.043 29.832 22.069 273 HA LYS 39 HA LYS 39 4.379 30.134 21.047 274 HB2 LYS 39 HB2 LYS 39 4.097 31.223 23.301 275 HB3 LYS 39 HB3 LYS 39 5.313 32.409 22.822 276 HG2 LYS 39 HG2 LYS 39 3.944 33.345 21.169 277 HG3 LYS 39 HG3 LYS 39 2.939 31.899 21.044 278 HD2 LYS 39 HD2 LYS 39 2.425 32.461 23.595 279 HD3 LYS 39 HD3 LYS 39 2.854 34.093 23.083 280 HE2 LYS 39 HE2 LYS 39 0.492 33.900 22.761 281 HE3 LYS 39 HE3 LYS 39 1.204 33.761 21.150 282 HZ1 LYS 39 HZ1 LYS 39 1.149 31.218 22.354 283 HZ2 LYS 39 HZ2 LYS 39 0.334 31.741 20.955 284 HZ3 LYS 39 HZ3 LYS 39 -0.402 31.899 22.479 285 H GLY 40 H GLY 40 7.369 31.995 21.724 286 HA2 GLY 40 HA2 GLY 40 8.826 33.088 20.227 287 HA3 GLY 40 HA3 GLY 40 8.094 32.138 18.931 288 H ASN 41 H ASN 41 6.082 34.041 20.995 289 HA ASN 41 HA ASN 41 4.829 35.476 18.895 290 HB2 ASN 41 HB2 ASN 41 4.116 37.057 20.810 291 HB3 ASN 41 HB3 ASN 41 3.645 35.369 20.957 292 HD21 ASN 41 HD21 ASN 41 4.908 37.851 22.736 293 HD22 ASN 41 HD22 ASN 41 5.764 36.948 23.901 294 H LEU 42 H LEU 42 5.419 37.227 17.791 295 HA LEU 42 HA LEU 42 7.132 39.317 18.838 296 HB2 LEU 42 HB2 LEU 42 8.662 37.257 18.264 297 HB3 LEU 42 HB3 LEU 42 8.383 37.738 16.589 298 HG LEU 42 HG LEU 42 9.005 40.131 17.464 299 HD11 LEU 42 HD11 LEU 42 10.756 39.909 19.291 300 HD12 LEU 42 HD12 LEU 42 10.136 38.282 19.574 301 HD13 LEU 42 HD13 LEU 42 9.086 39.684 19.811 302 HD21 LEU 42 HD21 LEU 42 11.563 38.962 17.456 303 HD22 LEU 42 HD22 LEU 42 10.697 39.616 16.065 304 HD23 LEU 42 HD23 LEU 42 10.573 37.896 16.455 305 H ALA 43 H ALA 43 6.387 37.721 15.739 306 HA ALA 43 HA ALA 43 6.269 40.038 14.123 307 HB1 ALA 43 HB1 ALA 43 6.142 37.642 13.319 308 HB2 ALA 43 HB2 ALA 43 4.936 38.695 12.580 309 HB3 ALA 43 HB3 ALA 43 4.467 37.591 13.874 310 H ASP 44 H ASP 44 3.983 38.775 16.453 311 HA ASP 44 HA ASP 44 1.703 40.356 15.558 312 HB2 ASP 44 HB2 ASP 44 0.977 39.715 18.006 313 HB3 ASP 44 HB3 ASP 44 1.124 38.445 16.799 314 H VAL 45 H VAL 45 3.535 40.529 18.613 315 HA VAL 45 HA VAL 45 2.708 43.219 19.187 316 HB VAL 45 HB VAL 45 4.442 43.052 20.997 317 HG11 VAL 45 HG11 VAL 45 3.379 40.622 21.711 318 HG12 VAL 45 HG12 VAL 45 2.227 41.159 20.483 319 HG13 VAL 45 HG13 VAL 45 2.538 42.162 21.898 320 HG21 VAL 45 HG21 VAL 45 6.132 41.746 19.867 321 HG22 VAL 45 HG22 VAL 45 4.993 40.451 19.545 322 HG23 VAL 45 HG23 VAL 45 5.522 40.764 21.194 323 H ALA 46 H ALA 46 5.407 41.883 17.417 324 HA ALA 46 HA ALA 46 6.183 44.667 16.692 325 HB1 ALA 46 HB1 ALA 46 8.444 44.465 17.304 326 HB2 ALA 46 HB2 ALA 46 8.372 42.711 17.397 327 HB3 ALA 46 HB3 ALA 46 7.620 43.683 18.654 328 HA PRO 47 HA PRO 47 5.646 41.699 13.168 329 HB2 PRO 47 HB2 PRO 47 4.824 44.194 11.813 330 HB3 PRO 47 HB3 PRO 47 3.977 42.643 11.936 331 HG2 PRO 47 HG2 PRO 47 3.203 44.845 13.275 332 HG3 PRO 47 HG3 PRO 47 2.952 43.213 13.904 333 HD2 PRO 47 HD2 PRO 47 4.964 45.262 14.713 334 HD3 PRO 47 HD3 PRO 47 4.169 44.013 15.695 335 H GLY 48 H GLY 48 8.242 42.370 13.729 336 HA2 GLY 48 HA2 GLY 48 9.774 42.197 11.573 337 HA3 GLY 48 HA3 GLY 48 9.234 43.858 11.338 338 H LYS 49 H LYS 49 10.053 42.258 14.387 339 HA LYS 49 HA LYS 49 12.260 44.227 14.651 340 HB2 LYS 49 HB2 LYS 49 10.010 44.182 16.163 341 HB3 LYS 49 HB3 LYS 49 11.079 43.166 17.134 342 HG2 LYS 49 HG2 LYS 49 12.706 44.885 17.336 343 HG3 LYS 49 HG3 LYS 49 11.968 45.849 16.054 344 HD2 LYS 49 HD2 LYS 49 10.016 46.280 17.444 345 HD3 LYS 49 HD3 LYS 49 10.631 45.205 18.698 346 HE2 LYS 49 HE2 LYS 49 12.604 46.674 18.980 347 HE3 LYS 49 HE3 LYS 49 11.944 47.775 17.764 348 HZ1 LYS 49 HZ1 LYS 49 10.504 46.993 20.238 349 HZ2 LYS 49 HZ2 LYS 49 10.051 48.201 19.131 350 HZ3 LYS 49 HZ3 LYS 49 11.436 48.401 20.103 351 H SER 50 H SER 50 14.210 43.502 15.687 352 HA SER 50 HA SER 50 14.355 40.515 15.995 353 HB2 SER 50 HB2 SER 50 16.670 42.255 15.133 354 HB3 SER 50 HB3 SER 50 16.525 40.499 15.027 355 HG SER 50 HG SER 50 14.886 42.394 13.680 356 H ILE 51 H ILE 51 15.134 39.765 17.924 357 HA ILE 51 HA ILE 51 15.570 41.584 20.096 358 HB ILE 51 HB ILE 51 16.751 38.856 20.321 359 HG12 ILE 51 HG12 ILE 51 14.742 38.420 18.941 360 HG13 ILE 51 HG13 ILE 51 14.498 37.831 20.582 361 HG21 ILE 51 HG21 ILE 51 16.714 39.858 22.398 362 HG22 ILE 51 HG22 ILE 51 15.073 39.215 22.430 363 HG23 ILE 51 HG23 ILE 51 15.350 40.898 21.991 364 HD11 ILE 51 HD11 ILE 51 13.553 40.352 20.859 365 HD12 ILE 51 HD12 ILE 51 12.538 38.984 20.407 366 HD13 ILE 51 HD13 ILE 51 13.159 40.068 19.162 367 H GLY 52 H GLY 52 17.482 41.931 21.338 368 HA2 GLY 52 HA2 GLY 52 20.053 41.176 21.083 369 HA3 GLY 52 HA3 GLY 52 19.880 42.160 19.627 370 H GLY 53 H GLY 53 21.564 42.706 21.898 371 HA2 GLY 53 HA2 GLY 53 22.027 45.123 22.393 372 HA3 GLY 53 HA3 GLY 53 20.314 45.288 22.753 373 H ASP 54 H ASP 54 21.796 42.365 23.863 374 HA ASP 54 HA ASP 54 21.269 43.148 26.616 375 HB2 ASP 54 HB2 ASP 54 22.905 40.738 25.908 376 HB3 ASP 54 HB3 ASP 54 21.643 40.919 27.133 377 H ILE 55 H ILE 55 23.270 42.185 28.009 378 HA ILE 55 HA ILE 55 25.719 43.654 27.218 379 HB ILE 55 HB ILE 55 24.374 43.710 29.927 380 HG12 ILE 55 HG12 ILE 55 23.419 45.209 28.073 381 HG13 ILE 55 HG13 ILE 55 23.986 46.062 29.488 382 HG21 ILE 55 HG21 ILE 55 27.058 44.659 28.939 383 HG22 ILE 55 HG22 ILE 55 26.678 43.765 30.411 384 HG23 ILE 55 HG23 ILE 55 26.266 45.473 30.287 385 HD11 ILE 55 HD11 ILE 55 24.765 46.552 26.864 386 HD12 ILE 55 HD12 ILE 55 26.126 45.663 27.551 387 HD13 ILE 55 HD13 ILE 55 25.573 47.149 28.313 388 H PHE 56 H PHE 56 27.602 42.641 27.690 389 HA PHE 56 HA PHE 56 27.672 40.407 29.625 390 HB2 PHE 56 HB2 PHE 56 27.049 39.646 27.178 391 HB3 PHE 56 HB3 PHE 56 28.774 39.873 26.887 392 HD1 PHE 56 HD1 PHE 56 26.411 38.303 29.325 393 HD2 PHE 56 HD2 PHE 56 30.269 38.134 27.432 394 HE1 PHE 56 HE1 PHE 56 26.861 36.131 30.435 395 HE2 PHE 56 HE2 PHE 56 30.719 35.956 28.545 396 HZ PHE 56 HZ PHE 56 29.013 34.958 30.046 397 H SER 57 H SER 57 29.807 39.956 30.354 398 HA SER 57 HA SER 57 31.787 42.086 29.767 399 HB2 SER 57 HB2 SER 57 32.860 40.490 31.764 400 HB3 SER 57 HB3 SER 57 31.923 41.960 32.023 401 HG SER 57 HG SER 57 30.091 40.746 32.295 402 H ASN 58 H ASN 58 31.205 38.784 29.037 403 HA ASN 58 HA ASN 58 32.405 37.276 27.702 404 HB2 ASN 58 HB2 ASN 58 32.820 39.420 26.394 405 HB3 ASN 58 HB3 ASN 58 34.373 39.525 27.221 406 HD21 ASN 58 HD21 ASN 58 35.602 39.142 25.248 407 HD22 ASN 58 HD22 ASN 58 35.627 37.622 24.490 408 H ARG 59 H ARG 59 33.102 37.700 30.602 409 HA ARG 59 HA ARG 59 35.892 37.441 31.087 410 HB2 ARG 59 HB2 ARG 59 33.397 36.606 32.478 411 HB3 ARG 59 HB3 ARG 59 34.859 35.751 32.939 412 HG2 ARG 59 HG2 ARG 59 35.974 37.858 33.493 413 HG3 ARG 59 HG3 ARG 59 34.565 38.775 32.962 414 HD2 ARG 59 HD2 ARG 59 34.857 36.985 35.370 415 HD3 ARG 59 HD3 ARG 59 34.252 38.640 35.307 416 HE ARG 59 HE ARG 59 32.658 36.273 35.102 417 HH11 ARG 59 HH11 ARG 59 33.059 39.329 33.634 418 HH12 ARG 59 HH12 ARG 59 31.559 39.277 32.746 419 HH21 ARG 59 HH21 ARG 59 30.746 36.132 33.915 420 HH22 ARG 59 HH22 ARG 59 30.303 37.434 32.870 421 H GLU 60 H GLU 60 33.483 35.168 29.903 422 HA GLU 60 HA GLU 60 35.021 32.767 30.187 423 HB2 GLU 60 HB2 GLU 60 32.788 33.553 28.290 424 HB3 GLU 60 HB3 GLU 60 33.469 31.924 28.359 425 HG2 GLU 60 HG2 GLU 60 31.462 32.049 29.773 426 HG3 GLU 60 HG3 GLU 60 32.889 31.803 30.775 427 H GLY 61 H GLY 61 35.549 35.493 28.289 428 HA2 GLY 61 HA2 GLY 61 37.076 35.926 26.559 429 HA3 GLY 61 HA3 GLY 61 37.865 34.422 27.029 430 H LYS 62 H LYS 62 34.583 34.922 25.733 431 HA LYS 62 HA LYS 62 35.137 32.845 23.693 432 HB2 LYS 62 HB2 LYS 62 32.867 33.559 25.187 433 HB3 LYS 62 HB3 LYS 62 32.506 34.091 23.545 434 HG2 LYS 62 HG2 LYS 62 33.748 31.418 23.695 435 HG3 LYS 62 HG3 LYS 62 32.167 31.521 24.466 436 HD2 LYS 62 HD2 LYS 62 31.404 31.150 22.338 437 HD3 LYS 62 HD3 LYS 62 31.642 32.890 22.181 438 HE2 LYS 62 HE2 LYS 62 34.141 31.510 21.715 439 HE3 LYS 62 HE3 LYS 62 32.885 30.852 20.665 440 HZ1 LYS 62 HZ1 LYS 62 33.717 32.651 19.482 441 HZ2 LYS 62 HZ2 LYS 62 33.874 33.643 20.871 442 HZ3 LYS 62 HZ3 LYS 62 32.328 33.298 20.215 443 H LEU 63 H LEU 63 35.121 36.229 24.007 444 HA LEU 63 HA LEU 63 35.220 36.569 21.030 445 HB2 LEU 63 HB2 LEU 63 33.881 38.482 22.974 446 HB3 LEU 63 HB3 LEU 63 33.915 38.623 21.222 447 HG LEU 63 HG LEU 63 32.684 36.243 22.625 448 HD11 LEU 63 HD11 LEU 63 31.640 38.518 23.226 449 HD12 LEU 63 HD12 LEU 63 30.565 37.284 22.576 450 HD13 LEU 63 HD13 LEU 63 31.134 38.592 21.541 451 HD21 LEU 63 HD21 LEU 63 33.290 36.899 19.925 452 HD22 LEU 63 HD22 LEU 63 31.535 36.978 20.098 453 HD23 LEU 63 HD23 LEU 63 32.397 35.503 20.523 454 HA PRO 64 HA PRO 64 38.946 38.927 21.547 455 HB2 PRO 64 HB2 PRO 64 37.484 41.412 20.714 456 HB3 PRO 64 HB3 PRO 64 39.042 40.779 20.147 457 HG2 PRO 64 HG2 PRO 64 36.877 40.498 18.666 458 HG3 PRO 64 HG3 PRO 64 38.055 39.176 18.804 459 HD2 PRO 64 HD2 PRO 64 35.351 39.413 20.053 460 HD3 PRO 64 HD3 PRO 64 36.202 37.960 19.490 461 H GLY 65 H GLY 65 39.968 39.983 23.244 462 HA2 GLY 65 HA2 GLY 65 38.261 41.538 25.146 463 HA3 GLY 65 HA3 GLY 65 39.329 40.268 25.729 464 H LYS 66 H LYS 66 40.157 42.133 26.993 465 HA LYS 66 HA LYS 66 42.717 43.033 26.204 466 HB2 LYS 66 HB2 LYS 66 42.322 45.412 25.659 467 HB3 LYS 66 HB3 LYS 66 41.395 44.440 24.534 468 HG2 LYS 66 HG2 LYS 66 39.351 44.828 25.741 469 HG3 LYS 66 HG3 LYS 66 40.217 45.559 27.086 470 HD2 LYS 66 HD2 LYS 66 41.018 46.995 24.787 471 HD3 LYS 66 HD3 LYS 66 39.271 46.810 24.659 472 HE2 LYS 66 HE2 LYS 66 40.553 47.690 27.248 473 HE3 LYS 66 HE3 LYS 66 40.184 48.856 25.977 474 HZ1 LYS 66 HZ1 LYS 66 38.153 48.903 26.898 475 HZ2 LYS 66 HZ2 LYS 66 38.398 47.454 27.775 476 HZ3 LYS 66 HZ3 LYS 66 37.909 47.403 26.150 477 H SER 67 H SER 67 42.588 45.613 27.602 478 HA SER 67 HA SER 67 42.354 44.647 30.359 479 HB2 SER 67 HB2 SER 67 43.138 46.822 30.995 480 HB3 SER 67 HB3 SER 67 44.008 46.417 29.517 481 HG SER 67 HG SER 67 41.552 47.855 29.550 482 H GLY 68 H GLY 68 40.072 44.049 30.398 483 HA2 GLY 68 HA2 GLY 68 37.869 44.589 31.154 484 HA3 GLY 68 HA3 GLY 68 38.287 46.302 31.043 485 H ARG 69 H ARG 69 36.848 43.603 29.344 486 HA ARG 69 HA ARG 69 36.365 45.424 27.012 487 HB2 ARG 69 HB2 ARG 69 37.843 43.546 26.390 488 HB3 ARG 69 HB3 ARG 69 36.642 42.401 26.981 489 HG2 ARG 69 HG2 ARG 69 36.126 42.435 24.711 490 HG3 ARG 69 HG3 ARG 69 35.039 43.688 25.302 491 HD2 ARG 69 HD2 ARG 69 36.192 44.556 23.351 492 HD3 ARG 69 HD3 ARG 69 36.821 45.386 24.770 493 HE ARG 69 HE ARG 69 38.425 43.084 24.322 494 HH11 ARG 69 HH11 ARG 69 37.585 46.031 22.762 495 HH12 ARG 69 HH12 ARG 69 39.106 46.122 21.915 496 HH21 ARG 69 HH21 ARG 69 40.373 43.209 23.244 497 HH22 ARG 69 HH22 ARG 69 40.642 44.538 22.159 498 H THR 70 H THR 70 34.298 45.615 26.288 499 HA THR 70 HA THR 70 32.145 44.269 27.902 500 HB THR 70 HB THR 70 30.744 46.150 27.283 501 HG1 THR 70 HG1 THR 70 32.911 46.729 25.523 502 HG21 THR 70 HG21 THR 70 33.471 47.366 27.786 503 HG22 THR 70 HG22 THR 70 32.557 46.538 29.043 504 HG23 THR 70 HG23 THR 70 31.899 47.991 28.285 505 H TRP 71 H TRP 71 30.803 42.812 26.779 506 HA TRP 71 HA TRP 71 30.919 42.943 23.778 507 HB2 TRP 71 HB2 TRP 71 31.347 40.611 25.606 508 HB3 TRP 71 HB3 TRP 71 30.472 40.318 24.100 509 HD1 TRP 71 HD1 TRP 71 33.934 40.790 25.408 510 HE1 TRP 71 HE1 TRP 71 35.611 41.003 23.433 511 HE3 TRP 71 HE3 TRP 71 30.641 41.292 21.557 512 HZ2 TRP 71 HZ2 TRP 71 35.514 41.383 20.582 513 HZ3 TRP 71 HZ3 TRP 71 31.434 41.576 19.226 514 HH2 TRP 71 HH2 TRP 71 33.865 41.618 18.730 515 H ARG 72 H ARG 72 28.960 42.665 22.674 516 HA ARG 72 HA ARG 72 26.523 41.915 24.215 517 HB2 ARG 72 HB2 ARG 72 26.797 44.445 22.594 518 HB3 ARG 72 HB3 ARG 72 25.293 43.857 23.282 519 HG2 ARG 72 HG2 ARG 72 25.872 45.228 25.006 520 HG3 ARG 72 HG3 ARG 72 26.876 43.857 25.488 521 HD2 ARG 72 HD2 ARG 72 28.471 45.539 25.464 522 HD3 ARG 72 HD3 ARG 72 28.609 44.960 23.800 523 HE ARG 72 HE ARG 72 26.607 46.946 23.775 524 HH11 ARG 72 HH11 ARG 72 29.909 46.633 24.637 525 HH12 ARG 72 HH12 ARG 72 30.296 48.271 24.276 526 HH21 ARG 72 HH21 ARG 72 27.100 49.105 23.294 527 HH22 ARG 72 HH22 ARG 72 28.734 49.650 23.461 528 H GLU 73 H GLU 73 24.850 41.061 22.878 529 HA GLU 73 HA GLU 73 25.771 40.553 20.107 530 HB2 GLU 73 HB2 GLU 73 24.622 38.417 20.213 531 HB3 GLU 73 HB3 GLU 73 25.664 38.589 21.622 532 HG2 GLU 73 HG2 GLU 73 23.799 38.059 22.812 533 HG3 GLU 73 HG3 GLU 73 23.328 39.735 22.526 534 H ALA 74 H ALA 74 23.861 39.831 18.611 535 HA ALA 74 HA ALA 74 21.306 41.165 19.045 536 HB1 ALA 74 HB1 ALA 74 23.284 42.813 18.061 537 HB2 ALA 74 HB2 ALA 74 21.552 43.073 17.851 538 HB3 ALA 74 HB3 ALA 74 22.483 42.266 16.587 539 H ASP 75 H ASP 75 19.675 40.296 17.741 540 HA ASP 75 HA ASP 75 20.246 37.860 16.297 541 HB2 ASP 75 HB2 ASP 75 17.871 39.371 17.053 542 HB3 ASP 75 HB3 ASP 75 17.730 38.770 15.409 543 H ILE 76 H ILE 76 19.986 37.444 14.001 544 HA ILE 76 HA ILE 76 20.104 39.862 12.264 545 HB ILE 76 HB ILE 76 22.113 37.592 12.326 546 HG12 ILE 76 HG12 ILE 76 22.481 39.632 13.775 547 HG13 ILE 76 HG13 ILE 76 23.741 39.358 12.576 548 HG21 ILE 76 HG21 ILE 76 23.053 38.947 10.290 549 HG22 ILE 76 HG22 ILE 76 21.398 39.507 10.117 550 HG23 ILE 76 HG23 ILE 76 21.761 37.786 10.016 551 HD11 ILE 76 HD11 ILE 76 23.282 41.282 11.488 552 HD12 ILE 76 HD12 ILE 76 22.375 41.733 12.931 553 HD13 ILE 76 HD13 ILE 76 21.540 41.007 11.555 554 H ASN 77 H ASN 77 19.438 39.465 10.094 555 HA ASN 77 HA ASN 77 18.054 38.529 8.470 556 HB2 ASN 77 HB2 ASN 77 19.253 35.979 9.586 557 HB3 ASN 77 HB3 ASN 77 18.388 36.104 8.054 558 HD21 ASN 77 HD21 ASN 77 21.017 35.238 7.987 559 HD22 ASN 77 HD22 ASN 77 22.013 36.451 7.331 560 H TYR 78 H TYR 78 16.450 39.271 10.468 561 HA TYR 78 HA TYR 78 14.644 36.924 10.883 562 HB2 TYR 78 HB2 TYR 78 15.368 37.621 13.075 563 HB3 TYR 78 HB3 TYR 78 15.085 39.318 12.689 564 HD1 TYR 78 HD1 TYR 78 13.342 36.022 13.082 565 HD2 TYR 78 HD2 TYR 78 12.920 40.305 13.036 566 HE1 TYR 78 HE1 TYR 78 10.989 35.803 13.870 567 HE2 TYR 78 HE2 TYR 78 10.574 40.080 13.820 568 HH TYR 78 HH TYR 78 9.146 38.530 14.945 569 H THR 79 H THR 79 12.376 37.396 10.721 570 HA THR 79 HA THR 79 11.701 40.004 9.420 571 HB THR 79 HB THR 79 10.301 38.865 7.791 572 HG1 THR 79 HG1 THR 79 10.445 36.476 7.823 573 HG21 THR 79 HG21 THR 79 12.800 37.200 7.767 574 HG22 THR 79 HG22 THR 79 12.915 38.947 7.559 575 HG23 THR 79 HG23 THR 79 11.971 37.980 6.421 576 H SER 80 H SER 80 9.803 37.120 9.982 577 HA SER 80 HA SER 80 8.371 38.299 12.289 578 HB2 SER 80 HB2 SER 80 6.728 39.167 10.975 579 HB3 SER 80 HB3 SER 80 7.279 38.289 9.556 580 HG SER 80 HG SER 80 6.338 36.380 10.605 581 H GLY 81 H GLY 81 8.711 36.507 13.595 582 HA2 GLY 81 HA2 GLY 81 7.131 34.308 13.726 583 HA3 GLY 81 HA3 GLY 81 8.298 33.773 12.512 584 H PHE 82 H PHE 82 10.285 33.028 13.222 585 HA PHE 82 HA PHE 82 10.956 33.553 16.094 586 HB2 PHE 82 HB2 PHE 82 10.129 31.153 15.457 587 HB3 PHE 82 HB3 PHE 82 11.724 30.979 14.728 588 HD1 PHE 82 HD1 PHE 82 10.000 31.900 17.913 589 HD2 PHE 82 HD2 PHE 82 13.622 30.530 16.056 590 HE1 PHE 82 HE1 PHE 82 10.995 31.495 20.150 591 HE2 PHE 82 HE2 PHE 82 14.618 30.133 18.290 592 HZ PHE 82 HZ PHE 82 13.306 30.614 20.338 593 H ARG 83 H ARG 83 13.440 32.636 16.294 594 HA ARG 83 HA ARG 83 14.967 34.433 14.550 595 HB2 ARG 83 HB2 ARG 83 16.377 32.589 16.414 596 HB3 ARG 83 HB3 ARG 83 16.615 34.311 16.150 597 HG2 ARG 83 HG2 ARG 83 14.220 34.486 17.277 598 HG3 ARG 83 HG3 ARG 83 14.670 32.921 17.954 599 HD2 ARG 83 HD2 ARG 83 16.141 35.549 18.249 600 HD3 ARG 83 HD3 ARG 83 15.405 34.583 19.527 601 HE ARG 83 HE ARG 83 17.316 32.895 18.362 602 HH11 ARG 83 HH11 ARG 83 17.246 36.002 19.809 603 HH12 ARG 83 HH12 ARG 83 18.884 35.942 20.341 604 HH21 ARG 83 HH21 ARG 83 19.473 32.816 19.062 605 HH22 ARG 83 HH22 ARG 83 20.136 34.139 19.987 606 H ASN 84 H ASN 84 17.373 32.745 14.711 607 HA ASN 84 HA ASN 84 16.915 30.277 13.259 608 HB2 ASN 84 HB2 ASN 84 18.027 31.038 11.145 609 HB3 ASN 84 HB3 ASN 84 16.490 31.856 11.426 610 HD21 ASN 84 HD21 ASN 84 17.973 33.345 9.801 611 HD22 ASN 84 HD22 ASN 84 18.759 34.614 10.611 612 H SER 85 H SER 85 19.711 31.062 11.928 613 HA SER 85 HA SER 85 21.272 30.510 14.423 614 HB2 SER 85 HB2 SER 85 22.736 29.125 13.179 615 HB3 SER 85 HB3 SER 85 21.122 28.698 12.607 616 HG SER 85 HG SER 85 23.228 29.804 11.264 617 H ASP 86 H ASP 86 20.709 32.771 11.987 618 HA ASP 86 HA ASP 86 23.375 33.873 11.676 619 HB2 ASP 86 HB2 ASP 86 20.580 34.838 11.060 620 HB3 ASP 86 HB3 ASP 86 21.975 35.884 10.826 621 H ARG 87 H ARG 87 24.400 34.706 13.502 622 HA ARG 87 HA ARG 87 22.826 36.732 15.054 623 HB2 ARG 87 HB2 ARG 87 24.535 34.497 16.205 624 HB3 ARG 87 HB3 ARG 87 23.899 35.842 17.157 625 HG2 ARG 87 HG2 ARG 87 22.023 34.333 15.429 626 HG3 ARG 87 HG3 ARG 87 22.532 33.552 16.922 627 HD2 ARG 87 HD2 ARG 87 21.496 35.117 18.268 628 HD3 ARG 87 HD3 ARG 87 21.708 36.405 17.096 629 HE ARG 87 HE ARG 87 19.306 35.835 17.253 630 HH11 ARG 87 HH11 ARG 87 20.940 33.282 15.657 631 HH12 ARG 87 HH12 ARG 87 19.985 33.393 14.221 632 HH21 ARG 87 HH21 ARG 87 17.970 35.890 15.471 633 HH22 ARG 87 HH22 ARG 87 18.287 34.804 14.138 634 H ILE 88 H ILE 88 23.961 38.615 15.539 635 HA ILE 88 HA ILE 88 26.807 38.724 14.629 636 HB ILE 88 HB ILE 88 25.098 40.252 13.536 637 HG12 ILE 88 HG12 ILE 88 27.359 41.614 15.033 638 HG13 ILE 88 HG13 ILE 88 27.544 40.716 13.525 639 HG21 ILE 88 HG21 ILE 88 25.292 41.993 15.952 640 HG22 ILE 88 HG22 ILE 88 24.137 40.661 15.989 641 HG23 ILE 88 HG23 ILE 88 24.015 41.897 14.741 642 HD11 ILE 88 HD11 ILE 88 27.022 43.414 13.687 643 HD12 ILE 88 HD12 ILE 88 25.409 42.742 13.438 644 HD13 ILE 88 HD13 ILE 88 26.692 42.408 12.275 645 H LEU 89 H LEU 89 28.405 39.669 15.908 646 HA LEU 89 HA LEU 89 27.617 40.240 18.743 647 HB2 LEU 89 HB2 LEU 89 29.551 38.325 17.620 648 HB3 LEU 89 HB3 LEU 89 30.260 39.369 18.849 649 HG LEU 89 HG LEU 89 29.296 37.231 19.773 650 HD11 LEU 89 HD11 LEU 89 27.540 39.399 20.822 651 HD12 LEU 89 HD12 LEU 89 29.277 39.691 20.857 652 HD13 LEU 89 HD13 LEU 89 28.600 38.294 21.694 653 HD21 LEU 89 HD21 LEU 89 27.351 37.265 18.104 654 HD22 LEU 89 HD22 LEU 89 26.606 38.455 19.174 655 HD23 LEU 89 HD23 LEU 89 26.959 36.835 19.771 656 H TYR 90 H TYR 90 28.277 42.199 19.483 657 HA TYR 90 HA TYR 90 30.535 43.595 18.022 658 HB2 TYR 90 HB2 TYR 90 29.301 45.627 17.904 659 HB3 TYR 90 HB3 TYR 90 28.250 44.362 17.270 660 HD1 TYR 90 HD1 TYR 90 26.556 43.283 18.883 661 HD2 TYR 90 HD2 TYR 90 28.593 46.975 19.706 662 HE1 TYR 90 HE1 TYR 90 24.812 43.879 20.539 663 HE2 TYR 90 HE2 TYR 90 26.840 47.564 21.353 664 HH TYR 90 HH TYR 90 24.141 45.367 22.056 665 H SER 91 H SER 91 31.906 44.776 19.358 666 HA SER 91 HA SER 91 31.444 44.416 22.294 667 HB2 SER 91 HB2 SER 91 33.902 44.728 22.452 668 HB3 SER 91 HB3 SER 91 33.450 43.396 21.392 669 HG SER 91 HG SER 91 35.002 45.349 20.735 670 H SER 92 H SER 92 32.895 46.092 23.572 671 HA SER 92 HA SER 92 31.677 48.650 23.572 672 HB2 SER 92 HB2 SER 92 34.314 49.056 24.466 673 HB3 SER 92 HB3 SER 92 32.929 48.657 25.474 674 HG SER 92 HG SER 92 34.868 46.930 24.295 675 H ASP 93 H ASP 93 34.780 47.662 22.353 676 HA ASP 93 HA ASP 93 35.486 50.121 21.076 677 HB2 ASP 93 HB2 ASP 93 37.001 48.251 19.830 678 HB3 ASP 93 HB3 ASP 93 37.334 48.805 21.472 679 H TRP 94 H TRP 94 32.998 48.170 20.322 680 HA TRP 94 HA TRP 94 31.590 48.037 18.503 681 HB2 TRP 94 HB2 TRP 94 33.536 49.944 17.188 682 HB3 TRP 94 HB3 TRP 94 31.941 49.515 16.579 683 HD1 TRP 94 HD1 TRP 94 33.569 52.074 18.568 684 HE1 TRP 94 HE1 TRP 94 31.862 53.391 19.975 685 HE3 TRP 94 HE3 TRP 94 29.516 48.966 18.225 686 HZ2 TRP 94 HZ2 TRP 94 29.175 53.186 20.825 687 HZ3 TRP 94 HZ3 TRP 94 27.387 49.568 19.356 688 HH2 TRP 94 HH2 TRP 94 27.216 51.674 20.655 689 H LEU 95 H LEU 95 34.282 46.408 18.756 690 HA LEU 95 HA LEU 95 34.872 45.665 16.005 691 HB2 LEU 95 HB2 LEU 95 35.374 44.378 18.697 692 HB3 LEU 95 HB3 LEU 95 35.790 43.547 17.198 693 HG LEU 95 HG LEU 95 36.799 46.253 18.096 694 HD11 LEU 95 HD11 LEU 95 37.949 43.485 18.022 695 HD12 LEU 95 HD12 LEU 95 38.090 44.724 19.268 696 HD13 LEU 95 HD13 LEU 95 39.021 44.865 17.776 697 HD21 LEU 95 HD21 LEU 95 38.322 45.667 15.958 698 HD22 LEU 95 HD22 LEU 95 36.811 46.564 15.813 699 HD23 LEU 95 HD23 LEU 95 36.845 44.834 15.469 700 H ILE 96 H ILE 96 33.594 44.385 14.737 701 HA ILE 96 HA ILE 96 31.372 42.961 16.099 702 HB ILE 96 HB ILE 96 31.424 43.968 13.247 703 HG12 ILE 96 HG12 ILE 96 29.474 45.290 14.849 704 HG13 ILE 96 HG13 ILE 96 30.988 45.328 15.762 705 HG21 ILE 96 HG21 ILE 96 29.973 42.000 13.730 706 HG22 ILE 96 HG22 ILE 96 29.041 43.430 13.308 707 HG23 ILE 96 HG23 ILE 96 29.175 42.934 14.989 708 HD11 ILE 96 HD11 ILE 96 30.813 46.103 12.840 709 HD12 ILE 96 HD12 ILE 96 32.163 46.352 13.939 710 HD13 ILE 96 HD13 ILE 96 30.673 47.266 14.158 711 H TYR 97 H TYR 97 31.067 40.889 15.812 712 HA TYR 97 HA TYR 97 32.697 39.420 13.767 713 HB2 TYR 97 HB2 TYR 97 32.238 38.798 16.688 714 HB3 TYR 97 HB3 TYR 97 32.670 37.532 15.540 715 HD1 TYR 97 HD1 TYR 97 33.729 41.021 16.415 716 HD2 TYR 97 HD2 TYR 97 34.964 37.056 15.316 717 HE1 TYR 97 HE1 TYR 97 36.093 41.710 16.590 718 HE2 TYR 97 HE2 TYR 97 37.338 37.755 15.506 719 HH TYR 97 HH TYR 97 38.720 39.384 16.137 720 H LYS 98 H LYS 98 31.598 37.334 13.119 721 HA LYS 98 HA LYS 98 28.618 37.519 13.621 722 HB2 LYS 98 HB2 LYS 98 28.168 37.314 11.369 723 HB3 LYS 98 HB3 LYS 98 29.608 38.326 11.334 724 HG2 LYS 98 HG2 LYS 98 31.020 36.365 10.879 725 HG3 LYS 98 HG3 LYS 98 29.625 35.295 10.997 726 HD2 LYS 98 HD2 LYS 98 30.293 37.291 8.832 727 HD3 LYS 98 HD3 LYS 98 29.867 35.590 8.673 728 HE2 LYS 98 HE2 LYS 98 28.038 37.898 9.347 729 HE3 LYS 98 HE3 LYS 98 27.954 36.825 7.955 730 HZ1 LYS 98 HZ1 LYS 98 27.069 35.142 9.175 731 HZ2 LYS 98 HZ2 LYS 98 26.478 36.453 10.069 732 HZ3 LYS 98 HZ3 LYS 98 27.843 35.613 10.613 733 H THR 99 H THR 99 27.499 35.602 13.874 734 HA THR 99 HA THR 99 28.974 33.057 13.405 735 HB THR 99 HB THR 99 29.223 33.061 15.716 736 HG1 THR 99 HG1 THR 99 28.170 31.215 15.420 737 HG21 THR 99 HG21 THR 99 27.484 33.916 17.294 738 HG22 THR 99 HG22 THR 99 26.538 34.449 15.902 739 HG23 THR 99 HG23 THR 99 28.125 35.154 16.216 740 H THR 100 H THR 100 27.748 31.630 12.342 741 HA THR 100 HA THR 100 24.821 32.199 11.887 742 HB THR 100 HB THR 100 25.340 30.821 9.726 743 HG1 THR 100 HG1 THR 100 27.643 30.691 10.849 744 HG21 THR 100 HG21 THR 100 26.759 33.327 9.335 745 HG22 THR 100 HG22 THR 100 25.318 33.565 10.323 746 HG23 THR 100 HG23 THR 100 25.178 32.838 8.724 747 H ASP 101 H ASP 101 26.663 30.247 13.694 748 HA ASP 101 HA ASP 101 24.976 27.834 13.061 749 HB2 ASP 101 HB2 ASP 101 26.972 26.901 14.672 750 HB3 ASP 101 HB3 ASP 101 27.058 26.910 12.910 751 H ALA 102 H ALA 102 24.057 30.081 14.649 752 HA ALA 102 HA ALA 102 22.949 30.465 16.664 753 HB1 ALA 102 HB1 ALA 102 23.282 27.552 17.339 754 HB2 ALA 102 HB2 ALA 102 22.222 28.042 16.017 755 HB3 ALA 102 HB3 ALA 102 21.914 28.619 17.654 756 H TYR 103 H TYR 103 25.151 31.496 17.176 757 HA TYR 103 HA TYR 103 26.773 31.990 18.784 758 HB2 TYR 103 HB2 TYR 103 25.228 30.029 20.511 759 HB3 TYR 103 HB3 TYR 103 26.298 31.304 21.067 760 HD1 TYR 103 HD1 TYR 103 25.447 33.600 19.377 761 HD2 TYR 103 HD2 TYR 103 23.107 30.590 21.354 762 HE1 TYR 103 HE1 TYR 103 23.540 35.180 19.538 763 HE2 TYR 103 HE2 TYR 103 21.201 32.169 21.503 764 HH TYR 103 HH TYR 103 21.559 35.560 20.566 765 H GLN 104 H GLN 104 27.600 30.023 16.944 766 HA GLN 104 HA GLN 104 29.143 28.105 18.699 767 HB2 GLN 104 HB2 GLN 104 28.089 27.758 15.890 768 HB3 GLN 104 HB3 GLN 104 29.278 26.683 16.596 769 HG2 GLN 104 HG2 GLN 104 26.767 27.229 18.135 770 HG3 GLN 104 HG3 GLN 104 26.666 26.160 16.737 771 HE21 GLN 104 HE21 GLN 104 26.325 25.279 19.485 772 HE22 GLN 104 HE22 GLN 104 27.576 24.181 19.813 773 H THR 105 H THR 105 29.575 29.029 15.256 774 HA THR 105 HA THR 105 32.432 29.603 15.904 775 HB THR 105 HB THR 105 32.855 29.435 13.557 776 HG1 THR 105 HG1 THR 105 30.107 29.129 13.000 777 HG21 THR 105 HG21 THR 105 31.434 27.253 13.052 778 HG22 THR 105 HG22 THR 105 30.978 27.423 14.745 779 HG23 THR 105 HG23 THR 105 32.677 27.245 14.299 780 H PHE 106 H PHE 106 33.074 31.658 16.239 781 HA PHE 106 HA PHE 106 31.359 33.920 15.306 782 HB2 PHE 106 HB2 PHE 106 33.623 33.885 17.337 783 HB3 PHE 106 HB3 PHE 106 32.579 35.253 16.970 784 HD1 PHE 106 HD1 PHE 106 32.252 31.614 17.906 785 HD2 PHE 106 HD2 PHE 106 30.771 35.630 18.323 786 HE1 PHE 106 HE1 PHE 106 30.570 30.826 19.561 787 HE2 PHE 106 HE2 PHE 106 29.103 34.845 19.971 788 HZ PHE 106 HZ PHE 106 28.997 32.444 20.589 789 H THR 107 H THR 107 32.223 33.844 13.067 790 HA THR 107 HA THR 107 35.057 34.381 12.666 791 HB THR 107 HB THR 107 32.700 34.351 10.763 792 HG1 THR 107 HG1 THR 107 33.496 32.353 11.458 793 HG21 THR 107 HG21 THR 107 35.605 34.988 10.186 794 HG22 THR 107 HG22 THR 107 34.204 36.023 9.885 795 HG23 THR 107 HG23 THR 107 34.429 34.545 8.949 796 H LYS 108 H LYS 108 36.005 36.295 12.192 797 HA LYS 108 HA LYS 108 34.715 38.681 13.217 798 HB2 LYS 108 HB2 LYS 108 37.162 38.246 13.417 799 HB3 LYS 108 HB3 LYS 108 37.308 38.417 11.673 800 HG2 LYS 108 HG2 LYS 108 36.467 40.724 11.803 801 HG3 LYS 108 HG3 LYS 108 36.252 40.565 13.543 802 HD2 LYS 108 HD2 LYS 108 38.617 40.354 13.904 803 HD3 LYS 108 HD3 LYS 108 38.932 40.180 12.179 804 HE2 LYS 108 HE2 LYS 108 39.509 42.442 12.780 805 HE3 LYS 108 HE3 LYS 108 37.993 42.527 11.881 806 HZ1 LYS 108 HZ1 LYS 108 36.819 43.130 13.712 807 HZ2 LYS 108 HZ2 LYS 108 38.348 43.684 14.243 808 HZ3 LYS 108 HZ3 LYS 108 37.770 42.170 14.763 809 H ILE 109 H ILE 109 34.013 40.474 12.075 810 HA ILE 109 HA ILE 109 34.026 40.279 9.097 811 HB ILE 109 HB ILE 109 31.772 41.304 9.057 812 HG12 ILE 109 HG12 ILE 109 31.870 40.870 12.063 813 HG13 ILE 109 HG13 ILE 109 31.867 42.437 11.257 814 HG21 ILE 109 HG21 ILE 109 32.228 38.767 9.128 815 HG22 ILE 109 HG22 ILE 109 30.585 39.303 9.501 816 HG23 ILE 109 HG23 ILE 109 31.681 38.841 10.804 817 HD11 ILE 109 HD11 ILE 109 29.636 42.351 10.824 818 HD12 ILE 109 HD12 ILE 109 29.611 41.155 12.117 819 HD13 ILE 109 HD13 ILE 109 29.676 40.633 10.440 820 H ARG 110 H ARG 110 34.201 42.270 11.980 821 HA ARG 110 HA ARG 110 35.359 44.484 10.346 822 HB2 ARG 110 HB2 ARG 110 33.174 44.818 12.438 823 HB3 ARG 110 HB3 ARG 110 34.073 46.144 11.711 824 HG2 ARG 110 HG2 ARG 110 32.952 44.325 9.714 825 HG3 ARG 110 HG3 ARG 110 31.710 45.050 10.721 826 HD2 ARG 110 HD2 ARG 110 32.806 47.287 10.288 827 HD3 ARG 110 HD3 ARG 110 33.832 46.493 9.099 828 HE ARG 110 HE ARG 110 31.195 47.447 8.620 829 HH11 ARG 110 HH11 ARG 110 32.950 44.472 8.134 830 HH12 ARG 110 HH12 ARG 110 31.854 43.936 6.906 831 HH21 ARG 110 HH21 ARG 110 29.881 46.743 7.034 832 HH22 ARG 110 HH22 ARG 110 30.179 45.202 6.252 Start of MODEL 2 1 H VAL 3 H VAL 3 16.391 49.240 12.619 2 HA VAL 3 HA VAL 3 14.302 48.009 11.866 3 HB VAL 3 HB VAL 3 14.384 49.945 9.565 4 HG11 VAL 3 HG11 VAL 3 13.161 47.912 9.192 5 HG12 VAL 3 HG12 VAL 3 11.960 49.172 9.478 6 HG13 VAL 3 HG13 VAL 3 12.363 48.030 10.761 7 HG21 VAL 3 HG21 VAL 3 13.020 50.338 12.233 8 HG22 VAL 3 HG22 VAL 3 12.306 50.986 10.758 9 HG23 VAL 3 HG23 VAL 3 13.909 51.515 11.266 10 H ILE 4 H ILE 4 16.861 47.335 12.015 11 HA ILE 4 HA ILE 4 17.589 46.517 9.234 12 HB ILE 4 HB ILE 4 19.394 47.829 11.290 13 HG12 ILE 4 HG12 ILE 4 19.415 48.563 8.406 14 HG13 ILE 4 HG13 ILE 4 17.951 48.981 9.294 15 HG21 ILE 4 HG21 ILE 4 21.163 47.351 9.446 16 HG22 ILE 4 HG22 ILE 4 20.049 46.091 8.916 17 HG23 ILE 4 HG23 ILE 4 20.728 46.043 10.543 18 HD11 ILE 4 HD11 ILE 4 19.125 50.357 10.816 19 HD12 ILE 4 HD12 ILE 4 19.870 50.716 9.260 20 HD13 ILE 4 HD13 ILE 4 20.682 49.640 10.397 21 H ASN 5 H ASN 5 18.575 44.450 9.133 22 HA ASN 5 HA ASN 5 19.121 43.023 11.681 23 HB2 ASN 5 HB2 ASN 5 17.641 41.157 11.012 24 HB3 ASN 5 HB3 ASN 5 16.724 42.653 11.186 25 HD21 ASN 5 HD21 ASN 5 15.535 40.774 9.552 26 HD22 ASN 5 HD22 ASN 5 15.690 41.224 7.922 27 H THR 6 H THR 6 20.785 43.943 9.401 28 HA THR 6 HA THR 6 21.652 41.261 8.381 29 HB THR 6 HB THR 6 22.299 42.203 6.326 30 HG1 THR 6 HG1 THR 6 22.310 44.523 6.075 31 HG21 THR 6 HG21 THR 6 20.334 43.320 5.482 32 HG22 THR 6 HG22 THR 6 19.882 43.851 7.103 33 HG23 THR 6 HG23 THR 6 19.810 42.140 6.684 34 H PHE 7 H PHE 7 23.760 40.722 8.555 35 HA PHE 7 HA PHE 7 25.356 41.478 10.630 36 HB2 PHE 7 HB2 PHE 7 26.200 40.545 7.871 37 HB3 PHE 7 HB3 PHE 7 27.324 40.665 9.230 38 HD1 PHE 7 HD1 PHE 7 26.397 39.639 11.502 39 HD2 PHE 7 HD2 PHE 7 25.076 38.510 7.559 40 HE1 PHE 7 HE1 PHE 7 25.498 37.510 12.411 41 HE2 PHE 7 HE2 PHE 7 24.184 36.376 8.470 42 HZ PHE 7 HZ PHE 7 24.384 35.876 10.897 43 H ASP 8 H ASP 8 26.767 42.358 7.503 44 HA ASP 8 HA ASP 8 28.365 44.442 8.416 45 HB2 ASP 8 HB2 ASP 8 27.017 44.206 5.705 46 HB3 ASP 8 HB3 ASP 8 28.364 45.285 6.063 47 H GLY 9 H GLY 9 25.038 44.735 7.182 48 HA2 GLY 9 HA2 GLY 9 24.690 47.499 7.328 49 HA3 GLY 9 HA3 GLY 9 23.401 46.340 7.649 50 H VAL 10 H VAL 10 24.092 45.150 10.001 51 HA VAL 10 HA VAL 10 23.490 47.167 11.964 52 HB VAL 10 HB VAL 10 24.485 44.319 12.205 53 HG11 VAL 10 HG11 VAL 10 25.188 45.323 14.226 54 HG12 VAL 10 HG12 VAL 10 23.605 44.661 14.629 55 HG13 VAL 10 HG13 VAL 10 23.781 46.385 14.297 56 HG21 VAL 10 HG21 VAL 10 21.762 45.604 12.680 57 HG22 VAL 10 HG22 VAL 10 22.134 43.892 12.892 58 HG23 VAL 10 HG23 VAL 10 22.196 44.617 11.285 59 H ALA 11 H ALA 11 26.492 45.415 11.188 60 HA ALA 11 HA ALA 11 28.164 46.498 13.210 61 HB1 ALA 11 HB1 ALA 11 29.812 46.202 11.005 62 HB2 ALA 11 HB2 ALA 11 28.471 45.124 10.643 63 HB3 ALA 11 HB3 ALA 11 29.382 44.923 12.135 64 H ASP 12 H ASP 12 27.882 47.582 9.798 65 HA ASP 12 HA ASP 12 29.432 49.936 9.961 66 HB2 ASP 12 HB2 ASP 12 27.172 48.981 8.268 67 HB3 ASP 12 HB3 ASP 12 27.551 50.703 8.210 68 H TYR 13 H TYR 13 25.927 49.511 10.450 69 HA TYR 13 HA TYR 13 25.214 52.132 11.155 70 HB2 TYR 13 HB2 TYR 13 23.774 49.948 10.957 71 HB3 TYR 13 HB3 TYR 13 24.132 49.781 12.674 72 HD1 TYR 13 HD1 TYR 13 22.464 51.880 10.121 73 HD2 TYR 13 HD2 TYR 13 23.166 51.283 14.321 74 HE1 TYR 13 HE1 TYR 13 20.660 53.493 10.656 75 HE2 TYR 13 HE2 TYR 13 21.353 52.890 14.847 76 HH TYR 13 HH TYR 13 19.035 53.740 13.033 77 H LEU 14 H LEU 14 26.281 49.509 13.262 78 HA LEU 14 HA LEU 14 26.394 51.096 15.625 79 HB2 LEU 14 HB2 LEU 14 27.509 48.437 14.802 80 HB3 LEU 14 HB3 LEU 14 27.967 49.138 16.355 81 HG LEU 14 HG LEU 14 25.107 48.756 15.438 82 HD11 LEU 14 HD11 LEU 14 26.492 46.622 15.845 83 HD12 LEU 14 HD12 LEU 14 25.005 46.785 16.776 84 HD13 LEU 14 HD13 LEU 14 26.556 47.121 17.543 85 HD21 LEU 14 HD21 LEU 14 26.309 50.263 17.554 86 HD22 LEU 14 HD22 LEU 14 25.493 48.879 18.288 87 HD23 LEU 14 HD23 LEU 14 24.589 49.999 17.265 88 H GLN 15 H GLN 15 29.002 50.117 13.343 89 HA GLN 15 HA GLN 15 31.061 51.501 14.758 90 HB2 GLN 15 HB2 GLN 15 30.809 50.728 11.872 91 HB3 GLN 15 HB3 GLN 15 32.274 51.434 12.550 92 HG2 GLN 15 HG2 GLN 15 31.909 49.470 14.345 93 HG3 GLN 15 HG3 GLN 15 31.100 48.725 12.958 94 HE21 GLN 15 HE21 GLN 15 33.673 47.853 14.124 95 HE22 GLN 15 HE22 GLN 15 34.821 48.004 12.883 96 H THR 16 H THR 16 28.580 52.779 12.690 97 HA THR 16 HA THR 16 30.054 55.374 12.443 98 HB THR 16 HB THR 16 27.468 54.593 11.066 99 HG1 THR 16 HG1 THR 16 29.075 53.129 10.457 100 HG21 THR 16 HG21 THR 16 27.864 56.948 11.009 101 HG22 THR 16 HG22 THR 16 28.348 56.313 9.434 102 HG23 THR 16 HG23 THR 16 29.575 56.716 10.638 103 H TYR 17 H TYR 17 26.828 54.137 13.397 104 HA TYR 17 HA TYR 17 26.196 56.777 14.600 105 HB2 TYR 17 HB2 TYR 17 24.482 54.330 14.082 106 HB3 TYR 17 HB3 TYR 17 23.884 55.868 14.706 107 HD1 TYR 17 HD1 TYR 17 24.450 57.993 13.294 108 HD2 TYR 17 HD2 TYR 17 24.570 53.977 11.748 109 HE1 TYR 17 HE1 TYR 17 24.280 58.875 10.979 110 HE2 TYR 17 HE2 TYR 17 24.399 54.870 9.430 111 HH TYR 17 HH TYR 17 25.102 57.821 8.565 112 H HIS 18 H HIS 18 27.168 53.617 15.509 113 HA HIS 18 HA HIS 18 27.544 52.614 17.584 114 HB2 HIS 18 HB2 HIS 18 27.282 55.506 18.424 115 HB3 HIS 18 HB3 HIS 18 27.739 54.217 19.536 116 HD1 HIS 18 HD1 HIS 18 29.050 53.143 16.440 117 HD2 HIS 18 HD2 HIS 18 30.229 56.079 19.183 118 HE1 HIS 18 HE1 HIS 18 31.523 53.576 16.035 119 H LYS 19 H LYS 19 24.705 54.621 17.293 120 HA LYS 19 HA LYS 19 23.332 53.522 19.560 121 HB2 LYS 19 HB2 LYS 19 22.131 55.394 19.089 122 HB3 LYS 19 HB3 LYS 19 22.846 55.501 17.485 123 HG2 LYS 19 HG2 LYS 19 21.202 53.777 16.691 124 HG3 LYS 19 HG3 LYS 19 20.436 53.828 18.277 125 HD2 LYS 19 HD2 LYS 19 19.141 55.403 17.234 126 HD3 LYS 19 HD3 LYS 19 20.458 56.464 17.732 127 HE2 LYS 19 HE2 LYS 19 20.650 57.008 15.541 128 HE3 LYS 19 HE3 LYS 19 21.378 55.417 15.332 129 HZ1 LYS 19 HZ1 LYS 19 19.685 54.907 14.008 130 HZ2 LYS 19 HZ2 LYS 19 18.890 56.373 14.374 131 HZ3 LYS 19 HZ3 LYS 19 18.620 54.998 15.350 132 H LEU 20 H LEU 20 22.714 51.488 19.680 133 HA LEU 20 HA LEU 20 22.785 49.495 17.765 134 HB2 LEU 20 HB2 LEU 20 21.356 49.915 20.292 135 HB3 LEU 20 HB3 LEU 20 20.485 48.840 19.204 136 HG LEU 20 HG LEU 20 23.436 48.427 19.677 137 HD11 LEU 20 HD11 LEU 20 21.154 47.547 21.468 138 HD12 LEU 20 HD12 LEU 20 22.582 48.472 21.927 139 HD13 LEU 20 HD13 LEU 20 22.739 46.775 21.476 140 HD21 LEU 20 HD21 LEU 20 21.151 46.955 18.496 141 HD22 LEU 20 HD22 LEU 20 22.217 45.978 19.504 142 HD23 LEU 20 HD23 LEU 20 22.872 46.852 18.119 143 HA PRO 21 HA PRO 21 20.142 50.711 14.389 144 HB2 PRO 21 HB2 PRO 21 19.281 47.856 14.553 145 HB3 PRO 21 HB3 PRO 21 19.790 48.804 13.144 146 HG2 PRO 21 HG2 PRO 21 21.402 47.027 14.418 147 HG3 PRO 21 HG3 PRO 21 21.997 48.436 13.522 148 HD2 PRO 21 HD2 PRO 21 22.055 47.947 16.410 149 HD3 PRO 21 HD3 PRO 21 22.876 49.223 15.482 150 H ASP 22 H ASP 22 18.148 51.569 14.333 151 HA ASP 22 HA ASP 22 16.402 51.503 16.591 152 HB2 ASP 22 HB2 ASP 22 15.439 52.298 13.861 153 HB3 ASP 22 HB3 ASP 22 15.191 53.107 15.413 154 H ASN 23 H ASN 23 16.287 49.087 16.715 155 HA ASN 23 HA ASN 23 13.718 48.102 16.070 156 HB2 ASN 23 HB2 ASN 23 14.331 46.461 14.249 157 HB3 ASN 23 HB3 ASN 23 14.307 48.143 13.743 158 HD21 ASN 23 HD21 ASN 23 16.496 45.475 14.622 159 HD22 ASN 23 HD22 ASN 23 17.871 46.149 13.889 160 H TYR 24 H TYR 24 16.322 47.871 17.849 161 HA TYR 24 HA TYR 24 16.244 44.893 18.127 162 HB2 TYR 24 HB2 TYR 24 18.383 46.947 18.451 163 HB3 TYR 24 HB3 TYR 24 18.454 45.526 19.491 164 HD1 TYR 24 HD1 TYR 24 18.237 43.226 18.371 165 HD2 TYR 24 HD2 TYR 24 19.115 46.833 16.226 166 HE1 TYR 24 HE1 TYR 24 19.124 41.885 16.484 167 HE2 TYR 24 HE2 TYR 24 20.005 45.491 14.332 168 HH TYR 24 HH TYR 24 19.896 41.916 14.423 169 H ILE 25 H ILE 25 16.533 44.080 20.399 170 HA ILE 25 HA ILE 25 15.799 45.939 22.568 171 HB ILE 25 HB ILE 25 13.872 44.114 23.126 172 HG12 ILE 25 HG12 ILE 25 13.653 44.375 20.122 173 HG13 ILE 25 HG13 ILE 25 14.518 43.018 20.847 174 HG21 ILE 25 HG21 ILE 25 12.744 46.064 23.035 175 HG22 ILE 25 HG22 ILE 25 12.670 45.926 21.277 176 HG23 ILE 25 HG23 ILE 25 14.015 46.777 22.040 177 HD11 ILE 25 HD11 ILE 25 11.817 43.667 21.938 178 HD12 ILE 25 HD12 ILE 25 12.610 42.102 21.747 179 HD13 ILE 25 HD13 ILE 25 11.894 42.902 20.352 180 H THR 26 H THR 26 16.193 45.068 24.632 181 HA THR 26 HA THR 26 18.286 43.040 24.748 182 HB THR 26 HB THR 26 18.113 43.383 27.184 183 HG1 THR 26 HG1 THR 26 15.850 44.980 26.563 184 HG21 THR 26 HG21 THR 26 17.808 46.102 26.944 185 HG22 THR 26 HG22 THR 26 18.176 45.646 25.282 186 HG23 THR 26 HG23 THR 26 19.299 45.238 26.575 187 H LYS 27 H LYS 27 18.113 40.917 25.715 188 HA LYS 27 HA LYS 27 15.851 39.339 25.107 189 HB2 LYS 27 HB2 LYS 27 18.315 39.063 26.632 190 HB3 LYS 27 HB3 LYS 27 17.002 38.197 27.413 191 HG2 LYS 27 HG2 LYS 27 17.210 36.542 25.898 192 HG3 LYS 27 HG3 LYS 27 16.800 37.676 24.613 193 HD2 LYS 27 HD2 LYS 27 19.559 37.867 25.654 194 HD3 LYS 27 HD3 LYS 27 19.199 36.386 24.779 195 HE2 LYS 27 HE2 LYS 27 18.574 37.579 22.803 196 HE3 LYS 27 HE3 LYS 27 18.511 39.114 23.665 197 HZ1 LYS 27 HZ1 LYS 27 20.604 38.449 22.222 198 HZ2 LYS 27 HZ2 LYS 27 21.045 37.635 23.664 199 HZ3 LYS 27 HZ3 LYS 27 20.773 39.324 23.687 200 H SER 28 H SER 28 16.742 40.819 28.238 201 HA SER 28 HA SER 28 14.542 40.128 29.822 202 HB2 SER 28 HB2 SER 28 16.240 41.380 30.875 203 HB3 SER 28 HB3 SER 28 16.191 42.657 29.658 204 HG SER 28 HG SER 28 14.593 43.561 30.706 205 H GLU 29 H GLU 29 14.708 43.228 27.951 206 HA GLU 29 HA GLU 29 12.050 44.074 28.244 207 HB2 GLU 29 HB2 GLU 29 13.927 44.252 25.866 208 HB3 GLU 29 HB3 GLU 29 12.366 45.059 25.905 209 HG2 GLU 29 HG2 GLU 29 13.023 46.487 27.646 210 HG3 GLU 29 HG3 GLU 29 14.373 45.471 28.126 211 H ALA 30 H ALA 30 13.382 42.138 25.498 212 HA ALA 30 HA ALA 30 10.956 41.530 24.210 213 HB1 ALA 30 HB1 ALA 30 13.563 40.842 23.814 214 HB2 ALA 30 HB2 ALA 30 12.227 40.069 22.961 215 HB3 ALA 30 HB3 ALA 30 12.920 39.304 24.391 216 H GLN 31 H GLN 31 12.578 39.627 26.743 217 HA GLN 31 HA GLN 31 10.540 37.635 26.998 218 HB2 GLN 31 HB2 GLN 31 12.604 38.637 28.970 219 HB3 GLN 31 HB3 GLN 31 11.628 37.188 29.210 220 HG2 GLN 31 HG2 GLN 31 12.594 36.115 27.290 221 HG3 GLN 31 HG3 GLN 31 13.367 37.611 26.766 222 HE21 GLN 31 HE21 GLN 31 13.635 34.893 28.961 223 HE22 GLN 31 HE22 GLN 31 15.145 35.317 29.603 224 H ALA 32 H ALA 32 11.126 40.600 28.958 225 HA ALA 32 HA ALA 32 8.824 40.164 30.638 226 HB1 ALA 32 HB1 ALA 32 10.376 41.634 31.583 227 HB2 ALA 32 HB2 ALA 32 9.138 42.747 31.002 228 HB3 ALA 32 HB3 ALA 32 10.615 42.505 30.068 229 H LEU 33 H LEU 33 9.252 41.755 27.524 230 HA LEU 33 HA LEU 33 6.719 43.106 27.490 231 HB2 LEU 33 HB2 LEU 33 8.793 42.352 25.479 232 HB3 LEU 33 HB3 LEU 33 7.185 42.729 24.860 233 HG LEU 33 HG LEU 33 8.434 44.614 26.849 234 HD11 LEU 33 HD11 LEU 33 10.237 44.271 25.242 235 HD12 LEU 33 HD12 LEU 33 9.483 45.832 24.926 236 HD13 LEU 33 HD13 LEU 33 9.116 44.448 23.894 237 HD21 LEU 33 HD21 LEU 33 6.050 44.603 25.584 238 HD22 LEU 33 HD22 LEU 33 7.008 45.441 24.363 239 HD23 LEU 33 HD23 LEU 33 6.892 46.097 25.995 240 H GLY 34 H GLY 34 7.634 39.803 27.139 241 HA2 GLY 34 HA2 GLY 34 5.549 38.315 27.484 242 HA3 GLY 34 HA3 GLY 34 4.916 39.131 26.059 243 H TRP 35 H TRP 35 8.165 38.858 25.472 244 HA TRP 35 HA TRP 35 7.846 36.868 23.450 245 HB2 TRP 35 HB2 TRP 35 9.709 38.502 23.473 246 HB3 TRP 35 HB3 TRP 35 10.385 37.700 24.890 247 HD1 TRP 35 HD1 TRP 35 8.949 36.149 21.649 248 HE1 TRP 35 HE1 TRP 35 10.753 34.605 20.645 249 HE3 TRP 35 HE3 TRP 35 12.754 36.966 24.960 250 HZ2 TRP 35 HZ2 TRP 35 13.462 33.823 21.172 251 HZ3 TRP 35 HZ3 TRP 35 14.934 35.808 24.698 252 HH2 TRP 35 HH2 TRP 35 15.291 34.233 22.806 253 H VAL 36 H VAL 36 7.409 34.742 23.804 254 HA VAL 36 HA VAL 36 8.695 33.420 26.183 255 HB VAL 36 HB VAL 36 5.912 33.106 25.029 256 HG11 VAL 36 HG11 VAL 36 6.776 30.854 25.420 257 HG12 VAL 36 HG12 VAL 36 5.648 31.267 26.707 258 HG13 VAL 36 HG13 VAL 36 7.385 31.330 27.007 259 HG21 VAL 36 HG21 VAL 36 7.099 33.923 27.691 260 HG22 VAL 36 HG22 VAL 36 5.410 33.438 27.538 261 HG23 VAL 36 HG23 VAL 36 6.008 34.845 26.657 262 H ALA 37 H ALA 37 9.574 31.373 25.860 263 HA ALA 37 HA ALA 37 10.485 30.680 23.242 264 HB1 ALA 37 HB1 ALA 37 11.169 28.509 24.358 265 HB2 ALA 37 HB2 ALA 37 10.378 29.093 25.824 266 HB3 ALA 37 HB3 ALA 37 11.759 29.967 25.157 267 H SER 38 H SER 38 7.925 29.188 25.267 268 HA SER 38 HA SER 38 7.147 27.420 23.064 269 HB2 SER 38 HB2 SER 38 5.584 26.492 24.563 270 HB3 SER 38 HB3 SER 38 6.897 27.003 25.626 271 HG SER 38 HG SER 38 4.591 28.554 24.982 272 H LYS 39 H LYS 39 7.141 29.886 22.038 273 HA LYS 39 HA LYS 39 4.466 30.244 21.058 274 HB2 LYS 39 HB2 LYS 39 4.224 31.300 23.327 275 HB3 LYS 39 HB3 LYS 39 5.461 32.470 22.867 276 HG2 LYS 39 HG2 LYS 39 4.106 33.474 21.255 277 HG3 LYS 39 HG3 LYS 39 3.085 32.047 21.077 278 HD2 LYS 39 HD2 LYS 39 2.653 32.600 23.698 279 HD3 LYS 39 HD3 LYS 39 2.947 34.229 23.090 280 HE2 LYS 39 HE2 LYS 39 0.606 33.896 22.854 281 HE3 LYS 39 HE3 LYS 39 1.261 33.658 21.232 282 HZ1 LYS 39 HZ1 LYS 39 1.447 31.198 22.045 283 HZ2 LYS 39 HZ2 LYS 39 -0.034 31.796 21.461 284 HZ3 LYS 39 HZ3 LYS 39 0.236 31.667 23.135 285 H GLY 40 H GLY 40 7.481 32.062 21.727 286 HA2 GLY 40 HA2 GLY 40 8.948 33.140 20.233 287 HA3 GLY 40 HA3 GLY 40 8.201 32.212 18.934 288 H ASN 41 H ASN 41 6.164 34.047 20.980 289 HA ASN 41 HA ASN 41 4.958 35.527 18.890 290 HB2 ASN 41 HB2 ASN 41 4.212 37.082 20.808 291 HB3 ASN 41 HB3 ASN 41 3.742 35.390 20.927 292 HD21 ASN 41 HD21 ASN 41 4.882 37.821 22.818 293 HD22 ASN 41 HD22 ASN 41 5.763 36.907 23.959 294 H LEU 42 H LEU 42 5.538 37.354 17.858 295 HA LEU 42 HA LEU 42 7.211 39.410 19.014 296 HB2 LEU 42 HB2 LEU 42 8.805 37.404 18.356 297 HB3 LEU 42 HB3 LEU 42 8.533 37.977 16.711 298 HG LEU 42 HG LEU 42 9.072 40.325 17.716 299 HD11 LEU 42 HD11 LEU 42 10.806 40.112 19.541 300 HD12 LEU 42 HD12 LEU 42 10.297 38.436 19.750 301 HD13 LEU 42 HD13 LEU 42 9.159 39.754 20.051 302 HD21 LEU 42 HD21 LEU 42 11.646 39.496 17.586 303 HD22 LEU 42 HD22 LEU 42 10.639 39.737 16.167 304 HD23 LEU 42 HD23 LEU 42 10.851 38.120 16.830 305 H ALA 43 H ALA 43 6.573 37.883 15.889 306 HA ALA 43 HA ALA 43 6.391 40.237 14.335 307 HB1 ALA 43 HB1 ALA 43 6.483 37.874 13.502 308 HB2 ALA 43 HB2 ALA 43 5.261 38.859 12.705 309 HB3 ALA 43 HB3 ALA 43 4.790 37.691 13.941 310 H ASP 44 H ASP 44 4.119 38.837 16.579 311 HA ASP 44 HA ASP 44 1.774 40.253 15.573 312 HB2 ASP 44 HB2 ASP 44 1.021 39.602 18.021 313 HB3 ASP 44 HB3 ASP 44 1.239 38.336 16.818 314 H VAL 45 H VAL 45 3.549 40.522 18.644 315 HA VAL 45 HA VAL 45 2.587 43.164 19.257 316 HB VAL 45 HB VAL 45 4.328 43.061 21.067 317 HG11 VAL 45 HG11 VAL 45 2.590 41.970 22.046 318 HG12 VAL 45 HG12 VAL 45 3.435 40.478 21.639 319 HG13 VAL 45 HG13 VAL 45 2.196 41.112 20.556 320 HG21 VAL 45 HG21 VAL 45 6.149 41.918 20.084 321 HG22 VAL 45 HG22 VAL 45 5.121 40.635 19.463 322 HG23 VAL 45 HG23 VAL 45 5.468 40.724 21.186 323 H ALA 46 H ALA 46 5.321 41.922 17.466 324 HA ALA 46 HA ALA 46 5.983 44.712 16.693 325 HB1 ALA 46 HB1 ALA 46 8.301 44.531 17.180 326 HB2 ALA 46 HB2 ALA 46 8.186 42.802 17.497 327 HB3 ALA 46 HB3 ALA 46 7.484 43.956 18.630 328 HA PRO 47 HA PRO 47 5.680 41.714 13.146 329 HB2 PRO 47 HB2 PRO 47 4.774 44.132 11.722 330 HB3 PRO 47 HB3 PRO 47 4.000 42.545 11.869 331 HG2 PRO 47 HG2 PRO 47 3.114 44.777 13.130 332 HG3 PRO 47 HG3 PRO 47 2.847 43.138 13.737 333 HD2 PRO 47 HD2 PRO 47 4.734 45.226 14.716 334 HD3 PRO 47 HD3 PRO 47 3.956 43.894 15.605 335 H GLY 48 H GLY 48 8.205 42.446 13.774 336 HA2 GLY 48 HA2 GLY 48 9.816 42.341 11.668 337 HA3 GLY 48 HA3 GLY 48 9.271 43.999 11.453 338 H LYS 49 H LYS 49 10.127 42.292 14.491 339 HA LYS 49 HA LYS 49 12.266 44.321 14.802 340 HB2 LYS 49 HB2 LYS 49 10.080 44.394 16.284 341 HB3 LYS 49 HB3 LYS 49 10.915 43.131 17.187 342 HG2 LYS 49 HG2 LYS 49 12.603 44.552 17.892 343 HG3 LYS 49 HG3 LYS 49 12.454 45.597 16.480 344 HD2 LYS 49 HD2 LYS 49 10.266 46.418 17.355 345 HD3 LYS 49 HD3 LYS 49 10.509 45.444 18.805 346 HE2 LYS 49 HE2 LYS 49 12.821 46.723 18.902 347 HE3 LYS 49 HE3 LYS 49 11.975 47.904 17.902 348 HZ1 LYS 49 HZ1 LYS 49 11.176 46.933 20.594 349 HZ2 LYS 49 HZ2 LYS 49 10.176 47.888 19.606 350 HZ3 LYS 49 HZ3 LYS 49 11.658 48.504 20.173 351 H SER 50 H SER 50 14.242 43.580 15.737 352 HA SER 50 HA SER 50 14.379 40.594 15.961 353 HB2 SER 50 HB2 SER 50 16.637 42.461 15.202 354 HB3 SER 50 HB3 SER 50 16.639 40.698 15.133 355 HG SER 50 HG SER 50 15.030 42.501 13.630 356 H ILE 51 H ILE 51 15.246 39.732 17.790 357 HA ILE 51 HA ILE 51 15.512 41.369 20.144 358 HB ILE 51 HB ILE 51 16.743 38.645 19.858 359 HG12 ILE 51 HG12 ILE 51 14.600 38.336 18.808 360 HG13 ILE 51 HG13 ILE 51 14.463 37.706 20.445 361 HG21 ILE 51 HG21 ILE 51 17.103 39.509 22.011 362 HG22 ILE 51 HG22 ILE 51 15.658 38.505 22.211 363 HG23 ILE 51 HG23 ILE 51 15.498 40.260 22.079 364 HD11 ILE 51 HD11 ILE 51 13.702 40.292 20.860 365 HD12 ILE 51 HD12 ILE 51 12.568 38.994 20.495 366 HD13 ILE 51 HD13 ILE 51 13.133 40.048 19.209 367 H GLY 52 H GLY 52 17.450 41.856 21.357 368 HA2 GLY 52 HA2 GLY 52 20.053 41.214 21.008 369 HA3 GLY 52 HA3 GLY 52 19.786 42.221 19.583 370 H GLY 53 H GLY 53 21.458 42.618 22.038 371 HA2 GLY 53 HA2 GLY 53 21.993 45.063 22.467 372 HA3 GLY 53 HA3 GLY 53 20.289 45.257 22.862 373 H ASP 54 H ASP 54 21.686 42.295 23.921 374 HA ASP 54 HA ASP 54 21.243 43.027 26.689 375 HB2 ASP 54 HB2 ASP 54 22.929 40.687 25.875 376 HB3 ASP 54 HB3 ASP 54 21.688 40.796 27.134 377 H ILE 55 H ILE 55 23.280 42.071 28.055 378 HA ILE 55 HA ILE 55 25.685 43.636 27.284 379 HB ILE 55 HB ILE 55 24.446 43.500 30.032 380 HG12 ILE 55 HG12 ILE 55 23.610 45.024 27.841 381 HG13 ILE 55 HG13 ILE 55 23.240 45.354 29.508 382 HG21 ILE 55 HG21 ILE 55 26.837 44.982 28.890 383 HG22 ILE 55 HG22 ILE 55 26.860 43.730 30.133 384 HG23 ILE 55 HG23 ILE 55 26.152 45.305 30.481 385 HD11 ILE 55 HD11 ILE 55 24.172 47.337 28.449 386 HD12 ILE 55 HD12 ILE 55 25.585 46.419 27.935 387 HD13 ILE 55 HD13 ILE 55 25.312 46.729 29.650 388 H PHE 56 H PHE 56 27.591 42.601 27.717 389 HA PHE 56 HA PHE 56 27.637 40.353 29.622 390 HB2 PHE 56 HB2 PHE 56 27.011 39.626 27.159 391 HB3 PHE 56 HB3 PHE 56 28.740 39.837 26.885 392 HD1 PHE 56 HD1 PHE 56 26.360 38.257 29.316 393 HD2 PHE 56 HD2 PHE 56 30.192 38.091 27.377 394 HE1 PHE 56 HE1 PHE 56 26.797 36.055 30.375 395 HE2 PHE 56 HE2 PHE 56 30.636 35.889 28.433 396 HZ PHE 56 HZ PHE 56 28.940 34.872 29.932 397 H SER 57 H SER 57 29.744 39.939 30.397 398 HA SER 57 HA SER 57 31.709 42.060 29.784 399 HB2 SER 57 HB2 SER 57 32.850 40.413 31.704 400 HB3 SER 57 HB3 SER 57 31.940 41.886 32.027 401 HG SER 57 HG SER 57 30.169 40.721 32.481 402 H ASN 58 H ASN 58 31.173 38.720 29.111 403 HA ASN 58 HA ASN 58 32.323 37.279 27.673 404 HB2 ASN 58 HB2 ASN 58 32.817 39.444 26.418 405 HB3 ASN 58 HB3 ASN 58 34.370 39.465 27.246 406 HD21 ASN 58 HD21 ASN 58 35.546 39.106 25.209 407 HD22 ASN 58 HD22 ASN 58 35.534 37.590 24.446 408 H ARG 59 H ARG 59 33.028 37.600 30.591 409 HA ARG 59 HA ARG 59 35.812 37.292 31.068 410 HB2 ARG 59 HB2 ARG 59 33.319 36.396 32.437 411 HB3 ARG 59 HB3 ARG 59 34.805 35.563 32.863 412 HG2 ARG 59 HG2 ARG 59 35.883 37.643 33.479 413 HG3 ARG 59 HG3 ARG 59 34.479 38.572 32.948 414 HD2 ARG 59 HD2 ARG 59 34.720 36.697 35.305 415 HD3 ARG 59 HD3 ARG 59 34.174 38.374 35.303 416 HE ARG 59 HE ARG 59 32.488 36.087 35.004 417 HH11 ARG 59 HH11 ARG 59 33.026 39.168 33.655 418 HH12 ARG 59 HH12 ARG 59 31.560 39.193 32.711 419 HH21 ARG 59 HH21 ARG 59 30.604 36.043 33.753 420 HH22 ARG 59 HH22 ARG 59 30.239 37.390 32.734 421 H GLU 60 H GLU 60 33.388 35.067 29.834 422 HA GLU 60 HA GLU 60 34.873 32.643 30.060 423 HB2 GLU 60 HB2 GLU 60 32.705 33.539 28.140 424 HB3 GLU 60 HB3 GLU 60 33.353 31.898 28.155 425 HG2 GLU 60 HG2 GLU 60 31.310 32.013 29.527 426 HG3 GLU 60 HG3 GLU 60 32.707 31.668 30.542 427 H GLY 61 H GLY 61 35.453 35.411 28.202 428 HA2 GLY 61 HA2 GLY 61 37.043 35.876 26.531 429 HA3 GLY 61 HA3 GLY 61 37.816 34.363 26.994 430 H LYS 62 H LYS 62 34.588 34.944 25.587 431 HA LYS 62 HA LYS 62 35.199 32.898 23.521 432 HB2 LYS 62 HB2 LYS 62 32.892 33.582 25.015 433 HB3 LYS 62 HB3 LYS 62 32.529 34.017 23.344 434 HG2 LYS 62 HG2 LYS 62 33.874 31.397 23.674 435 HG3 LYS 62 HG3 LYS 62 32.263 31.495 24.381 436 HD2 LYS 62 HD2 LYS 62 31.659 30.921 22.230 437 HD3 LYS 62 HD3 LYS 62 31.716 32.671 22.032 438 HE2 LYS 62 HE2 LYS 62 34.357 31.532 21.678 439 HE3 LYS 62 HE3 LYS 62 33.196 30.751 20.597 440 HZ1 LYS 62 HZ1 LYS 62 33.810 32.596 19.392 441 HZ2 LYS 62 HZ2 LYS 62 33.973 33.603 20.770 442 HZ3 LYS 62 HZ3 LYS 62 32.422 33.172 20.180 443 H LEU 63 H LEU 63 35.119 36.248 23.892 444 HA LEU 63 HA LEU 63 35.274 36.644 20.935 445 HB2 LEU 63 HB2 LEU 63 33.818 38.507 22.834 446 HB3 LEU 63 HB3 LEU 63 33.906 38.646 21.084 447 HG LEU 63 HG LEU 63 32.665 36.255 22.468 448 HD11 LEU 63 HD11 LEU 63 31.611 38.580 22.937 449 HD12 LEU 63 HD12 LEU 63 30.558 37.289 22.365 450 HD13 LEU 63 HD13 LEU 63 31.124 38.529 21.246 451 HD21 LEU 63 HD21 LEU 63 33.394 36.748 19.805 452 HD22 LEU 63 HD22 LEU 63 31.662 37.056 19.855 453 HD23 LEU 63 HD23 LEU 63 32.295 35.492 20.372 454 HA PRO 64 HA PRO 64 38.942 39.054 21.498 455 HB2 PRO 64 HB2 PRO 64 37.343 41.476 20.708 456 HB3 PRO 64 HB3 PRO 64 38.951 40.962 20.152 457 HG2 PRO 64 HG2 PRO 64 36.812 40.552 18.646 458 HG3 PRO 64 HG3 PRO 64 38.089 39.324 18.756 459 HD2 PRO 64 HD2 PRO 64 35.367 39.296 19.934 460 HD3 PRO 64 HD3 PRO 64 36.387 37.932 19.440 461 H GLY 65 H GLY 65 39.947 40.093 23.204 462 HA2 GLY 65 HA2 GLY 65 38.222 41.562 25.157 463 HA3 GLY 65 HA3 GLY 65 39.346 40.321 25.697 464 H LYS 66 H LYS 66 40.015 42.308 26.973 465 HA LYS 66 HA LYS 66 42.578 43.247 26.204 466 HB2 LYS 66 HB2 LYS 66 42.123 45.638 25.719 467 HB3 LYS 66 HB3 LYS 66 41.295 44.628 24.539 468 HG2 LYS 66 HG2 LYS 66 39.186 44.891 25.654 469 HG3 LYS 66 HG3 LYS 66 39.952 45.638 27.052 470 HD2 LYS 66 HD2 LYS 66 40.706 47.129 24.720 471 HD3 LYS 66 HD3 LYS 66 38.956 46.921 24.706 472 HE2 LYS 66 HE2 LYS 66 40.341 47.755 27.246 473 HE3 LYS 66 HE3 LYS 66 39.984 48.956 26.004 474 HZ1 LYS 66 HZ1 LYS 66 37.958 49.047 26.904 475 HZ2 LYS 66 HZ2 LYS 66 38.207 47.633 27.842 476 HZ3 LYS 66 HZ3 LYS 66 37.677 47.514 26.230 477 H SER 67 H SER 67 42.438 45.793 27.634 478 HA SER 67 HA SER 67 42.248 44.769 30.370 479 HB2 SER 67 HB2 SER 67 43.039 46.931 31.037 480 HB3 SER 67 HB3 SER 67 43.858 46.599 29.508 481 HG SER 67 HG SER 67 41.346 47.900 29.588 482 H GLY 68 H GLY 68 39.979 44.126 30.356 483 HA2 GLY 68 HA2 GLY 68 37.770 44.598 31.132 484 HA3 GLY 68 HA3 GLY 68 38.153 46.322 31.073 485 H ARG 69 H ARG 69 36.775 43.640 29.317 486 HA ARG 69 HA ARG 69 36.255 45.482 27.010 487 HB2 ARG 69 HB2 ARG 69 37.710 43.620 26.336 488 HB3 ARG 69 HB3 ARG 69 36.540 42.461 26.970 489 HG2 ARG 69 HG2 ARG 69 35.937 42.497 24.716 490 HG3 ARG 69 HG3 ARG 69 34.865 43.736 25.356 491 HD2 ARG 69 HD2 ARG 69 35.965 44.578 23.344 492 HD3 ARG 69 HD3 ARG 69 36.551 45.468 24.747 493 HE ARG 69 HE ARG 69 38.241 43.215 24.359 494 HH11 ARG 69 HH11 ARG 69 37.335 46.131 22.806 495 HH12 ARG 69 HH12 ARG 69 38.827 46.241 21.910 496 HH21 ARG 69 HH21 ARG 69 40.183 43.353 23.262 497 HH22 ARG 69 HH22 ARG 69 40.431 44.690 22.180 498 H THR 70 H THR 70 34.167 45.611 26.241 499 HA THR 70 HA THR 70 32.045 44.256 27.884 500 HB THR 70 HB THR 70 30.614 46.107 27.309 501 HG1 THR 70 HG1 THR 70 32.714 46.728 25.475 502 HG21 THR 70 HG21 THR 70 33.342 47.365 27.715 503 HG22 THR 70 HG22 THR 70 32.451 46.564 29.010 504 HG23 THR 70 HG23 THR 70 31.777 47.994 28.236 505 H TRP 71 H TRP 71 30.792 42.717 26.761 506 HA TRP 71 HA TRP 71 30.918 42.875 23.770 507 HB2 TRP 71 HB2 TRP 71 31.305 40.566 25.611 508 HB3 TRP 71 HB3 TRP 71 30.439 40.260 24.100 509 HD1 TRP 71 HD1 TRP 71 33.899 40.786 25.424 510 HE1 TRP 71 HE1 TRP 71 35.575 40.996 23.448 511 HE3 TRP 71 HE3 TRP 71 30.613 41.250 21.573 512 HZ2 TRP 71 HZ2 TRP 71 35.481 41.363 20.613 513 HZ3 TRP 71 HZ3 TRP 71 31.413 41.540 19.245 514 HH2 TRP 71 HH2 TRP 71 33.843 41.594 18.760 515 H ARG 72 H ARG 72 29.013 42.604 22.609 516 HA ARG 72 HA ARG 72 26.489 42.046 24.109 517 HB2 ARG 72 HB2 ARG 72 27.154 44.499 22.481 518 HB3 ARG 72 HB3 ARG 72 25.487 44.003 22.757 519 HG2 ARG 72 HG2 ARG 72 25.616 45.197 24.679 520 HG3 ARG 72 HG3 ARG 72 26.612 43.875 25.291 521 HD2 ARG 72 HD2 ARG 72 27.973 45.766 25.615 522 HD3 ARG 72 HD3 ARG 72 28.574 45.081 24.106 523 HE ARG 72 HE ARG 72 26.512 46.924 23.414 524 HH11 ARG 72 HH11 ARG 72 29.639 46.848 24.850 525 HH12 ARG 72 HH12 ARG 72 29.986 48.496 24.489 526 HH21 ARG 72 HH21 ARG 72 26.970 49.077 22.945 527 HH22 ARG 72 HH22 ARG 72 28.508 49.741 23.390 528 H GLU 73 H GLU 73 24.833 41.107 22.789 529 HA GLU 73 HA GLU 73 25.737 40.453 20.034 530 HB2 GLU 73 HB2 GLU 73 24.599 38.326 20.217 531 HB3 GLU 73 HB3 GLU 73 25.638 38.526 21.626 532 HG2 GLU 73 HG2 GLU 73 23.783 38.064 22.849 533 HG3 GLU 73 HG3 GLU 73 23.280 39.711 22.464 534 H ALA 74 H ALA 74 23.868 39.833 18.532 535 HA ALA 74 HA ALA 74 21.279 41.074 19.096 536 HB1 ALA 74 HB1 ALA 74 23.168 42.779 18.089 537 HB2 ALA 74 HB2 ALA 74 21.436 42.952 17.815 538 HB3 ALA 74 HB3 ALA 74 22.445 42.162 16.601 539 H ASP 75 H ASP 75 19.641 40.292 17.689 540 HA ASP 75 HA ASP 75 20.243 37.807 16.315 541 HB2 ASP 75 HB2 ASP 75 17.867 39.334 17.035 542 HB3 ASP 75 HB3 ASP 75 17.737 38.709 15.394 543 H ILE 76 H ILE 76 20.007 37.392 13.996 544 HA ILE 76 HA ILE 76 20.123 39.828 12.279 545 HB ILE 76 HB ILE 76 22.119 37.557 12.339 546 HG12 ILE 76 HG12 ILE 76 22.443 39.625 13.782 547 HG13 ILE 76 HG13 ILE 76 23.746 39.296 12.642 548 HG21 ILE 76 HG21 ILE 76 23.058 38.824 10.284 549 HG22 ILE 76 HG22 ILE 76 21.444 39.501 10.135 550 HG23 ILE 76 HG23 ILE 76 21.681 37.759 10.028 551 HD11 ILE 76 HD11 ILE 76 23.067 41.704 12.687 552 HD12 ILE 76 HD12 ILE 76 21.466 41.231 12.119 553 HD13 ILE 76 HD13 ILE 76 22.880 40.964 11.101 554 H ASN 77 H ASN 77 19.389 39.493 10.143 555 HA ASN 77 HA ASN 77 18.032 38.555 8.498 556 HB2 ASN 77 HB2 ASN 77 19.256 36.010 9.607 557 HB3 ASN 77 HB3 ASN 77 18.348 36.110 8.099 558 HD21 ASN 77 HD21 ASN 77 20.996 35.276 7.950 559 HD22 ASN 77 HD22 ASN 77 21.949 36.505 7.258 560 H TYR 78 H TYR 78 16.458 39.323 10.475 561 HA TYR 78 HA TYR 78 14.628 37.013 10.906 562 HB2 TYR 78 HB2 TYR 78 15.356 37.653 13.100 563 HB3 TYR 78 HB3 TYR 78 15.135 39.366 12.736 564 HD1 TYR 78 HD1 TYR 78 13.294 36.135 13.134 565 HD2 TYR 78 HD2 TYR 78 12.994 40.422 13.046 566 HE1 TYR 78 HE1 TYR 78 10.941 35.992 13.930 567 HE2 TYR 78 HE2 TYR 78 10.648 40.274 13.832 568 HH TYR 78 HH TYR 78 9.156 38.851 14.884 569 H THR 79 H THR 79 12.350 37.517 10.745 570 HA THR 79 HA THR 79 11.743 40.145 9.446 571 HB THR 79 HB THR 79 10.329 39.080 7.806 572 HG1 THR 79 HG1 THR 79 10.266 36.718 7.833 573 HG21 THR 79 HG21 THR 79 12.744 37.283 7.814 574 HG22 THR 79 HG22 THR 79 12.920 39.017 7.542 575 HG23 THR 79 HG23 THR 79 11.932 38.048 6.447 576 H SER 80 H SER 80 9.709 37.336 10.032 577 HA SER 80 HA SER 80 8.350 38.602 12.333 578 HB2 SER 80 HB2 SER 80 6.709 39.514 11.021 579 HB3 SER 80 HB3 SER 80 7.230 38.609 9.610 580 HG SER 80 HG SER 80 6.241 36.735 10.664 581 H GLY 81 H GLY 81 8.775 36.787 13.610 582 HA2 GLY 81 HA2 GLY 81 7.149 34.613 13.804 583 HA3 GLY 81 HA3 GLY 81 8.257 34.079 12.538 584 H PHE 82 H PHE 82 10.206 33.181 13.188 585 HA PHE 82 HA PHE 82 10.975 33.645 16.061 586 HB2 PHE 82 HB2 PHE 82 10.034 31.315 15.401 587 HB3 PHE 82 HB3 PHE 82 11.586 31.077 14.603 588 HD1 PHE 82 HD1 PHE 82 10.005 31.897 17.882 589 HD2 PHE 82 HD2 PHE 82 13.549 30.567 15.853 590 HE1 PHE 82 HE1 PHE 82 11.050 31.357 20.067 591 HE2 PHE 82 HE2 PHE 82 14.597 30.032 18.039 592 HZ PHE 82 HZ PHE 82 13.347 30.425 20.144 593 H ARG 83 H ARG 83 13.400 32.725 16.286 594 HA ARG 83 HA ARG 83 15.000 34.449 14.543 595 HB2 ARG 83 HB2 ARG 83 16.379 32.624 16.430 596 HB3 ARG 83 HB3 ARG 83 16.578 34.353 16.196 597 HG2 ARG 83 HG2 ARG 83 14.167 34.461 17.297 598 HG3 ARG 83 HG3 ARG 83 14.636 32.889 17.946 599 HD2 ARG 83 HD2 ARG 83 16.070 35.531 18.315 600 HD3 ARG 83 HD3 ARG 83 15.322 34.532 19.564 601 HE ARG 83 HE ARG 83 17.249 32.870 18.415 602 HH11 ARG 83 HH11 ARG 83 17.182 35.977 19.855 603 HH12 ARG 83 HH12 ARG 83 18.816 35.913 20.392 604 HH21 ARG 83 HH21 ARG 83 19.397 32.781 19.122 605 HH22 ARG 83 HH22 ARG 83 20.064 34.100 20.046 606 H ASN 84 H ASN 84 17.384 32.810 14.694 607 HA ASN 84 HA ASN 84 16.942 30.281 13.326 608 HB2 ASN 84 HB2 ASN 84 18.073 30.982 11.195 609 HB3 ASN 84 HB3 ASN 84 16.525 31.798 11.428 610 HD21 ASN 84 HD21 ASN 84 17.979 33.248 9.777 611 HD22 ASN 84 HD22 ASN 84 18.796 34.527 10.533 612 H SER 85 H SER 85 19.733 31.065 11.979 613 HA SER 85 HA SER 85 21.313 30.508 14.466 614 HB2 SER 85 HB2 SER 85 22.785 29.168 13.150 615 HB3 SER 85 HB3 SER 85 21.154 28.714 12.650 616 HG SER 85 HG SER 85 23.168 29.826 11.208 617 H ASP 86 H ASP 86 20.720 32.738 12.026 618 HA ASP 86 HA ASP 86 23.349 33.884 11.675 619 HB2 ASP 86 HB2 ASP 86 20.521 34.736 11.088 620 HB3 ASP 86 HB3 ASP 86 21.841 35.890 10.911 621 H ARG 87 H ARG 87 24.396 34.696 13.482 622 HA ARG 87 HA ARG 87 22.834 36.691 15.075 623 HB2 ARG 87 HB2 ARG 87 24.535 34.425 16.149 624 HB3 ARG 87 HB3 ARG 87 23.963 35.768 17.142 625 HG2 ARG 87 HG2 ARG 87 22.046 34.245 15.445 626 HG3 ARG 87 HG3 ARG 87 22.519 33.568 16.999 627 HD2 ARG 87 HD2 ARG 87 21.558 35.302 18.213 628 HD3 ARG 87 HD3 ARG 87 21.716 36.441 16.888 629 HE ARG 87 HE ARG 87 19.312 35.753 17.297 630 HH11 ARG 87 HH11 ARG 87 20.948 33.254 15.623 631 HH12 ARG 87 HH12 ARG 87 19.951 33.370 14.216 632 HH21 ARG 87 HH21 ARG 87 17.930 35.805 15.532 633 HH22 ARG 87 HH22 ARG 87 18.242 34.733 14.187 634 H ILE 88 H ILE 88 23.954 38.541 15.593 635 HA ILE 88 HA ILE 88 26.796 38.660 14.668 636 HB ILE 88 HB ILE 88 25.125 40.201 13.581 637 HG12 ILE 88 HG12 ILE 88 27.302 41.538 15.220 638 HG13 ILE 88 HG13 ILE 88 27.563 40.721 13.676 639 HG21 ILE 88 HG21 ILE 88 25.218 41.860 16.071 640 HG22 ILE 88 HG22 ILE 88 24.066 40.526 16.011 641 HG23 ILE 88 HG23 ILE 88 23.986 41.809 14.809 642 HD11 ILE 88 HD11 ILE 88 27.050 43.381 13.885 643 HD12 ILE 88 HD12 ILE 88 25.407 42.761 13.711 644 HD13 ILE 88 HD13 ILE 88 26.613 42.420 12.469 645 H LEU 89 H LEU 89 28.359 39.627 15.936 646 HA LEU 89 HA LEU 89 27.616 40.186 18.789 647 HB2 LEU 89 HB2 LEU 89 29.592 38.305 17.647 648 HB3 LEU 89 HB3 LEU 89 30.233 39.351 18.909 649 HG LEU 89 HG LEU 89 29.298 37.224 19.825 650 HD11 LEU 89 HD11 LEU 89 27.421 39.346 20.779 651 HD12 LEU 89 HD12 LEU 89 29.139 39.720 20.845 652 HD13 LEU 89 HD13 LEU 89 28.512 38.316 21.706 653 HD21 LEU 89 HD21 LEU 89 27.441 37.168 18.036 654 HD22 LEU 89 HD22 LEU 89 26.574 38.294 19.082 655 HD23 LEU 89 HD23 LEU 89 26.997 36.693 19.676 656 H TYR 90 H TYR 90 28.225 42.174 19.429 657 HA TYR 90 HA TYR 90 30.471 43.549 17.992 658 HB2 TYR 90 HB2 TYR 90 29.201 45.425 17.556 659 HB3 TYR 90 HB3 TYR 90 27.952 44.192 17.424 660 HD1 TYR 90 HD1 TYR 90 26.297 43.857 19.242 661 HD2 TYR 90 HD2 TYR 90 29.274 46.961 19.409 662 HE1 TYR 90 HE1 TYR 90 25.024 44.993 21.042 663 HE2 TYR 90 HE2 TYR 90 27.995 48.085 21.211 664 HH TYR 90 HH TYR 90 24.789 47.277 21.950 665 H SER 91 H SER 91 31.828 44.737 19.359 666 HA SER 91 HA SER 91 31.307 44.395 22.294 667 HB2 SER 91 HB2 SER 91 33.772 44.761 22.487 668 HB3 SER 91 HB3 SER 91 33.366 43.394 21.449 669 HG SER 91 HG SER 91 34.886 45.348 20.762 670 H SER 92 H SER 92 32.609 46.131 23.603 671 HA SER 92 HA SER 92 31.414 48.680 23.493 672 HB2 SER 92 HB2 SER 92 34.003 49.140 24.459 673 HB3 SER 92 HB3 SER 92 32.606 48.721 25.445 674 HG SER 92 HG SER 92 34.544 46.978 24.262 675 H ASP 93 H ASP 93 34.587 47.720 22.412 676 HA ASP 93 HA ASP 93 35.317 50.147 21.094 677 HB2 ASP 93 HB2 ASP 93 36.884 48.308 19.913 678 HB3 ASP 93 HB3 ASP 93 37.144 48.817 21.585 679 H TRP 94 H TRP 94 32.849 48.160 20.282 680 HA TRP 94 HA TRP 94 31.525 48.023 18.389 681 HB2 TRP 94 HB2 TRP 94 33.537 49.910 17.121 682 HB3 TRP 94 HB3 TRP 94 31.935 49.527 16.497 683 HD1 TRP 94 HD1 TRP 94 33.590 52.082 18.456 684 HE1 TRP 94 HE1 TRP 94 31.924 53.407 19.909 685 HE3 TRP 94 HE3 TRP 94 29.528 49.029 18.155 686 HZ2 TRP 94 HZ2 TRP 94 29.231 53.199 20.825 687 HZ3 TRP 94 HZ3 TRP 94 27.427 49.604 19.325 688 HH2 TRP 94 HH2 TRP 94 27.270 51.686 20.658 689 H LEU 95 H LEU 95 34.251 46.403 18.757 690 HA LEU 95 HA LEU 95 34.899 45.605 16.044 691 HB2 LEU 95 HB2 LEU 95 35.334 44.336 18.763 692 HB3 LEU 95 HB3 LEU 95 35.832 43.539 17.270 693 HG LEU 95 HG LEU 95 36.726 46.280 18.211 694 HD11 LEU 95 HD11 LEU 95 38.244 43.677 17.827 695 HD12 LEU 95 HD12 LEU 95 37.739 44.325 19.384 696 HD13 LEU 95 HD13 LEU 95 38.922 45.200 18.406 697 HD21 LEU 95 HD21 LEU 95 38.348 45.680 16.138 698 HD22 LEU 95 HD22 LEU 95 36.833 46.552 15.919 699 HD23 LEU 95 HD23 LEU 95 36.903 44.817 15.610 700 H ILE 96 H ILE 96 33.663 44.301 14.759 701 HA ILE 96 HA ILE 96 31.425 42.869 16.088 702 HB ILE 96 HB ILE 96 31.482 43.850 13.225 703 HG12 ILE 96 HG12 ILE 96 29.581 45.193 14.899 704 HG13 ILE 96 HG13 ILE 96 31.167 45.304 15.664 705 HG21 ILE 96 HG21 ILE 96 29.962 41.924 13.787 706 HG22 ILE 96 HG22 ILE 96 29.099 43.375 13.287 707 HG23 ILE 96 HG23 ILE 96 29.197 42.950 14.993 708 HD11 ILE 96 HD11 ILE 96 31.018 45.799 12.722 709 HD12 ILE 96 HD12 ILE 96 32.074 46.523 13.930 710 HD13 ILE 96 HD13 ILE 96 30.397 47.049 13.796 711 H TYR 97 H TYR 97 31.136 40.827 15.882 712 HA TYR 97 HA TYR 97 32.691 39.296 13.832 713 HB2 TYR 97 HB2 TYR 97 32.268 38.646 16.757 714 HB3 TYR 97 HB3 TYR 97 32.742 37.419 15.580 715 HD1 TYR 97 HD1 TYR 97 33.685 40.927 16.520 716 HD2 TYR 97 HD2 TYR 97 35.048 37.021 15.339 717 HE1 TYR 97 HE1 TYR 97 36.023 41.710 16.632 718 HE2 TYR 97 HE2 TYR 97 37.399 37.817 15.468 719 HH TYR 97 HH TYR 97 38.730 39.527 16.220 720 H LYS 98 H LYS 98 31.585 37.281 13.153 721 HA LYS 98 HA LYS 98 28.622 37.449 13.707 722 HB2 LYS 98 HB2 LYS 98 28.152 37.302 11.425 723 HB3 LYS 98 HB3 LYS 98 29.606 38.302 11.433 724 HG2 LYS 98 HG2 LYS 98 31.007 36.323 11.016 725 HG3 LYS 98 HG3 LYS 98 29.577 35.292 11.027 726 HD2 LYS 98 HD2 LYS 98 30.353 37.388 9.002 727 HD3 LYS 98 HD3 LYS 98 30.020 35.683 8.736 728 HE2 LYS 98 HE2 LYS 98 28.053 37.893 9.335 729 HE3 LYS 98 HE3 LYS 98 28.084 36.812 7.950 730 HZ1 LYS 98 HZ1 LYS 98 27.232 35.078 9.161 731 HZ2 LYS 98 HZ2 LYS 98 26.465 36.388 9.901 732 HZ3 LYS 98 HZ3 LYS 98 27.807 35.670 10.647 733 H THR 99 H THR 99 27.514 35.543 13.964 734 HA THR 99 HA THR 99 28.964 32.993 13.457 735 HB THR 99 HB THR 99 29.193 32.980 15.782 736 HG1 THR 99 HG1 THR 99 28.119 31.132 15.414 737 HG21 THR 99 HG21 THR 99 27.524 33.836 17.359 738 HG22 THR 99 HG22 THR 99 26.463 34.267 16.018 739 HG23 THR 99 HG23 THR 99 28.013 35.088 16.218 740 H THR 100 H THR 100 27.718 31.573 12.389 741 HA THR 100 HA THR 100 24.803 32.195 11.941 742 HB THR 100 HB THR 100 25.249 30.864 9.759 743 HG1 THR 100 HG1 THR 100 27.511 30.469 10.753 744 HG21 THR 100 HG21 THR 100 26.786 33.330 9.457 745 HG22 THR 100 HG22 THR 100 25.297 33.568 10.372 746 HG23 THR 100 HG23 THR 100 25.235 32.883 8.748 747 H ASP 101 H ASP 101 26.652 30.223 13.697 748 HA ASP 101 HA ASP 101 24.961 27.808 13.059 749 HB2 ASP 101 HB2 ASP 101 26.974 26.894 14.673 750 HB3 ASP 101 HB3 ASP 101 27.044 26.896 12.912 751 H ALA 102 H ALA 102 24.058 30.060 14.679 752 HA ALA 102 HA ALA 102 22.943 30.445 16.676 753 HB1 ALA 102 HB1 ALA 102 23.198 27.526 17.337 754 HB2 ALA 102 HB2 ALA 102 22.183 28.044 15.991 755 HB3 ALA 102 HB3 ALA 102 21.845 28.622 17.621 756 H TYR 103 H TYR 103 25.147 31.423 17.172 757 HA TYR 103 HA TYR 103 26.754 31.957 18.754 758 HB2 TYR 103 HB2 TYR 103 25.220 30.050 20.543 759 HB3 TYR 103 HB3 TYR 103 26.327 31.314 21.057 760 HD1 TYR 103 HD1 TYR 103 25.505 33.594 19.302 761 HD2 TYR 103 HD2 TYR 103 23.142 30.684 21.400 762 HE1 TYR 103 HE1 TYR 103 23.620 35.207 19.434 763 HE2 TYR 103 HE2 TYR 103 21.267 32.293 21.519 764 HH TYR 103 HH TYR 103 21.653 35.648 20.522 765 H GLN 104 H GLN 104 27.516 29.905 16.945 766 HA GLN 104 HA GLN 104 29.126 28.082 18.743 767 HB2 GLN 104 HB2 GLN 104 28.144 27.655 15.913 768 HB3 GLN 104 HB3 GLN 104 29.313 26.611 16.706 769 HG2 GLN 104 HG2 GLN 104 26.762 27.183 18.160 770 HG3 GLN 104 HG3 GLN 104 26.682 26.095 16.778 771 HE21 GLN 104 HE21 GLN 104 26.154 25.010 19.284 772 HE22 GLN 104 HE22 GLN 104 27.439 24.008 19.757 773 H THR 105 H THR 105 29.575 29.023 15.284 774 HA THR 105 HA THR 105 32.428 29.596 15.945 775 HB THR 105 HB THR 105 32.856 29.486 13.596 776 HG1 THR 105 HG1 THR 105 30.097 29.231 13.036 777 HG21 THR 105 HG21 THR 105 31.346 27.344 13.027 778 HG22 THR 105 HG22 THR 105 31.023 27.438 14.758 779 HG23 THR 105 HG23 THR 105 32.678 27.265 14.180 780 H PHE 106 H PHE 106 33.144 31.640 16.198 781 HA PHE 106 HA PHE 106 31.409 33.890 15.308 782 HB2 PHE 106 HB2 PHE 106 33.673 33.869 17.317 783 HB3 PHE 106 HB3 PHE 106 32.646 35.251 16.939 784 HD1 PHE 106 HD1 PHE 106 32.327 31.639 17.878 785 HD2 PHE 106 HD2 PHE 106 30.810 35.639 18.313 786 HE1 PHE 106 HE1 PHE 106 30.672 30.826 19.535 787 HE2 PHE 106 HE2 PHE 106 29.159 34.830 19.976 788 HZ PHE 106 HZ PHE 106 29.087 32.419 20.588 789 H THR 107 H THR 107 32.209 33.859 13.082 790 HA THR 107 HA THR 107 35.047 34.341 12.637 791 HB THR 107 HB THR 107 32.656 34.407 10.775 792 HG1 THR 107 HG1 THR 107 33.654 32.403 11.548 793 HG21 THR 107 HG21 THR 107 35.566 34.988 10.152 794 HG22 THR 107 HG22 THR 107 34.210 36.106 9.988 795 HG23 THR 107 HG23 THR 107 34.322 34.691 8.941 796 H LYS 108 H LYS 108 35.997 36.275 12.103 797 HA LYS 108 HA LYS 108 34.750 38.664 13.214 798 HB2 LYS 108 HB2 LYS 108 37.205 38.223 13.360 799 HB3 LYS 108 HB3 LYS 108 37.311 38.399 11.610 800 HG2 LYS 108 HG2 LYS 108 36.472 40.711 11.765 801 HG3 LYS 108 HG3 LYS 108 36.308 40.547 13.511 802 HD2 LYS 108 HD2 LYS 108 38.671 40.415 13.821 803 HD3 LYS 108 HD3 LYS 108 38.967 40.152 12.103 804 HE2 LYS 108 HE2 LYS 108 39.518 42.453 12.557 805 HE3 LYS 108 HE3 LYS 108 37.973 42.471 11.704 806 HZ1 LYS 108 HZ1 LYS 108 36.850 43.165 13.536 807 HZ2 LYS 108 HZ2 LYS 108 38.392 43.730 14.018 808 HZ3 LYS 108 HZ3 LYS 108 37.816 42.238 14.600 809 H ILE 109 H ILE 109 34.108 40.534 12.042 810 HA ILE 109 HA ILE 109 34.008 40.251 9.070 811 HB ILE 109 HB ILE 109 31.807 41.469 9.121 812 HG12 ILE 109 HG12 ILE 109 31.741 40.729 12.056 813 HG13 ILE 109 HG13 ILE 109 32.190 42.342 11.496 814 HG21 ILE 109 HG21 ILE 109 32.157 38.879 9.074 815 HG22 ILE 109 HG22 ILE 109 30.541 39.511 9.394 816 HG23 ILE 109 HG23 ILE 109 31.544 38.933 10.728 817 HD11 ILE 109 HD11 ILE 109 30.021 42.887 11.277 818 HD12 ILE 109 HD12 ILE 109 29.565 41.282 11.848 819 HD13 ILE 109 HD13 ILE 109 29.802 41.568 10.127 820 H ARG 110 H ARG 110 34.160 42.370 11.901 821 HA ARG 110 HA ARG 110 35.573 44.372 10.216 822 HB2 ARG 110 HB2 ARG 110 33.277 45.088 12.074 823 HB3 ARG 110 HB3 ARG 110 34.311 46.248 11.240 824 HG2 ARG 110 HG2 ARG 110 33.355 44.399 9.293 825 HG3 ARG 110 HG3 ARG 110 31.969 44.908 10.247 826 HD2 ARG 110 HD2 ARG 110 32.826 47.312 9.906 827 HD3 ARG 110 HD3 ARG 110 33.877 46.645 8.656 828 HE ARG 110 HE ARG 110 31.143 47.280 8.282 829 HH11 ARG 110 HH11 ARG 110 33.298 44.640 7.675 830 HH12 ARG 110 HH12 ARG 110 32.153 43.810 6.674 831 HH21 ARG 110 HH21 ARG 110 29.709 46.193 7.033 832 HH22 ARG 110 HH22 ARG 110 30.159 44.674 6.292 Start of MODEL 3 1 H VAL 3 H VAL 3 16.432 49.223 12.643 2 HA VAL 3 HA VAL 3 14.321 48.057 11.849 3 HB VAL 3 HB VAL 3 14.501 49.923 9.511 4 HG11 VAL 3 HG11 VAL 3 13.062 48.032 9.221 5 HG12 VAL 3 HG12 VAL 3 11.998 49.402 9.544 6 HG13 VAL 3 HG13 VAL 3 12.350 48.239 10.824 7 HG21 VAL 3 HG21 VAL 3 13.199 50.528 12.166 8 HG22 VAL 3 HG22 VAL 3 12.595 51.226 10.664 9 HG23 VAL 3 HG23 VAL 3 14.243 51.566 11.193 10 H ILE 4 H ILE 4 16.940 47.412 12.018 11 HA ILE 4 HA ILE 4 17.632 46.555 9.229 12 HB ILE 4 HB ILE 4 19.481 47.810 11.298 13 HG12 ILE 4 HG12 ILE 4 19.459 48.604 8.431 14 HG13 ILE 4 HG13 ILE 4 18.015 49.024 9.350 15 HG21 ILE 4 HG21 ILE 4 21.162 47.355 9.340 16 HG22 ILE 4 HG22 ILE 4 20.018 46.092 8.893 17 HG23 ILE 4 HG23 ILE 4 20.794 46.059 10.476 18 HD11 ILE 4 HD11 ILE 4 19.208 50.378 10.849 19 HD12 ILE 4 HD12 ILE 4 20.006 50.707 9.307 20 HD13 ILE 4 HD13 ILE 4 20.749 49.602 10.466 21 H ASN 5 H ASN 5 18.620 44.487 9.130 22 HA ASN 5 HA ASN 5 19.078 43.039 11.676 23 HB2 ASN 5 HB2 ASN 5 17.590 41.199 10.975 24 HB3 ASN 5 HB3 ASN 5 16.686 42.710 11.110 25 HD21 ASN 5 HD21 ASN 5 15.515 40.841 9.460 26 HD22 ASN 5 HD22 ASN 5 15.740 41.260 7.829 27 H THR 6 H THR 6 20.749 43.955 9.366 28 HA THR 6 HA THR 6 21.604 41.265 8.361 29 HB THR 6 HB THR 6 22.360 42.284 6.342 30 HG1 THR 6 HG1 THR 6 22.027 44.703 6.269 31 HG21 THR 6 HG21 THR 6 20.348 42.997 5.417 32 HG22 THR 6 HG22 THR 6 19.911 43.938 6.843 33 HG23 THR 6 HG23 THR 6 19.779 42.182 6.873 34 H PHE 7 H PHE 7 23.751 40.705 8.495 35 HA PHE 7 HA PHE 7 25.359 41.440 10.600 36 HB2 PHE 7 HB2 PHE 7 26.199 40.506 7.843 37 HB3 PHE 7 HB3 PHE 7 27.327 40.630 9.203 38 HD1 PHE 7 HD1 PHE 7 26.402 39.606 11.487 39 HD2 PHE 7 HD2 PHE 7 25.071 38.512 7.543 40 HE1 PHE 7 HE1 PHE 7 25.448 37.498 12.392 41 HE2 PHE 7 HE2 PHE 7 24.129 36.402 8.441 42 HZ PHE 7 HZ PHE 7 24.305 35.895 10.864 43 H ASP 8 H ASP 8 26.722 42.323 7.477 44 HA ASP 8 HA ASP 8 28.337 44.415 8.326 45 HB2 ASP 8 HB2 ASP 8 26.873 44.042 5.704 46 HB3 ASP 8 HB3 ASP 8 28.086 45.298 5.952 47 H GLY 9 H GLY 9 24.981 44.702 7.159 48 HA2 GLY 9 HA2 GLY 9 24.630 47.474 7.337 49 HA3 GLY 9 HA3 GLY 9 23.341 46.308 7.633 50 H VAL 10 H VAL 10 24.059 45.079 9.973 51 HA VAL 10 HA VAL 10 23.419 47.063 11.966 52 HB VAL 10 HB VAL 10 24.396 44.192 12.170 53 HG11 VAL 10 HG11 VAL 10 25.209 45.255 14.179 54 HG12 VAL 10 HG12 VAL 10 23.712 44.434 14.615 55 HG13 VAL 10 HG13 VAL 10 23.719 46.180 14.365 56 HG21 VAL 10 HG21 VAL 10 21.761 45.645 12.517 57 HG22 VAL 10 HG22 VAL 10 22.010 44.011 13.134 58 HG23 VAL 10 HG23 VAL 10 22.131 44.330 11.400 59 H ALA 11 H ALA 11 26.481 45.362 11.199 60 HA ALA 11 HA ALA 11 28.166 46.482 13.188 61 HB1 ALA 11 HB1 ALA 11 29.913 46.153 11.202 62 HB2 ALA 11 HB2 ALA 11 28.549 45.329 10.464 63 HB3 ALA 11 HB3 ALA 11 29.185 44.767 12.006 64 H ASP 12 H ASP 12 27.809 47.580 9.777 65 HA ASP 12 HA ASP 12 29.313 49.963 9.953 66 HB2 ASP 12 HB2 ASP 12 27.041 49.071 8.214 67 HB3 ASP 12 HB3 ASP 12 27.447 50.787 8.223 68 H TYR 13 H TYR 13 25.823 49.513 10.476 69 HA TYR 13 HA TYR 13 25.122 52.105 11.239 70 HB2 TYR 13 HB2 TYR 13 23.708 49.929 11.021 71 HB3 TYR 13 HB3 TYR 13 24.090 49.718 12.727 72 HD1 TYR 13 HD1 TYR 13 22.418 51.887 10.251 73 HD2 TYR 13 HD2 TYR 13 23.140 51.151 14.418 74 HE1 TYR 13 HE1 TYR 13 20.622 53.479 10.843 75 HE2 TYR 13 HE2 TYR 13 21.333 52.738 15.007 76 HH TYR 13 HH TYR 13 19.013 53.629 13.255 77 H LEU 14 H LEU 14 26.284 49.486 13.307 78 HA LEU 14 HA LEU 14 26.385 51.069 15.700 79 HB2 LEU 14 HB2 LEU 14 27.552 48.436 14.834 80 HB3 LEU 14 HB3 LEU 14 27.950 49.118 16.412 81 HG LEU 14 HG LEU 14 25.122 48.610 15.411 82 HD11 LEU 14 HD11 LEU 14 26.694 46.617 15.910 83 HD12 LEU 14 HD12 LEU 14 25.127 46.650 16.720 84 HD13 LEU 14 HD13 LEU 14 26.580 47.129 17.596 85 HD21 LEU 14 HD21 LEU 14 26.132 50.244 17.522 86 HD22 LEU 14 HD22 LEU 14 25.423 48.805 18.264 87 HD23 LEU 14 HD23 LEU 14 24.453 49.818 17.191 88 H GLN 15 H GLN 15 28.931 50.111 13.333 89 HA GLN 15 HA GLN 15 31.029 51.498 14.734 90 HB2 GLN 15 HB2 GLN 15 30.753 50.675 11.847 91 HB3 GLN 15 HB3 GLN 15 32.208 51.445 12.492 92 HG2 GLN 15 HG2 GLN 15 31.938 49.591 14.375 93 HG3 GLN 15 HG3 GLN 15 31.089 48.731 13.084 94 HE21 GLN 15 HE21 GLN 15 33.558 47.746 14.074 95 HE22 GLN 15 HE22 GLN 15 34.736 47.915 12.862 96 H THR 16 H THR 16 28.477 52.791 12.780 97 HA THR 16 HA THR 16 29.972 55.398 12.461 98 HB THR 16 HB THR 16 27.335 54.618 11.178 99 HG1 THR 16 HG1 THR 16 28.871 53.138 10.493 100 HG21 THR 16 HG21 THR 16 27.826 56.989 11.163 101 HG22 THR 16 HG22 THR 16 28.075 56.343 9.542 102 HG23 THR 16 HG23 THR 16 29.461 56.686 10.574 103 H TYR 17 H TYR 17 26.821 54.081 13.530 104 HA TYR 17 HA TYR 17 26.184 56.712 14.780 105 HB2 TYR 17 HB2 TYR 17 24.490 54.273 14.178 106 HB3 TYR 17 HB3 TYR 17 23.881 55.781 14.867 107 HD1 TYR 17 HD1 TYR 17 24.379 57.964 13.519 108 HD2 TYR 17 HD2 TYR 17 24.621 53.997 11.867 109 HE1 TYR 17 HE1 TYR 17 24.158 58.900 11.230 110 HE2 TYR 17 HE2 TYR 17 24.401 54.938 9.581 111 HH TYR 17 HH TYR 17 24.879 57.200 8.474 112 H HIS 18 H HIS 18 27.210 53.544 15.624 113 HA HIS 18 HA HIS 18 27.515 52.458 17.676 114 HB2 HIS 18 HB2 HIS 18 27.237 55.305 18.660 115 HB3 HIS 18 HB3 HIS 18 27.729 53.955 19.678 116 HD1 HIS 18 HD1 HIS 18 29.018 53.156 16.474 117 HD2 HIS 18 HD2 HIS 18 30.205 55.825 19.471 118 HE1 HIS 18 HE1 HIS 18 31.477 53.665 16.074 119 H LYS 19 H LYS 19 24.709 54.586 17.530 120 HA LYS 19 HA LYS 19 23.333 53.346 19.719 121 HB2 LYS 19 HB2 LYS 19 22.144 55.263 19.348 122 HB3 LYS 19 HB3 LYS 19 22.750 55.400 17.701 123 HG2 LYS 19 HG2 LYS 19 21.084 53.555 17.080 124 HG3 LYS 19 HG3 LYS 19 20.381 53.775 18.675 125 HD2 LYS 19 HD2 LYS 19 19.055 55.190 17.378 126 HD3 LYS 19 HD3 LYS 19 20.282 56.317 17.959 127 HE2 LYS 19 HE2 LYS 19 20.800 56.786 15.813 128 HE3 LYS 19 HE3 LYS 19 21.354 55.123 15.621 129 HZ1 LYS 19 HZ1 LYS 19 19.690 54.829 14.199 130 HZ2 LYS 19 HZ2 LYS 19 19.039 56.367 14.553 131 HZ3 LYS 19 HZ3 LYS 19 18.569 55.009 15.487 132 H LEU 20 H LEU 20 22.561 51.359 19.766 133 HA LEU 20 HA LEU 20 22.723 49.450 17.741 134 HB2 LEU 20 HB2 LEU 20 20.957 49.674 20.154 135 HB3 LEU 20 HB3 LEU 20 20.609 48.413 18.978 136 HG LEU 20 HG LEU 20 23.448 48.714 19.865 137 HD11 LEU 20 HD11 LEU 20 21.238 47.480 21.534 138 HD12 LEU 20 HD12 LEU 20 22.256 48.845 21.987 139 HD13 LEU 20 HD13 LEU 20 22.957 47.237 21.823 140 HD21 LEU 20 HD21 LEU 20 22.341 46.988 18.176 141 HD22 LEU 20 HD22 LEU 20 21.889 46.148 19.659 142 HD23 LEU 20 HD23 LEU 20 23.592 46.452 19.300 143 HA PRO 21 HA PRO 21 20.057 50.645 14.419 144 HB2 PRO 21 HB2 PRO 21 19.215 47.782 14.599 145 HB3 PRO 21 HB3 PRO 21 19.688 48.735 13.182 146 HG2 PRO 21 HG2 PRO 21 21.339 46.976 14.423 147 HG3 PRO 21 HG3 PRO 21 21.902 48.388 13.515 148 HD2 PRO 21 HD2 PRO 21 22.037 47.904 16.399 149 HD3 PRO 21 HD3 PRO 21 22.802 49.200 15.452 150 H ASP 22 H ASP 22 18.105 51.547 14.440 151 HA ASP 22 HA ASP 22 16.339 51.417 16.679 152 HB2 ASP 22 HB2 ASP 22 15.391 52.310 13.974 153 HB3 ASP 22 HB3 ASP 22 15.163 53.081 15.547 154 H ASN 23 H ASN 23 16.204 49.012 16.726 155 HA ASN 23 HA ASN 23 13.657 48.030 16.003 156 HB2 ASN 23 HB2 ASN 23 14.331 46.418 14.179 157 HB3 ASN 23 HB3 ASN 23 14.318 48.110 13.693 158 HD21 ASN 23 HD21 ASN 23 16.472 45.414 14.563 159 HD22 ASN 23 HD22 ASN 23 17.876 46.111 13.908 160 H TYR 24 H TYR 24 16.230 47.836 17.833 161 HA TYR 24 HA TYR 24 16.176 44.853 18.128 162 HB2 TYR 24 HB2 TYR 24 18.332 46.902 18.457 163 HB3 TYR 24 HB3 TYR 24 18.380 45.487 19.509 164 HD1 TYR 24 HD1 TYR 24 18.097 43.163 18.356 165 HD2 TYR 24 HD2 TYR 24 19.146 46.778 16.289 166 HE1 TYR 24 HE1 TYR 24 18.969 41.819 16.456 167 HE2 TYR 24 HE2 TYR 24 20.023 45.437 14.390 168 HH TYR 24 HH TYR 24 19.943 41.854 14.476 169 H ILE 25 H ILE 25 16.419 44.043 20.380 170 HA ILE 25 HA ILE 25 15.687 45.950 22.519 171 HB ILE 25 HB ILE 25 13.976 43.707 22.959 172 HG12 ILE 25 HG12 ILE 25 13.404 44.992 20.273 173 HG13 ILE 25 HG13 ILE 25 14.239 43.444 20.419 174 HG21 ILE 25 HG21 ILE 25 12.267 45.678 22.416 175 HG22 ILE 25 HG22 ILE 25 13.740 46.650 22.436 176 HG23 ILE 25 HG23 ILE 25 13.278 45.717 23.860 177 HD11 ILE 25 HD11 ILE 25 11.403 44.100 20.874 178 HD12 ILE 25 HD12 ILE 25 12.127 43.071 22.106 179 HD13 ILE 25 HD13 ILE 25 12.146 42.567 20.417 180 H THR 26 H THR 26 16.129 45.122 24.647 181 HA THR 26 HA THR 26 18.254 43.093 24.734 182 HB THR 26 HB THR 26 18.115 43.400 27.183 183 HG1 THR 26 HG1 THR 26 15.864 45.012 26.539 184 HG21 THR 26 HG21 THR 26 17.923 46.131 26.971 185 HG22 THR 26 HG22 THR 26 18.246 45.674 25.300 186 HG23 THR 26 HG23 THR 26 19.373 45.206 26.575 187 H LYS 27 H LYS 27 18.082 40.972 25.660 188 HA LYS 27 HA LYS 27 15.821 39.405 25.094 189 HB2 LYS 27 HB2 LYS 27 18.279 39.126 26.639 190 HB3 LYS 27 HB3 LYS 27 16.953 38.253 27.396 191 HG2 LYS 27 HG2 LYS 27 17.160 36.611 25.872 192 HG3 LYS 27 HG3 LYS 27 16.800 37.755 24.581 193 HD2 LYS 27 HD2 LYS 27 19.520 37.984 25.642 194 HD3 LYS 27 HD3 LYS 27 19.196 36.424 24.905 195 HE2 LYS 27 HE2 LYS 27 18.668 37.381 22.803 196 HE3 LYS 27 HE3 LYS 27 18.457 38.992 23.490 197 HZ1 LYS 27 HZ1 LYS 27 20.682 38.353 22.263 198 HZ2 LYS 27 HZ2 LYS 27 21.052 37.631 23.771 199 HZ3 LYS 27 HZ3 LYS 27 20.730 39.311 23.691 200 H SER 28 H SER 28 16.737 40.812 28.235 201 HA SER 28 HA SER 28 14.552 40.120 29.831 202 HB2 SER 28 HB2 SER 28 16.307 41.392 30.826 203 HB3 SER 28 HB3 SER 28 16.117 42.705 29.664 204 HG SER 28 HG SER 28 14.486 43.458 30.784 205 H GLU 29 H GLU 29 14.716 43.241 28.045 206 HA GLU 29 HA GLU 29 12.078 44.098 28.378 207 HB2 GLU 29 HB2 GLU 29 13.936 44.333 25.992 208 HB3 GLU 29 HB3 GLU 29 12.402 45.188 26.097 209 HG2 GLU 29 HG2 GLU 29 13.128 46.512 27.893 210 HG3 GLU 29 HG3 GLU 29 14.457 45.436 28.319 211 H ALA 30 H ALA 30 13.330 42.226 25.536 212 HA ALA 30 HA ALA 30 10.849 41.722 24.275 213 HB1 ALA 30 HB1 ALA 30 13.442 40.153 24.373 214 HB2 ALA 30 HB2 ALA 30 12.791 41.122 23.053 215 HB3 ALA 30 HB3 ALA 30 12.058 39.569 23.447 216 H GLN 31 H GLN 31 12.544 39.712 26.700 217 HA GLN 31 HA GLN 31 10.546 37.669 26.884 218 HB2 GLN 31 HB2 GLN 31 12.633 38.640 28.855 219 HB3 GLN 31 HB3 GLN 31 11.662 37.183 29.094 220 HG2 GLN 31 HG2 GLN 31 12.574 36.153 27.104 221 HG3 GLN 31 HG3 GLN 31 13.376 37.660 26.635 222 HE21 GLN 31 HE21 GLN 31 13.572 34.878 28.785 223 HE22 GLN 31 HE22 GLN 31 15.116 35.234 29.390 224 H ALA 32 H ALA 32 11.130 40.567 28.941 225 HA ALA 32 HA ALA 32 8.816 40.066 30.601 226 HB1 ALA 32 HB1 ALA 32 10.308 41.489 31.629 227 HB2 ALA 32 HB2 ALA 32 9.188 42.678 30.965 228 HB3 ALA 32 HB3 ALA 32 10.701 42.319 30.126 229 H LEU 33 H LEU 33 9.257 41.779 27.558 230 HA LEU 33 HA LEU 33 6.745 43.161 27.573 231 HB2 LEU 33 HB2 LEU 33 8.749 42.396 25.489 232 HB3 LEU 33 HB3 LEU 33 7.149 42.899 24.947 233 HG LEU 33 HG LEU 33 8.467 44.608 27.007 234 HD11 LEU 33 HD11 LEU 33 10.319 44.998 25.783 235 HD12 LEU 33 HD12 LEU 33 9.287 45.632 24.504 236 HD13 LEU 33 HD13 LEU 33 9.752 43.930 24.500 237 HD21 LEU 33 HD21 LEU 33 6.175 44.965 25.930 238 HD22 LEU 33 HD22 LEU 33 7.040 45.334 24.437 239 HD23 LEU 33 HD23 LEU 33 7.275 46.342 25.864 240 H GLY 34 H GLY 34 7.595 39.861 27.104 241 HA2 GLY 34 HA2 GLY 34 5.438 38.437 27.394 242 HA3 GLY 34 HA3 GLY 34 4.875 39.307 25.971 243 H TRP 35 H TRP 35 8.098 38.952 25.395 244 HA TRP 35 HA TRP 35 7.741 36.965 23.366 245 HB2 TRP 35 HB2 TRP 35 9.608 38.579 23.329 246 HB3 TRP 35 HB3 TRP 35 10.297 37.821 24.766 247 HD1 TRP 35 HD1 TRP 35 8.843 36.194 21.576 248 HE1 TRP 35 HE1 TRP 35 10.642 34.630 20.608 249 HE3 TRP 35 HE3 TRP 35 12.628 37.069 24.856 250 HZ2 TRP 35 HZ2 TRP 35 13.327 33.839 21.163 251 HZ3 TRP 35 HZ3 TRP 35 14.794 35.891 24.641 252 HH2 TRP 35 HH2 TRP 35 15.147 34.272 22.792 253 H VAL 36 H VAL 36 7.246 34.852 23.775 254 HA VAL 36 HA VAL 36 8.569 33.527 26.147 255 HB VAL 36 HB VAL 36 5.776 33.252 25.017 256 HG11 VAL 36 HG11 VAL 36 6.540 30.976 25.335 257 HG12 VAL 36 HG12 VAL 36 5.522 31.395 26.712 258 HG13 VAL 36 HG13 VAL 36 7.278 31.392 26.884 259 HG21 VAL 36 HG21 VAL 36 6.966 33.880 27.732 260 HG22 VAL 36 HG22 VAL 36 5.247 33.577 27.473 261 HG23 VAL 36 HG23 VAL 36 6.026 34.964 26.706 262 H ALA 37 H ALA 37 9.443 31.505 25.841 263 HA ALA 37 HA ALA 37 10.354 30.738 23.251 264 HB1 ALA 37 HB1 ALA 37 11.039 28.612 24.425 265 HB2 ALA 37 HB2 ALA 37 10.198 29.201 25.860 266 HB3 ALA 37 HB3 ALA 37 11.587 30.085 25.226 267 H SER 38 H SER 38 7.760 29.328 25.291 268 HA SER 38 HA SER 38 7.002 27.456 23.166 269 HB2 SER 38 HB2 SER 38 5.379 26.641 24.693 270 HB3 SER 38 HB3 SER 38 6.720 27.146 25.721 271 HG SER 38 HG SER 38 4.432 28.710 25.057 272 H LYS 39 H LYS 39 7.023 29.895 22.048 273 HA LYS 39 HA LYS 39 4.371 30.210 21.007 274 HB2 LYS 39 HB2 LYS 39 4.075 31.299 23.248 275 HB3 LYS 39 HB3 LYS 39 5.322 32.466 22.797 276 HG2 LYS 39 HG2 LYS 39 4.010 33.395 21.082 277 HG3 LYS 39 HG3 LYS 39 2.950 31.990 21.004 278 HD2 LYS 39 HD2 LYS 39 2.635 32.822 23.621 279 HD3 LYS 39 HD3 LYS 39 2.800 34.349 22.753 280 HE2 LYS 39 HE2 LYS 39 0.483 33.896 22.653 281 HE3 LYS 39 HE3 LYS 39 1.082 33.354 21.083 282 HZ1 LYS 39 HZ1 LYS 39 0.835 31.544 23.422 283 HZ2 LYS 39 HZ2 LYS 39 1.086 31.117 21.800 284 HZ3 LYS 39 HZ3 LYS 39 -0.413 31.750 22.292 285 H GLY 40 H GLY 40 7.327 32.092 21.715 286 HA2 GLY 40 HA2 GLY 40 8.823 33.150 20.239 287 HA3 GLY 40 HA3 GLY 40 8.109 32.203 18.932 288 H ASN 41 H ASN 41 6.054 34.094 20.956 289 HA ASN 41 HA ASN 41 4.826 35.525 18.846 290 HB2 ASN 41 HB2 ASN 41 4.108 37.108 20.760 291 HB3 ASN 41 HB3 ASN 41 3.635 35.418 20.893 292 HD21 ASN 41 HD21 ASN 41 4.947 37.897 22.692 293 HD22 ASN 41 HD22 ASN 41 5.764 36.962 23.863 294 H LEU 42 H LEU 42 5.447 37.293 17.725 295 HA LEU 42 HA LEU 42 7.150 39.365 18.837 296 HB2 LEU 42 HB2 LEU 42 8.656 37.284 18.224 297 HB3 LEU 42 HB3 LEU 42 8.430 37.851 16.568 298 HG LEU 42 HG LEU 42 9.078 40.185 17.568 299 HD11 LEU 42 HD11 LEU 42 10.782 39.849 19.417 300 HD12 LEU 42 HD12 LEU 42 10.139 38.221 19.620 301 HD13 LEU 42 HD13 LEU 42 9.104 39.625 19.902 302 HD21 LEU 42 HD21 LEU 42 11.608 39.062 17.535 303 HD22 LEU 42 HD22 LEU 42 10.719 39.613 16.119 304 HD23 LEU 42 HD23 LEU 42 10.662 37.917 16.588 305 H ALA 43 H ALA 43 6.541 37.853 15.675 306 HA ALA 43 HA ALA 43 6.360 40.235 14.149 307 HB1 ALA 43 HB1 ALA 43 6.466 37.889 13.231 308 HB2 ALA 43 HB2 ALA 43 5.223 38.880 12.473 309 HB3 ALA 43 HB3 ALA 43 4.776 37.677 13.683 310 H ASP 44 H ASP 44 4.110 38.783 16.363 311 HA ASP 44 HA ASP 44 1.746 40.191 15.396 312 HB2 ASP 44 HB2 ASP 44 0.964 39.460 17.809 313 HB3 ASP 44 HB3 ASP 44 1.255 38.219 16.587 314 H VAL 45 H VAL 45 3.509 40.445 18.474 315 HA VAL 45 HA VAL 45 2.498 43.074 19.067 316 HB VAL 45 HB VAL 45 4.203 42.990 20.929 317 HG11 VAL 45 HG11 VAL 45 3.304 40.596 21.739 318 HG12 VAL 45 HG12 VAL 45 2.229 40.806 20.356 319 HG13 VAL 45 HG13 VAL 45 2.234 41.996 21.657 320 HG21 VAL 45 HG21 VAL 45 6.028 41.787 19.936 321 HG22 VAL 45 HG22 VAL 45 4.983 40.453 19.459 322 HG23 VAL 45 HG23 VAL 45 5.355 40.716 21.161 323 H ALA 46 H ALA 46 5.265 41.877 17.320 324 HA ALA 46 HA ALA 46 5.963 44.672 16.587 325 HB1 ALA 46 HB1 ALA 46 8.268 44.437 17.138 326 HB2 ALA 46 HB2 ALA 46 8.110 42.703 17.412 327 HB3 ALA 46 HB3 ALA 46 7.392 43.847 18.549 328 HA PRO 47 HA PRO 47 5.658 41.682 13.010 329 HB2 PRO 47 HB2 PRO 47 4.856 44.142 11.595 330 HB3 PRO 47 HB3 PRO 47 4.042 42.571 11.686 331 HG2 PRO 47 HG2 PRO 47 3.166 44.790 12.964 332 HG3 PRO 47 HG3 PRO 47 2.861 43.148 13.544 333 HD2 PRO 47 HD2 PRO 47 4.756 45.194 14.583 334 HD3 PRO 47 HD3 PRO 47 3.941 43.867 15.450 335 H GLY 48 H GLY 48 8.208 42.465 13.741 336 HA2 GLY 48 HA2 GLY 48 9.836 42.286 11.632 337 HA3 GLY 48 HA3 GLY 48 9.317 43.952 11.399 338 H LYS 49 H LYS 49 10.092 42.255 14.451 339 HA LYS 49 HA LYS 49 12.285 44.245 14.810 340 HB2 LYS 49 HB2 LYS 49 10.067 44.357 16.255 341 HB3 LYS 49 HB3 LYS 49 10.867 43.091 17.188 342 HG2 LYS 49 HG2 LYS 49 12.469 44.521 17.991 343 HG3 LYS 49 HG3 LYS 49 12.556 45.426 16.482 344 HD2 LYS 49 HD2 LYS 49 10.336 46.461 17.028 345 HD3 LYS 49 HD3 LYS 49 10.398 45.665 18.601 346 HE2 LYS 49 HE2 LYS 49 12.772 46.830 18.752 347 HE3 LYS 49 HE3 LYS 49 12.080 47.914 17.543 348 HZ1 LYS 49 HZ1 LYS 49 10.810 47.263 20.147 349 HZ2 LYS 49 HZ2 LYS 49 10.244 48.388 19.003 350 HZ3 LYS 49 HZ3 LYS 49 11.700 48.673 19.837 351 H SER 50 H SER 50 14.224 43.503 15.721 352 HA SER 50 HA SER 50 14.389 40.513 15.967 353 HB2 SER 50 HB2 SER 50 16.654 42.373 15.195 354 HB3 SER 50 HB3 SER 50 16.630 40.614 15.099 355 HG SER 50 HG SER 50 15.055 42.465 13.615 356 H ILE 51 H ILE 51 15.143 39.720 17.867 357 HA ILE 51 HA ILE 51 15.478 41.428 20.138 358 HB ILE 51 HB ILE 51 16.667 38.684 20.081 359 HG12 ILE 51 HG12 ILE 51 14.531 38.483 18.826 360 HG13 ILE 51 HG13 ILE 51 14.439 37.675 20.389 361 HG21 ILE 51 HG21 ILE 51 16.827 39.531 22.215 362 HG22 ILE 51 HG22 ILE 51 15.223 38.808 22.326 363 HG23 ILE 51 HG23 ILE 51 15.394 40.539 22.040 364 HD11 ILE 51 HD11 ILE 51 13.618 40.279 20.961 365 HD12 ILE 51 HD12 ILE 51 12.556 38.891 20.744 366 HD13 ILE 51 HD13 ILE 51 12.899 39.950 19.385 367 H GLY 52 H GLY 52 17.394 41.933 21.347 368 HA2 GLY 52 HA2 GLY 52 20.012 41.244 21.066 369 HA3 GLY 52 HA3 GLY 52 19.787 42.239 19.627 370 H GLY 53 H GLY 53 21.495 42.769 21.968 371 HA2 GLY 53 HA2 GLY 53 21.942 45.192 22.482 372 HA3 GLY 53 HA3 GLY 53 20.227 45.349 22.839 373 H ASP 54 H ASP 54 21.728 42.406 23.892 374 HA ASP 54 HA ASP 54 21.207 43.082 26.682 375 HB2 ASP 54 HB2 ASP 54 22.928 40.767 25.867 376 HB3 ASP 54 HB3 ASP 54 21.644 40.836 27.082 377 H ILE 55 H ILE 55 23.259 42.127 28.020 378 HA ILE 55 HA ILE 55 25.686 43.643 27.232 379 HB ILE 55 HB ILE 55 24.323 43.631 29.909 380 HG12 ILE 55 HG12 ILE 55 23.751 45.144 27.728 381 HG13 ILE 55 HG13 ILE 55 23.578 45.749 29.368 382 HG21 ILE 55 HG21 ILE 55 27.012 44.737 29.037 383 HG22 ILE 55 HG22 ILE 55 26.695 43.588 30.338 384 HG23 ILE 55 HG23 ILE 55 26.189 45.268 30.503 385 HD11 ILE 55 HD11 ILE 55 24.920 47.195 27.699 386 HD12 ILE 55 HD12 ILE 55 26.186 45.979 27.875 387 HD13 ILE 55 HD13 ILE 55 25.648 46.903 29.280 388 H PHE 56 H PHE 56 27.597 42.674 27.780 389 HA PHE 56 HA PHE 56 27.653 40.395 29.644 390 HB2 PHE 56 HB2 PHE 56 26.991 39.612 27.215 391 HB3 PHE 56 HB3 PHE 56 28.706 39.855 26.881 392 HD1 PHE 56 HD1 PHE 56 26.444 38.242 29.416 393 HD2 PHE 56 HD2 PHE 56 30.221 38.110 27.352 394 HE1 PHE 56 HE1 PHE 56 26.971 36.074 30.511 395 HE2 PHE 56 HE2 PHE 56 30.746 35.941 28.453 396 HZ PHE 56 HZ PHE 56 29.123 34.930 30.035 397 H SER 57 H SER 57 29.786 39.962 30.382 398 HA SER 57 HA SER 57 31.740 42.080 29.712 399 HB2 SER 57 HB2 SER 57 32.891 40.534 31.692 400 HB3 SER 57 HB3 SER 57 31.943 41.997 31.958 401 HG SER 57 HG SER 57 30.165 40.784 32.367 402 H ASN 58 H ASN 58 31.210 38.745 29.073 403 HA ASN 58 HA ASN 58 32.414 37.268 27.710 404 HB2 ASN 58 HB2 ASN 58 32.802 39.407 26.397 405 HB3 ASN 58 HB3 ASN 58 34.351 39.541 27.219 406 HD21 ASN 58 HD21 ASN 58 35.543 39.208 25.214 407 HD22 ASN 58 HD22 ASN 58 35.627 37.681 24.477 408 H ARG 59 H ARG 59 33.079 37.587 30.599 409 HA ARG 59 HA ARG 59 35.881 37.397 31.096 410 HB2 ARG 59 HB2 ARG 59 33.411 36.424 32.460 411 HB3 ARG 59 HB3 ARG 59 34.921 35.644 32.896 412 HG2 ARG 59 HG2 ARG 59 35.928 37.775 33.494 413 HG3 ARG 59 HG3 ARG 59 34.481 38.638 32.968 414 HD2 ARG 59 HD2 ARG 59 34.777 36.744 35.308 415 HD3 ARG 59 HD3 ARG 59 34.240 38.425 35.344 416 HE ARG 59 HE ARG 59 32.544 36.152 34.993 417 HH11 ARG 59 HH11 ARG 59 33.044 39.299 33.745 418 HH12 ARG 59 HH12 ARG 59 31.597 39.314 32.772 419 HH21 ARG 59 HH21 ARG 59 30.709 36.106 33.659 420 HH22 ARG 59 HH22 ARG 59 30.337 37.485 32.691 421 H GLU 60 H GLU 60 33.529 35.107 29.851 422 HA GLU 60 HA GLU 60 35.083 32.724 30.094 423 HB2 GLU 60 HB2 GLU 60 32.901 33.534 28.147 424 HB3 GLU 60 HB3 GLU 60 33.571 31.905 28.232 425 HG2 GLU 60 HG2 GLU 60 31.495 32.070 29.569 426 HG3 GLU 60 HG3 GLU 60 32.880 31.735 30.602 427 H GLY 61 H GLY 61 35.574 35.491 28.181 428 HA2 GLY 61 HA2 GLY 61 37.167 35.945 26.516 429 HA3 GLY 61 HA3 GLY 61 37.942 34.433 26.979 430 H LYS 62 H LYS 62 34.662 34.883 25.680 431 HA LYS 62 HA LYS 62 35.285 32.879 23.584 432 HB2 LYS 62 HB2 LYS 62 32.972 33.542 25.085 433 HB3 LYS 62 HB3 LYS 62 32.610 33.987 23.419 434 HG2 LYS 62 HG2 LYS 62 33.971 31.393 23.628 435 HG3 LYS 62 HG3 LYS 62 32.432 31.428 24.484 436 HD2 LYS 62 HD2 LYS 62 31.692 30.863 22.357 437 HD3 LYS 62 HD3 LYS 62 31.594 32.620 22.260 438 HE2 LYS 62 HE2 LYS 62 34.265 31.660 21.600 439 HE3 LYS 62 HE3 LYS 62 33.039 30.945 20.550 440 HZ1 LYS 62 HZ1 LYS 62 33.352 32.886 19.456 441 HZ2 LYS 62 HZ2 LYS 62 33.859 33.743 20.850 442 HZ3 LYS 62 HZ3 LYS 62 32.197 33.445 20.568 443 H LEU 63 H LEU 63 35.155 36.256 23.971 444 HA LEU 63 HA LEU 63 35.260 36.649 21.018 445 HB2 LEU 63 HB2 LEU 63 33.803 38.491 22.941 446 HB3 LEU 63 HB3 LEU 63 33.840 38.613 21.184 447 HG LEU 63 HG LEU 63 32.702 36.200 22.635 448 HD11 LEU 63 HD11 LEU 63 31.557 38.611 22.872 449 HD12 LEU 63 HD12 LEU 63 30.620 37.131 22.683 450 HD13 LEU 63 HD13 LEU 63 30.927 38.163 21.287 451 HD21 LEU 63 HD21 LEU 63 33.549 36.203 20.161 452 HD22 LEU 63 HD22 LEU 63 32.101 37.160 19.847 453 HD23 LEU 63 HD23 LEU 63 31.957 35.537 20.515 454 HA PRO 64 HA PRO 64 38.921 39.073 21.505 455 HB2 PRO 64 HB2 PRO 64 37.327 41.500 20.698 456 HB3 PRO 64 HB3 PRO 64 38.932 40.981 20.146 457 HG2 PRO 64 HG2 PRO 64 36.833 40.541 18.620 458 HG3 PRO 64 HG3 PRO 64 38.070 39.285 18.815 459 HD2 PRO 64 HD2 PRO 64 35.322 39.412 20.001 460 HD3 PRO 64 HD3 PRO 64 36.249 37.994 19.471 461 H GLY 65 H GLY 65 39.921 40.087 23.248 462 HA2 GLY 65 HA2 GLY 65 38.184 41.604 25.163 463 HA3 GLY 65 HA3 GLY 65 39.275 40.344 25.734 464 H LYS 66 H LYS 66 40.127 42.214 27.013 465 HA LYS 66 HA LYS 66 42.670 43.102 26.178 466 HB2 LYS 66 HB2 LYS 66 42.291 45.473 25.553 467 HB3 LYS 66 HB3 LYS 66 41.319 44.463 24.500 468 HG2 LYS 66 HG2 LYS 66 39.319 44.933 25.712 469 HG3 LYS 66 HG3 LYS 66 40.213 45.629 27.058 470 HD2 LYS 66 HD2 LYS 66 41.002 47.081 24.756 471 HD3 LYS 66 HD3 LYS 66 39.251 46.929 24.670 472 HE2 LYS 66 HE2 LYS 66 40.549 47.717 27.268 473 HE3 LYS 66 HE3 LYS 66 40.298 48.929 26.010 474 HZ1 LYS 66 HZ1 LYS 66 38.295 49.083 27.021 475 HZ2 LYS 66 HZ2 LYS 66 38.340 47.487 27.642 476 HZ3 LYS 66 HZ3 LYS 66 37.917 47.767 26.016 477 H SER 67 H SER 67 42.516 45.731 27.444 478 HA SER 67 HA SER 67 42.417 44.940 30.258 479 HB2 SER 67 HB2 SER 67 43.300 47.092 30.693 480 HB3 SER 67 HB3 SER 67 43.940 46.735 29.092 481 HG SER 67 HG SER 67 41.420 47.963 29.331 482 H GLY 68 H GLY 68 40.164 44.233 30.255 483 HA2 GLY 68 HA2 GLY 68 37.945 44.634 31.006 484 HA3 GLY 68 HA3 GLY 68 38.271 46.370 30.963 485 H ARG 69 H ARG 69 36.806 43.746 29.307 486 HA ARG 69 HA ARG 69 36.302 45.520 26.941 487 HB2 ARG 69 HB2 ARG 69 37.794 43.642 26.325 488 HB3 ARG 69 HB3 ARG 69 36.601 42.500 26.939 489 HG2 ARG 69 HG2 ARG 69 36.062 42.515 24.666 490 HG3 ARG 69 HG3 ARG 69 34.973 43.763 25.261 491 HD2 ARG 69 HD2 ARG 69 36.109 44.605 23.284 492 HD3 ARG 69 HD3 ARG 69 36.718 45.472 24.692 493 HE ARG 69 HE ARG 69 38.369 43.200 24.309 494 HH11 ARG 69 HH11 ARG 69 37.471 46.077 22.688 495 HH12 ARG 69 HH12 ARG 69 38.975 46.185 21.814 496 HH21 ARG 69 HH21 ARG 69 40.317 43.315 23.208 497 HH22 ARG 69 HH22 ARG 69 40.561 44.622 22.087 498 H THR 70 H THR 70 34.236 45.631 26.216 499 HA THR 70 HA THR 70 32.123 44.258 27.850 500 HB THR 70 HB THR 70 30.686 46.087 27.260 501 HG1 THR 70 HG1 THR 70 32.796 46.762 25.458 502 HG21 THR 70 HG21 THR 70 33.394 47.375 27.702 503 HG22 THR 70 HG22 THR 70 32.505 46.546 28.980 504 HG23 THR 70 HG23 THR 70 31.814 47.974 28.214 505 H TRP 71 H TRP 71 30.830 42.754 26.756 506 HA TRP 71 HA TRP 71 30.914 42.892 23.753 507 HB2 TRP 71 HB2 TRP 71 31.359 40.589 25.600 508 HB3 TRP 71 HB3 TRP 71 30.454 40.259 24.117 509 HD1 TRP 71 HD1 TRP 71 33.936 40.741 25.345 510 HE1 TRP 71 HE1 TRP 71 35.580 40.968 23.350 511 HE3 TRP 71 HE3 TRP 71 30.596 41.258 21.545 512 HZ2 TRP 71 HZ2 TRP 71 35.443 41.365 20.521 513 HZ3 TRP 71 HZ3 TRP 71 31.363 41.567 19.212 514 HH2 TRP 71 HH2 TRP 71 33.784 41.615 18.698 515 H ARG 72 H ARG 72 28.986 42.475 22.623 516 HA ARG 72 HA ARG 72 26.487 41.950 24.153 517 HB2 ARG 72 HB2 ARG 72 27.093 44.460 22.532 518 HB3 ARG 72 HB3 ARG 72 25.441 43.928 22.874 519 HG2 ARG 72 HG2 ARG 72 25.642 45.140 24.784 520 HG3 ARG 72 HG3 ARG 72 26.628 43.792 25.367 521 HD2 ARG 72 HD2 ARG 72 28.012 45.682 25.655 522 HD3 ARG 72 HD3 ARG 72 28.588 44.934 24.166 523 HE ARG 72 HE ARG 72 26.604 46.817 23.400 524 HH11 ARG 72 HH11 ARG 72 29.760 46.638 24.766 525 HH12 ARG 72 HH12 ARG 72 30.103 48.312 24.531 526 HH21 ARG 72 HH21 ARG 72 27.058 49.013 23.091 527 HH22 ARG 72 HH22 ARG 72 28.605 49.635 23.559 528 H GLU 73 H GLU 73 24.950 40.864 22.871 529 HA GLU 73 HA GLU 73 25.776 40.389 20.048 530 HB2 GLU 73 HB2 GLU 73 24.663 38.233 20.189 531 HB3 GLU 73 HB3 GLU 73 25.777 38.394 21.544 532 HG2 GLU 73 HG2 GLU 73 24.031 37.939 22.906 533 HG3 GLU 73 HG3 GLU 73 23.384 39.525 22.477 534 H ALA 74 H ALA 74 23.959 39.952 18.501 535 HA ALA 74 HA ALA 74 21.320 41.089 19.187 536 HB1 ALA 74 HB1 ALA 74 23.240 42.791 18.144 537 HB2 ALA 74 HB2 ALA 74 21.498 43.035 18.007 538 HB3 ALA 74 HB3 ALA 74 22.387 42.262 16.693 539 H ASP 75 H ASP 75 19.651 40.349 17.714 540 HA ASP 75 HA ASP 75 20.248 37.874 16.316 541 HB2 ASP 75 HB2 ASP 75 17.874 39.408 17.026 542 HB3 ASP 75 HB3 ASP 75 17.751 38.787 15.387 543 H ILE 76 H ILE 76 19.964 37.445 14.014 544 HA ILE 76 HA ILE 76 20.099 39.846 12.240 545 HB ILE 76 HB ILE 76 22.062 37.542 12.311 546 HG12 ILE 76 HG12 ILE 76 22.407 39.579 13.795 547 HG13 ILE 76 HG13 ILE 76 23.717 39.228 12.670 548 HG21 ILE 76 HG21 ILE 76 23.050 38.852 10.300 549 HG22 ILE 76 HG22 ILE 76 21.435 39.529 10.132 550 HG23 ILE 76 HG23 ILE 76 21.680 37.788 10.005 551 HD11 ILE 76 HD11 ILE 76 23.363 41.117 11.461 552 HD12 ILE 76 HD12 ILE 76 22.561 41.679 12.925 553 HD13 ILE 76 HD13 ILE 76 21.608 41.009 11.601 554 H ASN 77 H ASN 77 19.413 39.451 10.094 555 HA ASN 77 HA ASN 77 18.059 38.518 8.464 556 HB2 ASN 77 HB2 ASN 77 19.217 35.940 9.558 557 HB3 ASN 77 HB3 ASN 77 18.380 36.108 8.014 558 HD21 ASN 77 HD21 ASN 77 21.078 35.245 8.078 559 HD22 ASN 77 HD22 ASN 77 22.054 36.466 7.407 560 H TYR 78 H TYR 78 16.520 39.270 10.494 561 HA TYR 78 HA TYR 78 14.676 36.963 10.875 562 HB2 TYR 78 HB2 TYR 78 15.387 37.616 13.076 563 HB3 TYR 78 HB3 TYR 78 15.153 39.326 12.708 564 HD1 TYR 78 HD1 TYR 78 13.377 36.083 13.161 565 HD2 TYR 78 HD2 TYR 78 12.977 40.356 12.923 566 HE1 TYR 78 HE1 TYR 78 11.020 35.907 13.927 567 HE2 TYR 78 HE2 TYR 78 10.624 40.177 13.684 568 HH TYR 78 HH TYR 78 9.206 38.684 14.890 569 H THR 79 H THR 79 12.415 37.455 10.684 570 HA THR 79 HA THR 79 11.775 40.083 9.377 571 HB THR 79 HB THR 79 10.419 38.986 7.710 572 HG1 THR 79 HG1 THR 79 10.470 36.595 7.735 573 HG21 THR 79 HG21 THR 79 12.801 37.174 7.687 574 HG22 THR 79 HG22 THR 79 13.075 38.914 7.606 575 HG23 THR 79 HG23 THR 79 12.096 38.118 6.374 576 H SER 80 H SER 80 9.798 37.225 9.956 577 HA SER 80 HA SER 80 8.378 38.497 12.222 578 HB2 SER 80 HB2 SER 80 6.742 39.350 10.869 579 HB3 SER 80 HB3 SER 80 7.317 38.446 9.480 580 HG SER 80 HG SER 80 6.343 36.562 10.508 581 H GLY 81 H GLY 81 8.739 36.715 13.565 582 HA2 GLY 81 HA2 GLY 81 7.121 34.544 13.750 583 HA3 GLY 81 HA3 GLY 81 8.258 33.976 12.529 584 H PHE 82 H PHE 82 10.228 33.169 13.229 585 HA PHE 82 HA PHE 82 10.929 33.678 16.101 586 HB2 PHE 82 HB2 PHE 82 9.998 31.331 15.513 587 HB3 PHE 82 HB3 PHE 82 11.546 31.073 14.709 588 HD1 PHE 82 HD1 PHE 82 9.993 31.998 17.980 589 HD2 PHE 82 HD2 PHE 82 13.499 30.585 15.944 590 HE1 PHE 82 HE1 PHE 82 11.062 31.501 20.165 591 HE2 PHE 82 HE2 PHE 82 14.569 30.095 18.124 592 HZ PHE 82 HZ PHE 82 13.352 30.550 20.236 593 H ARG 83 H ARG 83 13.380 32.744 16.352 594 HA ARG 83 HA ARG 83 14.968 34.447 14.572 595 HB2 ARG 83 HB2 ARG 83 16.320 32.670 16.546 596 HB3 ARG 83 HB3 ARG 83 16.580 34.376 16.210 597 HG2 ARG 83 HG2 ARG 83 14.212 34.694 17.281 598 HG3 ARG 83 HG3 ARG 83 14.512 33.102 17.980 599 HD2 ARG 83 HD2 ARG 83 16.083 35.651 18.381 600 HD3 ARG 83 HD3 ARG 83 15.348 34.616 19.604 601 HE ARG 83 HE ARG 83 17.244 32.978 18.361 602 HH11 ARG 83 HH11 ARG 83 17.227 36.056 19.838 603 HH12 ARG 83 HH12 ARG 83 18.837 35.940 20.435 604 HH21 ARG 83 HH21 ARG 83 19.390 32.814 19.152 605 HH22 ARG 83 HH22 ARG 83 20.058 34.119 20.093 606 H ASN 84 H ASN 84 17.367 32.787 14.791 607 HA ASN 84 HA ASN 84 16.905 30.270 13.399 608 HB2 ASN 84 HB2 ASN 84 18.031 31.002 11.274 609 HB3 ASN 84 HB3 ASN 84 16.495 31.826 11.534 610 HD21 ASN 84 HD21 ASN 84 18.004 33.278 9.892 611 HD22 ASN 84 HD22 ASN 84 18.810 34.545 10.679 612 H SER 85 H SER 85 19.681 31.075 12.059 613 HA SER 85 HA SER 85 21.294 30.451 14.506 614 HB2 SER 85 HB2 SER 85 22.633 29.022 13.200 615 HB3 SER 85 HB3 SER 85 21.016 28.745 12.550 616 HG SER 85 HG SER 85 23.223 29.786 11.338 617 H ASP 86 H ASP 86 20.671 32.737 12.122 618 HA ASP 86 HA ASP 86 23.316 33.858 11.749 619 HB2 ASP 86 HB2 ASP 86 20.498 34.723 11.153 620 HB3 ASP 86 HB3 ASP 86 21.819 35.872 10.980 621 H ARG 87 H ARG 87 24.373 34.714 13.541 622 HA ARG 87 HA ARG 87 22.835 36.753 15.099 623 HB2 ARG 87 HB2 ARG 87 24.566 34.551 16.287 624 HB3 ARG 87 HB3 ARG 87 23.910 35.909 17.206 625 HG2 ARG 87 HG2 ARG 87 22.057 34.349 15.507 626 HG3 ARG 87 HG3 ARG 87 22.568 33.597 17.017 627 HD2 ARG 87 HD2 ARG 87 21.554 35.217 18.334 628 HD3 ARG 87 HD3 ARG 87 21.718 36.453 17.101 629 HE ARG 87 HE ARG 87 19.325 35.821 17.347 630 HH11 ARG 87 HH11 ARG 87 21.003 33.289 15.716 631 HH12 ARG 87 HH12 ARG 87 19.986 33.366 14.320 632 HH21 ARG 87 HH21 ARG 87 17.952 35.806 15.609 633 HH22 ARG 87 HH22 ARG 87 18.266 34.709 14.287 634 H ILE 88 H ILE 88 23.991 38.590 15.641 635 HA ILE 88 HA ILE 88 26.802 38.703 14.650 636 HB ILE 88 HB ILE 88 25.098 40.255 13.593 637 HG12 ILE 88 HG12 ILE 88 27.364 41.579 15.128 638 HG13 ILE 88 HG13 ILE 88 27.525 40.782 13.562 639 HG21 ILE 88 HG21 ILE 88 25.275 42.028 15.959 640 HG22 ILE 88 HG22 ILE 88 24.236 40.613 16.146 641 HG23 ILE 88 HG23 ILE 88 23.929 41.769 14.849 642 HD11 ILE 88 HD11 ILE 88 26.938 43.475 13.952 643 HD12 ILE 88 HD12 ILE 88 25.361 42.766 13.604 644 HD13 ILE 88 HD13 ILE 88 26.687 42.577 12.453 645 H LEU 89 H LEU 89 28.378 39.691 15.897 646 HA LEU 89 HA LEU 89 27.645 40.191 18.744 647 HB2 LEU 89 HB2 LEU 89 29.573 38.302 17.561 648 HB3 LEU 89 HB3 LEU 89 30.278 39.326 18.803 649 HG LEU 89 HG LEU 89 29.363 37.232 19.762 650 HD11 LEU 89 HD11 LEU 89 27.458 39.265 20.765 651 HD12 LEU 89 HD12 LEU 89 29.158 39.717 20.777 652 HD13 LEU 89 HD13 LEU 89 28.625 38.274 21.641 653 HD21 LEU 89 HD21 LEU 89 27.436 37.275 17.968 654 HD22 LEU 89 HD22 LEU 89 26.598 38.265 19.164 655 HD23 LEU 89 HD23 LEU 89 27.102 36.627 19.573 656 H TYR 90 H TYR 90 28.206 42.205 19.372 657 HA TYR 90 HA TYR 90 30.456 43.592 17.941 658 HB2 TYR 90 HB2 TYR 90 29.157 45.468 17.552 659 HB3 TYR 90 HB3 TYR 90 27.935 44.210 17.417 660 HD1 TYR 90 HD1 TYR 90 26.283 43.818 19.243 661 HD2 TYR 90 HD2 TYR 90 29.191 47.009 19.430 662 HE1 TYR 90 HE1 TYR 90 24.961 44.931 21.039 663 HE2 TYR 90 HE2 TYR 90 27.864 48.101 21.220 664 HH TYR 90 HH TYR 90 24.706 47.336 21.883 665 H SER 91 H SER 91 31.849 44.787 19.303 666 HA SER 91 HA SER 91 31.357 44.379 22.229 667 HB2 SER 91 HB2 SER 91 33.822 44.739 22.421 668 HB3 SER 91 HB3 SER 91 33.404 43.389 21.370 669 HG SER 91 HG SER 91 34.928 45.364 20.715 670 H SER 92 H SER 92 32.771 46.087 23.518 671 HA SER 92 HA SER 92 31.516 48.622 23.455 672 HB2 SER 92 HB2 SER 92 34.092 49.117 24.425 673 HB3 SER 92 HB3 SER 92 32.704 48.658 25.402 674 HG SER 92 HG SER 92 34.685 46.965 24.213 675 H ASP 93 H ASP 93 34.698 47.718 22.393 676 HA ASP 93 HA ASP 93 35.397 50.144 21.073 677 HB2 ASP 93 HB2 ASP 93 36.966 48.289 19.885 678 HB3 ASP 93 HB3 ASP 93 37.225 48.813 21.553 679 H TRP 94 H TRP 94 32.911 48.206 20.257 680 HA TRP 94 HA TRP 94 31.576 48.029 18.391 681 HB2 TRP 94 HB2 TRP 94 33.563 49.929 17.115 682 HB3 TRP 94 HB3 TRP 94 31.959 49.535 16.501 683 HD1 TRP 94 HD1 TRP 94 33.616 52.057 18.486 684 HE1 TRP 94 HE1 TRP 94 31.950 53.357 19.959 685 HE3 TRP 94 HE3 TRP 94 29.548 48.989 18.173 686 HZ2 TRP 94 HZ2 TRP 94 29.265 53.136 20.880 687 HZ3 TRP 94 HZ3 TRP 94 27.450 49.559 19.362 688 HH2 TRP 94 HH2 TRP 94 27.303 51.628 20.711 689 H LEU 95 H LEU 95 34.298 46.391 18.741 690 HA LEU 95 HA LEU 95 34.963 45.618 16.027 691 HB2 LEU 95 HB2 LEU 95 35.391 44.322 18.741 692 HB3 LEU 95 HB3 LEU 95 35.886 43.528 17.247 693 HG LEU 95 HG LEU 95 36.811 46.260 18.202 694 HD11 LEU 95 HD11 LEU 95 38.326 43.655 17.835 695 HD12 LEU 95 HD12 LEU 95 37.829 44.317 19.393 696 HD13 LEU 95 HD13 LEU 95 39.004 45.180 18.398 697 HD21 LEU 95 HD21 LEU 95 38.475 45.631 16.186 698 HD22 LEU 95 HD22 LEU 95 36.982 46.530 15.920 699 HD23 LEU 95 HD23 LEU 95 37.033 44.792 15.616 700 H ILE 96 H ILE 96 33.702 44.299 14.730 701 HA ILE 96 HA ILE 96 31.462 42.878 16.078 702 HB ILE 96 HB ILE 96 31.489 43.941 13.249 703 HG12 ILE 96 HG12 ILE 96 29.514 45.149 14.962 704 HG13 ILE 96 HG13 ILE 96 31.096 45.323 15.724 705 HG21 ILE 96 HG21 ILE 96 30.034 41.901 13.931 706 HG22 ILE 96 HG22 ILE 96 29.227 43.250 13.138 707 HG23 ILE 96 HG23 ILE 96 29.122 43.060 14.885 708 HD11 ILE 96 HD11 ILE 96 30.870 45.898 12.801 709 HD12 ILE 96 HD12 ILE 96 31.927 46.621 13.998 710 HD13 ILE 96 HD13 ILE 96 30.230 47.086 13.932 711 H TYR 97 H TYR 97 31.139 40.848 15.791 712 HA TYR 97 HA TYR 97 32.721 39.321 13.753 713 HB2 TYR 97 HB2 TYR 97 32.246 38.713 16.681 714 HB3 TYR 97 HB3 TYR 97 32.718 37.462 15.537 715 HD1 TYR 97 HD1 TYR 97 33.722 40.959 16.476 716 HD2 TYR 97 HD2 TYR 97 35.019 37.025 15.319 717 HE1 TYR 97 HE1 TYR 97 36.074 41.695 16.613 718 HE2 TYR 97 HE2 TYR 97 37.385 37.772 15.480 719 HH TYR 97 HH TYR 97 38.753 39.465 16.189 720 H LYS 98 H LYS 98 31.584 37.311 13.065 721 HA LYS 98 HA LYS 98 28.618 37.506 13.628 722 HB2 LYS 98 HB2 LYS 98 28.140 37.325 11.365 723 HB3 LYS 98 HB3 LYS 98 29.593 38.324 11.348 724 HG2 LYS 98 HG2 LYS 98 30.989 36.342 10.923 725 HG3 LYS 98 HG3 LYS 98 29.563 35.303 10.977 726 HD2 LYS 98 HD2 LYS 98 30.300 37.366 8.899 727 HD3 LYS 98 HD3 LYS 98 29.927 35.663 8.667 728 HE2 LYS 98 HE2 LYS 98 28.006 37.911 9.311 729 HE3 LYS 98 HE3 LYS 98 27.987 36.828 7.923 730 HZ1 LYS 98 HZ1 LYS 98 27.010 35.199 9.097 731 HZ2 LYS 98 HZ2 LYS 98 26.523 36.470 10.106 732 HZ3 LYS 98 HZ3 LYS 98 27.879 35.540 10.514 733 H THR 99 H THR 99 27.465 35.605 13.828 734 HA THR 99 HA THR 99 28.944 33.057 13.356 735 HB THR 99 HB THR 99 29.226 33.149 15.675 736 HG1 THR 99 HG1 THR 99 28.231 31.240 15.352 737 HG21 THR 99 HG21 THR 99 27.431 33.937 17.228 738 HG22 THR 99 HG22 THR 99 26.472 34.388 15.816 739 HG23 THR 99 HG23 THR 99 28.012 35.189 16.126 740 H THR 100 H THR 100 27.715 31.623 12.349 741 HA THR 100 HA THR 100 24.793 32.176 11.899 742 HB THR 100 HB THR 100 25.354 30.770 9.745 743 HG1 THR 100 HG1 THR 100 27.586 30.506 10.700 744 HG21 THR 100 HG21 THR 100 26.644 33.360 9.384 745 HG22 THR 100 HG22 THR 100 25.155 33.489 10.325 746 HG23 THR 100 HG23 THR 100 25.122 32.767 8.718 747 H ASP 101 H ASP 101 26.666 30.240 13.687 748 HA ASP 101 HA ASP 101 25.018 27.797 13.067 749 HB2 ASP 101 HB2 ASP 101 27.057 26.902 14.650 750 HB3 ASP 101 HB3 ASP 101 27.133 26.951 12.889 751 H ALA 102 H ALA 102 24.122 30.076 14.715 752 HA ALA 102 HA ALA 102 22.981 30.397 16.733 753 HB1 ALA 102 HB1 ALA 102 23.343 27.497 17.422 754 HB2 ALA 102 HB2 ALA 102 22.350 27.927 16.030 755 HB3 ALA 102 HB3 ALA 102 21.928 28.529 17.632 756 H TYR 103 H TYR 103 25.148 31.466 17.244 757 HA TYR 103 HA TYR 103 26.828 31.962 18.780 758 HB2 TYR 103 HB2 TYR 103 25.316 30.031 20.568 759 HB3 TYR 103 HB3 TYR 103 26.423 31.294 21.087 760 HD1 TYR 103 HD1 TYR 103 25.545 33.551 19.295 761 HD2 TYR 103 HD2 TYR 103 23.261 30.686 21.531 762 HE1 TYR 103 HE1 TYR 103 23.657 35.151 19.428 763 HE2 TYR 103 HE2 TYR 103 21.378 32.288 21.654 764 HH TYR 103 HH TYR 103 21.735 35.614 20.641 765 H GLN 104 H GLN 104 27.653 30.048 16.937 766 HA GLN 104 HA GLN 104 29.202 28.100 18.673 767 HB2 GLN 104 HB2 GLN 104 28.116 27.755 15.880 768 HB3 GLN 104 HB3 GLN 104 29.336 26.695 16.562 769 HG2 GLN 104 HG2 GLN 104 26.876 27.197 18.183 770 HG3 GLN 104 HG3 GLN 104 26.716 26.159 16.768 771 HE21 GLN 104 HE21 GLN 104 26.434 25.097 19.409 772 HE22 GLN 104 HE22 GLN 104 27.739 24.051 19.703 773 H THR 105 H THR 105 29.602 29.065 15.232 774 HA THR 105 HA THR 105 32.469 29.601 15.884 775 HB THR 105 HB THR 105 32.915 29.424 13.552 776 HG1 THR 105 HG1 THR 105 30.153 29.281 12.958 777 HG21 THR 105 HG21 THR 105 31.274 27.336 13.005 778 HG22 THR 105 HG22 THR 105 31.033 27.460 14.749 779 HG23 THR 105 HG23 THR 105 32.654 27.213 14.097 780 H PHE 106 H PHE 106 33.087 31.662 16.276 781 HA PHE 106 HA PHE 106 31.382 33.900 15.301 782 HB2 PHE 106 HB2 PHE 106 33.606 33.904 17.358 783 HB3 PHE 106 HB3 PHE 106 32.580 35.272 16.941 784 HD1 PHE 106 HD1 PHE 106 32.195 31.656 17.909 785 HD2 PHE 106 HD2 PHE 106 30.774 35.684 18.260 786 HE1 PHE 106 HE1 PHE 106 30.477 30.912 19.541 787 HE2 PHE 106 HE2 PHE 106 29.069 34.946 19.885 788 HZ PHE 106 HZ PHE 106 28.916 32.564 20.526 789 H THR 107 H THR 107 32.237 33.880 13.096 790 HA THR 107 HA THR 107 35.080 34.377 12.716 791 HB THR 107 HB THR 107 32.727 34.344 10.807 792 HG1 THR 107 HG1 THR 107 33.704 32.376 11.586 793 HG21 THR 107 HG21 THR 107 35.623 34.844 10.076 794 HG22 THR 107 HG22 THR 107 34.373 36.088 10.094 795 HG23 THR 107 HG23 THR 107 34.257 34.736 8.970 796 H LYS 108 H LYS 108 36.019 36.283 12.097 797 HA LYS 108 HA LYS 108 34.782 38.699 13.179 798 HB2 LYS 108 HB2 LYS 108 37.246 38.205 13.308 799 HB3 LYS 108 HB3 LYS 108 37.337 38.464 11.565 800 HG2 LYS 108 HG2 LYS 108 36.425 40.745 11.850 801 HG3 LYS 108 HG3 LYS 108 36.354 40.497 13.595 802 HD2 LYS 108 HD2 LYS 108 38.727 40.372 13.778 803 HD3 LYS 108 HD3 LYS 108 38.924 40.181 12.036 804 HE2 LYS 108 HE2 LYS 108 39.513 42.458 12.587 805 HE3 LYS 108 HE3 LYS 108 37.969 42.496 11.744 806 HZ1 LYS 108 HZ1 LYS 108 36.842 43.129 13.606 807 HZ2 LYS 108 HZ2 LYS 108 38.375 43.757 14.030 808 HZ3 LYS 108 HZ3 LYS 108 37.876 42.258 14.660 809 H ILE 109 H ILE 109 34.128 40.523 11.996 810 HA ILE 109 HA ILE 109 34.016 40.248 9.017 811 HB ILE 109 HB ILE 109 31.786 41.368 9.086 812 HG12 ILE 109 HG12 ILE 109 31.764 40.734 12.041 813 HG13 ILE 109 HG13 ILE 109 32.258 42.319 11.446 814 HG21 ILE 109 HG21 ILE 109 32.227 38.787 9.181 815 HG22 ILE 109 HG22 ILE 109 30.593 39.394 9.465 816 HG23 ILE 109 HG23 ILE 109 31.612 38.923 10.830 817 HD11 ILE 109 HD11 ILE 109 30.138 42.915 10.924 818 HD12 ILE 109 HD12 ILE 109 29.664 41.584 11.979 819 HD13 ILE 109 HD13 ILE 109 29.766 41.333 10.240 820 H ARG 110 H ARG 110 34.212 42.319 11.853 821 HA ARG 110 HA ARG 110 35.450 44.457 10.169 822 HB2 ARG 110 HB2 ARG 110 33.243 44.949 12.217 823 HB3 ARG 110 HB3 ARG 110 34.154 46.199 11.375 824 HG2 ARG 110 HG2 ARG 110 33.106 44.347 9.446 825 HG3 ARG 110 HG3 ARG 110 31.795 44.880 10.490 826 HD2 ARG 110 HD2 ARG 110 32.636 47.252 10.128 827 HD3 ARG 110 HD3 ARG 110 33.686 46.613 8.867 828 HE ARG 110 HE ARG 110 30.960 47.291 8.519 829 HH11 ARG 110 HH11 ARG 110 33.039 44.599 7.873 830 HH12 ARG 110 HH12 ARG 110 31.935 43.899 6.736 831 HH21 ARG 110 HH21 ARG 110 29.586 46.388 7.068 832 HH22 ARG 110 HH22 ARG 110 30.021 44.901 6.254 Start of MODEL 4 1 H VAL 3 H VAL 3 16.442 49.274 12.635 2 HA VAL 3 HA VAL 3 14.317 48.136 11.837 3 HB VAL 3 HB VAL 3 14.504 50.072 9.549 4 HG11 VAL 3 HG11 VAL 3 13.153 48.083 9.239 5 HG12 VAL 3 HG12 VAL 3 12.064 49.459 9.416 6 HG13 VAL 3 HG13 VAL 3 12.317 48.356 10.769 7 HG21 VAL 3 HG21 VAL 3 13.117 50.556 12.196 8 HG22 VAL 3 HG22 VAL 3 12.539 51.294 10.702 9 HG23 VAL 3 HG23 VAL 3 14.161 51.653 11.291 10 H ILE 4 H ILE 4 16.929 47.460 11.990 11 HA ILE 4 HA ILE 4 17.568 46.580 9.215 12 HB ILE 4 HB ILE 4 19.487 47.850 11.201 13 HG12 ILE 4 HG12 ILE 4 19.390 48.650 8.340 14 HG13 ILE 4 HG13 ILE 4 17.960 49.055 9.285 15 HG21 ILE 4 HG21 ILE 4 21.138 47.366 9.248 16 HG22 ILE 4 HG22 ILE 4 19.965 46.145 8.760 17 HG23 ILE 4 HG23 ILE 4 20.733 46.048 10.345 18 HD11 ILE 4 HD11 ILE 4 19.202 50.376 10.815 19 HD12 ILE 4 HD12 ILE 4 19.856 50.795 9.233 20 HD13 ILE 4 HD13 ILE 4 20.738 49.688 10.284 21 H ASN 5 H ASN 5 18.612 44.525 9.154 22 HA ASN 5 HA ASN 5 19.091 43.132 11.721 23 HB2 ASN 5 HB2 ASN 5 17.579 41.301 11.123 24 HB3 ASN 5 HB3 ASN 5 16.675 42.817 11.142 25 HD21 ASN 5 HD21 ASN 5 15.575 40.794 9.580 26 HD22 ASN 5 HD22 ASN 5 15.824 41.128 7.934 27 H THR 6 H THR 6 20.818 43.981 9.475 28 HA THR 6 HA THR 6 21.628 41.267 8.480 29 HB THR 6 HB THR 6 22.430 42.257 6.454 30 HG1 THR 6 HG1 THR 6 22.097 44.632 6.271 31 HG21 THR 6 HG21 THR 6 20.419 42.852 5.466 32 HG22 THR 6 HG22 THR 6 19.919 43.844 6.835 33 HG23 THR 6 HG23 THR 6 19.838 42.084 6.942 34 H PHE 7 H PHE 7 23.764 40.706 8.625 35 HA PHE 7 HA PHE 7 25.360 41.496 10.719 36 HB2 PHE 7 HB2 PHE 7 26.255 40.545 7.977 37 HB3 PHE 7 HB3 PHE 7 27.328 40.646 9.378 38 HD1 PHE 7 HD1 PHE 7 26.393 39.575 11.598 39 HD2 PHE 7 HD2 PHE 7 25.057 38.585 7.618 40 HE1 PHE 7 HE1 PHE 7 25.462 37.432 12.439 41 HE2 PHE 7 HE2 PHE 7 24.141 36.434 8.457 42 HZ PHE 7 HZ PHE 7 24.330 35.857 10.870 43 H ASP 8 H ASP 8 26.733 42.259 7.631 44 HA ASP 8 HA ASP 8 28.369 44.352 8.323 45 HB2 ASP 8 HB2 ASP 8 26.948 43.611 5.799 46 HB3 ASP 8 HB3 ASP 8 27.765 45.175 5.860 47 H GLY 9 H GLY 9 24.996 44.654 7.214 48 HA2 GLY 9 HA2 GLY 9 24.691 47.438 7.289 49 HA3 GLY 9 HA3 GLY 9 23.387 46.299 7.626 50 H VAL 10 H VAL 10 24.119 45.123 9.983 51 HA VAL 10 HA VAL 10 23.488 47.162 11.939 52 HB VAL 10 HB VAL 10 24.493 44.297 12.228 53 HG11 VAL 10 HG11 VAL 10 25.276 45.381 14.191 54 HG12 VAL 10 HG12 VAL 10 23.734 44.665 14.653 55 HG13 VAL 10 HG13 VAL 10 23.834 46.392 14.306 56 HG21 VAL 10 HG21 VAL 10 21.812 45.681 12.608 57 HG22 VAL 10 HG22 VAL 10 22.131 44.028 13.133 58 HG23 VAL 10 HG23 VAL 10 22.208 44.441 11.419 59 H ALA 11 H ALA 11 26.522 45.437 11.100 60 HA ALA 11 HA ALA 11 28.228 46.555 13.073 61 HB1 ALA 11 HB1 ALA 11 29.931 46.280 11.013 62 HB2 ALA 11 HB2 ALA 11 28.563 45.397 10.347 63 HB3 ALA 11 HB3 ALA 11 29.281 44.888 11.873 64 H ASP 12 H ASP 12 27.821 47.660 9.674 65 HA ASP 12 HA ASP 12 29.286 50.056 9.832 66 HB2 ASP 12 HB2 ASP 12 26.984 49.110 8.171 67 HB3 ASP 12 HB3 ASP 12 27.389 50.827 8.122 68 H TYR 13 H TYR 13 25.827 49.550 10.449 69 HA TYR 13 HA TYR 13 25.118 52.187 11.161 70 HB2 TYR 13 HB2 TYR 13 23.695 49.988 10.988 71 HB3 TYR 13 HB3 TYR 13 24.066 49.834 12.702 72 HD1 TYR 13 HD1 TYR 13 22.395 51.918 10.149 73 HD2 TYR 13 HD2 TYR 13 23.099 51.330 14.347 74 HE1 TYR 13 HE1 TYR 13 20.563 53.500 10.678 75 HE2 TYR 13 HE2 TYR 13 21.261 52.903 14.873 76 HH TYR 13 HH TYR 13 18.935 53.694 13.137 77 H LEU 14 H LEU 14 26.304 49.572 13.234 78 HA LEU 14 HA LEU 14 26.392 51.154 15.630 79 HB2 LEU 14 HB2 LEU 14 27.527 48.499 14.778 80 HB3 LEU 14 HB3 LEU 14 27.960 49.195 16.342 81 HG LEU 14 HG LEU 14 25.108 48.761 15.396 82 HD11 LEU 14 HD11 LEU 14 26.625 46.694 15.906 83 HD12 LEU 14 HD12 LEU 14 25.040 46.785 16.673 84 HD13 LEU 14 HD13 LEU 14 26.489 47.212 17.585 85 HD21 LEU 14 HD21 LEU 14 26.313 50.281 17.535 86 HD22 LEU 14 HD22 LEU 14 25.341 48.975 18.208 87 HD23 LEU 14 HD23 LEU 14 24.607 50.138 17.106 88 H GLN 15 H GLN 15 28.947 50.165 13.306 89 HA GLN 15 HA GLN 15 31.047 51.524 14.703 90 HB2 GLN 15 HB2 GLN 15 30.752 50.671 11.828 91 HB3 GLN 15 HB3 GLN 15 32.222 51.423 12.440 92 HG2 GLN 15 HG2 GLN 15 31.581 49.412 14.315 93 HG3 GLN 15 HG3 GLN 15 31.309 48.673 12.743 94 HE21 GLN 15 HE21 GLN 15 33.471 48.003 14.610 95 HE22 GLN 15 HE22 GLN 15 34.926 48.336 13.798 96 H THR 16 H THR 16 28.524 52.784 12.641 97 HA THR 16 HA THR 16 29.994 55.368 12.327 98 HB THR 16 HB THR 16 27.310 54.679 11.111 99 HG1 THR 16 HG1 THR 16 28.731 53.085 10.439 100 HG21 THR 16 HG21 THR 16 27.846 56.998 10.958 101 HG22 THR 16 HG22 THR 16 28.194 56.298 9.377 102 HG23 THR 16 HG23 THR 16 29.513 56.653 10.492 103 H TYR 17 H TYR 17 26.836 54.137 13.491 104 HA TYR 17 HA TYR 17 26.344 56.809 14.710 105 HB2 TYR 17 HB2 TYR 17 24.437 54.512 14.213 106 HB3 TYR 17 HB3 TYR 17 23.993 56.117 14.792 107 HD1 TYR 17 HD1 TYR 17 24.341 58.115 13.301 108 HD2 TYR 17 HD2 TYR 17 24.819 54.081 11.888 109 HE1 TYR 17 HE1 TYR 17 24.135 58.909 10.959 110 HE2 TYR 17 HE2 TYR 17 24.619 54.878 9.546 111 HH TYR 17 HH TYR 17 25.115 57.700 8.524 112 H HIS 18 H HIS 18 27.242 53.630 15.539 113 HA HIS 18 HA HIS 18 27.542 52.554 17.591 114 HB2 HIS 18 HB2 HIS 18 27.234 55.391 18.599 115 HB3 HIS 18 HB3 HIS 18 27.795 54.033 19.576 116 HD1 HIS 18 HD1 HIS 18 29.061 53.132 16.481 117 HD2 HIS 18 HD2 HIS 18 30.125 56.178 19.144 118 HE1 HIS 18 HE1 HIS 18 31.461 53.774 15.941 119 H LYS 19 H LYS 19 24.720 54.637 17.368 120 HA LYS 19 HA LYS 19 23.335 53.453 19.581 121 HB2 LYS 19 HB2 LYS 19 22.180 55.369 19.124 122 HB3 LYS 19 HB3 LYS 19 22.787 55.418 17.472 123 HG2 LYS 19 HG2 LYS 19 21.094 53.625 16.886 124 HG3 LYS 19 HG3 LYS 19 20.418 53.820 18.501 125 HD2 LYS 19 HD2 LYS 19 19.092 55.286 17.287 126 HD3 LYS 19 HD3 LYS 19 20.372 56.372 17.833 127 HE2 LYS 19 HE2 LYS 19 20.775 56.870 15.673 128 HE3 LYS 19 HE3 LYS 19 21.354 55.219 15.458 129 HZ1 LYS 19 HZ1 LYS 19 19.653 54.914 14.067 130 HZ2 LYS 19 HZ2 LYS 19 18.969 56.423 14.485 131 HZ3 LYS 19 HZ3 LYS 19 18.577 55.036 15.403 132 H LEU 20 H LEU 20 22.686 51.420 19.664 133 HA LEU 20 HA LEU 20 22.817 49.484 17.691 134 HB2 LEU 20 HB2 LEU 20 21.216 49.825 20.168 135 HB3 LEU 20 HB3 LEU 20 20.613 48.616 19.039 136 HG LEU 20 HG LEU 20 23.534 48.659 19.777 137 HD11 LEU 20 HD11 LEU 20 21.227 47.559 21.391 138 HD12 LEU 20 HD12 LEU 20 22.536 48.606 21.937 139 HD13 LEU 20 HD13 LEU 20 22.862 46.919 21.541 140 HD21 LEU 20 HD21 LEU 20 23.440 46.916 18.335 141 HD22 LEU 20 HD22 LEU 20 21.676 46.930 18.325 142 HD23 LEU 20 HD23 LEU 20 22.545 46.048 19.581 143 HA PRO 21 HA PRO 21 20.159 50.658 14.328 144 HB2 PRO 21 HB2 PRO 21 19.275 47.814 14.569 145 HB3 PRO 21 HB3 PRO 21 19.775 48.721 13.132 146 HG2 PRO 21 HG2 PRO 21 21.386 46.963 14.454 147 HG3 PRO 21 HG3 PRO 21 21.980 48.318 13.479 148 HD2 PRO 21 HD2 PRO 21 22.145 47.960 16.369 149 HD3 PRO 21 HD3 PRO 21 22.883 49.230 15.367 150 H ASP 22 H ASP 22 18.157 51.593 14.351 151 HA ASP 22 HA ASP 22 16.453 51.473 16.639 152 HB2 ASP 22 HB2 ASP 22 15.381 52.323 13.974 153 HB3 ASP 22 HB3 ASP 22 15.197 53.092 15.553 154 H ASN 23 H ASN 23 16.304 49.058 16.730 155 HA ASN 23 HA ASN 23 13.726 48.099 16.103 156 HB2 ASN 23 HB2 ASN 23 14.329 46.462 14.274 157 HB3 ASN 23 HB3 ASN 23 14.293 48.148 13.767 158 HD21 ASN 23 HD21 ASN 23 16.489 45.497 14.672 159 HD22 ASN 23 HD22 ASN 23 17.859 46.159 13.918 160 H TYR 24 H TYR 24 16.285 47.892 17.886 161 HA TYR 24 HA TYR 24 16.238 44.908 18.189 162 HB2 TYR 24 HB2 TYR 24 18.398 46.956 18.449 163 HB3 TYR 24 HB3 TYR 24 18.474 45.543 19.501 164 HD1 TYR 24 HD1 TYR 24 18.171 43.219 18.362 165 HD2 TYR 24 HD2 TYR 24 19.169 46.815 16.248 166 HE1 TYR 24 HE1 TYR 24 19.035 41.866 16.469 167 HE2 TYR 24 HE2 TYR 24 20.032 45.462 14.354 168 HH TYR 24 HH TYR 24 19.870 41.892 14.414 169 H ILE 25 H ILE 25 16.458 44.088 20.433 170 HA ILE 25 HA ILE 25 15.832 45.998 22.607 171 HB ILE 25 HB ILE 25 13.919 44.097 23.169 172 HG12 ILE 25 HG12 ILE 25 13.660 44.657 20.201 173 HG13 ILE 25 HG13 ILE 25 14.384 43.173 20.818 174 HG21 ILE 25 HG21 ILE 25 13.269 46.314 23.436 175 HG22 ILE 25 HG22 ILE 25 12.372 45.896 21.979 176 HG23 ILE 25 HG23 ILE 25 13.884 46.800 21.855 177 HD11 ILE 25 HD11 ILE 25 11.548 44.121 21.015 178 HD12 ILE 25 HD12 ILE 25 12.193 43.090 22.296 179 HD13 ILE 25 HD13 ILE 25 12.170 42.515 20.631 180 H THR 26 H THR 26 16.177 45.088 24.693 181 HA THR 26 HA THR 26 18.239 43.030 24.757 182 HB THR 26 HB THR 26 18.054 43.278 27.217 183 HG1 THR 26 HG1 THR 26 15.890 45.005 26.564 184 HG21 THR 26 HG21 THR 26 18.054 45.978 27.113 185 HG22 THR 26 HG22 THR 26 18.256 45.624 25.399 186 HG23 THR 26 HG23 THR 26 19.420 45.005 26.572 187 H LYS 27 H LYS 27 18.074 40.905 25.684 188 HA LYS 27 HA LYS 27 15.787 39.357 25.080 189 HB2 LYS 27 HB2 LYS 27 18.261 39.013 26.608 190 HB3 LYS 27 HB3 LYS 27 16.925 38.125 27.331 191 HG2 LYS 27 HG2 LYS 27 17.120 36.541 25.746 192 HG3 LYS 27 HG3 LYS 27 16.762 37.741 24.505 193 HD2 LYS 27 HD2 LYS 27 19.501 37.901 25.565 194 HD3 LYS 27 HD3 LYS 27 19.156 36.385 24.744 195 HE2 LYS 27 HE2 LYS 27 18.655 37.465 22.704 196 HE3 LYS 27 HE3 LYS 27 18.435 39.036 23.487 197 HZ1 LYS 27 HZ1 LYS 27 20.673 38.399 22.230 198 HZ2 LYS 27 HZ2 LYS 27 21.038 37.726 23.764 199 HZ3 LYS 27 HZ3 LYS 27 20.673 39.393 23.633 200 H SER 28 H SER 28 16.732 40.773 28.235 201 HA SER 28 HA SER 28 14.535 40.060 29.818 202 HB2 SER 28 HB2 SER 28 16.248 41.285 30.886 203 HB3 SER 28 HB3 SER 28 16.177 42.595 29.707 204 HG SER 28 HG SER 28 14.549 43.443 30.757 205 H GLU 29 H GLU 29 14.713 43.195 28.018 206 HA GLU 29 HA GLU 29 12.066 44.046 28.326 207 HB2 GLU 29 HB2 GLU 29 13.942 44.222 25.950 208 HB3 GLU 29 HB3 GLU 29 12.376 45.026 25.974 209 HG2 GLU 29 HG2 GLU 29 13.014 46.456 27.728 210 HG3 GLU 29 HG3 GLU 29 14.367 45.444 28.214 211 H ALA 30 H ALA 30 13.333 42.171 25.536 212 HA ALA 30 HA ALA 30 10.908 41.565 24.260 213 HB1 ALA 30 HB1 ALA 30 13.163 41.042 23.362 214 HB2 ALA 30 HB2 ALA 30 12.095 39.643 23.289 215 HB3 ALA 30 HB3 ALA 30 13.326 39.749 24.549 216 H GLN 31 H GLN 31 12.559 39.645 26.770 217 HA GLN 31 HA GLN 31 10.561 37.595 26.969 218 HB2 GLN 31 HB2 GLN 31 12.644 38.609 28.924 219 HB3 GLN 31 HB3 GLN 31 11.654 37.177 29.217 220 HG2 GLN 31 HG2 GLN 31 12.561 36.044 27.312 221 HG3 GLN 31 HG3 GLN 31 13.334 37.514 26.720 222 HE21 GLN 31 HE21 GLN 31 13.635 34.850 28.974 223 HE22 GLN 31 HE22 GLN 31 15.178 35.262 29.544 224 H ALA 32 H ALA 32 11.151 40.487 29.006 225 HA ALA 32 HA ALA 32 8.850 40.051 30.661 226 HB1 ALA 32 HB1 ALA 32 10.455 41.482 31.590 227 HB2 ALA 32 HB2 ALA 32 9.203 42.610 31.069 228 HB3 ALA 32 HB3 ALA 32 10.646 42.376 30.083 229 H LEU 33 H LEU 33 9.273 41.662 27.562 230 HA LEU 33 HA LEU 33 6.747 43.053 27.620 231 HB2 LEU 33 HB2 LEU 33 8.589 42.228 25.369 232 HB3 LEU 33 HB3 LEU 33 7.056 43.044 25.062 233 HG LEU 33 HG LEU 33 9.037 44.184 27.032 234 HD11 LEU 33 HD11 LEU 33 10.095 45.447 25.300 235 HD12 LEU 33 HD12 LEU 33 8.919 44.914 24.098 236 HD13 LEU 33 HD13 LEU 33 10.097 43.772 24.743 237 HD21 LEU 33 HD21 LEU 33 6.925 45.259 27.158 238 HD22 LEU 33 HD22 LEU 33 6.697 45.201 25.410 239 HD23 LEU 33 HD23 LEU 33 7.877 46.308 26.110 240 H GLY 34 H GLY 34 7.614 39.755 27.145 241 HA2 GLY 34 HA2 GLY 34 5.484 38.322 27.465 242 HA3 GLY 34 HA3 GLY 34 4.871 39.192 26.066 243 H TRP 35 H TRP 35 8.092 38.823 25.449 244 HA TRP 35 HA TRP 35 7.698 36.843 23.409 245 HB2 TRP 35 HB2 TRP 35 9.554 38.479 23.387 246 HB3 TRP 35 HB3 TRP 35 10.249 37.698 24.806 247 HD1 TRP 35 HD1 TRP 35 8.829 36.125 21.568 248 HE1 TRP 35 HE1 TRP 35 10.633 34.567 20.607 249 HE3 TRP 35 HE3 TRP 35 12.588 36.974 24.898 250 HZ2 TRP 35 HZ2 TRP 35 13.329 33.782 21.172 251 HZ3 TRP 35 HZ3 TRP 35 14.767 35.813 24.677 252 HH2 TRP 35 HH2 TRP 35 15.140 34.214 22.813 253 H VAL 36 H VAL 36 7.196 34.730 23.862 254 HA VAL 36 HA VAL 36 8.617 33.435 26.175 255 HB VAL 36 HB VAL 36 5.809 33.020 25.128 256 HG11 VAL 36 HG11 VAL 36 6.807 30.829 25.596 257 HG12 VAL 36 HG12 VAL 36 5.656 31.231 26.866 258 HG13 VAL 36 HG13 VAL 36 7.386 31.400 27.163 259 HG21 VAL 36 HG21 VAL 36 6.900 33.794 27.862 260 HG22 VAL 36 HG22 VAL 36 5.194 33.588 27.465 261 HG23 VAL 36 HG23 VAL 36 6.121 34.891 26.722 262 H ALA 37 H ALA 37 9.450 31.361 25.817 263 HA ALA 37 HA ALA 37 10.262 30.675 23.164 264 HB1 ALA 37 HB1 ALA 37 10.986 28.508 24.244 265 HB2 ALA 37 HB2 ALA 37 10.237 29.077 25.735 266 HB3 ALA 37 HB3 ALA 37 11.595 29.957 25.040 267 H SER 38 H SER 38 7.749 29.232 25.277 268 HA SER 38 HA SER 38 6.913 27.412 23.139 269 HB2 SER 38 HB2 SER 38 5.366 26.546 24.694 270 HB3 SER 38 HB3 SER 38 6.701 27.075 25.719 271 HG SER 38 HG SER 38 4.409 28.633 25.060 272 H LYS 39 H LYS 39 6.929 29.818 22.038 273 HA LYS 39 HA LYS 39 4.258 30.233 21.111 274 HB2 LYS 39 HB2 LYS 39 4.087 31.296 23.385 275 HB3 LYS 39 HB3 LYS 39 5.338 32.441 22.897 276 HG2 LYS 39 HG2 LYS 39 3.956 33.376 21.196 277 HG3 LYS 39 HG3 LYS 39 2.795 32.053 21.309 278 HD2 LYS 39 HD2 LYS 39 2.856 33.000 23.906 279 HD3 LYS 39 HD3 LYS 39 3.033 34.478 22.963 280 HE2 LYS 39 HE2 LYS 39 0.686 34.176 23.216 281 HE3 LYS 39 HE3 LYS 39 1.045 33.653 21.569 282 HZ1 LYS 39 HZ1 LYS 39 0.910 31.805 23.894 283 HZ2 LYS 39 HZ2 LYS 39 1.025 31.383 22.254 284 HZ3 LYS 39 HZ3 LYS 39 -0.398 32.098 22.853 285 H GLY 40 H GLY 40 7.320 32.065 21.691 286 HA2 GLY 40 HA2 GLY 40 8.767 33.055 20.095 287 HA3 GLY 40 HA3 GLY 40 7.925 32.132 18.849 288 H ASN 41 H ASN 41 6.046 34.120 20.965 289 HA ASN 41 HA ASN 41 4.822 35.563 18.854 290 HB2 ASN 41 HB2 ASN 41 4.117 37.133 20.779 291 HB3 ASN 41 HB3 ASN 41 3.613 35.450 20.871 292 HD21 ASN 41 HD21 ASN 41 4.938 37.867 22.721 293 HD22 ASN 41 HD22 ASN 41 5.738 36.907 23.882 294 H LEU 42 H LEU 42 5.489 37.237 17.701 295 HA LEU 42 HA LEU 42 7.125 39.395 18.793 296 HB2 LEU 42 HB2 LEU 42 8.620 37.248 18.115 297 HB3 LEU 42 HB3 LEU 42 8.482 37.991 16.522 298 HG LEU 42 HG LEU 42 9.063 40.193 17.938 299 HD11 LEU 42 HD11 LEU 42 10.815 39.550 19.620 300 HD12 LEU 42 HD12 LEU 42 10.286 37.877 19.452 301 HD13 LEU 42 HD13 LEU 42 9.178 39.094 20.086 302 HD21 LEU 42 HD21 LEU 42 11.598 39.256 17.550 303 HD22 LEU 42 HD22 LEU 42 10.582 39.896 16.262 304 HD23 LEU 42 HD23 LEU 42 10.681 38.155 16.524 305 H ALA 43 H ALA 43 6.458 37.781 15.682 306 HA ALA 43 HA ALA 43 6.267 40.076 14.072 307 HB1 ALA 43 HB1 ALA 43 6.203 37.588 13.381 308 HB2 ALA 43 HB2 ALA 43 5.157 38.684 12.477 309 HB3 ALA 43 HB3 ALA 43 4.473 37.649 13.732 310 H ASP 44 H ASP 44 3.965 38.711 16.357 311 HA ASP 44 HA ASP 44 1.659 40.263 15.458 312 HB2 ASP 44 HB2 ASP 44 0.927 39.583 17.923 313 HB3 ASP 44 HB3 ASP 44 1.043 38.357 16.658 314 H VAL 45 H VAL 45 3.525 40.436 18.500 315 HA VAL 45 HA VAL 45 2.582 43.095 19.132 316 HB VAL 45 HB VAL 45 4.364 42.979 20.933 317 HG11 VAL 45 HG11 VAL 45 3.283 40.610 21.750 318 HG12 VAL 45 HG12 VAL 45 2.150 41.048 20.470 319 HG13 VAL 45 HG13 VAL 45 2.419 42.148 21.822 320 HG21 VAL 45 HG21 VAL 45 6.026 41.626 19.765 321 HG22 VAL 45 HG22 VAL 45 4.875 40.303 19.574 322 HG23 VAL 45 HG23 VAL 45 5.467 40.733 21.177 323 H ALA 46 H ALA 46 5.254 41.876 17.265 324 HA ALA 46 HA ALA 46 6.041 44.657 16.595 325 HB1 ALA 46 HB1 ALA 46 8.312 44.405 17.191 326 HB2 ALA 46 HB2 ALA 46 8.181 42.652 17.334 327 HB3 ALA 46 HB3 ALA 46 7.459 43.695 18.562 328 HA PRO 47 HA PRO 47 5.843 41.627 13.068 329 HB2 PRO 47 HB2 PRO 47 4.727 43.824 11.517 330 HB3 PRO 47 HB3 PRO 47 4.009 42.258 11.916 331 HG2 PRO 47 HG2 PRO 47 3.237 44.702 12.952 332 HG3 PRO 47 HG3 PRO 47 2.830 43.122 13.624 333 HD2 PRO 47 HD2 PRO 47 4.757 45.123 14.610 334 HD3 PRO 47 HD3 PRO 47 3.984 43.786 15.468 335 H GLY 48 H GLY 48 8.287 42.497 13.691 336 HA2 GLY 48 HA2 GLY 48 9.893 42.578 11.545 337 HA3 GLY 48 HA3 GLY 48 9.311 44.239 11.490 338 H LYS 49 H LYS 49 10.020 42.405 14.470 339 HA LYS 49 HA LYS 49 12.241 44.352 14.920 340 HB2 LYS 49 HB2 LYS 49 10.044 44.395 16.421 341 HB3 LYS 49 HB3 LYS 49 10.870 43.086 17.266 342 HG2 LYS 49 HG2 LYS 49 12.458 44.476 18.134 343 HG3 LYS 49 HG3 LYS 49 12.589 45.412 16.648 344 HD2 LYS 49 HD2 LYS 49 10.438 46.549 17.210 345 HD3 LYS 49 HD3 LYS 49 10.403 45.671 18.740 346 HE2 LYS 49 HE2 LYS 49 12.825 46.673 19.035 347 HE3 LYS 49 HE3 LYS 49 12.266 47.856 17.850 348 HZ1 LYS 49 HZ1 LYS 49 11.190 47.286 20.543 349 HZ2 LYS 49 HZ2 LYS 49 10.235 48.064 19.368 350 HZ3 LYS 49 HZ3 LYS 49 11.690 48.772 19.895 351 H SER 50 H SER 50 14.188 43.567 15.789 352 HA SER 50 HA SER 50 14.341 40.568 15.944 353 HB2 SER 50 HB2 SER 50 16.599 42.442 15.180 354 HB3 SER 50 HB3 SER 50 16.597 40.681 15.088 355 HG SER 50 HG SER 50 14.987 42.505 13.611 356 H ILE 51 H ILE 51 15.174 39.719 17.801 357 HA ILE 51 HA ILE 51 15.475 41.351 20.140 358 HB ILE 51 HB ILE 51 16.673 38.596 19.913 359 HG12 ILE 51 HG12 ILE 51 14.494 38.444 18.783 360 HG13 ILE 51 HG13 ILE 51 14.418 37.647 20.352 361 HG21 ILE 51 HG21 ILE 51 16.956 39.454 22.079 362 HG22 ILE 51 HG22 ILE 51 15.473 38.514 22.223 363 HG23 ILE 51 HG23 ILE 51 15.390 40.268 22.067 364 HD11 ILE 51 HD11 ILE 51 13.714 40.219 21.009 365 HD12 ILE 51 HD12 ILE 51 12.572 38.916 20.681 366 HD13 ILE 51 HD13 ILE 51 13.009 40.051 19.402 367 H GLY 52 H GLY 52 17.377 41.936 21.306 368 HA2 GLY 52 HA2 GLY 52 19.992 41.253 21.009 369 HA3 GLY 52 HA3 GLY 52 19.748 42.222 19.560 370 H GLY 53 H GLY 53 21.398 42.658 22.019 371 HA2 GLY 53 HA2 GLY 53 21.941 45.110 22.434 372 HA3 GLY 53 HA3 GLY 53 20.233 45.309 22.807 373 H ASP 54 H ASP 54 21.649 42.333 23.911 374 HA ASP 54 HA ASP 54 21.138 43.067 26.674 375 HB2 ASP 54 HB2 ASP 54 22.885 40.759 25.893 376 HB3 ASP 54 HB3 ASP 54 21.604 40.832 27.113 377 H ILE 55 H ILE 55 23.234 42.075 28.021 378 HA ILE 55 HA ILE 55 25.620 43.655 27.243 379 HB ILE 55 HB ILE 55 24.318 43.598 29.960 380 HG12 ILE 55 HG12 ILE 55 23.585 45.130 27.847 381 HG13 ILE 55 HG13 ILE 55 23.516 45.717 29.492 382 HG21 ILE 55 HG21 ILE 55 26.919 44.819 28.986 383 HG22 ILE 55 HG22 ILE 55 26.717 43.623 30.266 384 HG23 ILE 55 HG23 ILE 55 26.148 45.273 30.505 385 HD11 ILE 55 HD11 ILE 55 24.703 47.187 27.714 386 HD12 ILE 55 HD12 ILE 55 26.019 46.023 27.847 387 HD13 ILE 55 HD13 ILE 55 25.516 46.948 29.261 388 H PHE 56 H PHE 56 27.555 42.672 27.717 389 HA PHE 56 HA PHE 56 27.632 40.379 29.563 390 HB2 PHE 56 HB2 PHE 56 26.959 39.664 27.120 391 HB3 PHE 56 HB3 PHE 56 28.679 39.889 26.792 392 HD1 PHE 56 HD1 PHE 56 26.360 38.283 29.253 393 HD2 PHE 56 HD2 PHE 56 30.180 38.160 27.286 394 HE1 PHE 56 HE1 PHE 56 26.844 36.102 30.332 395 HE2 PHE 56 HE2 PHE 56 30.668 35.976 28.365 396 HZ PHE 56 HZ PHE 56 28.998 34.950 29.890 397 H SER 57 H SER 57 29.746 39.955 30.313 398 HA SER 57 HA SER 57 31.704 42.097 29.699 399 HB2 SER 57 HB2 SER 57 32.824 40.524 31.682 400 HB3 SER 57 HB3 SER 57 31.877 41.988 31.940 401 HG SER 57 HG SER 57 30.066 40.765 32.260 402 H ASN 58 H ASN 58 31.173 38.768 28.999 403 HA ASN 58 HA ASN 58 32.392 37.298 27.639 404 HB2 ASN 58 HB2 ASN 58 32.866 39.480 26.391 405 HB3 ASN 58 HB3 ASN 58 34.413 39.508 27.229 406 HD21 ASN 58 HD21 ASN 58 35.574 39.175 25.185 407 HD22 ASN 58 HD22 ASN 58 35.588 37.660 24.423 408 H ARG 59 H ARG 59 32.998 37.601 30.562 409 HA ARG 59 HA ARG 59 35.784 37.360 31.111 410 HB2 ARG 59 HB2 ARG 59 33.270 36.443 32.415 411 HB3 ARG 59 HB3 ARG 59 34.742 35.613 32.888 412 HG2 ARG 59 HG2 ARG 59 35.793 37.722 33.529 413 HG3 ARG 59 HG3 ARG 59 34.381 38.626 32.977 414 HD2 ARG 59 HD2 ARG 59 34.598 36.734 35.323 415 HD3 ARG 59 HD3 ARG 59 34.046 38.409 35.329 416 HE ARG 59 HE ARG 59 32.384 36.109 34.948 417 HH11 ARG 59 HH11 ARG 59 32.912 39.245 33.731 418 HH12 ARG 59 HH12 ARG 59 31.486 39.281 32.728 419 HH21 ARG 59 HH21 ARG 59 30.550 36.074 33.608 420 HH22 ARG 59 HH22 ARG 59 30.193 37.458 32.637 421 H GLU 60 H GLU 60 33.431 35.134 29.786 422 HA GLU 60 HA GLU 60 34.943 32.719 30.031 423 HB2 GLU 60 HB2 GLU 60 32.772 33.593 28.103 424 HB3 GLU 60 HB3 GLU 60 33.422 31.952 28.142 425 HG2 GLU 60 HG2 GLU 60 31.398 32.037 29.517 426 HG3 GLU 60 HG3 GLU 60 32.796 31.804 30.564 427 H GLY 61 H GLY 61 35.515 35.499 28.185 428 HA2 GLY 61 HA2 GLY 61 37.086 35.978 26.512 429 HA3 GLY 61 HA3 GLY 61 37.887 34.482 26.989 430 H LYS 62 H LYS 62 34.653 34.986 25.594 431 HA LYS 62 HA LYS 62 35.300 32.937 23.548 432 HB2 LYS 62 HB2 LYS 62 32.989 33.596 25.041 433 HB3 LYS 62 HB3 LYS 62 32.618 34.022 23.371 434 HG2 LYS 62 HG2 LYS 62 34.005 31.428 23.708 435 HG3 LYS 62 HG3 LYS 62 32.389 31.498 24.407 436 HD2 LYS 62 HD2 LYS 62 31.825 30.905 22.244 437 HD3 LYS 62 HD3 LYS 62 31.806 32.659 22.080 438 HE2 LYS 62 HE2 LYS 62 34.497 31.670 21.694 439 HE3 LYS 62 HE3 LYS 62 33.381 30.821 20.620 440 HZ1 LYS 62 HZ1 LYS 62 33.868 32.694 19.407 441 HZ2 LYS 62 HZ2 LYS 62 34.001 33.706 20.782 442 HZ3 LYS 62 HZ3 LYS 62 32.464 33.204 20.213 443 H LEU 63 H LEU 63 35.168 36.298 23.913 444 HA LEU 63 HA LEU 63 35.284 36.660 20.948 445 HB2 LEU 63 HB2 LEU 63 33.865 38.544 22.858 446 HB3 LEU 63 HB3 LEU 63 33.912 38.654 21.102 447 HG LEU 63 HG LEU 63 32.730 36.269 22.547 448 HD11 LEU 63 HD11 LEU 63 31.612 38.523 23.056 449 HD12 LEU 63 HD12 LEU 63 30.582 37.261 22.385 450 HD13 LEU 63 HD13 LEU 63 31.172 38.560 21.351 451 HD21 LEU 63 HD21 LEU 63 33.472 36.662 19.906 452 HD22 LEU 63 HD22 LEU 63 31.758 37.076 19.896 453 HD23 LEU 63 HD23 LEU 63 32.277 35.493 20.465 454 HA PRO 64 HA PRO 64 38.962 39.065 21.464 455 HB2 PRO 64 HB2 PRO 64 37.380 41.484 20.639 456 HB3 PRO 64 HB3 PRO 64 38.986 40.954 20.093 457 HG2 PRO 64 HG2 PRO 64 36.875 40.540 18.577 458 HG3 PRO 64 HG3 PRO 64 38.112 39.283 18.739 459 HD2 PRO 64 HD2 PRO 64 35.370 39.371 19.921 460 HD3 PRO 64 HD3 PRO 64 36.333 37.963 19.416 461 H GLY 65 H GLY 65 39.916 40.026 23.234 462 HA2 GLY 65 HA2 GLY 65 38.160 41.593 25.080 463 HA3 GLY 65 HA3 GLY 65 39.209 40.320 25.691 464 H LYS 66 H LYS 66 39.988 42.202 26.981 465 HA LYS 66 HA LYS 66 42.583 43.056 26.270 466 HB2 LYS 66 HB2 LYS 66 42.245 45.447 25.741 467 HB3 LYS 66 HB3 LYS 66 41.380 44.469 24.562 468 HG2 LYS 66 HG2 LYS 66 39.276 44.846 25.668 469 HG3 LYS 66 HG3 LYS 66 40.070 45.595 27.050 470 HD2 LYS 66 HD2 LYS 66 40.928 46.985 24.709 471 HD3 LYS 66 HD3 LYS 66 39.174 46.842 24.632 472 HE2 LYS 66 HE2 LYS 66 40.536 47.720 27.178 473 HE3 LYS 66 HE3 LYS 66 40.175 48.880 25.899 474 HZ1 LYS 66 HZ1 LYS 66 38.171 48.997 26.869 475 HZ2 LYS 66 HZ2 LYS 66 38.383 47.536 27.741 476 HZ3 LYS 66 HZ3 LYS 66 37.861 47.506 26.121 477 H SER 67 H SER 67 42.534 45.601 27.655 478 HA SER 67 HA SER 67 42.167 44.639 30.388 479 HB2 SER 67 HB2 SER 67 43.041 46.737 31.078 480 HB3 SER 67 HB3 SER 67 43.883 46.404 29.566 481 HG SER 67 HG SER 67 41.421 47.794 29.578 482 H GLY 68 H GLY 68 39.941 44.137 30.541 483 HA2 GLY 68 HA2 GLY 68 37.720 44.691 31.157 484 HA3 GLY 68 HA3 GLY 68 38.163 46.397 31.051 485 H ARG 69 H ARG 69 36.745 43.714 29.367 486 HA ARG 69 HA ARG 69 36.260 45.506 27.014 487 HB2 ARG 69 HB2 ARG 69 37.779 43.670 26.393 488 HB3 ARG 69 HB3 ARG 69 36.621 42.494 27.012 489 HG2 ARG 69 HG2 ARG 69 36.047 42.473 24.759 490 HG3 ARG 69 HG3 ARG 69 34.964 43.737 25.333 491 HD2 ARG 69 HD2 ARG 69 36.088 44.537 23.328 492 HD3 ARG 69 HD3 ARG 69 36.694 45.441 24.710 493 HE ARG 69 HE ARG 69 38.363 43.163 24.336 494 HH11 ARG 69 HH11 ARG 69 37.476 46.067 22.713 495 HH12 ARG 69 HH12 ARG 69 38.982 46.149 21.836 496 HH21 ARG 69 HH21 ARG 69 40.306 43.276 23.232 497 HH22 ARG 69 HH22 ARG 69 40.560 44.592 22.126 498 H THR 70 H THR 70 34.196 45.668 26.320 499 HA THR 70 HA THR 70 32.082 44.246 27.906 500 HB THR 70 HB THR 70 30.658 46.103 27.358 501 HG1 THR 70 HG1 THR 70 32.730 46.696 25.493 502 HG21 THR 70 HG21 THR 70 33.384 47.380 27.718 503 HG22 THR 70 HG22 THR 70 32.515 46.579 29.034 504 HG23 THR 70 HG23 THR 70 31.821 47.998 28.256 505 H TRP 71 H TRP 71 30.793 42.749 26.759 506 HA TRP 71 HA TRP 71 30.921 42.928 23.765 507 HB2 TRP 71 HB2 TRP 71 31.345 40.589 25.570 508 HB3 TRP 71 HB3 TRP 71 30.436 40.289 24.084 509 HD1 TRP 71 HD1 TRP 71 33.924 40.777 25.326 510 HE1 TRP 71 HE1 TRP 71 35.577 41.010 23.337 511 HE3 TRP 71 HE3 TRP 71 30.596 41.240 21.496 512 HZ2 TRP 71 HZ2 TRP 71 35.463 41.395 20.512 513 HZ3 TRP 71 HZ3 TRP 71 31.383 41.545 19.167 514 HH2 TRP 71 HH2 TRP 71 33.812 41.617 18.669 515 H ARG 72 H ARG 72 28.999 42.548 22.614 516 HA ARG 72 HA ARG 72 26.497 42.002 24.146 517 HB2 ARG 72 HB2 ARG 72 27.121 44.470 22.502 518 HB3 ARG 72 HB3 ARG 72 25.461 43.920 22.732 519 HG2 ARG 72 HG2 ARG 72 25.526 45.199 24.614 520 HG3 ARG 72 HG3 ARG 72 26.418 43.838 25.304 521 HD2 ARG 72 HD2 ARG 72 27.836 45.682 25.706 522 HD3 ARG 72 HD3 ARG 72 28.513 44.937 24.262 523 HE ARG 72 HE ARG 72 26.571 46.885 23.434 524 HH11 ARG 72 HH11 ARG 72 29.725 46.599 24.807 525 HH12 ARG 72 HH12 ARG 72 30.138 48.247 24.516 526 HH21 ARG 72 HH21 ARG 72 27.125 49.021 23.030 527 HH22 ARG 72 HH22 ARG 72 28.691 49.602 23.491 528 H GLU 73 H GLU 73 24.870 40.990 22.856 529 HA GLU 73 HA GLU 73 25.760 40.374 20.102 530 HB2 GLU 73 HB2 GLU 73 24.650 38.217 20.281 531 HB3 GLU 73 HB3 GLU 73 25.706 38.424 21.674 532 HG2 GLU 73 HG2 GLU 73 23.891 37.975 22.950 533 HG3 GLU 73 HG3 GLU 73 23.307 39.580 22.506 534 H ALA 74 H ALA 74 23.929 39.827 18.542 535 HA ALA 74 HA ALA 74 21.309 41.012 19.170 536 HB1 ALA 74 HB1 ALA 74 23.230 42.735 18.185 537 HB2 ALA 74 HB2 ALA 74 21.489 42.979 18.032 538 HB3 ALA 74 HB3 ALA 74 22.395 42.234 16.715 539 H ASP 75 H ASP 75 19.643 40.232 17.765 540 HA ASP 75 HA ASP 75 20.212 37.819 16.291 541 HB2 ASP 75 HB2 ASP 75 17.857 39.375 17.024 542 HB3 ASP 75 HB3 ASP 75 17.719 38.735 15.391 543 H ILE 76 H ILE 76 19.998 37.405 14.004 544 HA ILE 76 HA ILE 76 20.140 39.806 12.241 545 HB ILE 76 HB ILE 76 22.099 37.492 12.314 546 HG12 ILE 76 HG12 ILE 76 22.430 39.514 13.818 547 HG13 ILE 76 HG13 ILE 76 23.746 39.194 12.691 548 HG21 ILE 76 HG21 ILE 76 23.095 38.958 10.342 549 HG22 ILE 76 HG22 ILE 76 21.414 39.427 10.125 550 HG23 ILE 76 HG23 ILE 76 21.876 37.732 10.008 551 HD11 ILE 76 HD11 ILE 76 23.359 41.091 11.493 552 HD12 ILE 76 HD12 ILE 76 22.556 41.630 12.966 553 HD13 ILE 76 HD13 ILE 76 21.610 40.951 11.642 554 H ASN 77 H ASN 77 19.508 39.395 10.063 555 HA ASN 77 HA ASN 77 18.132 38.486 8.429 556 HB2 ASN 77 HB2 ASN 77 19.290 35.928 9.564 557 HB3 ASN 77 HB3 ASN 77 18.421 36.046 8.034 558 HD21 ASN 77 HD21 ASN 77 21.067 35.184 7.968 559 HD22 ASN 77 HD22 ASN 77 22.047 36.399 7.292 560 H TYR 78 H TYR 78 16.582 39.236 10.524 561 HA TYR 78 HA TYR 78 14.691 36.955 10.819 562 HB2 TYR 78 HB2 TYR 78 15.381 37.566 13.036 563 HB3 TYR 78 HB3 TYR 78 15.185 39.283 12.686 564 HD1 TYR 78 HD1 TYR 78 13.367 36.080 13.119 565 HD2 TYR 78 HD2 TYR 78 13.001 40.350 12.867 566 HE1 TYR 78 HE1 TYR 78 11.016 35.921 13.897 567 HE2 TYR 78 HE2 TYR 78 10.645 40.191 13.638 568 HH TYR 78 HH TYR 78 9.212 38.690 14.862 569 H THR 79 H THR 79 12.433 37.484 10.627 570 HA THR 79 HA THR 79 11.833 40.150 9.376 571 HB THR 79 HB THR 79 10.429 39.101 7.717 572 HG1 THR 79 HG1 THR 79 10.444 36.692 7.748 573 HG21 THR 79 HG21 THR 79 12.869 37.326 7.781 574 HG22 THR 79 HG22 THR 79 12.988 39.045 7.407 575 HG23 THR 79 HG23 THR 79 12.027 37.981 6.377 576 H SER 80 H SER 80 9.828 37.330 9.891 577 HA SER 80 HA SER 80 8.441 38.531 12.216 578 HB2 SER 80 HB2 SER 80 6.854 39.438 10.846 579 HB3 SER 80 HB3 SER 80 7.364 38.474 9.465 580 HG SER 80 HG SER 80 6.309 36.672 10.513 581 H GLY 81 H GLY 81 8.703 36.754 13.543 582 HA2 GLY 81 HA2 GLY 81 7.165 34.526 13.611 583 HA3 GLY 81 HA3 GLY 81 8.350 34.032 12.403 584 H PHE 82 H PHE 82 10.265 33.163 13.152 585 HA PHE 82 HA PHE 82 10.947 33.659 16.027 586 HB2 PHE 82 HB2 PHE 82 10.030 31.294 15.409 587 HB3 PHE 82 HB3 PHE 82 11.607 31.051 14.661 588 HD1 PHE 82 HD1 PHE 82 9.926 31.954 17.878 589 HD2 PHE 82 HD2 PHE 82 13.539 30.597 15.981 590 HE1 PHE 82 HE1 PHE 82 10.921 31.487 20.105 591 HE2 PHE 82 HE2 PHE 82 14.533 30.137 18.208 592 HZ PHE 82 HZ PHE 82 13.224 30.581 20.269 593 H ARG 83 H ARG 83 13.394 32.716 16.282 594 HA ARG 83 HA ARG 83 14.982 34.448 14.538 595 HB2 ARG 83 HB2 ARG 83 16.381 32.624 16.413 596 HB3 ARG 83 HB3 ARG 83 16.566 34.358 16.186 597 HG2 ARG 83 HG2 ARG 83 14.161 34.448 17.287 598 HG3 ARG 83 HG3 ARG 83 14.627 32.871 17.923 599 HD2 ARG 83 HD2 ARG 83 16.042 35.517 18.327 600 HD3 ARG 83 HD3 ARG 83 15.302 34.494 19.559 601 HE ARG 83 HE ARG 83 17.256 32.869 18.416 602 HH11 ARG 83 HH11 ARG 83 17.143 35.995 19.801 603 HH12 ARG 83 HH12 ARG 83 18.758 35.948 20.394 604 HH21 ARG 83 HH21 ARG 83 19.386 32.787 19.200 605 HH22 ARG 83 HH22 ARG 83 20.031 34.127 20.107 606 H ASN 84 H ASN 84 17.377 32.775 14.712 607 HA ASN 84 HA ASN 84 16.911 30.289 13.270 608 HB2 ASN 84 HB2 ASN 84 18.063 31.042 11.168 609 HB3 ASN 84 HB3 ASN 84 16.517 31.854 11.420 610 HD21 ASN 84 HD21 ASN 84 18.049 33.308 9.806 611 HD22 ASN 84 HD22 ASN 84 18.821 34.586 10.610 612 H SER 85 H SER 85 19.720 31.053 11.958 613 HA SER 85 HA SER 85 21.271 30.488 14.459 614 HB2 SER 85 HB2 SER 85 22.755 29.122 13.189 615 HB3 SER 85 HB3 SER 85 21.126 28.660 12.681 616 HG SER 85 HG SER 85 23.158 29.715 11.230 617 H ASP 86 H ASP 86 20.716 32.735 12.030 618 HA ASP 86 HA ASP 86 23.376 33.835 11.716 619 HB2 ASP 86 HB2 ASP 86 20.582 34.787 11.104 620 HB3 ASP 86 HB3 ASP 86 21.963 35.858 10.904 621 H ARG 87 H ARG 87 24.401 34.671 13.524 622 HA ARG 87 HA ARG 87 22.839 36.707 15.066 623 HB2 ARG 87 HB2 ARG 87 24.534 34.480 16.240 624 HB3 ARG 87 HB3 ARG 87 23.935 35.854 17.172 625 HG2 ARG 87 HG2 ARG 87 22.034 34.294 15.506 626 HG3 ARG 87 HG3 ARG 87 22.525 33.605 17.050 627 HD2 ARG 87 HD2 ARG 87 21.522 35.291 18.289 628 HD3 ARG 87 HD3 ARG 87 21.713 36.475 17.011 629 HE ARG 87 HE ARG 87 19.305 35.845 17.300 630 HH11 ARG 87 HH11 ARG 87 20.946 33.289 15.700 631 HH12 ARG 87 HH12 ARG 87 19.953 33.377 14.289 632 HH21 ARG 87 HH21 ARG 87 17.947 35.859 15.548 633 HH22 ARG 87 HH22 ARG 87 18.251 34.758 14.228 634 H ILE 88 H ILE 88 23.995 38.537 15.616 635 HA ILE 88 HA ILE 88 26.806 38.647 14.644 636 HB ILE 88 HB ILE 88 25.084 40.213 13.594 637 HG12 ILE 88 HG12 ILE 88 27.333 41.599 15.089 638 HG13 ILE 88 HG13 ILE 88 27.581 40.629 13.636 639 HG21 ILE 88 HG21 ILE 88 25.329 41.974 15.969 640 HG22 ILE 88 HG22 ILE 88 24.249 40.592 16.143 641 HG23 ILE 88 HG23 ILE 88 23.975 41.765 14.858 642 HD11 ILE 88 HD11 ILE 88 26.813 43.368 13.792 643 HD12 ILE 88 HD12 ILE 88 25.428 42.476 13.161 644 HD13 ILE 88 HD13 ILE 88 26.988 42.376 12.342 645 H LEU 89 H LEU 89 28.383 39.660 15.895 646 HA LEU 89 HA LEU 89 27.625 40.163 18.750 647 HB2 LEU 89 HB2 LEU 89 29.607 38.318 17.590 648 HB3 LEU 89 HB3 LEU 89 30.269 39.375 18.837 649 HG LEU 89 HG LEU 89 29.364 37.254 19.791 650 HD11 LEU 89 HD11 LEU 89 27.403 39.254 20.758 651 HD12 LEU 89 HD12 LEU 89 29.074 39.806 20.742 652 HD13 LEU 89 HD13 LEU 89 28.632 38.366 21.659 653 HD21 LEU 89 HD21 LEU 89 27.454 37.295 17.976 654 HD22 LEU 89 HD22 LEU 89 26.602 38.252 19.190 655 HD23 LEU 89 HD23 LEU 89 27.141 36.620 19.574 656 H TYR 90 H TYR 90 28.198 42.176 19.432 657 HA TYR 90 HA TYR 90 30.433 43.569 18.003 658 HB2 TYR 90 HB2 TYR 90 29.184 45.465 17.599 659 HB3 TYR 90 HB3 TYR 90 27.929 44.244 17.451 660 HD1 TYR 90 HD1 TYR 90 26.286 43.880 19.289 661 HD2 TYR 90 HD2 TYR 90 29.219 47.032 19.448 662 HE1 TYR 90 HE1 TYR 90 24.971 45.028 21.061 663 HE2 TYR 90 HE2 TYR 90 27.897 48.166 21.216 664 HH TYR 90 HH TYR 90 24.698 47.309 21.983 665 H SER 91 H SER 91 31.800 44.737 19.313 666 HA SER 91 HA SER 91 31.396 44.365 22.256 667 HB2 SER 91 HB2 SER 91 33.841 44.749 22.370 668 HB3 SER 91 HB3 SER 91 33.429 43.436 21.270 669 HG SER 91 HG SER 91 34.872 45.492 20.660 670 H SER 92 H SER 92 32.817 46.088 23.501 671 HA SER 92 HA SER 92 31.510 48.613 23.498 672 HB2 SER 92 HB2 SER 92 34.072 49.126 24.475 673 HB3 SER 92 HB3 SER 92 32.707 48.596 25.445 674 HG SER 92 HG SER 92 34.783 47.048 24.246 675 H ASP 93 H ASP 93 34.637 47.666 22.289 676 HA ASP 93 HA ASP 93 35.338 50.163 21.063 677 HB2 ASP 93 HB2 ASP 93 36.951 48.370 19.856 678 HB3 ASP 93 HB3 ASP 93 37.189 48.853 21.540 679 H TRP 94 H TRP 94 32.888 48.190 20.237 680 HA TRP 94 HA TRP 94 31.548 48.053 18.355 681 HB2 TRP 94 HB2 TRP 94 33.558 49.932 17.082 682 HB3 TRP 94 HB3 TRP 94 31.947 49.555 16.471 683 HD1 TRP 94 HD1 TRP 94 33.648 52.027 18.504 684 HE1 TRP 94 HE1 TRP 94 31.996 53.330 19.988 685 HE3 TRP 94 HE3 TRP 94 29.524 49.036 18.104 686 HZ2 TRP 94 HZ2 TRP 94 29.306 53.153 20.872 687 HZ3 TRP 94 HZ3 TRP 94 27.427 49.631 19.290 688 HH2 TRP 94 HH2 TRP 94 27.314 51.687 20.671 689 H LEU 95 H LEU 95 34.162 46.371 18.770 690 HA LEU 95 HA LEU 95 34.872 45.610 16.052 691 HB2 LEU 95 HB2 LEU 95 35.344 44.365 18.771 692 HB3 LEU 95 HB3 LEU 95 35.779 43.511 17.291 693 HG LEU 95 HG LEU 95 36.774 46.227 18.161 694 HD11 LEU 95 HD11 LEU 95 38.358 43.714 17.628 695 HD12 LEU 95 HD12 LEU 95 37.762 44.143 19.231 696 HD13 LEU 95 HD13 LEU 95 38.911 45.197 18.404 697 HD21 LEU 95 HD21 LEU 95 38.288 45.643 16.020 698 HD22 LEU 95 HD22 LEU 95 36.772 46.529 15.878 699 HD23 LEU 95 HD23 LEU 95 36.817 44.797 15.544 700 H ILE 96 H ILE 96 33.633 44.349 14.776 701 HA ILE 96 HA ILE 96 31.384 42.923 16.090 702 HB ILE 96 HB ILE 96 31.504 43.899 13.237 703 HG12 ILE 96 HG12 ILE 96 29.555 45.251 14.819 704 HG13 ILE 96 HG13 ILE 96 31.076 45.311 15.708 705 HG21 ILE 96 HG21 ILE 96 29.989 41.948 13.820 706 HG22 ILE 96 HG22 ILE 96 29.153 43.365 13.201 707 HG23 ILE 96 HG23 ILE 96 29.156 43.026 14.929 708 HD11 ILE 96 HD11 ILE 96 30.951 45.980 12.769 709 HD12 ILE 96 HD12 ILE 96 32.207 46.388 13.930 710 HD13 ILE 96 HD13 ILE 96 30.639 47.193 14.008 711 H TYR 97 H TYR 97 31.109 40.839 15.862 712 HA TYR 97 HA TYR 97 32.722 39.360 13.796 713 HB2 TYR 97 HB2 TYR 97 32.296 38.675 16.722 714 HB3 TYR 97 HB3 TYR 97 32.758 37.455 15.533 715 HD1 TYR 97 HD1 TYR 97 33.723 40.951 16.478 716 HD2 TYR 97 HD2 TYR 97 35.050 37.043 15.290 717 HE1 TYR 97 HE1 TYR 97 36.066 41.713 16.607 718 HE2 TYR 97 HE2 TYR 97 37.407 37.812 15.431 719 HH TYR 97 HH TYR 97 38.734 39.529 16.359 720 H LYS 98 H LYS 98 31.633 37.298 13.110 721 HA LYS 98 HA LYS 98 28.666 37.467 13.660 722 HB2 LYS 98 HB2 LYS 98 28.164 37.290 11.386 723 HB3 LYS 98 HB3 LYS 98 29.624 38.284 11.359 724 HG2 LYS 98 HG2 LYS 98 31.001 36.281 10.936 725 HG3 LYS 98 HG3 LYS 98 29.558 35.268 10.965 726 HD2 LYS 98 HD2 LYS 98 30.317 37.377 8.933 727 HD3 LYS 98 HD3 LYS 98 29.967 35.676 8.655 728 HE2 LYS 98 HE2 LYS 98 28.007 37.880 9.355 729 HE3 LYS 98 HE3 LYS 98 28.025 36.858 7.923 730 HZ1 LYS 98 HZ1 LYS 98 27.178 35.089 9.054 731 HZ2 LYS 98 HZ2 LYS 98 26.466 36.353 9.927 732 HZ3 LYS 98 HZ3 LYS 98 27.839 35.572 10.543 733 H THR 99 H THR 99 27.515 35.574 13.872 734 HA THR 99 HA THR 99 28.972 33.005 13.466 735 HB THR 99 HB THR 99 29.188 33.091 15.797 736 HG1 THR 99 HG1 THR 99 28.146 31.211 15.452 737 HG21 THR 99 HG21 THR 99 27.561 34.026 17.326 738 HG22 THR 99 HG22 THR 99 26.414 34.276 16.012 739 HG23 THR 99 HG23 THR 99 27.912 35.208 16.064 740 H THR 100 H THR 100 27.751 31.625 12.358 741 HA THR 100 HA THR 100 24.822 32.185 11.893 742 HB THR 100 HB THR 100 25.354 30.801 9.741 743 HG1 THR 100 HG1 THR 100 27.630 30.597 10.832 744 HG21 THR 100 HG21 THR 100 26.776 33.312 9.377 745 HG22 THR 100 HG22 THR 100 25.309 33.534 10.334 746 HG23 THR 100 HG23 THR 100 25.213 32.813 8.728 747 H ASP 101 H ASP 101 26.655 30.247 13.712 748 HA ASP 101 HA ASP 101 24.971 27.826 13.108 749 HB2 ASP 101 HB2 ASP 101 26.993 26.885 14.672 750 HB3 ASP 101 HB3 ASP 101 27.073 26.946 12.911 751 H ALA 102 H ALA 102 24.097 30.105 14.675 752 HA ALA 102 HA ALA 102 22.990 30.543 16.678 753 HB1 ALA 102 HB1 ALA 102 23.223 27.583 17.249 754 HB2 ALA 102 HB2 ALA 102 22.098 28.226 16.053 755 HB3 ALA 102 HB3 ALA 102 21.946 28.694 17.746 756 H TYR 103 H TYR 103 25.218 31.513 17.196 757 HA TYR 103 HA TYR 103 26.811 32.021 18.822 758 HB2 TYR 103 HB2 TYR 103 25.297 30.041 20.555 759 HB3 TYR 103 HB3 TYR 103 26.378 31.315 21.108 760 HD1 TYR 103 HD1 TYR 103 25.517 33.563 19.318 761 HD2 TYR 103 HD2 TYR 103 23.220 30.663 21.494 762 HE1 TYR 103 HE1 TYR 103 23.616 35.151 19.433 763 HE2 TYR 103 HE2 TYR 103 21.322 32.248 21.602 764 HH TYR 103 HH TYR 103 21.678 35.590 20.627 765 H GLN 104 H GLN 104 27.533 29.955 16.945 766 HA GLN 104 HA GLN 104 29.158 28.127 18.720 767 HB2 GLN 104 HB2 GLN 104 28.115 27.709 15.919 768 HB3 GLN 104 HB3 GLN 104 29.310 26.668 16.669 769 HG2 GLN 104 HG2 GLN 104 26.824 27.237 18.221 770 HG3 GLN 104 HG3 GLN 104 26.681 26.158 16.833 771 HE21 GLN 104 HE21 GLN 104 26.383 25.193 19.528 772 HE22 GLN 104 HE22 GLN 104 27.680 24.149 19.854 773 H THR 105 H THR 105 29.558 29.085 15.261 774 HA THR 105 HA THR 105 32.436 29.582 15.912 775 HB THR 105 HB THR 105 32.858 29.486 13.560 776 HG1 THR 105 HG1 THR 105 30.082 29.257 13.059 777 HG21 THR 105 HG21 THR 105 31.388 27.333 12.993 778 HG22 THR 105 HG22 THR 105 31.010 27.439 14.716 779 HG23 THR 105 HG23 THR 105 32.687 27.271 14.184 780 H PHE 106 H PHE 106 33.138 31.629 16.215 781 HA PHE 106 HA PHE 106 31.432 33.901 15.316 782 HB2 PHE 106 HB2 PHE 106 33.718 33.831 17.304 783 HB3 PHE 106 HB3 PHE 106 32.705 35.227 16.946 784 HD1 PHE 106 HD1 PHE 106 32.300 31.600 17.892 785 HD2 PHE 106 HD2 PHE 106 30.933 35.655 18.351 786 HE1 PHE 106 HE1 PHE 106 30.649 30.851 19.592 787 HE2 PHE 106 HE2 PHE 106 29.293 34.912 20.053 788 HZ PHE 106 HZ PHE 106 29.146 32.508 20.673 789 H THR 107 H THR 107 32.272 33.832 13.075 790 HA THR 107 HA THR 107 35.112 34.323 12.689 791 HB THR 107 HB THR 107 32.751 34.332 10.800 792 HG1 THR 107 HG1 THR 107 33.604 32.327 11.493 793 HG21 THR 107 HG21 THR 107 35.640 35.046 10.270 794 HG22 THR 107 HG22 THR 107 34.202 36.004 9.907 795 HG23 THR 107 HG23 THR 107 34.535 34.526 9.000 796 H LYS 108 H LYS 108 36.090 36.264 12.125 797 HA LYS 108 HA LYS 108 34.810 38.652 13.203 798 HB2 LYS 108 HB2 LYS 108 37.252 38.305 13.426 799 HB3 LYS 108 HB3 LYS 108 37.420 38.379 11.673 800 HG2 LYS 108 HG2 LYS 108 36.507 40.674 11.669 801 HG3 LYS 108 HG3 LYS 108 36.315 40.607 13.420 802 HD2 LYS 108 HD2 LYS 108 38.709 40.440 13.741 803 HD3 LYS 108 HD3 LYS 108 38.978 40.266 12.007 804 HE2 LYS 108 HE2 LYS 108 39.474 42.551 12.529 805 HE3 LYS 108 HE3 LYS 108 37.908 42.568 11.730 806 HZ1 LYS 108 HZ1 LYS 108 36.849 43.237 13.598 807 HZ2 LYS 108 HZ2 LYS 108 38.410 43.738 14.091 808 HZ3 LYS 108 HZ3 LYS 108 37.802 42.238 14.611 809 H ILE 109 H ILE 109 34.058 40.436 12.067 810 HA ILE 109 HA ILE 109 34.015 40.223 9.084 811 HB ILE 109 HB ILE 109 31.746 41.235 9.117 812 HG12 ILE 109 HG12 ILE 109 31.878 40.715 12.099 813 HG13 ILE 109 HG13 ILE 109 31.972 42.316 11.362 814 HG21 ILE 109 HG21 ILE 109 32.284 38.677 9.230 815 HG22 ILE 109 HG22 ILE 109 30.624 39.222 9.484 816 HG23 ILE 109 HG23 ILE 109 31.634 38.793 10.869 817 HD11 ILE 109 HD11 ILE 109 29.743 42.389 10.987 818 HD12 ILE 109 HD12 ILE 109 29.640 41.041 12.120 819 HD13 ILE 109 HD13 ILE 109 29.707 40.730 10.389 820 H ARG 110 H ARG 110 34.129 42.272 11.950 821 HA ARG 110 HA ARG 110 35.251 44.488 10.286 822 HB2 ARG 110 HB2 ARG 110 33.061 44.784 12.376 823 HB3 ARG 110 HB3 ARG 110 33.954 46.133 11.679 824 HG2 ARG 110 HG2 ARG 110 32.828 44.277 9.689 825 HG3 ARG 110 HG3 ARG 110 31.615 45.111 10.650 826 HD2 ARG 110 HD2 ARG 110 32.845 47.265 10.145 827 HD3 ARG 110 HD3 ARG 110 33.827 46.367 8.993 828 HE ARG 110 HE ARG 110 31.219 47.431 8.491 829 HH11 ARG 110 HH11 ARG 110 32.890 44.412 8.079 830 HH12 ARG 110 HH12 ARG 110 31.783 43.873 6.862 831 HH21 ARG 110 HH21 ARG 110 29.865 46.720 6.937 832 HH22 ARG 110 HH22 ARG 110 30.125 45.155 6.186 Start of MODEL 5 1 H VAL 3 H VAL 3 16.425 49.278 12.574 2 HA VAL 3 HA VAL 3 14.314 48.138 11.744 3 HB VAL 3 HB VAL 3 14.559 50.123 9.497 4 HG11 VAL 3 HG11 VAL 3 13.304 48.141 9.007 5 HG12 VAL 3 HG12 VAL 3 12.119 49.418 9.288 6 HG13 VAL 3 HG13 VAL 3 12.446 48.224 10.546 7 HG21 VAL 3 HG21 VAL 3 13.078 50.461 12.108 8 HG22 VAL 3 HG22 VAL 3 12.451 51.179 10.625 9 HG23 VAL 3 HG23 VAL 3 14.040 51.651 11.228 10 H ILE 4 H ILE 4 16.903 47.455 11.971 11 HA ILE 4 HA ILE 4 17.586 46.533 9.196 12 HB ILE 4 HB ILE 4 19.490 47.835 11.184 13 HG12 ILE 4 HG12 ILE 4 19.508 48.600 8.333 14 HG13 ILE 4 HG13 ILE 4 17.991 48.956 9.156 15 HG21 ILE 4 HG21 ILE 4 21.184 47.299 9.306 16 HG22 ILE 4 HG22 ILE 4 20.002 46.118 8.748 17 HG23 ILE 4 HG23 ILE 4 20.704 45.967 10.359 18 HD11 ILE 4 HD11 ILE 4 19.033 50.372 10.735 19 HD12 ILE 4 HD12 ILE 4 19.863 50.752 9.224 20 HD13 ILE 4 HD13 ILE 4 20.636 49.699 10.407 21 H ASN 5 H ASN 5 18.613 44.475 9.140 22 HA ASN 5 HA ASN 5 19.117 43.045 11.697 23 HB2 ASN 5 HB2 ASN 5 17.639 41.180 11.014 24 HB3 ASN 5 HB3 ASN 5 16.710 42.669 11.198 25 HD21 ASN 5 HD21 ASN 5 15.518 40.809 9.578 26 HD22 ASN 5 HD22 ASN 5 15.666 41.235 7.942 27 H THR 6 H THR 6 20.754 43.953 9.415 28 HA THR 6 HA THR 6 21.593 41.284 8.339 29 HB THR 6 HB THR 6 22.360 42.420 6.345 30 HG1 THR 6 HG1 THR 6 22.127 44.685 6.200 31 HG21 THR 6 HG21 THR 6 20.282 42.775 5.418 32 HG22 THR 6 HG22 THR 6 19.750 43.810 6.745 33 HG23 THR 6 HG23 THR 6 19.766 42.057 6.944 34 H PHE 7 H PHE 7 23.705 40.716 8.556 35 HA PHE 7 HA PHE 7 25.319 41.481 10.620 36 HB2 PHE 7 HB2 PHE 7 26.135 40.543 7.859 37 HB3 PHE 7 HB3 PHE 7 27.286 40.691 9.193 38 HD1 PHE 7 HD1 PHE 7 26.400 39.703 11.502 39 HD2 PHE 7 HD2 PHE 7 25.053 38.513 7.589 40 HE1 PHE 7 HE1 PHE 7 25.550 37.572 12.440 41 HE2 PHE 7 HE2 PHE 7 24.210 36.373 8.520 42 HZ PHE 7 HZ PHE 7 24.448 35.901 10.956 43 H ASP 8 H ASP 8 26.771 42.285 7.604 44 HA ASP 8 HA ASP 8 28.408 44.354 8.329 45 HB2 ASP 8 HB2 ASP 8 27.017 43.577 5.807 46 HB3 ASP 8 HB3 ASP 8 27.772 45.174 5.838 47 H GLY 9 H GLY 9 25.084 44.681 7.128 48 HA2 GLY 9 HA2 GLY 9 24.772 47.464 7.237 49 HA3 GLY 9 HA3 GLY 9 23.459 46.328 7.520 50 H VAL 10 H VAL 10 24.112 45.124 9.899 51 HA VAL 10 HA VAL 10 23.440 47.160 11.831 52 HB VAL 10 HB VAL 10 24.480 44.322 12.173 53 HG11 VAL 10 HG11 VAL 10 25.134 45.347 14.183 54 HG12 VAL 10 HG12 VAL 10 23.507 44.787 14.565 55 HG13 VAL 10 HG13 VAL 10 23.785 46.482 14.159 56 HG21 VAL 10 HG21 VAL 10 21.748 45.606 12.593 57 HG22 VAL 10 HG22 VAL 10 22.133 43.906 12.861 58 HG23 VAL 10 HG23 VAL 10 22.188 44.578 11.230 59 H ALA 11 H ALA 11 26.504 45.407 11.152 60 HA ALA 11 HA ALA 11 28.146 46.555 13.148 61 HB1 ALA 11 HB1 ALA 11 29.878 46.275 11.089 62 HB2 ALA 11 HB2 ALA 11 28.524 45.326 10.493 63 HB3 ALA 11 HB3 ALA 11 29.279 44.912 12.030 64 H ASP 12 H ASP 12 27.867 47.649 9.743 65 HA ASP 12 HA ASP 12 29.349 50.038 9.931 66 HB2 ASP 12 HB2 ASP 12 27.063 49.096 8.253 67 HB3 ASP 12 HB3 ASP 12 27.455 50.815 8.221 68 H TYR 13 H TYR 13 25.860 49.551 10.434 69 HA TYR 13 HA TYR 13 25.115 52.175 11.081 70 HB2 TYR 13 HB2 TYR 13 23.699 49.979 10.926 71 HB3 TYR 13 HB3 TYR 13 24.057 49.837 12.644 72 HD1 TYR 13 HD1 TYR 13 22.367 51.876 10.070 73 HD2 TYR 13 HD2 TYR 13 23.111 51.351 14.276 74 HE1 TYR 13 HE1 TYR 13 20.525 53.458 10.595 75 HE2 TYR 13 HE2 TYR 13 21.264 52.926 14.791 76 HH TYR 13 HH TYR 13 18.924 53.674 13.096 77 H LEU 14 H LEU 14 26.238 49.621 13.225 78 HA LEU 14 HA LEU 14 26.346 51.249 15.587 79 HB2 LEU 14 HB2 LEU 14 27.447 48.566 14.782 80 HB3 LEU 14 HB3 LEU 14 27.899 49.283 16.328 81 HG LEU 14 HG LEU 14 25.053 48.756 15.390 82 HD11 LEU 14 HD11 LEU 14 26.783 46.853 16.206 83 HD12 LEU 14 HD12 LEU 14 25.068 46.808 16.606 84 HD13 LEU 14 HD13 LEU 14 26.230 47.418 17.783 85 HD21 LEU 14 HD21 LEU 14 26.185 50.391 17.542 86 HD22 LEU 14 HD22 LEU 14 25.081 49.160 18.152 87 HD23 LEU 14 HD23 LEU 14 24.526 50.321 16.946 88 H GLN 15 H GLN 15 28.939 50.220 13.263 89 HA GLN 15 HA GLN 15 31.002 51.574 14.716 90 HB2 GLN 15 HB2 GLN 15 30.829 50.771 11.833 91 HB3 GLN 15 HB3 GLN 15 32.269 51.519 12.524 92 HG2 GLN 15 HG2 GLN 15 31.855 49.572 14.353 93 HG3 GLN 15 HG3 GLN 15 31.165 48.786 12.934 94 HE21 GLN 15 HE21 GLN 15 33.611 47.869 14.200 95 HE22 GLN 15 HE22 GLN 15 34.876 48.091 13.088 96 H THR 16 H THR 16 28.563 52.818 12.644 97 HA THR 16 HA THR 16 30.054 55.392 12.366 98 HB THR 16 HB THR 16 27.410 54.695 11.054 99 HG1 THR 16 HG1 THR 16 28.930 53.129 10.433 100 HG21 THR 16 HG21 THR 16 27.953 57.022 10.967 101 HG22 THR 16 HG22 THR 16 28.317 56.333 9.384 102 HG23 THR 16 HG23 THR 16 29.624 56.676 10.520 103 H TYR 17 H TYR 17 26.859 54.184 13.451 104 HA TYR 17 HA TYR 17 26.325 56.851 14.668 105 HB2 TYR 17 HB2 TYR 17 24.490 54.498 14.118 106 HB3 TYR 17 HB3 TYR 17 23.983 56.075 14.728 107 HD1 TYR 17 HD1 TYR 17 24.478 58.159 13.307 108 HD2 TYR 17 HD2 TYR 17 24.797 54.137 11.808 109 HE1 TYR 17 HE1 TYR 17 24.390 59.015 10.977 110 HE2 TYR 17 HE2 TYR 17 24.712 54.995 9.482 111 HH TYR 17 HH TYR 17 25.376 57.862 8.563 112 H HIS 18 H HIS 18 27.225 53.678 15.535 113 HA HIS 18 HA HIS 18 27.505 52.616 17.588 114 HB2 HIS 18 HB2 HIS 18 27.369 55.512 18.449 115 HB3 HIS 18 HB3 HIS 18 27.689 54.200 19.585 116 HD1 HIS 18 HD1 HIS 18 29.069 53.115 16.482 117 HD2 HIS 18 HD2 HIS 18 30.328 55.823 19.421 118 HE1 HIS 18 HE1 HIS 18 31.583 53.391 16.201 119 H LYS 19 H LYS 19 24.683 54.646 17.256 120 HA LYS 19 HA LYS 19 23.283 53.579 19.537 121 HB2 LYS 19 HB2 LYS 19 22.133 55.469 19.014 122 HB3 LYS 19 HB3 LYS 19 22.802 55.490 17.387 123 HG2 LYS 19 HG2 LYS 19 21.120 53.746 16.724 124 HG3 LYS 19 HG3 LYS 19 20.401 53.887 18.323 125 HD2 LYS 19 HD2 LYS 19 19.091 55.384 17.147 126 HD3 LYS 19 HD3 LYS 19 20.362 56.471 17.701 127 HE2 LYS 19 HE2 LYS 19 20.725 56.995 15.532 128 HE3 LYS 19 HE3 LYS 19 21.372 55.367 15.325 129 HZ1 LYS 19 HZ1 LYS 19 19.669 54.931 13.974 130 HZ2 LYS 19 HZ2 LYS 19 18.985 56.465 14.290 131 HZ3 LYS 19 HZ3 LYS 19 18.576 55.135 15.283 132 H LEU 20 H LEU 20 22.603 51.552 19.672 133 HA LEU 20 HA LEU 20 22.725 49.572 17.741 134 HB2 LEU 20 HB2 LEU 20 21.233 49.928 20.256 135 HB3 LEU 20 HB3 LEU 20 20.491 48.786 19.136 136 HG LEU 20 HG LEU 20 23.446 48.597 19.536 137 HD11 LEU 20 HD11 LEU 20 21.366 47.740 21.569 138 HD12 LEU 20 HD12 LEU 20 22.779 48.759 21.840 139 HD13 LEU 20 HD13 LEU 20 22.982 47.042 21.497 140 HD21 LEU 20 HD21 LEU 20 21.609 47.213 18.099 141 HD22 LEU 20 HD22 LEU 20 21.614 46.265 19.586 142 HD23 LEU 20 HD23 LEU 20 23.113 46.504 18.686 143 HA PRO 21 HA PRO 21 20.094 50.751 14.358 144 HB2 PRO 21 HB2 PRO 21 19.276 47.882 14.523 145 HB3 PRO 21 HB3 PRO 21 19.798 48.828 13.118 146 HG2 PRO 21 HG2 PRO 21 21.394 47.076 14.486 147 HG3 PRO 21 HG3 PRO 21 21.989 48.423 13.502 148 HD2 PRO 21 HD2 PRO 21 22.148 48.100 16.382 149 HD3 PRO 21 HD3 PRO 21 22.835 49.395 15.381 150 H ASP 22 H ASP 22 18.089 51.612 14.320 151 HA ASP 22 HA ASP 22 16.338 51.459 16.571 152 HB2 ASP 22 HB2 ASP 22 15.315 52.352 13.911 153 HB3 ASP 22 HB3 ASP 22 15.159 53.124 15.492 154 H ASN 23 H ASN 23 16.187 49.071 16.668 155 HA ASN 23 HA ASN 23 13.638 48.081 15.994 156 HB2 ASN 23 HB2 ASN 23 14.277 46.443 14.160 157 HB3 ASN 23 HB3 ASN 23 14.231 48.132 13.665 158 HD21 ASN 23 HD21 ASN 23 16.408 45.456 14.444 159 HD22 ASN 23 HD22 ASN 23 17.796 46.161 13.769 160 H TYR 24 H TYR 24 16.241 47.865 17.797 161 HA TYR 24 HA TYR 24 16.194 44.885 18.111 162 HB2 TYR 24 HB2 TYR 24 18.317 46.964 18.462 163 HB3 TYR 24 HB3 TYR 24 18.380 45.539 19.501 164 HD1 TYR 24 HD1 TYR 24 18.230 43.233 18.381 165 HD2 TYR 24 HD2 TYR 24 19.056 46.849 16.232 166 HE1 TYR 24 HE1 TYR 24 19.128 41.904 16.489 167 HE2 TYR 24 HE2 TYR 24 19.957 45.523 14.342 168 HH TYR 24 HH TYR 24 19.898 41.947 14.411 169 H ILE 25 H ILE 25 16.553 44.119 20.439 170 HA ILE 25 HA ILE 25 15.807 45.976 22.579 171 HB ILE 25 HB ILE 25 13.887 44.116 23.164 172 HG12 ILE 25 HG12 ILE 25 13.650 44.543 20.180 173 HG13 ILE 25 HG13 ILE 25 14.410 43.106 20.861 174 HG21 ILE 25 HG21 ILE 25 12.492 45.920 22.998 175 HG22 ILE 25 HG22 ILE 25 12.950 46.250 21.327 176 HG23 ILE 25 HG23 ILE 25 13.977 46.804 22.641 177 HD11 ILE 25 HD11 ILE 25 11.551 43.910 20.848 178 HD12 ILE 25 HD12 ILE 25 12.135 43.128 22.316 179 HD13 ILE 25 HD13 ILE 25 12.271 42.305 20.762 180 H THR 26 H THR 26 16.179 45.071 24.646 181 HA THR 26 HA THR 26 18.256 43.033 24.740 182 HB THR 26 HB THR 26 18.012 43.278 27.190 183 HG1 THR 26 HG1 THR 26 15.784 44.907 26.495 184 HG21 THR 26 HG21 THR 26 17.859 45.988 27.063 185 HG22 THR 26 HG22 THR 26 18.160 45.612 25.368 186 HG23 THR 26 HG23 THR 26 19.296 45.077 26.603 187 H LYS 27 H LYS 27 18.062 40.916 25.745 188 HA LYS 27 HA LYS 27 15.798 39.334 25.053 189 HB2 LYS 27 HB2 LYS 27 18.257 39.006 26.622 190 HB3 LYS 27 HB3 LYS 27 16.913 38.141 27.355 191 HG2 LYS 27 HG2 LYS 27 17.165 36.504 25.831 192 HG3 LYS 27 HG3 LYS 27 16.738 37.646 24.561 193 HD2 LYS 27 HD2 LYS 27 19.530 37.794 25.594 194 HD3 LYS 27 HD3 LYS 27 19.130 36.370 24.638 195 HE2 LYS 27 HE2 LYS 27 18.492 37.696 22.753 196 HE3 LYS 27 HE3 LYS 27 18.497 39.179 23.713 197 HZ1 LYS 27 HZ1 LYS 27 20.561 38.464 22.196 198 HZ2 LYS 27 HZ2 LYS 27 20.977 37.631 23.630 199 HZ3 LYS 27 HZ3 LYS 27 20.757 39.330 23.663 200 H SER 28 H SER 28 16.698 40.813 28.205 201 HA SER 28 HA SER 28 14.465 40.120 29.761 202 HB2 SER 28 HB2 SER 28 16.144 41.353 30.866 203 HB3 SER 28 HB3 SER 28 16.106 42.647 29.670 204 HG SER 28 HG SER 28 14.467 43.515 30.687 205 H GLU 29 H GLU 29 14.675 43.225 27.928 206 HA GLU 29 HA GLU 29 12.022 44.057 28.189 207 HB2 GLU 29 HB2 GLU 29 13.911 44.246 25.832 208 HB3 GLU 29 HB3 GLU 29 12.357 45.075 25.877 209 HG2 GLU 29 HG2 GLU 29 13.015 46.443 27.672 210 HG3 GLU 29 HG3 GLU 29 14.375 45.422 28.112 211 H ALA 30 H ALA 30 13.338 42.133 25.435 212 HA ALA 30 HA ALA 30 10.892 41.536 24.178 213 HB1 ALA 30 HB1 ALA 30 13.189 40.952 23.330 214 HB2 ALA 30 HB2 ALA 30 12.038 39.624 23.192 215 HB3 ALA 30 HB3 ALA 30 13.231 39.628 24.493 216 H GLN 31 H GLN 31 12.540 39.635 26.725 217 HA GLN 31 HA GLN 31 10.514 37.624 26.979 218 HB2 GLN 31 HB2 GLN 31 12.584 38.647 28.939 219 HB3 GLN 31 HB3 GLN 31 11.594 37.212 29.219 220 HG2 GLN 31 HG2 GLN 31 12.540 36.074 27.347 221 HG3 GLN 31 HG3 GLN 31 13.273 37.551 26.728 222 HE21 GLN 31 HE21 GLN 31 13.614 34.985 29.107 223 HE22 GLN 31 HE22 GLN 31 15.163 35.431 29.632 224 H ALA 32 H ALA 32 11.098 40.559 28.961 225 HA ALA 32 HA ALA 32 8.783 40.170 30.616 226 HB1 ALA 32 HB1 ALA 32 10.451 41.604 31.479 227 HB2 ALA 32 HB2 ALA 32 9.149 42.707 31.034 228 HB3 ALA 32 HB3 ALA 32 10.551 42.521 29.980 229 H LEU 33 H LEU 33 9.261 41.776 27.517 230 HA LEU 33 HA LEU 33 6.731 43.122 27.471 231 HB2 LEU 33 HB2 LEU 33 8.718 42.311 25.377 232 HB3 LEU 33 HB3 LEU 33 7.117 42.845 24.868 233 HG LEU 33 HG LEU 33 8.616 44.509 26.870 234 HD11 LEU 33 HD11 LEU 33 10.359 44.584 25.378 235 HD12 LEU 33 HD12 LEU 33 9.307 45.752 24.578 236 HD13 LEU 33 HD13 LEU 33 9.358 44.083 24.016 237 HD21 LEU 33 HD21 LEU 33 6.391 45.233 26.414 238 HD22 LEU 33 HD22 LEU 33 6.575 44.958 24.682 239 HD23 LEU 33 HD23 LEU 33 7.423 46.295 25.456 240 H GLY 34 H GLY 34 7.602 39.812 27.107 241 HA2 GLY 34 HA2 GLY 34 5.489 38.369 27.458 242 HA3 GLY 34 HA3 GLY 34 4.874 39.194 26.030 243 H TRP 35 H TRP 35 8.115 38.870 25.457 244 HA TRP 35 HA TRP 35 7.789 36.892 23.427 245 HB2 TRP 35 HB2 TRP 35 9.676 38.496 23.448 246 HB3 TRP 35 HB3 TRP 35 10.334 37.695 24.876 247 HD1 TRP 35 HD1 TRP 35 8.892 36.127 21.651 248 HE1 TRP 35 HE1 TRP 35 10.670 34.555 20.666 249 HE3 TRP 35 HE3 TRP 35 12.709 36.946 24.930 250 HZ2 TRP 35 HZ2 TRP 35 13.369 33.745 21.195 251 HZ3 TRP 35 HZ3 TRP 35 14.873 35.762 24.682 252 HH2 TRP 35 HH2 TRP 35 15.207 34.162 22.816 253 H VAL 36 H VAL 36 7.262 34.796 23.800 254 HA VAL 36 HA VAL 36 8.568 33.415 26.141 255 HB VAL 36 HB VAL 36 5.764 33.205 25.027 256 HG11 VAL 36 HG11 VAL 36 6.366 30.927 25.358 257 HG12 VAL 36 HG12 VAL 36 5.581 31.396 26.864 258 HG13 VAL 36 HG13 VAL 36 7.339 31.307 26.781 259 HG21 VAL 36 HG21 VAL 36 6.970 33.802 27.750 260 HG22 VAL 36 HG22 VAL 36 5.241 33.626 27.450 261 HG23 VAL 36 HG23 VAL 36 6.139 34.944 26.696 262 H ALA 37 H ALA 37 9.377 31.378 25.810 263 HA ALA 37 HA ALA 37 10.248 30.616 23.199 264 HB1 ALA 37 HB1 ALA 37 10.916 28.474 24.368 265 HB2 ALA 37 HB2 ALA 37 10.125 29.092 25.817 266 HB3 ALA 37 HB3 ALA 37 11.511 29.942 25.139 267 H SER 38 H SER 38 7.692 29.208 25.281 268 HA SER 38 HA SER 38 6.881 27.367 23.153 269 HB2 SER 38 HB2 SER 38 5.318 26.518 24.720 270 HB3 SER 38 HB3 SER 38 6.673 27.042 25.722 271 HG SER 38 HG SER 38 4.344 28.569 25.110 272 H LYS 39 H LYS 39 6.898 29.767 22.030 273 HA LYS 39 HA LYS 39 4.234 30.170 21.063 274 HB2 LYS 39 HB2 LYS 39 4.064 31.252 23.350 275 HB3 LYS 39 HB3 LYS 39 5.274 32.421 22.815 276 HG2 LYS 39 HG2 LYS 39 3.845 33.399 21.261 277 HG3 LYS 39 HG3 LYS 39 2.858 31.948 21.096 278 HD2 LYS 39 HD2 LYS 39 2.387 32.481 23.701 279 HD3 LYS 39 HD3 LYS 39 2.713 34.119 23.139 280 HE2 LYS 39 HE2 LYS 39 0.399 33.911 22.798 281 HE3 LYS 39 HE3 LYS 39 1.058 33.535 21.204 282 HZ1 LYS 39 HZ1 LYS 39 1.085 31.123 22.175 283 HZ2 LYS 39 HZ2 LYS 39 -0.348 31.770 21.523 284 HZ3 LYS 39 HZ3 LYS 39 -0.117 31.730 23.208 285 H GLY 40 H GLY 40 7.266 32.004 21.701 286 HA2 GLY 40 HA2 GLY 40 8.761 32.981 20.153 287 HA3 GLY 40 HA3 GLY 40 7.939 32.089 18.872 288 H ASN 41 H ASN 41 5.948 33.934 20.923 289 HA ASN 41 HA ASN 41 4.776 35.486 18.893 290 HB2 ASN 41 HB2 ASN 41 4.132 37.079 20.811 291 HB3 ASN 41 HB3 ASN 41 3.595 35.410 20.945 292 HD21 ASN 41 HD21 ASN 41 4.816 37.791 22.827 293 HD22 ASN 41 HD22 ASN 41 5.684 36.858 23.961 294 H LEU 42 H LEU 42 5.385 37.256 17.803 295 HA LEU 42 HA LEU 42 7.093 39.315 18.892 296 HB2 LEU 42 HB2 LEU 42 8.643 37.269 18.277 297 HB3 LEU 42 HB3 LEU 42 8.390 37.812 16.620 298 HG LEU 42 HG LEU 42 8.992 40.179 17.658 299 HD11 LEU 42 HD11 LEU 42 10.801 39.846 19.384 300 HD12 LEU 42 HD12 LEU 42 10.263 38.175 19.538 301 HD13 LEU 42 HD13 LEU 42 9.175 39.494 19.967 302 HD21 LEU 42 HD21 LEU 42 11.537 39.242 17.396 303 HD22 LEU 42 HD22 LEU 42 10.492 39.633 16.034 304 HD23 LEU 42 HD23 LEU 42 10.635 37.961 16.584 305 H ALA 43 H ALA 43 6.388 37.773 15.760 306 HA ALA 43 HA ALA 43 6.193 40.134 14.196 307 HB1 ALA 43 HB1 ALA 43 6.184 37.671 13.431 308 HB2 ALA 43 HB2 ALA 43 5.108 38.763 12.560 309 HB3 ALA 43 HB3 ALA 43 4.457 37.679 13.788 310 H ASP 44 H ASP 44 3.986 38.712 16.482 311 HA ASP 44 HA ASP 44 1.612 40.173 15.599 312 HB2 ASP 44 HB2 ASP 44 0.902 39.367 18.015 313 HB3 ASP 44 HB3 ASP 44 1.115 38.182 16.728 314 H VAL 45 H VAL 45 3.591 40.345 18.570 315 HA VAL 45 HA VAL 45 2.573 42.972 19.261 316 HB VAL 45 HB VAL 45 4.358 42.893 21.033 317 HG11 VAL 45 HG11 VAL 45 3.305 41.114 22.310 318 HG12 VAL 45 HG12 VAL 45 2.706 40.353 20.833 319 HG13 VAL 45 HG13 VAL 45 2.071 41.919 21.340 320 HG21 VAL 45 HG21 VAL 45 6.148 41.645 20.189 321 HG22 VAL 45 HG22 VAL 45 5.089 40.435 19.458 322 HG23 VAL 45 HG23 VAL 45 5.342 40.447 21.202 323 H ALA 46 H ALA 46 5.203 41.773 17.323 324 HA ALA 46 HA ALA 46 5.955 44.566 16.681 325 HB1 ALA 46 HB1 ALA 46 8.276 44.254 17.178 326 HB2 ALA 46 HB2 ALA 46 8.066 42.522 17.436 327 HB3 ALA 46 HB3 ALA 46 7.406 43.675 18.598 328 HA PRO 47 HA PRO 47 5.462 41.670 13.044 329 HB2 PRO 47 HB2 PRO 47 4.734 44.255 11.783 330 HB3 PRO 47 HB3 PRO 47 3.887 42.699 11.741 331 HG2 PRO 47 HG2 PRO 47 2.998 44.771 13.188 332 HG3 PRO 47 HG3 PRO 47 2.791 43.093 13.714 333 HD2 PRO 47 HD2 PRO 47 4.703 45.155 14.718 334 HD3 PRO 47 HD3 PRO 47 3.905 43.835 15.591 335 H GLY 48 H GLY 48 8.063 42.374 13.769 336 HA2 GLY 48 HA2 GLY 48 9.708 42.170 11.695 337 HA3 GLY 48 HA3 GLY 48 9.184 43.824 11.399 338 H LYS 49 H LYS 49 9.980 42.181 14.474 339 HA LYS 49 HA LYS 49 12.085 44.225 14.795 340 HB2 LYS 49 HB2 LYS 49 9.940 44.274 16.325 341 HB3 LYS 49 HB3 LYS 49 10.789 42.994 17.193 342 HG2 LYS 49 HG2 LYS 49 12.457 44.394 17.924 343 HG3 LYS 49 HG3 LYS 49 12.383 45.407 16.485 344 HD2 LYS 49 HD2 LYS 49 10.222 46.352 17.302 345 HD3 LYS 49 HD3 LYS 49 10.405 45.414 18.786 346 HE2 LYS 49 HE2 LYS 49 12.755 46.561 18.922 347 HE3 LYS 49 HE3 LYS 49 12.062 47.728 17.796 348 HZ1 LYS 49 HZ1 LYS 49 11.202 47.093 20.553 349 HZ2 LYS 49 HZ2 LYS 49 10.137 47.840 19.460 350 HZ3 LYS 49 HZ3 LYS 49 11.594 48.603 19.890 351 H SER 50 H SER 50 14.082 43.549 15.708 352 HA SER 50 HA SER 50 14.347 40.562 15.909 353 HB2 SER 50 HB2 SER 50 16.512 42.527 15.119 354 HB3 SER 50 HB3 SER 50 16.595 40.768 15.044 355 HG SER 50 HG SER 50 14.957 42.532 13.538 356 H ILE 51 H ILE 51 15.261 39.745 17.758 357 HA ILE 51 HA ILE 51 15.494 41.481 20.050 358 HB ILE 51 HB ILE 51 16.721 38.749 19.988 359 HG12 ILE 51 HG12 ILE 51 14.624 38.454 18.753 360 HG13 ILE 51 HG13 ILE 51 14.446 37.782 20.371 361 HG21 ILE 51 HG21 ILE 51 16.877 39.674 22.114 362 HG22 ILE 51 HG22 ILE 51 15.336 38.830 22.238 363 HG23 ILE 51 HG23 ILE 51 15.369 40.568 21.949 364 HD11 ILE 51 HD11 ILE 51 13.672 40.411 20.725 365 HD12 ILE 51 HD12 ILE 51 12.575 39.047 20.509 366 HD13 ILE 51 HD13 ILE 51 13.044 40.036 19.122 367 H GLY 52 H GLY 52 17.428 41.947 21.306 368 HA2 GLY 52 HA2 GLY 52 20.039 41.282 20.964 369 HA3 GLY 52 HA3 GLY 52 19.790 42.290 19.541 370 H GLY 53 H GLY 53 21.421 42.688 22.072 371 HA2 GLY 53 HA2 GLY 53 21.864 45.198 22.487 372 HA3 GLY 53 HA3 GLY 53 20.160 45.266 22.928 373 H ASP 54 H ASP 54 21.657 42.333 23.909 374 HA ASP 54 HA ASP 54 21.296 43.066 26.693 375 HB2 ASP 54 HB2 ASP 54 22.922 40.690 25.922 376 HB3 ASP 54 HB3 ASP 54 21.609 40.829 27.098 377 H ILE 55 H ILE 55 23.304 42.139 28.056 378 HA ILE 55 HA ILE 55 25.750 43.630 27.237 379 HB ILE 55 HB ILE 55 24.511 43.471 29.962 380 HG12 ILE 55 HG12 ILE 55 23.804 45.040 27.718 381 HG13 ILE 55 HG13 ILE 55 23.267 45.274 29.371 382 HG21 ILE 55 HG21 ILE 55 26.924 45.007 28.919 383 HG22 ILE 55 HG22 ILE 55 26.956 43.659 30.058 384 HG23 ILE 55 HG23 ILE 55 26.238 45.198 30.532 385 HD11 ILE 55 HD11 ILE 55 24.245 47.349 28.586 386 HD12 ILE 55 HD12 ILE 55 25.706 46.511 28.068 387 HD13 ILE 55 HD13 ILE 55 25.333 46.655 29.789 388 H PHE 56 H PHE 56 27.687 42.656 27.800 389 HA PHE 56 HA PHE 56 27.713 40.363 29.634 390 HB2 PHE 56 HB2 PHE 56 26.979 39.597 27.245 391 HB3 PHE 56 HB3 PHE 56 28.681 39.818 26.838 392 HD1 PHE 56 HD1 PHE 56 26.448 38.155 29.370 393 HD2 PHE 56 HD2 PHE 56 30.227 38.129 27.316 394 HE1 PHE 56 HE1 PHE 56 26.998 35.958 30.399 395 HE2 PHE 56 HE2 PHE 56 30.776 35.939 28.344 396 HZ PHE 56 HZ PHE 56 29.162 34.852 29.884 397 H SER 57 H SER 57 29.815 39.882 30.360 398 HA SER 57 HA SER 57 31.800 41.988 29.756 399 HB2 SER 57 HB2 SER 57 32.926 40.440 31.723 400 HB3 SER 57 HB3 SER 57 31.898 41.842 32.011 401 HG SER 57 HG SER 57 30.176 40.532 32.344 402 H ASN 58 H ASN 58 31.209 38.716 28.951 403 HA ASN 58 HA ASN 58 32.418 37.238 27.603 404 HB2 ASN 58 HB2 ASN 58 32.839 39.357 26.303 405 HB3 ASN 58 HB3 ASN 58 34.357 39.524 27.178 406 HD21 ASN 58 HD21 ASN 58 35.664 39.190 25.255 407 HD22 ASN 58 HD22 ASN 58 35.788 37.670 24.508 408 H ARG 59 H ARG 59 33.090 37.545 30.518 409 HA ARG 59 HA ARG 59 35.889 37.292 30.999 410 HB2 ARG 59 HB2 ARG 59 33.410 36.403 32.387 411 HB3 ARG 59 HB3 ARG 59 34.884 35.547 32.798 412 HG2 ARG 59 HG2 ARG 59 36.008 37.621 33.382 413 HG3 ARG 59 HG3 ARG 59 34.587 38.555 32.917 414 HD2 ARG 59 HD2 ARG 59 34.916 36.652 35.235 415 HD3 ARG 59 HD3 ARG 59 34.359 38.325 35.273 416 HE ARG 59 HE ARG 59 32.678 36.030 35.001 417 HH11 ARG 59 HH11 ARG 59 33.179 39.114 33.630 418 HH12 ARG 59 HH12 ARG 59 31.671 39.150 32.752 419 HH21 ARG 59 HH21 ARG 59 30.738 36.006 33.827 420 HH22 ARG 59 HH22 ARG 59 30.347 37.355 32.821 421 H GLU 60 H GLU 60 33.490 35.065 29.752 422 HA GLU 60 HA GLU 60 34.971 32.643 29.991 423 HB2 GLU 60 HB2 GLU 60 32.855 33.535 28.004 424 HB3 GLU 60 HB3 GLU 60 33.481 31.888 28.085 425 HG2 GLU 60 HG2 GLU 60 31.379 32.120 29.389 426 HG3 GLU 60 HG3 GLU 60 32.736 31.683 30.420 427 H GLY 61 H GLY 61 35.562 35.419 28.133 428 HA2 GLY 61 HA2 GLY 61 37.193 35.884 26.522 429 HA3 GLY 61 HA3 GLY 61 37.957 34.370 27.006 430 H LYS 62 H LYS 62 34.723 34.819 25.625 431 HA LYS 62 HA LYS 62 35.413 32.871 23.484 432 HB2 LYS 62 HB2 LYS 62 33.064 33.417 25.002 433 HB3 LYS 62 HB3 LYS 62 32.699 33.831 23.330 434 HG2 LYS 62 HG2 LYS 62 34.195 31.313 23.579 435 HG3 LYS 62 HG3 LYS 62 32.635 31.277 24.400 436 HD2 LYS 62 HD2 LYS 62 31.933 30.691 22.277 437 HD3 LYS 62 HD3 LYS 62 31.822 32.443 22.138 438 HE2 LYS 62 HE2 LYS 62 34.517 31.491 21.545 439 HE3 LYS 62 HE3 LYS 62 33.310 30.747 20.492 440 HZ1 LYS 62 HZ1 LYS 62 33.777 32.707 19.400 441 HZ2 LYS 62 HZ2 LYS 62 33.979 33.613 20.842 442 HZ3 LYS 62 HZ3 LYS 62 32.413 33.152 20.309 443 H LEU 63 H LEU 63 35.261 36.218 23.957 444 HA LEU 63 HA LEU 63 35.287 36.664 21.015 445 HB2 LEU 63 HB2 LEU 63 33.889 38.473 23.006 446 HB3 LEU 63 HB3 LEU 63 33.919 38.660 21.254 447 HG LEU 63 HG LEU 63 32.761 36.226 22.637 448 HD11 LEU 63 HD11 LEU 63 31.622 38.476 23.134 449 HD12 LEU 63 HD12 LEU 63 30.615 37.196 22.463 450 HD13 LEU 63 HD13 LEU 63 31.195 38.496 21.424 451 HD21 LEU 63 HD21 LEU 63 33.409 36.862 19.928 452 HD22 LEU 63 HD22 LEU 63 31.652 36.867 20.074 453 HD23 LEU 63 HD23 LEU 63 32.568 35.436 20.537 454 HA PRO 64 HA PRO 64 38.982 38.999 21.527 455 HB2 PRO 64 HB2 PRO 64 37.455 41.455 20.729 456 HB3 PRO 64 HB3 PRO 64 39.042 40.888 20.168 457 HG2 PRO 64 HG2 PRO 64 36.918 40.535 18.657 458 HG3 PRO 64 HG3 PRO 64 38.120 39.239 18.819 459 HD2 PRO 64 HD2 PRO 64 35.387 39.419 20.027 460 HD3 PRO 64 HD3 PRO 64 36.284 37.987 19.484 461 H GLY 65 H GLY 65 39.991 39.972 23.263 462 HA2 GLY 65 HA2 GLY 65 38.274 41.514 25.171 463 HA3 GLY 65 HA3 GLY 65 39.350 40.242 25.738 464 H LYS 66 H LYS 66 40.088 42.166 27.018 465 HA LYS 66 HA LYS 66 42.672 43.033 26.274 466 HB2 LYS 66 HB2 LYS 66 42.328 45.389 25.658 467 HB3 LYS 66 HB3 LYS 66 41.375 44.398 24.569 468 HG2 LYS 66 HG2 LYS 66 39.346 44.858 25.787 469 HG3 LYS 66 HG3 LYS 66 40.240 45.651 27.083 470 HD2 LYS 66 HD2 LYS 66 41.006 46.937 24.669 471 HD3 LYS 66 HD3 LYS 66 39.254 46.783 24.621 472 HE2 LYS 66 HE2 LYS 66 40.698 47.838 27.063 473 HE3 LYS 66 HE3 LYS 66 40.190 48.895 25.746 474 HZ1 LYS 66 HZ1 LYS 66 38.351 48.976 27.080 475 HZ2 LYS 66 HZ2 LYS 66 38.540 47.382 27.670 476 HZ3 LYS 66 HZ3 LYS 66 37.927 47.654 26.107 477 H SER 67 H SER 67 42.548 45.607 27.667 478 HA SER 67 HA SER 67 42.329 44.619 30.409 479 HB2 SER 67 HB2 SER 67 43.088 46.800 31.061 480 HB3 SER 67 HB3 SER 67 43.958 46.415 29.577 481 HG SER 67 HG SER 67 41.477 47.798 29.603 482 H GLY 68 H GLY 68 40.061 43.976 30.384 483 HA2 GLY 68 HA2 GLY 68 37.843 44.429 31.110 484 HA3 GLY 68 HA3 GLY 68 38.233 46.151 31.130 485 H ARG 69 H ARG 69 36.797 43.609 29.341 486 HA ARG 69 HA ARG 69 36.357 45.459 27.025 487 HB2 ARG 69 HB2 ARG 69 37.856 43.622 26.407 488 HB3 ARG 69 HB3 ARG 69 36.703 42.445 27.033 489 HG2 ARG 69 HG2 ARG 69 36.154 42.407 24.779 490 HG3 ARG 69 HG3 ARG 69 35.046 43.652 25.348 491 HD2 ARG 69 HD2 ARG 69 36.163 44.485 23.354 492 HD3 ARG 69 HD3 ARG 69 36.768 45.378 24.745 493 HE ARG 69 HE ARG 69 38.453 43.133 24.385 494 HH11 ARG 69 HH11 ARG 69 37.537 46.011 22.734 495 HH12 ARG 69 HH12 ARG 69 39.018 46.074 21.817 496 HH21 ARG 69 HH21 ARG 69 40.372 43.221 23.257 497 HH22 ARG 69 HH22 ARG 69 40.621 44.513 22.123 498 H THR 70 H THR 70 34.266 45.599 26.275 499 HA THR 70 HA THR 70 32.156 44.181 27.878 500 HB THR 70 HB THR 70 30.705 46.019 27.355 501 HG1 THR 70 HG1 THR 70 32.782 46.713 25.523 502 HG21 THR 70 HG21 THR 70 33.432 47.272 27.807 503 HG22 THR 70 HG22 THR 70 32.492 46.484 29.075 504 HG23 THR 70 HG23 THR 70 31.866 47.927 28.281 505 H TRP 71 H TRP 71 30.837 42.724 26.741 506 HA TRP 71 HA TRP 71 30.971 42.915 23.748 507 HB2 TRP 71 HB2 TRP 71 31.325 40.571 25.562 508 HB3 TRP 71 HB3 TRP 71 30.459 40.297 24.045 509 HD1 TRP 71 HD1 TRP 71 33.913 40.752 25.387 510 HE1 TRP 71 HE1 TRP 71 35.611 40.961 23.437 511 HE3 TRP 71 HE3 TRP 71 30.677 41.296 21.498 512 HZ2 TRP 71 HZ2 TRP 71 35.564 41.351 20.614 513 HZ3 TRP 71 HZ3 TRP 71 31.517 41.592 19.186 514 HH2 TRP 71 HH2 TRP 71 33.956 41.615 18.734 515 H ARG 72 H ARG 72 29.052 42.482 22.574 516 HA ARG 72 HA ARG 72 26.526 42.012 24.092 517 HB2 ARG 72 HB2 ARG 72 27.205 44.467 22.458 518 HB3 ARG 72 HB3 ARG 72 25.537 43.951 22.688 519 HG2 ARG 72 HG2 ARG 72 25.601 45.188 24.589 520 HG3 ARG 72 HG3 ARG 72 26.550 43.856 25.259 521 HD2 ARG 72 HD2 ARG 72 27.974 45.674 25.612 522 HD3 ARG 72 HD3 ARG 72 28.563 45.020 24.090 523 HE ARG 72 HE ARG 72 26.565 46.975 23.452 524 HH11 ARG 72 HH11 ARG 72 29.701 46.656 24.812 525 HH12 ARG 72 HH12 ARG 72 30.136 48.305 24.561 526 HH21 ARG 72 HH21 ARG 72 27.137 49.136 23.072 527 HH22 ARG 72 HH22 ARG 72 28.707 49.694 23.548 528 H GLU 73 H GLU 73 24.908 41.008 22.788 529 HA GLU 73 HA GLU 73 25.782 40.436 20.010 530 HB2 GLU 73 HB2 GLU 73 24.658 38.283 20.174 531 HB3 GLU 73 HB3 GLU 73 25.777 38.461 21.524 532 HG2 GLU 73 HG2 GLU 73 23.998 37.920 22.826 533 HG3 GLU 73 HG3 GLU 73 23.477 39.582 22.549 534 H ALA 74 H ALA 74 23.956 39.941 18.462 535 HA ALA 74 HA ALA 74 21.336 41.107 19.124 536 HB1 ALA 74 HB1 ALA 74 23.198 42.836 18.076 537 HB2 ALA 74 HB2 ALA 74 21.456 43.019 17.868 538 HB3 ALA 74 HB3 ALA 74 22.416 42.240 16.612 539 H ASP 75 H ASP 75 19.675 40.398 17.682 540 HA ASP 75 HA ASP 75 20.217 37.898 16.309 541 HB2 ASP 75 HB2 ASP 75 17.873 39.443 17.072 542 HB3 ASP 75 HB3 ASP 75 17.706 38.832 15.433 543 H ILE 76 H ILE 76 20.062 37.458 14.041 544 HA ILE 76 HA ILE 76 20.144 39.859 12.268 545 HB ILE 76 HB ILE 76 22.108 37.553 12.347 546 HG12 ILE 76 HG12 ILE 76 22.387 39.609 13.838 547 HG13 ILE 76 HG13 ILE 76 23.738 39.248 12.769 548 HG21 ILE 76 HG21 ILE 76 23.102 38.978 10.363 549 HG22 ILE 76 HG22 ILE 76 21.434 39.497 10.155 550 HG23 ILE 76 HG23 ILE 76 21.846 37.786 10.039 551 HD11 ILE 76 HD11 ILE 76 23.411 41.114 11.500 552 HD12 ILE 76 HD12 ILE 76 22.588 41.702 12.945 553 HD13 ILE 76 HD13 ILE 76 21.653 41.011 11.618 554 H ASN 77 H ASN 77 19.412 39.483 10.128 555 HA ASN 77 HA ASN 77 18.034 38.521 8.497 556 HB2 ASN 77 HB2 ASN 77 19.295 36.014 9.647 557 HB3 ASN 77 HB3 ASN 77 18.382 36.073 8.140 558 HD21 ASN 77 HD21 ASN 77 21.050 35.294 7.983 559 HD22 ASN 77 HD22 ASN 77 21.974 36.536 7.277 560 H TYR 78 H TYR 78 16.401 39.295 10.381 561 HA TYR 78 HA TYR 78 14.624 36.956 10.876 562 HB2 TYR 78 HB2 TYR 78 15.347 37.672 13.049 563 HB3 TYR 78 HB3 TYR 78 15.066 39.367 12.649 564 HD1 TYR 78 HD1 TYR 78 13.338 36.084 13.099 565 HD2 TYR 78 HD2 TYR 78 12.897 40.357 12.959 566 HE1 TYR 78 HE1 TYR 78 10.992 35.868 13.897 567 HE2 TYR 78 HE2 TYR 78 10.553 40.143 13.756 568 HH TYR 78 HH TYR 78 9.119 38.617 14.895 569 H THR 79 H THR 79 12.346 37.416 10.705 570 HA THR 79 HA THR 79 11.652 40.004 9.348 571 HB THR 79 HB THR 79 10.286 38.850 7.732 572 HG1 THR 79 HG1 THR 79 10.274 36.482 7.843 573 HG21 THR 79 HG21 THR 79 12.772 37.142 7.870 574 HG22 THR 79 HG22 THR 79 12.858 38.853 7.445 575 HG23 THR 79 HG23 THR 79 11.927 37.738 6.441 576 H SER 80 H SER 80 9.686 37.160 10.010 577 HA SER 80 HA SER 80 8.287 38.435 12.296 578 HB2 SER 80 HB2 SER 80 6.635 39.257 10.960 579 HB3 SER 80 HB3 SER 80 7.197 38.346 9.562 580 HG SER 80 HG SER 80 6.250 36.461 10.678 581 H GLY 81 H GLY 81 8.680 36.639 13.639 582 HA2 GLY 81 HA2 GLY 81 7.082 34.441 13.807 583 HA3 GLY 81 HA3 GLY 81 8.220 33.912 12.568 584 H PHE 82 H PHE 82 10.208 33.136 13.232 585 HA PHE 82 HA PHE 82 10.926 33.600 16.096 586 HB2 PHE 82 HB2 PHE 82 10.050 31.223 15.445 587 HB3 PHE 82 HB3 PHE 82 11.642 31.023 14.714 588 HD1 PHE 82 HD1 PHE 82 9.906 31.906 17.904 589 HD2 PHE 82 HD2 PHE 82 13.561 30.611 16.056 590 HE1 PHE 82 HE1 PHE 82 10.894 31.491 20.144 591 HE2 PHE 82 HE2 PHE 82 14.549 30.204 18.293 592 HZ PHE 82 HZ PHE 82 13.217 30.643 20.337 593 H ARG 83 H ARG 83 13.366 32.711 16.322 594 HA ARG 83 HA ARG 83 14.931 34.473 14.583 595 HB2 ARG 83 HB2 ARG 83 16.260 32.675 16.559 596 HB3 ARG 83 HB3 ARG 83 16.539 34.382 16.229 597 HG2 ARG 83 HG2 ARG 83 14.116 34.671 17.250 598 HG3 ARG 83 HG3 ARG 83 14.470 33.109 17.992 599 HD2 ARG 83 HD2 ARG 83 15.970 35.709 18.313 600 HD3 ARG 83 HD3 ARG 83 15.249 34.698 19.573 601 HE ARG 83 HE ARG 83 17.152 33.048 18.364 602 HH11 ARG 83 HH11 ARG 83 17.089 36.120 19.855 603 HH12 ARG 83 HH12 ARG 83 18.729 36.061 20.374 604 HH21 ARG 83 HH21 ARG 83 19.293 32.930 19.046 605 HH22 ARG 83 HH22 ARG 83 19.994 34.230 19.969 606 H ASN 84 H ASN 84 17.366 32.847 14.788 607 HA ASN 84 HA ASN 84 16.939 30.344 13.371 608 HB2 ASN 84 HB2 ASN 84 17.976 31.069 11.236 609 HB3 ASN 84 HB3 ASN 84 16.489 31.963 11.546 610 HD21 ASN 84 HD21 ASN 84 18.083 33.265 9.840 611 HD22 ASN 84 HD22 ASN 84 18.922 34.534 10.585 612 H SER 85 H SER 85 19.681 31.067 11.997 613 HA SER 85 HA SER 85 21.282 30.535 14.469 614 HB2 SER 85 HB2 SER 85 22.676 29.130 13.195 615 HB3 SER 85 HB3 SER 85 21.058 28.781 12.584 616 HG SER 85 HG SER 85 23.214 29.863 11.317 617 H ASP 86 H ASP 86 20.708 32.767 11.993 618 HA ASP 86 HA ASP 86 23.339 33.917 11.691 619 HB2 ASP 86 HB2 ASP 86 20.528 34.770 11.061 620 HB3 ASP 86 HB3 ASP 86 21.843 35.931 10.923 621 H ARG 87 H ARG 87 24.372 34.741 13.470 622 HA ARG 87 HA ARG 87 22.851 36.757 15.063 623 HB2 ARG 87 HB2 ARG 87 24.545 34.497 16.170 624 HB3 ARG 87 HB3 ARG 87 23.972 35.858 17.140 625 HG2 ARG 87 HG2 ARG 87 22.018 34.379 15.462 626 HG3 ARG 87 HG3 ARG 87 22.535 33.613 16.960 627 HD2 ARG 87 HD2 ARG 87 21.584 35.255 18.300 628 HD3 ARG 87 HD3 ARG 87 21.758 36.491 17.067 629 HE ARG 87 HE ARG 87 19.353 35.922 17.350 630 HH11 ARG 87 HH11 ARG 87 20.943 33.343 15.715 631 HH12 ARG 87 HH12 ARG 87 19.911 33.427 14.330 632 HH21 ARG 87 HH21 ARG 87 17.948 35.926 15.614 633 HH22 ARG 87 HH22 ARG 87 18.225 34.818 14.297 634 H ILE 88 H ILE 88 24.026 38.567 15.638 635 HA ILE 88 HA ILE 88 26.845 38.682 14.636 636 HB ILE 88 HB ILE 88 25.118 40.210 13.572 637 HG12 ILE 88 HG12 ILE 88 27.383 41.600 15.047 638 HG13 ILE 88 HG13 ILE 88 27.554 40.739 13.516 639 HG21 ILE 88 HG21 ILE 88 25.315 41.971 15.957 640 HG22 ILE 88 HG22 ILE 88 24.249 40.571 16.095 641 HG23 ILE 88 HG23 ILE 88 23.978 41.762 14.825 642 HD11 ILE 88 HD11 ILE 88 27.085 43.397 13.632 643 HD12 ILE 88 HD12 ILE 88 25.417 42.819 13.646 644 HD13 ILE 88 HD13 ILE 88 26.490 42.390 12.309 645 H LEU 89 H LEU 89 28.393 39.716 15.891 646 HA LEU 89 HA LEU 89 27.684 40.222 18.748 647 HB2 LEU 89 HB2 LEU 89 29.634 38.372 17.548 648 HB3 LEU 89 HB3 LEU 89 30.310 39.409 18.806 649 HG LEU 89 HG LEU 89 29.374 37.272 19.717 650 HD11 LEU 89 HD11 LEU 89 27.498 39.334 20.727 651 HD12 LEU 89 HD12 LEU 89 29.197 39.792 20.730 652 HD13 LEU 89 HD13 LEU 89 28.670 38.356 21.611 653 HD21 LEU 89 HD21 LEU 89 27.479 37.299 17.952 654 HD22 LEU 89 HD22 LEU 89 26.667 38.407 19.063 655 HD23 LEU 89 HD23 LEU 89 27.069 36.771 19.586 656 H TYR 90 H TYR 90 28.285 42.213 19.417 657 HA TYR 90 HA TYR 90 30.549 43.603 18.000 658 HB2 TYR 90 HB2 TYR 90 29.305 45.490 17.582 659 HB3 TYR 90 HB3 TYR 90 28.036 44.278 17.445 660 HD1 TYR 90 HD1 TYR 90 26.385 43.959 19.255 661 HD2 TYR 90 HD2 TYR 90 29.404 47.017 19.474 662 HE1 TYR 90 HE1 TYR 90 25.110 45.098 21.046 663 HE2 TYR 90 HE2 TYR 90 28.123 48.147 21.270 664 HH TYR 90 HH TYR 90 24.879 47.246 22.052 665 H SER 91 H SER 91 31.902 44.780 19.381 666 HA SER 91 HA SER 91 31.376 44.412 22.306 667 HB2 SER 91 HB2 SER 91 33.837 44.736 22.512 668 HB3 SER 91 HB3 SER 91 33.414 43.396 21.451 669 HG SER 91 HG SER 91 34.971 45.331 20.800 670 H SER 92 H SER 92 32.741 46.116 23.619 671 HA SER 92 HA SER 92 31.503 48.662 23.544 672 HB2 SER 92 HB2 SER 92 34.017 49.210 24.574 673 HB3 SER 92 HB3 SER 92 32.659 48.621 25.521 674 HG SER 92 HG SER 92 34.772 47.127 24.291 675 H ASP 93 H ASP 93 34.638 47.677 22.393 676 HA ASP 93 HA ASP 93 35.379 50.149 21.160 677 HB2 ASP 93 HB2 ASP 93 36.951 48.323 19.946 678 HB3 ASP 93 HB3 ASP 93 37.216 48.835 21.615 679 H TRP 94 H TRP 94 32.901 48.187 20.322 680 HA TRP 94 HA TRP 94 31.562 48.078 18.431 681 HB2 TRP 94 HB2 TRP 94 33.584 49.979 17.206 682 HB3 TRP 94 HB3 TRP 94 32.009 49.574 16.525 683 HD1 TRP 94 HD1 TRP 94 33.592 52.043 18.669 684 HE1 TRP 94 HE1 TRP 94 31.860 53.310 20.089 685 HE3 TRP 94 HE3 TRP 94 29.518 49.038 18.008 686 HZ2 TRP 94 HZ2 TRP 94 29.123 53.094 20.843 687 HZ3 TRP 94 HZ3 TRP 94 27.360 49.585 19.103 688 HH2 TRP 94 HH2 TRP 94 27.162 51.614 20.518 689 H LEU 95 H LEU 95 34.277 46.432 18.780 690 HA LEU 95 HA LEU 95 34.895 45.685 16.035 691 HB2 LEU 95 HB2 LEU 95 35.422 44.389 18.713 692 HB3 LEU 95 HB3 LEU 95 35.852 43.591 17.204 693 HG LEU 95 HG LEU 95 36.829 46.299 18.147 694 HD11 LEU 95 HD11 LEU 95 38.151 43.593 17.753 695 HD12 LEU 95 HD12 LEU 95 37.922 44.454 19.274 696 HD13 LEU 95 HD13 LEU 95 39.041 45.085 18.065 697 HD21 LEU 95 HD21 LEU 95 38.350 45.689 15.976 698 HD22 LEU 95 HD22 LEU 95 36.887 46.666 15.874 699 HD23 LEU 95 HD23 LEU 95 36.829 44.947 15.487 700 H ILE 96 H ILE 96 33.686 44.328 14.746 701 HA ILE 96 HA ILE 96 31.432 42.919 16.094 702 HB ILE 96 HB ILE 96 31.538 43.852 13.233 703 HG12 ILE 96 HG12 ILE 96 29.625 45.238 14.863 704 HG13 ILE 96 HG13 ILE 96 31.199 45.339 15.650 705 HG21 ILE 96 HG21 ILE 96 30.008 41.905 13.977 706 HG22 ILE 96 HG22 ILE 96 29.239 43.259 13.159 707 HG23 ILE 96 HG23 ILE 96 29.137 43.119 14.911 708 HD11 ILE 96 HD11 ILE 96 31.148 45.787 12.712 709 HD12 ILE 96 HD12 ILE 96 32.129 46.564 13.948 710 HD13 ILE 96 HD13 ILE 96 30.449 47.051 13.719 711 H TYR 97 H TYR 97 31.120 40.815 15.823 712 HA TYR 97 HA TYR 97 32.725 39.319 13.793 713 HB2 TYR 97 HB2 TYR 97 32.298 38.688 16.719 714 HB3 TYR 97 HB3 TYR 97 32.766 37.444 15.560 715 HD1 TYR 97 HD1 TYR 97 33.726 40.967 16.438 716 HD2 TYR 97 HD2 TYR 97 35.059 37.030 15.340 717 HE1 TYR 97 HE1 TYR 97 36.070 41.720 16.565 718 HE2 TYR 97 HE2 TYR 97 37.409 37.798 15.484 719 HH TYR 97 HH TYR 97 38.744 39.475 16.258 720 H LYS 98 H LYS 98 31.619 37.314 13.073 721 HA LYS 98 HA LYS 98 28.667 37.486 13.633 722 HB2 LYS 98 HB2 LYS 98 28.215 37.233 11.358 723 HB3 LYS 98 HB3 LYS 98 29.600 38.316 11.369 724 HG2 LYS 98 HG2 LYS 98 31.128 36.480 10.900 725 HG3 LYS 98 HG3 LYS 98 29.822 35.306 11.028 726 HD2 LYS 98 HD2 LYS 98 30.398 37.258 8.828 727 HD3 LYS 98 HD3 LYS 98 29.942 35.562 8.727 728 HE2 LYS 98 HE2 LYS 98 28.114 37.879 9.448 729 HE3 LYS 98 HE3 LYS 98 28.062 36.909 7.978 730 HZ1 LYS 98 HZ1 LYS 98 27.239 35.101 9.088 731 HZ2 LYS 98 HZ2 LYS 98 26.520 36.363 9.958 732 HZ3 LYS 98 HZ3 LYS 98 27.885 35.575 10.585 733 H THR 99 H THR 99 27.512 35.589 13.857 734 HA THR 99 HA THR 99 28.957 33.019 13.429 735 HB THR 99 HB THR 99 29.216 33.102 15.754 736 HG1 THR 99 HG1 THR 99 28.167 31.220 15.402 737 HG21 THR 99 HG21 THR 99 27.502 33.970 17.304 738 HG22 THR 99 HG22 THR 99 26.469 34.358 15.926 739 HG23 THR 99 HG23 THR 99 28.012 35.192 16.136 740 H THR 100 H THR 100 27.694 31.606 12.412 741 HA THR 100 HA THR 100 24.779 32.219 11.982 742 HB THR 100 HB THR 100 25.214 30.905 9.798 743 HG1 THR 100 HG1 THR 100 27.457 30.443 10.805 744 HG21 THR 100 HG21 THR 100 26.806 33.373 9.605 745 HG22 THR 100 HG22 THR 100 25.260 33.583 10.429 746 HG23 THR 100 HG23 THR 100 25.303 32.940 8.787 747 H ASP 101 H ASP 101 26.577 30.298 13.797 748 HA ASP 101 HA ASP 101 24.895 27.867 13.211 749 HB2 ASP 101 HB2 ASP 101 26.900 26.954 14.809 750 HB3 ASP 101 HB3 ASP 101 26.990 26.967 13.047 751 H ALA 102 H ALA 102 24.081 30.204 14.836 752 HA ALA 102 HA ALA 102 22.962 30.569 16.862 753 HB1 ALA 102 HB1 ALA 102 23.340 27.666 17.563 754 HB2 ALA 102 HB2 ALA 102 22.240 28.132 16.267 755 HB3 ALA 102 HB3 ALA 102 21.970 28.724 17.905 756 H TYR 103 H TYR 103 25.239 31.585 17.266 757 HA TYR 103 HA TYR 103 26.881 32.107 18.847 758 HB2 TYR 103 HB2 TYR 103 25.421 30.162 20.661 759 HB3 TYR 103 HB3 TYR 103 26.451 31.504 21.143 760 HD1 TYR 103 HD1 TYR 103 25.486 33.692 19.388 761 HD2 TYR 103 HD2 TYR 103 23.300 30.672 21.519 762 HE1 TYR 103 HE1 TYR 103 23.518 35.195 19.508 763 HE2 TYR 103 HE2 TYR 103 21.333 32.173 21.628 764 HH TYR 103 HH TYR 103 21.548 35.538 20.609 765 H GLN 104 H GLN 104 27.598 30.035 17.011 766 HA GLN 104 HA GLN 104 29.180 28.185 18.802 767 HB2 GLN 104 HB2 GLN 104 28.091 27.759 16.015 768 HB3 GLN 104 HB3 GLN 104 29.279 26.700 16.748 769 HG2 GLN 104 HG2 GLN 104 26.795 27.307 18.305 770 HG3 GLN 104 HG3 GLN 104 26.649 26.220 16.929 771 HE21 GLN 104 HE21 GLN 104 26.307 25.345 19.670 772 HE22 GLN 104 HE22 GLN 104 27.550 24.238 20.005 773 H THR 105 H THR 105 29.543 29.065 15.322 774 HA THR 105 HA THR 105 32.427 29.579 15.935 775 HB THR 105 HB THR 105 32.823 29.418 13.583 776 HG1 THR 105 HG1 THR 105 30.030 29.225 13.136 777 HG21 THR 105 HG21 THR 105 31.277 27.260 13.118 778 HG22 THR 105 HG22 THR 105 31.024 27.415 14.857 779 HG23 THR 105 HG23 THR 105 32.657 27.217 14.218 780 H PHE 106 H PHE 106 33.104 31.630 16.250 781 HA PHE 106 HA PHE 106 31.406 33.892 15.318 782 HB2 PHE 106 HB2 PHE 106 33.665 33.867 17.336 783 HB3 PHE 106 HB3 PHE 106 32.638 35.247 16.957 784 HD1 PHE 106 HD1 PHE 106 32.310 31.642 17.891 785 HD2 PHE 106 HD2 PHE 106 30.821 35.647 18.361 786 HE1 PHE 106 HE1 PHE 106 30.664 30.831 19.555 787 HE2 PHE 106 HE2 PHE 106 29.175 34.832 20.033 788 HZ PHE 106 HZ PHE 106 29.097 32.422 20.625 789 H THR 107 H THR 107 32.245 33.825 13.103 790 HA THR 107 HA THR 107 35.081 34.325 12.695 791 HB THR 107 HB THR 107 32.697 34.299 10.824 792 HG1 THR 107 HG1 THR 107 33.651 32.318 11.542 793 HG21 THR 107 HG21 THR 107 35.583 34.882 10.123 794 HG22 THR 107 HG22 THR 107 34.262 36.054 10.070 795 HG23 THR 107 HG23 THR 107 34.260 34.666 8.981 796 H LYS 108 H LYS 108 36.051 36.261 12.153 797 HA LYS 108 HA LYS 108 34.776 38.654 13.215 798 HB2 LYS 108 HB2 LYS 108 37.218 38.284 13.426 799 HB3 LYS 108 HB3 LYS 108 37.380 38.377 11.673 800 HG2 LYS 108 HG2 LYS 108 36.492 40.682 11.699 801 HG3 LYS 108 HG3 LYS 108 36.293 40.592 13.448 802 HD2 LYS 108 HD2 LYS 108 38.687 40.407 13.775 803 HD3 LYS 108 HD3 LYS 108 38.959 40.261 12.037 804 HE2 LYS 108 HE2 LYS 108 39.444 42.548 12.617 805 HE3 LYS 108 HE3 LYS 108 37.886 42.555 11.786 806 HZ1 LYS 108 HZ1 LYS 108 36.784 43.156 13.649 807 HZ2 LYS 108 HZ2 LYS 108 38.323 43.694 14.172 808 HZ3 LYS 108 HZ3 LYS 108 37.750 42.166 14.657 809 H ILE 109 H ILE 109 34.145 40.505 12.075 810 HA ILE 109 HA ILE 109 34.010 40.279 9.096 811 HB ILE 109 HB ILE 109 31.766 41.355 9.189 812 HG12 ILE 109 HG12 ILE 109 31.887 40.756 12.154 813 HG13 ILE 109 HG13 ILE 109 32.121 42.371 11.481 814 HG21 ILE 109 HG21 ILE 109 32.265 38.779 9.268 815 HG22 ILE 109 HG22 ILE 109 30.617 39.349 9.531 816 HG23 ILE 109 HG23 ILE 109 31.623 38.896 10.909 817 HD11 ILE 109 HD11 ILE 109 29.906 42.661 11.263 818 HD12 ILE 109 HD12 ILE 109 29.669 41.130 12.107 819 HD13 ILE 109 HD13 ILE 109 29.753 41.161 10.348 820 H ARG 110 H ARG 110 34.244 42.304 11.964 821 HA ARG 110 HA ARG 110 35.443 44.481 10.330 822 HB2 ARG 110 HB2 ARG 110 33.214 44.899 12.356 823 HB3 ARG 110 HB3 ARG 110 34.144 46.189 11.602 824 HG2 ARG 110 HG2 ARG 110 33.079 44.361 9.614 825 HG3 ARG 110 HG3 ARG 110 31.796 45.036 10.605 826 HD2 ARG 110 HD2 ARG 110 32.850 47.311 10.229 827 HD3 ARG 110 HD3 ARG 110 33.889 46.559 9.024 828 HE ARG 110 HE ARG 110 31.263 47.483 8.532 829 HH11 ARG 110 HH11 ARG 110 33.040 44.536 8.061 830 HH12 ARG 110 HH12 ARG 110 31.912 43.942 6.893 831 HH21 ARG 110 HH21 ARG 110 29.898 46.713 7.016 832 HH22 ARG 110 HH22 ARG 110 30.203 45.167 6.248 Start of MODEL 6 1 H VAL 3 H VAL 3 16.386 49.220 12.731 2 HA VAL 3 HA VAL 3 14.303 48.063 11.879 3 HB VAL 3 HB VAL 3 14.430 49.955 9.572 4 HG11 VAL 3 HG11 VAL 3 12.997 47.966 9.485 5 HG12 VAL 3 HG12 VAL 3 11.991 49.412 9.556 6 HG13 VAL 3 HG13 VAL 3 12.224 48.431 11.003 7 HG21 VAL 3 HG21 VAL 3 13.218 50.588 12.269 8 HG22 VAL 3 HG22 VAL 3 12.568 51.278 10.781 9 HG23 VAL 3 HG23 VAL 3 14.234 51.617 11.257 10 H ILE 4 H ILE 4 16.881 47.372 12.048 11 HA ILE 4 HA ILE 4 17.562 46.559 9.275 12 HB ILE 4 HB ILE 4 19.454 47.854 11.261 13 HG12 ILE 4 HG12 ILE 4 19.417 48.617 8.396 14 HG13 ILE 4 HG13 ILE 4 17.936 48.988 9.273 15 HG21 ILE 4 HG21 ILE 4 21.113 47.331 9.297 16 HG22 ILE 4 HG22 ILE 4 19.953 46.074 8.884 17 HG23 ILE 4 HG23 ILE 4 20.738 46.061 10.460 18 HD11 ILE 4 HD11 ILE 4 19.129 50.286 10.912 19 HD12 ILE 4 HD12 ILE 4 19.670 50.832 9.321 20 HD13 ILE 4 HD13 ILE 4 20.688 49.751 10.273 21 H ASN 5 H ASN 5 18.601 44.500 9.192 22 HA ASN 5 HA ASN 5 19.150 43.088 11.737 23 HB2 ASN 5 HB2 ASN 5 17.657 41.220 11.121 24 HB3 ASN 5 HB3 ASN 5 16.730 42.711 11.287 25 HD21 ASN 5 HD21 ASN 5 15.510 40.824 9.714 26 HD22 ASN 5 HD22 ASN 5 15.648 41.231 8.070 27 H THR 6 H THR 6 20.809 43.973 9.479 28 HA THR 6 HA THR 6 21.588 41.277 8.401 29 HB THR 6 HB THR 6 22.400 42.357 6.396 30 HG1 THR 6 HG1 THR 6 22.272 44.630 6.222 31 HG21 THR 6 HG21 THR 6 20.368 42.864 5.424 32 HG22 THR 6 HG22 THR 6 19.861 43.889 6.765 33 HG23 THR 6 HG23 THR 6 19.787 42.135 6.921 34 H PHE 7 H PHE 7 23.767 40.723 8.490 35 HA PHE 7 HA PHE 7 25.383 41.484 10.592 36 HB2 PHE 7 HB2 PHE 7 26.217 40.517 7.830 37 HB3 PHE 7 HB3 PHE 7 27.338 40.633 9.190 38 HD1 PHE 7 HD1 PHE 7 26.404 39.642 11.460 39 HD2 PHE 7 HD2 PHE 7 25.073 38.501 7.521 40 HE1 PHE 7 HE1 PHE 7 25.475 37.540 12.382 41 HE2 PHE 7 HE2 PHE 7 24.153 36.386 8.450 42 HZ PHE 7 HZ PHE 7 24.341 35.910 10.878 43 H ASP 8 H ASP 8 26.764 42.279 7.493 44 HA ASP 8 HA ASP 8 28.414 44.355 8.247 45 HB2 ASP 8 HB2 ASP 8 27.078 43.647 5.665 46 HB3 ASP 8 HB3 ASP 8 27.866 45.225 5.779 47 H GLY 9 H GLY 9 25.052 44.676 7.139 48 HA2 GLY 9 HA2 GLY 9 24.799 47.472 7.260 49 HA3 GLY 9 HA3 GLY 9 23.471 46.354 7.523 50 H VAL 10 H VAL 10 24.120 45.111 9.899 51 HA VAL 10 HA VAL 10 23.467 47.148 11.855 52 HB VAL 10 HB VAL 10 24.374 44.264 12.082 53 HG11 VAL 10 HG11 VAL 10 25.166 45.188 14.119 54 HG12 VAL 10 HG12 VAL 10 23.548 44.618 14.528 55 HG13 VAL 10 HG13 VAL 10 23.827 46.332 14.218 56 HG21 VAL 10 HG21 VAL 10 21.763 45.759 12.463 57 HG22 VAL 10 HG22 VAL 10 21.993 44.097 13.010 58 HG23 VAL 10 HG23 VAL 10 22.108 44.487 11.290 59 H ALA 11 H ALA 11 26.516 45.402 11.029 60 HA ALA 11 HA ALA 11 28.152 46.508 13.101 61 HB1 ALA 11 HB1 ALA 11 29.925 46.174 11.093 62 HB2 ALA 11 HB2 ALA 11 28.587 45.214 10.483 63 HB3 ALA 11 HB3 ALA 11 29.288 44.838 12.054 64 H ASP 12 H ASP 12 27.840 47.576 9.655 65 HA ASP 12 HA ASP 12 29.365 49.948 9.837 66 HB2 ASP 12 HB2 ASP 12 27.066 49.061 8.137 67 HB3 ASP 12 HB3 ASP 12 27.456 50.785 8.151 68 H TYR 13 H TYR 13 25.883 49.508 10.401 69 HA TYR 13 HA TYR 13 25.199 52.124 11.158 70 HB2 TYR 13 HB2 TYR 13 23.738 49.999 10.890 71 HB3 TYR 13 HB3 TYR 13 24.101 49.729 12.587 72 HD1 TYR 13 HD1 TYR 13 22.411 51.909 10.164 73 HD2 TYR 13 HD2 TYR 13 23.205 51.214 14.333 74 HE1 TYR 13 HE1 TYR 13 20.605 53.485 10.772 75 HE2 TYR 13 HE2 TYR 13 21.380 52.784 14.930 76 HH TYR 13 HH TYR 13 19.036 53.609 13.264 77 H LEU 14 H LEU 14 26.303 49.478 13.230 78 HA LEU 14 HA LEU 14 26.392 51.041 15.633 79 HB2 LEU 14 HB2 LEU 14 27.576 48.428 14.733 80 HB3 LEU 14 HB3 LEU 14 27.970 49.095 16.317 81 HG LEU 14 HG LEU 14 25.139 48.673 15.331 82 HD11 LEU 14 HD11 LEU 14 26.683 46.588 15.708 83 HD12 LEU 14 HD12 LEU 14 25.087 46.612 16.455 84 HD13 LEU 14 HD13 LEU 14 26.507 46.983 17.425 85 HD21 LEU 14 HD21 LEU 14 26.265 50.134 17.493 86 HD22 LEU 14 HD22 LEU 14 25.530 48.687 18.185 87 HD23 LEU 14 HD23 LEU 14 24.564 49.794 17.203 88 H GLN 15 H GLN 15 28.928 50.061 13.272 89 HA GLN 15 HA GLN 15 31.032 51.387 14.723 90 HB2 GLN 15 HB2 GLN 15 30.720 50.625 11.821 91 HB3 GLN 15 HB3 GLN 15 32.176 51.406 12.434 92 HG2 GLN 15 HG2 GLN 15 31.504 49.293 14.242 93 HG3 GLN 15 HG3 GLN 15 31.474 48.639 12.609 94 HE21 GLN 15 HE21 GLN 15 33.446 48.099 14.711 95 HE22 GLN 15 HE22 GLN 15 34.947 48.618 14.110 96 H THR 16 H THR 16 28.511 52.714 12.649 97 HA THR 16 HA THR 16 29.980 55.313 12.532 98 HB THR 16 HB THR 16 27.437 54.547 11.057 99 HG1 THR 16 HG1 THR 16 29.087 53.151 10.403 100 HG21 THR 16 HG21 THR 16 27.788 56.917 11.136 101 HG22 THR 16 HG22 THR 16 28.277 56.361 9.536 102 HG23 THR 16 HG23 THR 16 29.501 56.735 10.746 103 H TYR 17 H TYR 17 26.794 53.971 13.507 104 HA TYR 17 HA TYR 17 26.134 56.615 14.724 105 HB2 TYR 17 HB2 TYR 17 24.431 54.175 14.126 106 HB3 TYR 17 HB3 TYR 17 23.820 55.684 14.816 107 HD1 TYR 17 HD1 TYR 17 24.419 57.876 13.502 108 HD2 TYR 17 HD2 TYR 17 24.504 53.932 11.781 109 HE1 TYR 17 HE1 TYR 17 24.285 58.858 11.232 110 HE2 TYR 17 HE2 TYR 17 24.368 54.929 9.505 111 HH TYR 17 HH TYR 17 25.114 57.780 8.711 112 H HIS 18 H HIS 18 27.157 53.451 15.573 113 HA HIS 18 HA HIS 18 27.521 52.428 17.649 114 HB2 HIS 18 HB2 HIS 18 27.254 55.325 18.473 115 HB3 HIS 18 HB3 HIS 18 27.668 54.050 19.616 116 HD1 HIS 18 HD1 HIS 18 29.018 53.016 16.483 117 HD2 HIS 18 HD2 HIS 18 30.240 55.793 19.369 118 HE1 HIS 18 HE1 HIS 18 31.512 53.369 16.154 119 H LYS 19 H LYS 19 24.715 54.578 17.544 120 HA LYS 19 HA LYS 19 23.344 53.294 19.693 121 HB2 LYS 19 HB2 LYS 19 22.086 55.165 19.386 122 HB3 LYS 19 HB3 LYS 19 22.820 55.440 17.809 123 HG2 LYS 19 HG2 LYS 19 21.233 53.655 16.906 124 HG3 LYS 19 HG3 LYS 19 20.405 53.726 18.454 125 HD2 LYS 19 HD2 LYS 19 19.153 55.273 17.308 126 HD3 LYS 19 HD3 LYS 19 20.421 56.361 17.876 127 HE2 LYS 19 HE2 LYS 19 20.876 56.849 15.722 128 HE3 LYS 19 HE3 LYS 19 21.422 55.181 15.517 129 HZ1 LYS 19 HZ1 LYS 19 19.731 54.907 14.114 130 HZ2 LYS 19 HZ2 LYS 19 19.059 56.426 14.531 131 HZ3 LYS 19 HZ3 LYS 19 18.654 55.040 15.447 132 H LEU 20 H LEU 20 22.645 51.309 19.736 133 HA LEU 20 HA LEU 20 22.794 49.392 17.738 134 HB2 LEU 20 HB2 LEU 20 21.201 49.669 20.219 135 HB3 LEU 20 HB3 LEU 20 20.558 48.519 19.052 136 HG LEU 20 HG LEU 20 23.493 48.411 19.619 137 HD11 LEU 20 HD11 LEU 20 21.335 47.403 21.497 138 HD12 LEU 20 HD12 LEU 20 22.501 48.678 21.846 139 HD13 LEU 20 HD13 LEU 20 23.049 47.016 21.626 140 HD21 LEU 20 HD21 LEU 20 21.648 46.844 18.199 141 HD22 LEU 20 HD22 LEU 20 21.892 45.943 19.690 142 HD23 LEU 20 HD23 LEU 20 23.275 46.351 18.673 143 HA PRO 21 HA PRO 21 20.139 50.627 14.403 144 HB2 PRO 21 HB2 PRO 21 19.184 47.809 14.547 145 HB3 PRO 21 HB3 PRO 21 19.743 48.748 13.150 146 HG2 PRO 21 HG2 PRO 21 21.279 46.891 14.457 147 HG3 PRO 21 HG3 PRO 21 21.918 48.243 13.510 148 HD2 PRO 21 HD2 PRO 21 22.056 47.830 16.393 149 HD3 PRO 21 HD3 PRO 21 22.843 49.088 15.417 150 H ASP 22 H ASP 22 18.148 51.556 14.408 151 HA ASP 22 HA ASP 22 16.446 51.458 16.704 152 HB2 ASP 22 HB2 ASP 22 15.385 52.341 14.045 153 HB3 ASP 22 HB3 ASP 22 15.240 53.118 15.627 154 H ASN 23 H ASN 23 16.327 49.039 16.752 155 HA ASN 23 HA ASN 23 13.730 48.088 16.120 156 HB2 ASN 23 HB2 ASN 23 14.325 46.467 14.289 157 HB3 ASN 23 HB3 ASN 23 14.329 48.156 13.799 158 HD21 ASN 23 HD21 ASN 23 16.472 45.443 14.649 159 HD22 ASN 23 HD22 ASN 23 17.860 46.108 13.933 160 H TYR 24 H TYR 24 16.236 47.874 17.932 161 HA TYR 24 HA TYR 24 16.205 44.889 18.224 162 HB2 TYR 24 HB2 TYR 24 18.330 46.975 18.508 163 HB3 TYR 24 HB3 TYR 24 18.424 45.554 19.549 164 HD1 TYR 24 HD1 TYR 24 18.220 43.242 18.428 165 HD2 TYR 24 HD2 TYR 24 19.051 46.856 16.268 166 HE1 TYR 24 HE1 TYR 24 19.099 41.903 16.533 167 HE2 TYR 24 HE2 TYR 24 19.931 45.510 14.368 168 HH TYR 24 HH TYR 24 19.849 41.935 14.446 169 H ILE 25 H ILE 25 16.455 44.083 20.475 170 HA ILE 25 HA ILE 25 15.803 45.982 22.643 171 HB ILE 25 HB ILE 25 14.019 43.808 23.091 172 HG12 ILE 25 HG12 ILE 25 13.460 45.076 20.399 173 HG13 ILE 25 HG13 ILE 25 14.283 43.524 20.554 174 HG21 ILE 25 HG21 ILE 25 12.374 45.844 22.495 175 HG22 ILE 25 HG22 ILE 25 13.879 46.751 22.603 176 HG23 ILE 25 HG23 ILE 25 13.319 45.805 23.977 177 HD11 ILE 25 HD11 ILE 25 11.594 44.136 21.801 178 HD12 ILE 25 HD12 ILE 25 12.407 42.574 21.753 179 HD13 ILE 25 HD13 ILE 25 11.803 43.301 20.263 180 H THR 26 H THR 26 16.217 45.091 24.772 181 HA THR 26 HA THR 26 18.311 43.032 24.785 182 HB THR 26 HB THR 26 18.210 43.278 27.232 183 HG1 THR 26 HG1 THR 26 16.029 45.018 26.754 184 HG21 THR 26 HG21 THR 26 18.139 45.962 27.195 185 HG22 THR 26 HG22 THR 26 18.230 45.671 25.463 186 HG23 THR 26 HG23 THR 26 19.493 45.047 26.532 187 H LYS 27 H LYS 27 18.133 40.918 25.747 188 HA LYS 27 HA LYS 27 15.862 39.361 25.162 189 HB2 LYS 27 HB2 LYS 27 18.286 39.069 26.788 190 HB3 LYS 27 HB3 LYS 27 16.917 38.186 27.464 191 HG2 LYS 27 HG2 LYS 27 17.267 36.572 25.943 192 HG3 LYS 27 HG3 LYS 27 16.812 37.713 24.684 193 HD2 LYS 27 HD2 LYS 27 19.557 38.052 25.686 194 HD3 LYS 27 HD3 LYS 27 19.284 36.508 24.896 195 HE2 LYS 27 HE2 LYS 27 18.589 37.567 22.854 196 HE3 LYS 27 HE3 LYS 27 18.480 39.148 23.638 197 HZ1 LYS 27 HZ1 LYS 27 20.611 38.467 22.234 198 HZ2 LYS 27 HZ2 LYS 27 21.053 37.740 23.720 199 HZ3 LYS 27 HZ3 LYS 27 20.742 39.423 23.660 200 H SER 28 H SER 28 16.754 40.790 28.324 201 HA SER 28 HA SER 28 14.511 40.112 29.861 202 HB2 SER 28 HB2 SER 28 16.224 41.322 30.947 203 HB3 SER 28 HB3 SER 28 16.189 42.618 29.755 204 HG SER 28 HG SER 28 14.540 43.496 30.752 205 H GLU 29 H GLU 29 14.737 43.256 28.073 206 HA GLU 29 HA GLU 29 12.085 44.112 28.333 207 HB2 GLU 29 HB2 GLU 29 14.004 44.343 25.986 208 HB3 GLU 29 HB3 GLU 29 12.464 45.189 26.048 209 HG2 GLU 29 HG2 GLU 29 13.151 46.555 27.822 210 HG3 GLU 29 HG3 GLU 29 14.411 45.453 28.344 211 H ALA 30 H ALA 30 13.401 42.237 25.536 212 HA ALA 30 HA ALA 30 10.965 41.654 24.248 213 HB1 ALA 30 HB1 ALA 30 13.401 39.871 24.552 214 HB2 ALA 30 HB2 ALA 30 13.188 41.111 23.320 215 HB3 ALA 30 HB3 ALA 30 12.152 39.684 23.319 216 H GLN 31 H GLN 31 12.587 39.704 26.767 217 HA GLN 31 HA GLN 31 10.564 37.684 26.927 218 HB2 GLN 31 HB2 GLN 31 12.626 38.660 28.918 219 HB3 GLN 31 HB3 GLN 31 11.624 37.222 29.175 220 HG2 GLN 31 HG2 GLN 31 12.554 36.127 27.242 221 HG3 GLN 31 HG3 GLN 31 13.364 37.607 26.717 222 HE21 GLN 31 HE21 GLN 31 13.565 34.879 28.925 223 HE22 GLN 31 HE22 GLN 31 15.110 35.243 29.524 224 H ALA 32 H ALA 32 11.142 40.576 28.956 225 HA ALA 32 HA ALA 32 8.844 40.156 30.612 226 HB1 ALA 32 HB1 ALA 32 10.479 41.586 31.497 227 HB2 ALA 32 HB2 ALA 32 9.193 42.700 31.028 228 HB3 ALA 32 HB3 ALA 32 10.604 42.496 29.996 229 H LEU 33 H LEU 33 9.231 41.786 27.527 230 HA LEU 33 HA LEU 33 6.701 43.154 27.526 231 HB2 LEU 33 HB2 LEU 33 8.767 42.401 25.493 232 HB3 LEU 33 HB3 LEU 33 7.179 42.906 24.904 233 HG LEU 33 HG LEU 33 8.582 44.560 26.983 234 HD11 LEU 33 HD11 LEU 33 9.904 45.696 25.377 235 HD12 LEU 33 HD12 LEU 33 9.010 44.995 24.028 236 HD13 LEU 33 HD13 LEU 33 10.115 43.992 24.960 237 HD21 LEU 33 HD21 LEU 33 6.308 45.209 26.441 238 HD22 LEU 33 HD22 LEU 33 6.644 45.104 24.711 239 HD23 LEU 33 HD23 LEU 33 7.387 46.378 25.676 240 H GLY 34 H GLY 34 7.603 39.873 27.103 241 HA2 GLY 34 HA2 GLY 34 5.497 38.411 27.390 242 HA3 GLY 34 HA3 GLY 34 4.894 39.264 25.972 243 H TRP 35 H TRP 35 8.173 38.888 25.475 244 HA TRP 35 HA TRP 35 7.810 36.936 23.403 245 HB2 TRP 35 HB2 TRP 35 9.709 38.524 23.431 246 HB3 TRP 35 HB3 TRP 35 10.362 37.715 24.856 247 HD1 TRP 35 HD1 TRP 35 8.914 36.151 21.618 248 HE1 TRP 35 HE1 TRP 35 10.703 34.579 20.635 249 HE3 TRP 35 HE3 TRP 35 12.717 36.965 24.930 250 HZ2 TRP 35 HZ2 TRP 35 13.391 33.777 21.172 251 HZ3 TRP 35 HZ3 TRP 35 14.882 35.781 24.678 252 HH2 TRP 35 HH2 TRP 35 15.223 34.185 22.800 253 H VAL 36 H VAL 36 7.251 34.844 23.798 254 HA VAL 36 HA VAL 36 8.504 33.459 26.186 255 HB VAL 36 HB VAL 36 5.728 33.252 24.985 256 HG11 VAL 36 HG11 VAL 36 6.466 30.965 25.330 257 HG12 VAL 36 HG12 VAL 36 5.427 31.394 26.687 258 HG13 VAL 36 HG13 VAL 36 7.178 31.382 26.890 259 HG21 VAL 36 HG21 VAL 36 6.907 33.937 27.687 260 HG22 VAL 36 HG22 VAL 36 5.206 33.519 27.493 261 HG23 VAL 36 HG23 VAL 36 5.867 34.938 26.675 262 H ALA 37 H ALA 37 9.385 31.463 25.836 263 HA ALA 37 HA ALA 37 10.229 30.712 23.217 264 HB1 ALA 37 HB1 ALA 37 10.937 28.572 24.345 265 HB2 ALA 37 HB2 ALA 37 10.150 29.152 25.818 266 HB3 ALA 37 HB3 ALA 37 11.522 30.031 25.143 267 H SER 38 H SER 38 7.679 29.319 25.324 268 HA SER 38 HA SER 38 6.890 27.447 23.225 269 HB2 SER 38 HB2 SER 38 5.240 26.657 24.757 270 HB3 SER 38 HB3 SER 38 6.613 27.123 25.763 271 HG SER 38 HG SER 38 4.298 28.681 25.186 272 H LYS 39 H LYS 39 6.938 29.844 22.056 273 HA LYS 39 HA LYS 39 4.303 30.167 20.983 274 HB2 LYS 39 HB2 LYS 39 3.966 31.260 23.205 275 HB3 LYS 39 HB3 LYS 39 5.235 32.416 22.794 276 HG2 LYS 39 HG2 LYS 39 3.968 33.349 21.033 277 HG3 LYS 39 HG3 LYS 39 2.863 31.982 20.986 278 HD2 LYS 39 HD2 LYS 39 2.575 32.816 23.585 279 HD3 LYS 39 HD3 LYS 39 2.844 34.351 22.755 280 HE2 LYS 39 HE2 LYS 39 0.504 34.049 22.626 281 HE3 LYS 39 HE3 LYS 39 1.080 33.491 21.049 282 HZ1 LYS 39 HZ1 LYS 39 0.490 31.774 23.406 283 HZ2 LYS 39 HZ2 LYS 39 1.109 31.220 21.924 284 HZ3 LYS 39 HZ3 LYS 39 -0.455 31.893 21.998 285 H GLY 40 H GLY 40 7.304 32.001 21.677 286 HA2 GLY 40 HA2 GLY 40 8.782 33.073 20.198 287 HA3 GLY 40 HA3 GLY 40 8.069 32.131 18.895 288 H ASN 41 H ASN 41 6.006 34.010 20.909 289 HA ASN 41 HA ASN 41 4.805 35.473 18.805 290 HB2 ASN 41 HB2 ASN 41 4.122 37.085 20.702 291 HB3 ASN 41 HB3 ASN 41 3.598 35.411 20.852 292 HD21 ASN 41 HD21 ASN 41 4.855 37.849 22.664 293 HD22 ASN 41 HD22 ASN 41 5.702 36.936 23.830 294 H LEU 42 H LEU 42 5.438 37.262 17.707 295 HA LEU 42 HA LEU 42 7.086 39.326 18.857 296 HB2 LEU 42 HB2 LEU 42 8.701 37.329 18.354 297 HB3 LEU 42 HB3 LEU 42 8.481 37.787 16.668 298 HG LEU 42 HG LEU 42 9.006 40.214 17.589 299 HD11 LEU 42 HD11 LEU 42 10.690 40.124 19.408 300 HD12 LEU 42 HD12 LEU 42 10.368 38.402 19.609 301 HD13 LEU 42 HD13 LEU 42 9.107 39.584 19.961 302 HD21 LEU 42 HD21 LEU 42 11.585 39.227 17.502 303 HD22 LEU 42 HD22 LEU 42 10.623 39.674 16.096 304 HD23 LEU 42 HD23 LEU 42 10.677 37.992 16.626 305 H ALA 43 H ALA 43 6.579 37.778 15.714 306 HA ALA 43 HA ALA 43 6.447 40.117 14.131 307 HB1 ALA 43 HB1 ALA 43 6.579 37.757 13.271 308 HB2 ALA 43 HB2 ALA 43 5.333 38.713 12.470 309 HB3 ALA 43 HB3 ALA 43 4.883 37.543 13.707 310 H ASP 44 H ASP 44 4.126 38.682 16.297 311 HA ASP 44 HA ASP 44 1.794 40.099 15.244 312 HB2 ASP 44 HB2 ASP 44 0.957 39.439 17.658 313 HB3 ASP 44 HB3 ASP 44 1.236 38.169 16.470 314 H VAL 45 H VAL 45 3.459 40.390 18.392 315 HA VAL 45 HA VAL 45 2.416 43.010 18.933 316 HB VAL 45 HB VAL 45 4.187 43.018 20.746 317 HG11 VAL 45 HG11 VAL 45 3.242 40.593 21.588 318 HG12 VAL 45 HG12 VAL 45 2.076 40.980 20.320 319 HG13 VAL 45 HG13 VAL 45 2.315 42.091 21.668 320 HG21 VAL 45 HG21 VAL 45 5.994 41.771 19.819 321 HG22 VAL 45 HG22 VAL 45 4.938 40.450 19.315 322 HG23 VAL 45 HG23 VAL 45 5.299 40.688 21.023 323 H ALA 46 H ALA 46 5.280 41.833 17.301 324 HA ALA 46 HA ALA 46 5.955 44.633 16.512 325 HB1 ALA 46 HB1 ALA 46 8.243 44.369 17.096 326 HB2 ALA 46 HB2 ALA 46 8.074 42.628 17.317 327 HB3 ALA 46 HB3 ALA 46 7.355 43.740 18.483 328 HA PRO 47 HA PRO 47 5.638 41.647 12.901 329 HB2 PRO 47 HB2 PRO 47 4.870 44.167 11.549 330 HB3 PRO 47 HB3 PRO 47 4.068 42.587 11.543 331 HG2 PRO 47 HG2 PRO 47 3.122 44.720 12.896 332 HG3 PRO 47 HG3 PRO 47 2.858 43.046 13.415 333 HD2 PRO 47 HD2 PRO 47 4.682 45.107 14.551 334 HD3 PRO 47 HD3 PRO 47 3.892 43.735 15.359 335 H GLY 48 H GLY 48 8.168 42.469 13.715 336 HA2 GLY 48 HA2 GLY 48 9.848 42.288 11.655 337 HA3 GLY 48 HA3 GLY 48 9.312 43.942 11.386 338 H LYS 49 H LYS 49 10.053 42.283 14.467 339 HA LYS 49 HA LYS 49 12.196 44.300 14.855 340 HB2 LYS 49 HB2 LYS 49 9.995 44.456 16.255 341 HB3 LYS 49 HB3 LYS 49 10.691 43.111 17.163 342 HG2 LYS 49 HG2 LYS 49 12.277 44.424 18.132 343 HG3 LYS 49 HG3 LYS 49 12.569 45.328 16.645 344 HD2 LYS 49 HD2 LYS 49 10.450 46.583 17.015 345 HD3 LYS 49 HD3 LYS 49 10.235 45.724 18.543 346 HE2 LYS 49 HE2 LYS 49 12.700 46.608 18.999 347 HE3 LYS 49 HE3 LYS 49 12.226 47.838 17.817 348 HZ1 LYS 49 HZ1 LYS 49 10.609 47.120 20.198 349 HZ2 LYS 49 HZ2 LYS 49 10.351 48.422 19.137 350 HZ3 LYS 49 HZ3 LYS 49 11.707 48.408 20.166 351 H SER 50 H SER 50 14.162 43.540 15.817 352 HA SER 50 HA SER 50 14.298 40.534 16.072 353 HB2 SER 50 HB2 SER 50 16.571 42.355 15.212 354 HB3 SER 50 HB3 SER 50 16.529 40.594 15.148 355 HG SER 50 HG SER 50 14.947 42.443 13.676 356 H ILE 51 H ILE 51 15.131 39.728 17.986 357 HA ILE 51 HA ILE 51 15.524 41.485 20.223 358 HB ILE 51 HB ILE 51 16.721 38.747 20.288 359 HG12 ILE 51 HG12 ILE 51 14.670 38.359 18.997 360 HG13 ILE 51 HG13 ILE 51 14.448 37.771 20.643 361 HG21 ILE 51 HG21 ILE 51 16.763 39.657 22.399 362 HG22 ILE 51 HG22 ILE 51 15.133 38.991 22.458 363 HG23 ILE 51 HG23 ILE 51 15.376 40.695 22.090 364 HD11 ILE 51 HD11 ILE 51 13.584 40.303 20.970 365 HD12 ILE 51 HD12 ILE 51 12.523 38.974 20.516 366 HD13 ILE 51 HD13 ILE 51 13.163 40.075 19.273 367 H GLY 52 H GLY 52 17.482 41.921 21.421 368 HA2 GLY 52 HA2 GLY 52 20.067 41.219 21.088 369 HA3 GLY 52 HA3 GLY 52 19.820 42.173 19.626 370 H GLY 53 H GLY 53 21.466 42.658 22.078 371 HA2 GLY 53 HA2 GLY 53 21.954 45.135 22.448 372 HA3 GLY 53 HA3 GLY 53 20.242 45.285 22.853 373 H ASP 54 H ASP 54 21.703 42.353 23.975 374 HA ASP 54 HA ASP 54 21.244 43.172 26.722 375 HB2 ASP 54 HB2 ASP 54 22.917 40.790 26.003 376 HB3 ASP 54 HB3 ASP 54 21.652 40.947 27.232 377 H ILE 55 H ILE 55 23.312 42.152 28.072 378 HA ILE 55 HA ILE 55 25.739 43.676 27.280 379 HB ILE 55 HB ILE 55 24.432 43.607 29.990 380 HG12 ILE 55 HG12 ILE 55 23.706 45.170 27.850 381 HG13 ILE 55 HG13 ILE 55 23.502 45.650 29.523 382 HG21 ILE 55 HG21 ILE 55 26.965 44.986 29.025 383 HG22 ILE 55 HG22 ILE 55 26.881 43.694 30.215 384 HG23 ILE 55 HG23 ILE 55 26.207 45.278 30.592 385 HD11 ILE 55 HD11 ILE 55 24.658 47.347 27.984 386 HD12 ILE 55 HD12 ILE 55 26.035 46.249 27.967 387 HD13 ILE 55 HD13 ILE 55 25.504 46.962 29.488 388 H PHE 56 H PHE 56 27.632 42.637 27.743 389 HA PHE 56 HA PHE 56 27.689 40.362 29.627 390 HB2 PHE 56 HB2 PHE 56 26.982 39.640 27.183 391 HB3 PHE 56 HB3 PHE 56 28.700 39.830 26.841 392 HD1 PHE 56 HD1 PHE 56 26.337 38.209 29.256 393 HD2 PHE 56 HD2 PHE 56 30.209 38.097 27.379 394 HE1 PHE 56 HE1 PHE 56 26.784 36.005 30.313 395 HE2 PHE 56 HE2 PHE 56 30.661 35.893 28.439 396 HZ PHE 56 HZ PHE 56 28.948 34.847 29.908 397 H SER 57 H SER 57 29.822 39.934 30.352 398 HA SER 57 HA SER 57 31.773 42.089 29.707 399 HB2 SER 57 HB2 SER 57 32.954 40.575 31.658 400 HB3 SER 57 HB3 SER 57 31.920 41.972 31.953 401 HG SER 57 HG SER 57 30.183 40.616 32.250 402 H ASN 58 H ASN 58 31.194 38.766 29.027 403 HA ASN 58 HA ASN 58 32.379 37.286 27.651 404 HB2 ASN 58 HB2 ASN 58 32.813 39.451 26.377 405 HB3 ASN 58 HB3 ASN 58 34.366 39.521 27.203 406 HD21 ASN 58 HD21 ASN 58 35.605 39.141 25.257 407 HD22 ASN 58 HD22 ASN 58 35.598 37.640 24.461 408 H ARG 59 H ARG 59 33.067 37.551 30.571 409 HA ARG 59 HA ARG 59 35.883 37.327 31.036 410 HB2 ARG 59 HB2 ARG 59 33.422 36.378 32.442 411 HB3 ARG 59 HB3 ARG 59 34.923 35.563 32.837 412 HG2 ARG 59 HG2 ARG 59 35.978 37.632 33.503 413 HG3 ARG 59 HG3 ARG 59 34.587 38.570 32.963 414 HD2 ARG 59 HD2 ARG 59 34.789 36.685 35.316 415 HD3 ARG 59 HD3 ARG 59 34.257 38.367 35.313 416 HE ARG 59 HE ARG 59 32.554 36.096 34.985 417 HH11 ARG 59 HH11 ARG 59 33.171 39.168 33.665 418 HH12 ARG 59 HH12 ARG 59 31.720 39.235 32.700 419 HH21 ARG 59 HH21 ARG 59 30.683 36.093 33.701 420 HH22 ARG 59 HH22 ARG 59 30.362 37.447 32.678 421 H GLU 60 H GLU 60 33.493 35.115 29.783 422 HA GLU 60 HA GLU 60 34.946 32.671 30.019 423 HB2 GLU 60 HB2 GLU 60 32.771 33.616 28.131 424 HB3 GLU 60 HB3 GLU 60 33.377 31.959 28.134 425 HG2 GLU 60 HG2 GLU 60 31.364 32.125 29.544 426 HG3 GLU 60 HG3 GLU 60 32.771 31.740 30.531 427 H GLY 61 H GLY 61 35.533 35.416 28.123 428 HA2 GLY 61 HA2 GLY 61 37.105 35.853 26.432 429 HA3 GLY 61 HA3 GLY 61 37.884 34.343 26.907 430 H LYS 62 H LYS 62 34.642 34.893 25.546 431 HA LYS 62 HA LYS 62 35.222 32.839 23.474 432 HB2 LYS 62 HB2 LYS 62 32.950 33.543 25.028 433 HB3 LYS 62 HB3 LYS 62 32.550 33.952 23.357 434 HG2 LYS 62 HG2 LYS 62 33.901 31.342 23.681 435 HG3 LYS 62 HG3 LYS 62 32.319 31.442 24.444 436 HD2 LYS 62 HD2 LYS 62 31.678 30.824 22.306 437 HD3 LYS 62 HD3 LYS 62 31.652 32.579 22.131 438 HE2 LYS 62 HE2 LYS 62 34.324 31.556 21.684 439 HE3 LYS 62 HE3 LYS 62 33.164 30.752 20.621 440 HZ1 LYS 62 HZ1 LYS 62 33.653 32.635 19.428 441 HZ2 LYS 62 HZ2 LYS 62 33.863 33.620 20.813 442 HZ3 LYS 62 HZ3 LYS 62 32.293 33.170 20.288 443 H LEU 63 H LEU 63 35.142 36.214 23.885 444 HA LEU 63 HA LEU 63 35.236 36.630 20.930 445 HB2 LEU 63 HB2 LEU 63 33.740 38.415 22.892 446 HB3 LEU 63 HB3 LEU 63 33.867 38.660 21.154 447 HG LEU 63 HG LEU 63 32.644 36.171 22.376 448 HD11 LEU 63 HD11 LEU 63 31.524 38.590 22.711 449 HD12 LEU 63 HD12 LEU 63 30.560 37.146 22.365 450 HD13 LEU 63 HD13 LEU 63 30.978 38.264 21.068 451 HD21 LEU 63 HD21 LEU 63 33.560 36.706 19.810 452 HD22 LEU 63 HD22 LEU 63 31.840 37.096 19.705 453 HD23 LEU 63 HD23 LEU 63 32.353 35.488 20.231 454 HA PRO 64 HA PRO 64 38.931 39.006 21.462 455 HB2 PRO 64 HB2 PRO 64 37.398 41.438 20.641 456 HB3 PRO 64 HB3 PRO 64 38.983 40.869 20.091 457 HG2 PRO 64 HG2 PRO 64 36.821 40.497 18.587 458 HG3 PRO 64 HG3 PRO 64 38.071 39.251 18.707 459 HD2 PRO 64 HD2 PRO 64 35.340 39.271 19.881 460 HD3 PRO 64 HD3 PRO 64 36.361 37.890 19.400 461 H GLY 65 H GLY 65 39.936 40.095 23.153 462 HA2 GLY 65 HA2 GLY 65 38.172 41.595 25.049 463 HA3 GLY 65 HA3 GLY 65 39.291 40.371 25.628 464 H LYS 66 H LYS 66 40.056 42.260 26.918 465 HA LYS 66 HA LYS 66 42.593 43.209 26.123 466 HB2 LYS 66 HB2 LYS 66 42.167 45.601 25.595 467 HB3 LYS 66 HB3 LYS 66 41.297 44.590 24.461 468 HG2 LYS 66 HG2 LYS 66 39.219 44.909 25.626 469 HG3 LYS 66 HG3 LYS 66 40.038 45.655 26.992 470 HD2 LYS 66 HD2 LYS 66 40.742 47.138 24.650 471 HD3 LYS 66 HD3 LYS 66 38.993 46.924 24.654 472 HE2 LYS 66 HE2 LYS 66 40.380 47.733 27.195 473 HE3 LYS 66 HE3 LYS 66 40.050 48.951 25.962 474 HZ1 LYS 66 HZ1 LYS 66 38.011 49.055 26.839 475 HZ2 LYS 66 HZ2 LYS 66 38.238 47.633 27.766 476 HZ3 LYS 66 HZ3 LYS 66 37.724 47.531 26.152 477 H SER 67 H SER 67 42.482 45.775 27.488 478 HA SER 67 HA SER 67 42.335 44.835 30.252 479 HB2 SER 67 HB2 SER 67 43.121 47.014 30.845 480 HB3 SER 67 HB3 SER 67 43.916 46.659 29.309 481 HG SER 67 HG SER 67 41.388 47.914 29.389 482 H GLY 68 H GLY 68 40.096 44.187 30.318 483 HA2 GLY 68 HA2 GLY 68 37.891 44.662 31.085 484 HA3 GLY 68 HA3 GLY 68 38.273 46.386 30.978 485 H ARG 69 H ARG 69 36.863 43.676 29.289 486 HA ARG 69 HA ARG 69 36.313 45.477 26.950 487 HB2 ARG 69 HB2 ARG 69 37.786 43.585 26.341 488 HB3 ARG 69 HB3 ARG 69 36.586 42.455 26.970 489 HG2 ARG 69 HG2 ARG 69 36.081 42.461 24.685 490 HG3 ARG 69 HG3 ARG 69 34.954 43.670 25.294 491 HD2 ARG 69 HD2 ARG 69 36.030 44.614 23.354 492 HD3 ARG 69 HD3 ARG 69 36.696 45.427 24.765 493 HE ARG 69 HE ARG 69 38.303 43.143 24.190 494 HH11 ARG 69 HH11 ARG 69 37.408 46.149 22.819 495 HH12 ARG 69 HH12 ARG 69 38.891 46.296 21.912 496 HH21 ARG 69 HH21 ARG 69 40.222 43.322 23.073 497 HH22 ARG 69 HH22 ARG 69 40.457 44.699 22.039 498 H THR 70 H THR 70 34.212 45.625 26.258 499 HA THR 70 HA THR 70 32.121 44.215 27.896 500 HB THR 70 HB THR 70 30.660 46.066 27.406 501 HG1 THR 70 HG1 THR 70 32.696 46.691 25.513 502 HG21 THR 70 HG21 THR 70 33.412 47.274 27.841 503 HG22 THR 70 HG22 THR 70 32.438 46.551 29.114 504 HG23 THR 70 HG23 THR 70 31.863 47.999 28.274 505 H TRP 71 H TRP 71 30.810 42.756 26.751 506 HA TRP 71 HA TRP 71 30.931 42.939 23.765 507 HB2 TRP 71 HB2 TRP 71 31.309 40.620 25.597 508 HB3 TRP 71 HB3 TRP 71 30.430 40.317 24.098 509 HD1 TRP 71 HD1 TRP 71 33.893 40.813 25.405 510 HE1 TRP 71 HE1 TRP 71 35.577 40.984 23.437 511 HE3 TRP 71 HE3 TRP 71 30.634 41.301 21.522 512 HZ2 TRP 71 HZ2 TRP 71 35.512 41.338 20.606 513 HZ3 TRP 71 HZ3 TRP 71 31.455 41.572 19.200 514 HH2 TRP 71 HH2 TRP 71 33.893 41.588 18.735 515 H ARG 72 H ARG 72 29.044 42.630 22.615 516 HA ARG 72 HA ARG 72 26.506 42.115 24.094 517 HB2 ARG 72 HB2 ARG 72 27.214 44.550 22.430 518 HB3 ARG 72 HB3 ARG 72 25.533 44.052 22.685 519 HG2 ARG 72 HG2 ARG 72 25.648 45.329 24.564 520 HG3 ARG 72 HG3 ARG 72 26.551 43.973 25.250 521 HD2 ARG 72 HD2 ARG 72 28.051 45.724 25.591 522 HD3 ARG 72 HD3 ARG 72 28.593 45.099 24.030 523 HE ARG 72 HE ARG 72 26.632 47.027 23.410 524 HH11 ARG 72 HH11 ARG 72 29.702 46.844 24.966 525 HH12 ARG 72 HH12 ARG 72 30.066 48.510 24.722 526 HH21 ARG 72 HH21 ARG 72 27.094 49.173 23.090 527 HH22 ARG 72 HH22 ARG 72 28.593 49.834 23.657 528 H GLU 73 H GLU 73 24.857 41.209 22.777 529 HA GLU 73 HA GLU 73 25.756 40.534 20.020 530 HB2 GLU 73 HB2 GLU 73 24.718 38.375 20.233 531 HB3 GLU 73 HB3 GLU 73 25.745 38.637 21.637 532 HG2 GLU 73 HG2 GLU 73 23.912 38.051 22.844 533 HG3 GLU 73 HG3 GLU 73 23.363 39.697 22.517 534 H ALA 74 H ALA 74 23.870 39.881 18.539 535 HA ALA 74 HA ALA 74 21.277 41.115 19.119 536 HB1 ALA 74 HB1 ALA 74 23.130 42.828 18.084 537 HB2 ALA 74 HB2 ALA 74 21.404 42.968 17.780 538 HB3 ALA 74 HB3 ALA 74 22.451 42.165 16.600 539 H ASP 75 H ASP 75 19.617 40.310 17.733 540 HA ASP 75 HA ASP 75 20.175 37.829 16.336 541 HB2 ASP 75 HB2 ASP 75 17.829 39.358 17.113 542 HB3 ASP 75 HB3 ASP 75 17.660 38.785 15.458 543 H ILE 76 H ILE 76 19.989 37.403 14.033 544 HA ILE 76 HA ILE 76 20.078 39.823 12.281 545 HB ILE 76 HB ILE 76 22.052 37.530 12.334 546 HG12 ILE 76 HG12 ILE 76 22.366 39.577 13.838 547 HG13 ILE 76 HG13 ILE 76 23.695 39.199 12.751 548 HG21 ILE 76 HG21 ILE 76 23.059 38.879 10.353 549 HG22 ILE 76 HG22 ILE 76 21.444 39.552 10.182 550 HG23 ILE 76 HG23 ILE 76 21.698 37.808 10.023 551 HD11 ILE 76 HD11 ILE 76 23.358 41.050 11.461 552 HD12 ILE 76 HD12 ILE 76 22.628 41.671 12.938 553 HD13 ILE 76 HD13 ILE 76 21.602 41.008 11.667 554 H ASN 77 H ASN 77 19.413 39.439 10.112 555 HA ASN 77 HA ASN 77 18.061 38.506 8.467 556 HB2 ASN 77 HB2 ASN 77 19.218 35.950 9.600 557 HB3 ASN 77 HB3 ASN 77 18.356 36.072 8.064 558 HD21 ASN 77 HD21 ASN 77 21.015 35.205 8.050 559 HD22 ASN 77 HD22 ASN 77 22.010 36.419 7.389 560 H TYR 78 H TYR 78 16.517 39.246 10.581 561 HA TYR 78 HA TYR 78 14.652 36.940 10.878 562 HB2 TYR 78 HB2 TYR 78 15.346 37.538 13.090 563 HB3 TYR 78 HB3 TYR 78 15.140 39.261 12.756 564 HD1 TYR 78 HD1 TYR 78 13.313 36.037 13.145 565 HD2 TYR 78 HD2 TYR 78 12.995 40.315 12.937 566 HE1 TYR 78 HE1 TYR 78 10.945 35.896 13.886 567 HE2 TYR 78 HE2 TYR 78 10.636 40.176 13.680 568 HH TYR 78 HH TYR 78 9.227 38.581 14.987 569 H THR 79 H THR 79 12.394 37.429 10.677 570 HA THR 79 HA THR 79 11.759 40.074 9.416 571 HB THR 79 HB THR 79 10.423 38.994 7.719 572 HG1 THR 79 HG1 THR 79 10.244 36.715 7.710 573 HG21 THR 79 HG21 THR 79 12.861 37.225 7.767 574 HG22 THR 79 HG22 THR 79 13.037 38.970 7.544 575 HG23 THR 79 HG23 THR 79 12.093 38.019 6.399 576 H SER 80 H SER 80 9.823 37.173 9.968 577 HA SER 80 HA SER 80 8.363 38.402 12.234 578 HB2 SER 80 HB2 SER 80 6.727 39.236 10.862 579 HB3 SER 80 HB3 SER 80 7.308 38.314 9.482 580 HG SER 80 HG SER 80 6.363 36.430 10.587 581 H GLY 81 H GLY 81 8.745 36.617 13.565 582 HA2 GLY 81 HA2 GLY 81 7.160 34.414 13.698 583 HA3 GLY 81 HA3 GLY 81 8.327 33.889 12.484 584 H PHE 82 H PHE 82 10.297 33.117 13.184 585 HA PHE 82 HA PHE 82 10.973 33.563 16.070 586 HB2 PHE 82 HB2 PHE 82 10.126 31.180 15.349 587 HB3 PHE 82 HB3 PHE 82 11.746 31.016 14.670 588 HD1 PHE 82 HD1 PHE 82 9.893 31.821 17.809 589 HD2 PHE 82 HD2 PHE 82 13.620 30.615 16.051 590 HE1 PHE 82 HE1 PHE 82 10.810 31.362 20.071 591 HE2 PHE 82 HE2 PHE 82 14.541 30.161 18.307 592 HZ PHE 82 HZ PHE 82 13.136 30.532 20.319 593 H ARG 83 H ARG 83 13.422 32.713 16.334 594 HA ARG 83 HA ARG 83 14.991 34.467 14.603 595 HB2 ARG 83 HB2 ARG 83 16.412 32.645 16.465 596 HB3 ARG 83 HB3 ARG 83 16.578 34.384 16.247 597 HG2 ARG 83 HG2 ARG 83 14.175 34.438 17.369 598 HG3 ARG 83 HG3 ARG 83 14.679 32.872 18.001 599 HD2 ARG 83 HD2 ARG 83 16.056 35.543 18.382 600 HD3 ARG 83 HD3 ARG 83 15.366 34.500 19.628 601 HE ARG 83 HE ARG 83 17.308 32.908 18.425 602 HH11 ARG 83 HH11 ARG 83 17.220 36.016 19.860 603 HH12 ARG 83 HH12 ARG 83 18.852 35.959 20.402 604 HH21 ARG 83 HH21 ARG 83 19.442 32.818 19.169 605 HH22 ARG 83 HH22 ARG 83 20.115 34.161 20.053 606 H ASN 84 H ASN 84 17.393 32.782 14.773 607 HA ASN 84 HA ASN 84 16.943 30.325 13.296 608 HB2 ASN 84 HB2 ASN 84 18.140 31.148 11.214 609 HB3 ASN 84 HB3 ASN 84 16.547 31.853 11.446 610 HD21 ASN 84 HD21 ASN 84 17.770 33.512 9.919 611 HD22 ASN 84 HD22 ASN 84 18.531 34.798 10.722 612 H SER 85 H SER 85 19.751 31.029 12.006 613 HA SER 85 HA SER 85 21.284 30.462 14.518 614 HB2 SER 85 HB2 SER 85 22.754 29.092 13.237 615 HB3 SER 85 HB3 SER 85 21.131 28.674 12.680 616 HG SER 85 HG SER 85 23.207 29.747 11.307 617 H ASP 86 H ASP 86 20.722 32.710 12.099 618 HA ASP 86 HA ASP 86 23.352 33.858 11.762 619 HB2 ASP 86 HB2 ASP 86 20.535 34.741 11.174 620 HB3 ASP 86 HB3 ASP 86 21.876 35.860 10.974 621 H ARG 87 H ARG 87 24.393 34.705 13.557 622 HA ARG 87 HA ARG 87 22.846 36.706 15.160 623 HB2 ARG 87 HB2 ARG 87 24.553 34.439 16.205 624 HB3 ARG 87 HB3 ARG 87 24.018 35.789 17.213 625 HG2 ARG 87 HG2 ARG 87 22.053 34.280 15.549 626 HG3 ARG 87 HG3 ARG 87 22.546 33.592 17.092 627 HD2 ARG 87 HD2 ARG 87 21.558 35.290 18.334 628 HD3 ARG 87 HD3 ARG 87 21.732 36.469 17.044 629 HE ARG 87 HE ARG 87 19.323 35.838 17.356 630 HH11 ARG 87 HH11 ARG 87 20.970 33.265 15.807 631 HH12 ARG 87 HH12 ARG 87 19.985 33.318 14.389 632 HH21 ARG 87 HH21 ARG 87 17.943 35.791 15.606 633 HH22 ARG 87 HH22 ARG 87 18.273 34.679 14.298 634 H ILE 88 H ILE 88 23.972 38.571 15.618 635 HA ILE 88 HA ILE 88 26.804 38.665 14.681 636 HB ILE 88 HB ILE 88 25.118 40.168 13.552 637 HG12 ILE 88 HG12 ILE 88 27.297 41.614 15.074 638 HG13 ILE 88 HG13 ILE 88 27.549 40.700 13.582 639 HG21 ILE 88 HG21 ILE 88 25.215 41.911 15.972 640 HG22 ILE 88 HG22 ILE 88 24.049 40.581 15.937 641 HG23 ILE 88 HG23 ILE 88 23.992 41.832 14.703 642 HD11 ILE 88 HD11 ILE 88 26.764 43.415 13.810 643 HD12 ILE 88 HD12 ILE 88 25.339 42.536 13.247 644 HD13 ILE 88 HD13 ILE 88 26.847 42.446 12.336 645 H LEU 89 H LEU 89 28.368 39.598 15.926 646 HA LEU 89 HA LEU 89 27.652 40.189 18.765 647 HB2 LEU 89 HB2 LEU 89 29.571 38.311 17.556 648 HB3 LEU 89 HB3 LEU 89 30.277 39.326 18.815 649 HG LEU 89 HG LEU 89 29.367 37.238 19.782 650 HD11 LEU 89 HD11 LEU 89 27.477 39.414 20.624 651 HD12 LEU 89 HD12 LEU 89 29.211 39.619 20.880 652 HD13 LEU 89 HD13 LEU 89 28.369 38.260 21.622 653 HD21 LEU 89 HD21 LEU 89 27.463 37.183 17.987 654 HD22 LEU 89 HD22 LEU 89 26.602 38.239 19.098 655 HD23 LEU 89 HD23 LEU 89 27.096 36.628 19.613 656 H TYR 90 H TYR 90 28.249 42.183 19.421 657 HA TYR 90 HA TYR 90 30.487 43.574 17.970 658 HB2 TYR 90 HB2 TYR 90 29.200 45.438 17.493 659 HB3 TYR 90 HB3 TYR 90 27.942 44.211 17.413 660 HD1 TYR 90 HD1 TYR 90 26.279 43.968 19.224 661 HD2 TYR 90 HD2 TYR 90 29.359 46.983 19.338 662 HE1 TYR 90 HE1 TYR 90 25.056 45.156 21.039 663 HE2 TYR 90 HE2 TYR 90 28.140 48.164 21.147 664 HH TYR 90 HH TYR 90 24.903 47.262 22.090 665 H SER 91 H SER 91 31.841 44.763 19.330 666 HA SER 91 HA SER 91 31.343 44.417 22.275 667 HB2 SER 91 HB2 SER 91 33.790 44.759 22.468 668 HB3 SER 91 HB3 SER 91 33.402 43.440 21.364 669 HG SER 91 HG SER 91 34.903 45.458 20.790 670 H SER 92 H SER 92 32.646 46.099 23.585 671 HA SER 92 HA SER 92 31.484 48.654 23.543 672 HB2 SER 92 HB2 SER 92 34.096 49.069 24.480 673 HB3 SER 92 HB3 SER 92 32.711 48.655 25.474 674 HG SER 92 HG SER 92 34.652 46.936 24.286 675 H ASP 93 H ASP 93 34.628 47.702 22.414 676 HA ASP 93 HA ASP 93 35.330 50.147 21.121 677 HB2 ASP 93 HB2 ASP 93 36.991 48.356 20.003 678 HB3 ASP 93 HB3 ASP 93 37.157 48.849 21.688 679 H TRP 94 H TRP 94 32.879 48.220 20.269 680 HA TRP 94 HA TRP 94 31.588 48.053 18.361 681 HB2 TRP 94 HB2 TRP 94 33.600 49.931 17.101 682 HB3 TRP 94 HB3 TRP 94 32.006 49.533 16.461 683 HD1 TRP 94 HD1 TRP 94 33.628 52.059 18.455 684 HE1 TRP 94 HE1 TRP 94 31.964 53.332 19.952 685 HE3 TRP 94 HE3 TRP 94 29.544 48.982 18.118 686 HZ2 TRP 94 HZ2 TRP 94 29.283 53.106 20.873 687 HZ3 TRP 94 HZ3 TRP 94 27.450 49.547 19.327 688 HH2 TRP 94 HH2 TRP 94 27.315 51.602 20.701 689 H LEU 95 H LEU 95 34.248 46.384 18.766 690 HA LEU 95 HA LEU 95 34.934 45.629 16.042 691 HB2 LEU 95 HB2 LEU 95 35.351 44.360 18.760 692 HB3 LEU 95 HB3 LEU 95 35.811 43.519 17.288 693 HG LEU 95 HG LEU 95 36.825 46.208 18.234 694 HD11 LEU 95 HD11 LEU 95 38.262 43.591 17.736 695 HD12 LEU 95 HD12 LEU 95 37.767 44.177 19.323 696 HD13 LEU 95 HD13 LEU 95 38.972 45.067 18.387 697 HD21 LEU 95 HD21 LEU 95 38.402 45.593 16.119 698 HD22 LEU 95 HD22 LEU 95 36.958 46.593 15.969 699 HD23 LEU 95 HD23 LEU 95 36.890 44.877 15.567 700 H ILE 96 H ILE 96 33.668 44.345 14.741 701 HA ILE 96 HA ILE 96 31.436 42.919 16.072 702 HB ILE 96 HB ILE 96 31.456 43.911 13.223 703 HG12 ILE 96 HG12 ILE 96 29.554 45.301 14.805 704 HG13 ILE 96 HG13 ILE 96 31.053 45.326 15.726 705 HG21 ILE 96 HG21 ILE 96 29.967 41.939 14.049 706 HG22 ILE 96 HG22 ILE 96 29.181 43.257 13.181 707 HG23 ILE 96 HG23 ILE 96 29.098 43.181 14.944 708 HD11 ILE 96 HD11 ILE 96 30.978 46.043 12.792 709 HD12 ILE 96 HD12 ILE 96 32.243 46.371 13.949 710 HD13 ILE 96 HD13 ILE 96 30.702 47.240 14.054 711 H TYR 97 H TYR 97 31.084 40.865 15.788 712 HA TYR 97 HA TYR 97 32.671 39.366 13.744 713 HB2 TYR 97 HB2 TYR 97 32.278 38.688 16.675 714 HB3 TYR 97 HB3 TYR 97 32.716 37.461 15.485 715 HD1 TYR 97 HD1 TYR 97 33.740 40.940 16.394 716 HD2 TYR 97 HD2 TYR 97 34.978 37.001 15.253 717 HE1 TYR 97 HE1 TYR 97 36.099 41.659 16.518 718 HE2 TYR 97 HE2 TYR 97 37.352 37.711 15.384 719 HH TYR 97 HH TYR 97 38.745 39.349 16.109 720 H LYS 98 H LYS 98 31.553 37.305 13.078 721 HA LYS 98 HA LYS 98 28.607 37.488 13.648 722 HB2 LYS 98 HB2 LYS 98 28.118 37.235 11.395 723 HB3 LYS 98 HB3 LYS 98 29.538 38.284 11.341 724 HG2 LYS 98 HG2 LYS 98 30.974 36.293 10.988 725 HG3 LYS 98 HG3 LYS 98 29.552 35.249 11.002 726 HD2 LYS 98 HD2 LYS 98 30.332 37.333 8.961 727 HD3 LYS 98 HD3 LYS 98 29.970 35.630 8.698 728 HE2 LYS 98 HE2 LYS 98 28.046 37.873 9.331 729 HE3 LYS 98 HE3 LYS 98 28.044 36.805 7.927 730 HZ1 LYS 98 HZ1 LYS 98 27.007 35.176 9.068 731 HZ2 LYS 98 HZ2 LYS 98 26.548 36.423 10.125 732 HZ3 LYS 98 HZ3 LYS 98 27.888 35.455 10.489 733 H THR 99 H THR 99 27.446 35.574 13.827 734 HA THR 99 HA THR 99 28.942 33.029 13.411 735 HB THR 99 HB THR 99 29.218 33.128 15.726 736 HG1 THR 99 HG1 THR 99 28.183 31.235 15.438 737 HG21 THR 99 HG21 THR 99 27.518 34.021 17.289 738 HG22 THR 99 HG22 THR 99 26.478 34.391 15.907 739 HG23 THR 99 HG23 THR 99 28.024 35.221 16.096 740 H THR 100 H THR 100 27.712 31.636 12.352 741 HA THR 100 HA THR 100 24.792 32.200 11.931 742 HB THR 100 HB THR 100 25.271 30.853 9.756 743 HG1 THR 100 HG1 THR 100 27.527 30.542 10.810 744 HG21 THR 100 HG21 THR 100 26.746 33.338 9.395 745 HG22 THR 100 HG22 THR 100 25.298 33.580 10.386 746 HG23 THR 100 HG23 THR 100 25.161 32.884 8.774 747 H ASP 101 H ASP 101 26.627 30.298 13.743 748 HA ASP 101 HA ASP 101 24.945 27.865 13.183 749 HB2 ASP 101 HB2 ASP 101 26.987 26.906 14.691 750 HB3 ASP 101 HB3 ASP 101 27.029 26.967 12.927 751 H ALA 102 H ALA 102 24.137 30.148 14.766 752 HA ALA 102 HA ALA 102 23.053 30.574 16.797 753 HB1 ALA 102 HB1 ALA 102 23.364 27.602 17.298 754 HB2 ALA 102 HB2 ALA 102 22.128 28.285 16.241 755 HB3 ALA 102 HB3 ALA 102 22.132 28.677 17.959 756 H TYR 103 H TYR 103 25.303 31.576 17.250 757 HA TYR 103 HA TYR 103 26.953 32.082 18.824 758 HB2 TYR 103 HB2 TYR 103 25.496 30.135 20.624 759 HB3 TYR 103 HB3 TYR 103 26.530 31.467 21.112 760 HD1 TYR 103 HD1 TYR 103 25.541 33.663 19.319 761 HD2 TYR 103 HD2 TYR 103 23.402 30.660 21.521 762 HE1 TYR 103 HE1 TYR 103 23.560 35.157 19.443 763 HE2 TYR 103 HE2 TYR 103 21.429 32.149 21.638 764 HH TYR 103 HH TYR 103 21.595 35.505 20.594 765 H GLN 104 H GLN 104 27.661 30.042 16.971 766 HA GLN 104 HA GLN 104 29.257 28.155 18.728 767 HB2 GLN 104 HB2 GLN 104 28.157 27.762 15.940 768 HB3 GLN 104 HB3 GLN 104 29.377 26.719 16.644 769 HG2 GLN 104 HG2 GLN 104 26.902 27.239 18.244 770 HG3 GLN 104 HG3 GLN 104 26.764 26.171 16.848 771 HE21 GLN 104 HE21 GLN 104 26.604 25.362 19.718 772 HE22 GLN 104 HE22 GLN 104 27.852 24.232 19.942 773 H THR 105 H THR 105 29.605 29.070 15.263 774 HA THR 105 HA THR 105 32.471 29.632 15.859 775 HB THR 105 HB THR 105 32.875 29.448 13.508 776 HG1 THR 105 HG1 THR 105 30.095 29.227 13.010 777 HG21 THR 105 HG21 THR 105 31.344 27.291 13.021 778 HG22 THR 105 HG22 THR 105 31.040 27.442 14.749 779 HG23 THR 105 HG23 THR 105 32.688 27.238 14.150 780 H PHE 106 H PHE 106 33.103 31.684 16.228 781 HA PHE 106 HA PHE 106 31.409 33.931 15.280 782 HB2 PHE 106 HB2 PHE 106 33.678 33.878 17.282 783 HB3 PHE 106 HB3 PHE 106 32.699 35.288 16.888 784 HD1 PHE 106 HD1 PHE 106 32.275 31.700 17.907 785 HD2 PHE 106 HD2 PHE 106 30.840 35.735 18.171 786 HE1 PHE 106 HE1 PHE 106 30.543 30.977 19.535 787 HE2 PHE 106 HE2 PHE 106 29.117 35.020 19.791 788 HZ PHE 106 HZ PHE 106 28.962 32.643 20.470 789 H THR 107 H THR 107 32.224 33.810 13.028 790 HA THR 107 HA THR 107 35.031 34.393 12.569 791 HB THR 107 HB THR 107 32.607 34.328 10.762 792 HG1 THR 107 HG1 THR 107 33.564 32.357 11.390 793 HG21 THR 107 HG21 THR 107 35.457 35.049 10.036 794 HG22 THR 107 HG22 THR 107 34.045 36.099 9.918 795 HG23 THR 107 HG23 THR 107 34.180 34.682 8.881 796 H LYS 108 H LYS 108 35.975 36.304 12.096 797 HA LYS 108 HA LYS 108 34.685 38.684 13.158 798 HB2 LYS 108 HB2 LYS 108 37.126 38.236 13.394 799 HB3 LYS 108 HB3 LYS 108 37.308 38.415 11.654 800 HG2 LYS 108 HG2 LYS 108 36.416 40.733 11.814 801 HG3 LYS 108 HG3 LYS 108 36.310 40.555 13.564 802 HD2 LYS 108 HD2 LYS 108 38.684 40.362 13.780 803 HD3 LYS 108 HD3 LYS 108 38.895 40.169 12.036 804 HE2 LYS 108 HE2 LYS 108 39.481 42.457 12.619 805 HE3 LYS 108 HE3 LYS 108 37.948 42.492 11.745 806 HZ1 LYS 108 HZ1 LYS 108 36.777 43.070 13.584 807 HZ2 LYS 108 HZ2 LYS 108 38.295 43.706 14.066 808 HZ3 LYS 108 HZ3 LYS 108 37.795 42.183 14.639 809 H ILE 109 H ILE 109 34.117 40.565 12.013 810 HA ILE 109 HA ILE 109 34.058 40.328 9.035 811 HB ILE 109 HB ILE 109 31.799 41.379 9.046 812 HG12 ILE 109 HG12 ILE 109 31.926 40.833 12.028 813 HG13 ILE 109 HG13 ILE 109 32.029 42.437 11.306 814 HG21 ILE 109 HG21 ILE 109 32.338 38.795 9.189 815 HG22 ILE 109 HG22 ILE 109 30.676 39.355 9.356 816 HG23 ILE 109 HG23 ILE 109 31.615 38.938 10.793 817 HD11 ILE 109 HD11 ILE 109 29.792 42.493 10.794 818 HD12 ILE 109 HD12 ILE 109 29.704 41.360 12.143 819 HD13 ILE 109 HD13 ILE 109 29.710 40.759 10.489 820 H ARG 110 H ARG 110 34.206 42.324 11.908 821 HA ARG 110 HA ARG 110 35.404 44.532 10.304 822 HB2 ARG 110 HB2 ARG 110 33.182 44.853 12.345 823 HB3 ARG 110 HB3 ARG 110 34.073 46.184 11.610 824 HG2 ARG 110 HG2 ARG 110 33.024 44.305 9.628 825 HG3 ARG 110 HG3 ARG 110 31.748 45.029 10.597 826 HD2 ARG 110 HD2 ARG 110 32.855 47.275 10.136 827 HD3 ARG 110 HD3 ARG 110 33.858 46.458 8.946 828 HE ARG 110 HE ARG 110 31.200 47.417 8.522 829 HH11 ARG 110 HH11 ARG 110 32.940 44.450 8.022 830 HH12 ARG 110 HH12 ARG 110 31.873 43.946 6.753 831 HH21 ARG 110 HH21 ARG 110 29.916 46.775 6.900 832 HH22 ARG 110 HH22 ARG 110 30.197 45.238 6.098 Start of MODEL 7 1 H VAL 3 H VAL 3 16.401 49.157 12.536 2 HA VAL 3 HA VAL 3 14.272 47.986 11.800 3 HB VAL 3 HB VAL 3 14.373 49.873 9.476 4 HG11 VAL 3 HG11 VAL 3 12.996 47.958 9.166 5 HG12 VAL 3 HG12 VAL 3 11.874 49.257 9.571 6 HG13 VAL 3 HG13 VAL 3 12.329 48.071 10.797 7 HG21 VAL 3 HG21 VAL 3 13.167 50.449 12.182 8 HG22 VAL 3 HG22 VAL 3 12.391 51.061 10.721 9 HG23 VAL 3 HG23 VAL 3 14.045 51.537 11.104 10 H ILE 4 H ILE 4 16.858 47.338 11.931 11 HA ILE 4 HA ILE 4 17.512 46.463 9.148 12 HB ILE 4 HB ILE 4 19.402 47.757 11.154 13 HG12 ILE 4 HG12 ILE 4 19.388 48.565 8.308 14 HG13 ILE 4 HG13 ILE 4 17.900 48.930 9.178 15 HG21 ILE 4 HG21 ILE 4 21.089 47.297 9.232 16 HG22 ILE 4 HG22 ILE 4 19.944 46.062 8.721 17 HG23 ILE 4 HG23 ILE 4 20.685 45.971 10.318 18 HD11 ILE 4 HD11 ILE 4 19.146 50.142 10.890 19 HD12 ILE 4 HD12 ILE 4 19.575 50.781 9.302 20 HD13 ILE 4 HD13 ILE 4 20.674 49.687 10.140 21 H ASN 5 H ASN 5 18.621 44.429 9.093 22 HA ASN 5 HA ASN 5 19.112 43.045 11.660 23 HB2 ASN 5 HB2 ASN 5 17.680 41.128 10.998 24 HB3 ASN 5 HB3 ASN 5 16.726 42.604 11.174 25 HD21 ASN 5 HD21 ASN 5 15.575 40.697 9.543 26 HD22 ASN 5 HD22 ASN 5 15.727 41.138 7.911 27 H THR 6 H THR 6 20.814 43.934 9.452 28 HA THR 6 HA THR 6 21.669 41.273 8.387 29 HB THR 6 HB THR 6 22.458 42.334 6.395 30 HG1 THR 6 HG1 THR 6 22.168 44.712 6.294 31 HG21 THR 6 HG21 THR 6 20.465 42.992 5.414 32 HG22 THR 6 HG22 THR 6 19.973 43.959 6.803 33 HG23 THR 6 HG23 THR 6 19.849 42.199 6.864 34 H PHE 7 H PHE 7 23.804 40.710 8.592 35 HA PHE 7 HA PHE 7 25.387 41.486 10.705 36 HB2 PHE 7 HB2 PHE 7 26.291 40.543 7.967 37 HB3 PHE 7 HB3 PHE 7 27.362 40.638 9.371 38 HD1 PHE 7 HD1 PHE 7 26.437 39.546 11.584 39 HD2 PHE 7 HD2 PHE 7 25.071 38.591 7.600 40 HE1 PHE 7 HE1 PHE 7 25.486 37.400 12.418 41 HE2 PHE 7 HE2 PHE 7 24.130 36.446 8.437 42 HZ PHE 7 HZ PHE 7 24.331 35.849 10.840 43 H ASP 8 H ASP 8 26.779 42.285 7.630 44 HA ASP 8 HA ASP 8 28.406 44.378 8.384 45 HB2 ASP 8 HB2 ASP 8 27.023 43.717 5.803 46 HB3 ASP 8 HB3 ASP 8 27.939 45.222 5.934 47 H GLY 9 H GLY 9 25.048 44.667 7.211 48 HA2 GLY 9 HA2 GLY 9 24.781 47.464 7.333 49 HA3 GLY 9 HA3 GLY 9 23.449 46.342 7.590 50 H VAL 10 H VAL 10 24.139 45.091 9.998 51 HA VAL 10 HA VAL 10 23.450 47.133 11.934 52 HB VAL 10 HB VAL 10 24.459 44.281 12.239 53 HG11 VAL 10 HG11 VAL 10 25.257 45.366 14.206 54 HG12 VAL 10 HG12 VAL 10 23.714 44.657 14.680 55 HG13 VAL 10 HG13 VAL 10 23.820 46.383 14.323 56 HG21 VAL 10 HG21 VAL 10 21.794 45.696 12.526 57 HG22 VAL 10 HG22 VAL 10 22.078 44.116 13.258 58 HG23 VAL 10 HG23 VAL 10 22.186 44.313 11.506 59 H ALA 11 H ALA 11 26.515 45.430 11.166 60 HA ALA 11 HA ALA 11 28.172 46.590 13.159 61 HB1 ALA 11 HB1 ALA 11 29.807 46.307 10.951 62 HB2 ALA 11 HB2 ALA 11 28.482 45.215 10.597 63 HB3 ALA 11 HB3 ALA 11 29.409 45.026 12.086 64 H ASP 12 H ASP 12 27.857 47.657 9.724 65 HA ASP 12 HA ASP 12 29.343 50.046 9.934 66 HB2 ASP 12 HB2 ASP 12 27.098 49.114 8.184 67 HB3 ASP 12 HB3 ASP 12 27.483 50.839 8.174 68 H TYR 13 H TYR 13 25.845 49.560 10.376 69 HA TYR 13 HA TYR 13 25.105 52.144 11.135 70 HB2 TYR 13 HB2 TYR 13 23.690 49.949 10.926 71 HB3 TYR 13 HB3 TYR 13 24.052 49.770 12.641 72 HD1 TYR 13 HD1 TYR 13 22.350 51.853 10.106 73 HD2 TYR 13 HD2 TYR 13 23.084 51.275 14.308 74 HE1 TYR 13 HE1 TYR 13 20.504 53.419 10.644 75 HE2 TYR 13 HE2 TYR 13 21.229 52.837 14.838 76 HH TYR 13 HH TYR 13 18.878 53.626 13.026 77 H LEU 14 H LEU 14 26.261 49.533 13.235 78 HA LEU 14 HA LEU 14 26.285 51.149 15.618 79 HB2 LEU 14 HB2 LEU 14 27.474 48.481 14.855 80 HB3 LEU 14 HB3 LEU 14 27.865 49.226 16.404 81 HG LEU 14 HG LEU 14 25.057 48.657 15.415 82 HD11 LEU 14 HD11 LEU 14 26.743 46.749 16.240 83 HD12 LEU 14 HD12 LEU 14 25.041 46.736 16.696 84 HD13 LEU 14 HD13 LEU 14 26.249 47.346 17.827 85 HD21 LEU 14 HD21 LEU 14 26.117 50.387 17.478 86 HD22 LEU 14 HD22 LEU 14 25.167 49.099 18.211 87 HD23 LEU 14 HD23 LEU 14 24.442 50.149 16.995 88 H GLN 15 H GLN 15 28.893 50.173 13.341 89 HA GLN 15 HA GLN 15 30.939 51.526 14.774 90 HB2 GLN 15 HB2 GLN 15 30.738 50.766 11.871 91 HB3 GLN 15 HB3 GLN 15 32.195 51.470 12.589 92 HG2 GLN 15 HG2 GLN 15 31.740 49.518 14.392 93 HG3 GLN 15 HG3 GLN 15 31.020 48.758 12.979 94 HE21 GLN 15 HE21 GLN 15 33.382 47.738 14.181 95 HE22 GLN 15 HE22 GLN 15 34.668 47.950 13.092 96 H THR 16 H THR 16 28.448 52.835 12.755 97 HA THR 16 HA THR 16 29.939 55.432 12.517 98 HB THR 16 HB THR 16 27.327 54.667 11.183 99 HG1 THR 16 HG1 THR 16 28.912 53.186 10.567 100 HG21 THR 16 HG21 THR 16 27.753 57.031 11.114 101 HG22 THR 16 HG22 THR 16 28.138 56.374 9.526 102 HG23 THR 16 HG23 THR 16 29.440 56.774 10.648 103 H TYR 17 H TYR 17 26.741 54.162 13.515 104 HA TYR 17 HA TYR 17 26.130 56.806 14.773 105 HB2 TYR 17 HB2 TYR 17 24.389 54.374 14.235 106 HB3 TYR 17 HB3 TYR 17 23.825 55.926 14.870 107 HD1 TYR 17 HD1 TYR 17 24.321 58.032 13.472 108 HD2 TYR 17 HD2 TYR 17 24.560 54.029 11.912 109 HE1 TYR 17 HE1 TYR 17 24.143 58.918 11.162 110 HE2 TYR 17 HE2 TYR 17 24.381 54.924 9.602 111 HH TYR 17 HH TYR 17 25.028 57.612 8.615 112 H HIS 18 H HIS 18 27.116 53.621 15.591 113 HA HIS 18 HA HIS 18 27.437 52.524 17.623 114 HB2 HIS 18 HB2 HIS 18 27.230 55.390 18.566 115 HB3 HIS 18 HB3 HIS 18 27.589 54.052 19.658 116 HD1 HIS 18 HD1 HIS 18 28.982 53.103 16.523 117 HD2 HIS 18 HD2 HIS 18 30.197 55.733 19.549 118 HE1 HIS 18 HE1 HIS 18 31.477 53.494 16.202 119 H LYS 19 H LYS 19 24.618 54.590 17.416 120 HA LYS 19 HA LYS 19 23.198 53.401 19.590 121 HB2 LYS 19 HB2 LYS 19 22.076 55.338 19.118 122 HB3 LYS 19 HB3 LYS 19 22.700 55.370 17.475 123 HG2 LYS 19 HG2 LYS 19 21.001 53.603 16.869 124 HG3 LYS 19 HG3 LYS 19 20.316 53.782 18.480 125 HD2 LYS 19 HD2 LYS 19 18.991 55.266 17.293 126 HD3 LYS 19 HD3 LYS 19 20.274 56.350 17.820 127 HE2 LYS 19 HE2 LYS 19 20.594 56.851 15.644 128 HE3 LYS 19 HE3 LYS 19 21.263 55.233 15.456 129 HZ1 LYS 19 HZ1 LYS 19 19.579 54.804 14.070 130 HZ2 LYS 19 HZ2 LYS 19 18.827 56.292 14.446 131 HZ3 LYS 19 HZ3 LYS 19 18.492 54.913 15.398 132 H LEU 20 H LEU 20 22.527 51.379 19.653 133 HA LEU 20 HA LEU 20 22.679 49.460 17.651 134 HB2 LEU 20 HB2 LEU 20 21.096 49.724 20.144 135 HB3 LEU 20 HB3 LEU 20 20.481 48.549 18.984 136 HG LEU 20 HG LEU 20 23.417 48.525 19.528 137 HD11 LEU 20 HD11 LEU 20 21.292 47.577 21.462 138 HD12 LEU 20 HD12 LEU 20 22.600 48.715 21.781 139 HD13 LEU 20 HD13 LEU 20 22.962 47.012 21.502 140 HD21 LEU 20 HD21 LEU 20 22.440 46.944 17.916 141 HD22 LEU 20 HD22 LEU 20 21.300 46.373 19.136 142 HD23 LEU 20 HD23 LEU 20 23.028 46.071 19.326 143 HA PRO 21 HA PRO 21 20.010 50.640 14.328 144 HB2 PRO 21 HB2 PRO 21 19.179 47.777 14.458 145 HB3 PRO 21 HB3 PRO 21 19.713 48.741 13.064 146 HG2 PRO 21 HG2 PRO 21 21.304 46.955 14.373 147 HG3 PRO 21 HG3 PRO 21 21.906 48.352 13.461 148 HD2 PRO 21 HD2 PRO 21 21.964 47.896 16.345 149 HD3 PRO 21 HD3 PRO 21 22.760 49.173 15.413 150 H ASP 22 H ASP 22 18.003 51.498 14.320 151 HA ASP 22 HA ASP 22 16.270 51.312 16.587 152 HB2 ASP 22 HB2 ASP 22 15.243 52.209 13.923 153 HB3 ASP 22 HB3 ASP 22 15.051 52.963 15.512 154 H ASN 23 H ASN 23 16.152 48.925 16.649 155 HA ASN 23 HA ASN 23 13.606 47.916 15.943 156 HB2 ASN 23 HB2 ASN 23 14.331 46.260 14.151 157 HB3 ASN 23 HB3 ASN 23 14.245 47.943 13.635 158 HD21 ASN 23 HD21 ASN 23 16.508 45.361 14.541 159 HD22 ASN 23 HD22 ASN 23 17.874 46.091 13.852 160 H TYR 24 H TYR 24 16.212 47.768 17.768 161 HA TYR 24 HA TYR 24 16.154 44.800 18.150 162 HB2 TYR 24 HB2 TYR 24 18.296 46.871 18.455 163 HB3 TYR 24 HB3 TYR 24 18.359 45.439 19.479 164 HD1 TYR 24 HD1 TYR 24 18.163 43.146 18.329 165 HD2 TYR 24 HD2 TYR 24 19.052 46.776 16.229 166 HE1 TYR 24 HE1 TYR 24 19.053 41.825 16.429 167 HE2 TYR 24 HE2 TYR 24 19.945 45.452 14.325 168 HH TYR 24 HH TYR 24 19.962 41.872 14.425 169 H ILE 25 H ILE 25 16.450 44.060 20.420 170 HA ILE 25 HA ILE 25 15.740 45.984 22.539 171 HB ILE 25 HB ILE 25 13.991 43.747 22.956 172 HG12 ILE 25 HG12 ILE 25 13.397 45.140 20.334 173 HG13 ILE 25 HG13 ILE 25 14.253 43.601 20.391 174 HG21 ILE 25 HG21 ILE 25 12.293 45.703 22.601 175 HG22 ILE 25 HG22 ILE 25 13.738 46.708 22.433 176 HG23 ILE 25 HG23 ILE 25 13.453 45.814 23.925 177 HD11 ILE 25 HD11 ILE 25 11.550 44.100 21.665 178 HD12 ILE 25 HD12 ILE 25 12.398 42.556 21.567 179 HD13 ILE 25 HD13 ILE 25 11.792 43.324 20.100 180 H THR 26 H THR 26 16.168 45.137 24.666 181 HA THR 26 HA THR 26 18.298 43.122 24.698 182 HB THR 26 HB THR 26 18.221 43.427 27.136 183 HG1 THR 26 HG1 THR 26 15.924 45.012 26.595 184 HG21 THR 26 HG21 THR 26 18.061 46.113 27.024 185 HG22 THR 26 HG22 THR 26 18.134 45.767 25.295 186 HG23 THR 26 HG23 THR 26 19.431 45.222 26.354 187 H LYS 27 H LYS 27 18.133 40.997 25.649 188 HA LYS 27 HA LYS 27 15.847 39.450 25.081 189 HB2 LYS 27 HB2 LYS 27 18.342 39.121 26.555 190 HB3 LYS 27 HB3 LYS 27 17.030 38.243 27.337 191 HG2 LYS 27 HG2 LYS 27 17.142 36.648 25.751 192 HG3 LYS 27 HG3 LYS 27 16.790 37.847 24.510 193 HD2 LYS 27 HD2 LYS 27 19.563 37.876 25.553 194 HD3 LYS 27 HD3 LYS 27 19.125 36.442 24.632 195 HE2 LYS 27 HE2 LYS 27 18.579 37.717 22.695 196 HE3 LYS 27 HE3 LYS 27 18.548 39.224 23.604 197 HZ1 LYS 27 HZ1 LYS 27 20.656 38.491 22.166 198 HZ2 LYS 27 HZ2 LYS 27 21.041 37.695 23.634 199 HZ3 LYS 27 HZ3 LYS 27 20.807 39.391 23.622 200 H SER 28 H SER 28 16.789 40.856 28.244 201 HA SER 28 HA SER 28 14.597 40.121 29.824 202 HB2 SER 28 HB2 SER 28 16.342 41.375 30.853 203 HB3 SER 28 HB3 SER 28 16.165 42.707 29.715 204 HG SER 28 HG SER 28 14.544 43.451 30.851 205 H GLU 29 H GLU 29 14.749 43.247 28.025 206 HA GLU 29 HA GLU 29 12.097 44.069 28.371 207 HB2 GLU 29 HB2 GLU 29 13.928 44.327 25.959 208 HB3 GLU 29 HB3 GLU 29 12.397 45.185 26.113 209 HG2 GLU 29 HG2 GLU 29 13.174 46.484 27.901 210 HG3 GLU 29 HG3 GLU 29 14.504 45.400 28.291 211 H ALA 30 H ALA 30 13.402 42.210 25.555 212 HA ALA 30 HA ALA 30 10.951 41.673 24.267 213 HB1 ALA 30 HB1 ALA 30 13.638 40.409 24.312 214 HB2 ALA 30 HB2 ALA 30 12.638 40.876 22.938 215 HB3 ALA 30 HB3 ALA 30 12.322 39.362 23.779 216 H GLN 31 H GLN 31 12.616 39.698 26.735 217 HA GLN 31 HA GLN 31 10.591 37.673 26.897 218 HB2 GLN 31 HB2 GLN 31 12.665 38.593 28.905 219 HB3 GLN 31 HB3 GLN 31 11.679 37.141 29.095 220 HG2 GLN 31 HG2 GLN 31 12.621 36.127 27.139 221 HG3 GLN 31 HG3 GLN 31 13.383 37.639 26.645 222 HE21 GLN 31 HE21 GLN 31 13.644 34.905 28.861 223 HE22 GLN 31 HE22 GLN 31 15.205 35.275 29.409 224 H ALA 32 H ALA 32 11.211 40.530 28.974 225 HA ALA 32 HA ALA 32 8.912 40.059 30.634 226 HB1 ALA 32 HB1 ALA 32 10.455 41.475 31.629 227 HB2 ALA 32 HB2 ALA 32 9.279 42.644 31.032 228 HB3 ALA 32 HB3 ALA 32 10.765 42.344 30.127 229 H LEU 33 H LEU 33 9.339 41.760 27.578 230 HA LEU 33 HA LEU 33 6.813 43.142 27.662 231 HB2 LEU 33 HB2 LEU 33 8.719 42.396 25.448 232 HB3 LEU 33 HB3 LEU 33 7.147 43.090 25.064 233 HG LEU 33 HG LEU 33 8.895 44.448 27.108 234 HD11 LEU 33 HD11 LEU 33 10.508 44.751 25.564 235 HD12 LEU 33 HD12 LEU 33 9.362 45.790 24.718 236 HD13 LEU 33 HD13 LEU 33 9.508 44.093 24.272 237 HD21 LEU 33 HD21 LEU 33 6.381 44.976 26.128 238 HD22 LEU 33 HD22 LEU 33 7.383 45.968 25.069 239 HD23 LEU 33 HD23 LEU 33 7.455 46.194 26.815 240 H GLY 34 H GLY 34 7.656 39.840 27.141 241 HA2 GLY 34 HA2 GLY 34 5.487 38.439 27.424 242 HA3 GLY 34 HA3 GLY 34 4.936 39.315 26.002 243 H TRP 35 H TRP 35 8.149 38.938 25.428 244 HA TRP 35 HA TRP 35 7.748 36.935 23.421 245 HB2 TRP 35 HB2 TRP 35 9.604 38.556 23.334 246 HB3 TRP 35 HB3 TRP 35 10.324 37.811 24.760 247 HD1 TRP 35 HD1 TRP 35 8.851 36.198 21.563 248 HE1 TRP 35 HE1 TRP 35 10.624 34.594 20.602 249 HE3 TRP 35 HE3 TRP 35 12.666 37.025 24.854 250 HZ2 TRP 35 HZ2 TRP 35 13.313 33.773 21.147 251 HZ3 TRP 35 HZ3 TRP 35 14.825 35.826 24.617 252 HH2 TRP 35 HH2 TRP 35 15.153 34.199 22.765 253 H VAL 36 H VAL 36 7.295 34.829 23.824 254 HA VAL 36 HA VAL 36 8.609 33.510 26.199 255 HB VAL 36 HB VAL 36 5.806 33.269 25.078 256 HG11 VAL 36 HG11 VAL 36 6.551 30.995 25.390 257 HG12 VAL 36 HG12 VAL 36 5.544 31.413 26.773 258 HG13 VAL 36 HG13 VAL 36 7.299 31.395 26.937 259 HG21 VAL 36 HG21 VAL 36 7.019 33.943 27.777 260 HG22 VAL 36 HG22 VAL 36 5.308 33.562 27.572 261 HG23 VAL 36 HG23 VAL 36 6.002 34.968 26.763 262 H ALA 37 H ALA 37 9.463 31.476 25.865 263 HA ALA 37 HA ALA 37 10.311 30.695 23.263 264 HB1 ALA 37 HB1 ALA 37 10.983 28.564 24.388 265 HB2 ALA 37 HB2 ALA 37 10.122 29.099 25.834 266 HB3 ALA 37 HB3 ALA 37 11.521 30.003 25.256 267 H SER 38 H SER 38 7.707 29.309 25.320 268 HA SER 38 HA SER 38 6.927 27.448 23.206 269 HB2 SER 38 HB2 SER 38 5.273 26.663 24.724 270 HB3 SER 38 HB3 SER 38 6.616 27.157 25.760 271 HG SER 38 HG SER 38 4.304 28.689 25.090 272 H LYS 39 H LYS 39 6.979 29.920 22.081 273 HA LYS 39 HA LYS 39 4.339 30.197 20.986 274 HB2 LYS 39 HB2 LYS 39 3.935 31.273 23.186 275 HB3 LYS 39 HB3 LYS 39 5.239 32.414 22.859 276 HG2 LYS 39 HG2 LYS 39 4.054 33.438 21.088 277 HG3 LYS 39 HG3 LYS 39 2.926 32.090 20.946 278 HD2 LYS 39 HD2 LYS 39 2.603 32.893 23.586 279 HD3 LYS 39 HD3 LYS 39 2.827 34.420 22.731 280 HE2 LYS 39 HE2 LYS 39 0.484 33.994 22.656 281 HE3 LYS 39 HE3 LYS 39 1.088 33.563 21.053 282 HZ1 LYS 39 HZ1 LYS 39 0.633 31.654 23.292 283 HZ2 LYS 39 HZ2 LYS 39 1.189 31.250 21.739 284 HZ3 LYS 39 HZ3 LYS 39 -0.387 31.851 21.949 285 H GLY 40 H GLY 40 7.304 32.101 21.704 286 HA2 GLY 40 HA2 GLY 40 8.806 33.129 20.195 287 HA3 GLY 40 HA3 GLY 40 8.038 32.207 18.899 288 H ASN 41 H ASN 41 6.092 34.147 20.985 289 HA ASN 41 HA ASN 41 4.873 35.610 18.879 290 HB2 ASN 41 HB2 ASN 41 4.169 37.179 20.800 291 HB3 ASN 41 HB3 ASN 41 3.682 35.492 20.930 292 HD21 ASN 41 HD21 ASN 41 4.997 37.950 22.720 293 HD22 ASN 41 HD22 ASN 41 5.841 37.023 23.877 294 H LEU 42 H LEU 42 5.487 37.388 17.801 295 HA LEU 42 HA LEU 42 7.160 39.466 18.900 296 HB2 LEU 42 HB2 LEU 42 8.750 37.430 18.359 297 HB3 LEU 42 HB3 LEU 42 8.532 37.944 16.685 298 HG LEU 42 HG LEU 42 9.092 40.329 17.650 299 HD11 LEU 42 HD11 LEU 42 10.676 40.216 19.531 300 HD12 LEU 42 HD12 LEU 42 10.401 38.478 19.666 301 HD13 LEU 42 HD13 LEU 42 9.093 39.608 20.010 302 HD21 LEU 42 HD21 LEU 42 11.643 39.466 17.545 303 HD22 LEU 42 HD22 LEU 42 10.641 39.636 16.107 304 HD23 LEU 42 HD23 LEU 42 10.842 38.053 16.856 305 H ALA 43 H ALA 43 6.537 37.849 15.791 306 HA ALA 43 HA ALA 43 6.397 40.165 14.168 307 HB1 ALA 43 HB1 ALA 43 6.421 37.808 13.325 308 HB2 ALA 43 HB2 ALA 43 5.141 38.775 12.594 309 HB3 ALA 43 HB3 ALA 43 4.756 37.622 13.870 310 H ASP 44 H ASP 44 4.147 38.889 16.491 311 HA ASP 44 HA ASP 44 1.804 40.335 15.498 312 HB2 ASP 44 HB2 ASP 44 1.039 39.685 17.925 313 HB3 ASP 44 HB3 ASP 44 1.294 38.401 16.747 314 H VAL 45 H VAL 45 3.569 40.573 18.587 315 HA VAL 45 HA VAL 45 2.658 43.248 19.112 316 HB VAL 45 HB VAL 45 4.418 43.194 20.921 317 HG11 VAL 45 HG11 VAL 45 3.405 40.842 21.820 318 HG12 VAL 45 HG12 VAL 45 2.277 41.166 20.502 319 HG13 VAL 45 HG13 VAL 45 2.474 42.338 21.804 320 HG21 VAL 45 HG21 VAL 45 6.138 41.854 19.872 321 HG22 VAL 45 HG22 VAL 45 5.013 40.519 19.613 322 HG23 VAL 45 HG23 VAL 45 5.525 40.938 21.247 323 H ALA 46 H ALA 46 5.378 41.909 17.354 324 HA ALA 46 HA ALA 46 6.104 44.680 16.556 325 HB1 ALA 46 HB1 ALA 46 8.396 44.413 17.056 326 HB2 ALA 46 HB2 ALA 46 8.241 42.671 17.262 327 HB3 ALA 46 HB3 ALA 46 7.575 43.765 18.472 328 HA PRO 47 HA PRO 47 5.559 41.681 13.006 329 HB2 PRO 47 HB2 PRO 47 4.797 44.208 11.661 330 HB3 PRO 47 HB3 PRO 47 3.958 42.650 11.700 331 HG2 PRO 47 HG2 PRO 47 3.107 44.795 13.078 332 HG3 PRO 47 HG3 PRO 47 2.855 43.141 13.643 333 HD2 PRO 47 HD2 PRO 47 4.780 45.197 14.620 334 HD3 PRO 47 HD3 PRO 47 3.996 43.875 15.505 335 H GLY 48 H GLY 48 8.149 42.428 13.695 336 HA2 GLY 48 HA2 GLY 48 9.748 42.150 11.582 337 HA3 GLY 48 HA3 GLY 48 9.251 43.814 11.289 338 H LYS 49 H LYS 49 10.032 42.257 14.419 339 HA LYS 49 HA LYS 49 12.250 44.223 14.632 340 HB2 LYS 49 HB2 LYS 49 10.055 44.318 16.166 341 HB3 LYS 49 HB3 LYS 49 10.997 43.175 17.122 342 HG2 LYS 49 HG2 LYS 49 12.608 44.739 17.658 343 HG3 LYS 49 HG3 LYS 49 12.397 45.631 16.153 344 HD2 LYS 49 HD2 LYS 49 10.302 46.580 16.950 345 HD3 LYS 49 HD3 LYS 49 10.378 45.604 18.416 346 HE2 LYS 49 HE2 LYS 49 12.723 46.767 18.737 347 HE3 LYS 49 HE3 LYS 49 12.051 47.976 17.636 348 HZ1 LYS 49 HZ1 LYS 49 10.650 47.055 20.086 349 HZ2 LYS 49 HZ2 LYS 49 10.244 48.383 19.103 350 HZ3 LYS 49 HZ3 LYS 49 11.658 48.417 20.051 351 H SER 50 H SER 50 14.212 43.497 15.622 352 HA SER 50 HA SER 50 14.374 40.515 15.919 353 HB2 SER 50 HB2 SER 50 16.611 42.376 15.073 354 HB3 SER 50 HB3 SER 50 16.614 40.612 15.032 355 HG SER 50 HG SER 50 14.916 42.361 13.557 356 H ILE 51 H ILE 51 15.198 39.749 17.850 357 HA ILE 51 HA ILE 51 15.518 41.571 20.051 358 HB ILE 51 HB ILE 51 16.692 38.829 20.250 359 HG12 ILE 51 HG12 ILE 51 14.710 38.439 18.845 360 HG13 ILE 51 HG13 ILE 51 14.424 37.850 20.479 361 HG21 ILE 51 HG21 ILE 51 16.637 39.984 22.297 362 HG22 ILE 51 HG22 ILE 51 15.154 39.032 22.364 363 HG23 ILE 51 HG23 ILE 51 15.086 40.742 21.936 364 HD11 ILE 51 HD11 ILE 51 13.543 40.409 20.729 365 HD12 ILE 51 HD12 ILE 51 12.503 39.047 20.313 366 HD13 ILE 51 HD13 ILE 51 13.139 40.094 19.041 367 H GLY 52 H GLY 52 17.427 41.970 21.323 368 HA2 GLY 52 HA2 GLY 52 20.016 41.245 21.077 369 HA3 GLY 52 HA3 GLY 52 19.828 42.206 19.609 370 H GLY 53 H GLY 53 21.486 42.746 21.987 371 HA2 GLY 53 HA2 GLY 53 21.947 45.214 22.410 372 HA3 GLY 53 HA3 GLY 53 20.241 45.347 22.810 373 H ASP 54 H ASP 54 21.751 42.423 23.858 374 HA ASP 54 HA ASP 54 21.279 43.156 26.628 375 HB2 ASP 54 HB2 ASP 54 22.929 40.786 25.867 376 HB3 ASP 54 HB3 ASP 54 21.632 40.918 27.062 377 H ILE 55 H ILE 55 23.337 42.114 27.957 378 HA ILE 55 HA ILE 55 25.755 43.692 27.238 379 HB ILE 55 HB ILE 55 24.341 43.541 29.891 380 HG12 ILE 55 HG12 ILE 55 23.645 45.168 27.905 381 HG13 ILE 55 HG13 ILE 55 23.724 45.779 29.542 382 HG21 ILE 55 HG21 ILE 55 27.047 44.664 29.132 383 HG22 ILE 55 HG22 ILE 55 26.663 43.525 30.424 384 HG23 ILE 55 HG23 ILE 55 26.176 45.212 30.565 385 HD11 ILE 55 HD11 ILE 55 25.004 46.915 27.413 386 HD12 ILE 55 HD12 ILE 55 26.281 45.891 28.069 387 HD13 ILE 55 HD13 ILE 55 25.512 47.106 29.090 388 H PHE 56 H PHE 56 27.694 42.692 27.752 389 HA PHE 56 HA PHE 56 27.714 40.385 29.582 390 HB2 PHE 56 HB2 PHE 56 27.085 39.676 27.117 391 HB3 PHE 56 HB3 PHE 56 28.815 39.871 26.835 392 HD1 PHE 56 HD1 PHE 56 26.427 38.309 29.271 393 HD2 PHE 56 HD2 PHE 56 30.257 38.102 27.333 394 HE1 PHE 56 HE1 PHE 56 26.865 36.124 30.366 395 HE2 PHE 56 HE2 PHE 56 30.696 35.917 28.425 396 HZ PHE 56 HZ PHE 56 29.002 34.930 29.946 397 H SER 57 H SER 57 29.807 39.945 30.386 398 HA SER 57 HA SER 57 31.800 42.050 29.783 399 HB2 SER 57 HB2 SER 57 32.929 40.477 31.749 400 HB3 SER 57 HB3 SER 57 31.963 41.922 32.039 401 HG SER 57 HG SER 57 30.153 40.640 32.289 402 H ASN 58 H ASN 58 31.206 38.756 29.019 403 HA ASN 58 HA ASN 58 32.415 37.271 27.665 404 HB2 ASN 58 HB2 ASN 58 32.861 39.430 26.392 405 HB3 ASN 58 HB3 ASN 58 34.401 39.520 27.242 406 HD21 ASN 58 HD21 ASN 58 35.689 39.151 25.316 407 HD22 ASN 58 HD22 ASN 58 35.713 37.648 24.524 408 H ARG 59 H ARG 59 33.008 37.443 30.556 409 HA ARG 59 HA ARG 59 35.825 37.255 31.085 410 HB2 ARG 59 HB2 ARG 59 33.337 36.345 32.442 411 HB3 ARG 59 HB3 ARG 59 34.809 35.497 32.866 412 HG2 ARG 59 HG2 ARG 59 35.898 37.552 33.547 413 HG3 ARG 59 HG3 ARG 59 34.516 38.511 33.007 414 HD2 ARG 59 HD2 ARG 59 34.704 36.622 35.355 415 HD3 ARG 59 HD3 ARG 59 34.133 38.291 35.341 416 HE ARG 59 HE ARG 59 32.501 35.956 34.971 417 HH11 ARG 59 HH11 ARG 59 33.007 39.088 33.756 418 HH12 ARG 59 HH12 ARG 59 31.576 39.128 32.758 419 HH21 ARG 59 HH21 ARG 59 30.661 35.903 33.616 420 HH22 ARG 59 HH22 ARG 59 30.296 37.288 32.649 421 H GLU 60 H GLU 60 33.472 35.038 29.756 422 HA GLU 60 HA GLU 60 34.959 32.616 30.041 423 HB2 GLU 60 HB2 GLU 60 32.823 33.502 28.081 424 HB3 GLU 60 HB3 GLU 60 33.461 31.857 28.129 425 HG2 GLU 60 HG2 GLU 60 31.414 31.971 29.479 426 HG3 GLU 60 HG3 GLU 60 32.798 31.698 30.533 427 H GLY 61 H GLY 61 35.511 35.366 28.089 428 HA2 GLY 61 HA2 GLY 61 37.181 35.807 26.497 429 HA3 GLY 61 HA3 GLY 61 37.905 34.263 26.951 430 H LYS 62 H LYS 62 34.678 34.882 25.598 431 HA LYS 62 HA LYS 62 35.256 32.878 23.482 432 HB2 LYS 62 HB2 LYS 62 32.972 33.539 25.041 433 HB3 LYS 62 HB3 LYS 62 32.578 33.954 23.376 434 HG2 LYS 62 HG2 LYS 62 33.969 31.361 23.697 435 HG3 LYS 62 HG3 LYS 62 32.370 31.434 24.435 436 HD2 LYS 62 HD2 LYS 62 31.778 30.809 22.282 437 HD3 LYS 62 HD3 LYS 62 31.707 32.563 22.124 438 HE2 LYS 62 HE2 LYS 62 34.412 31.621 21.673 439 HE3 LYS 62 HE3 LYS 62 33.279 30.790 20.600 440 HZ1 LYS 62 HZ1 LYS 62 33.742 32.706 19.436 441 HZ2 LYS 62 HZ2 LYS 62 33.859 33.681 20.837 442 HZ3 LYS 62 HZ3 LYS 62 32.331 33.161 20.261 443 H LEU 63 H LEU 63 35.257 36.217 23.931 444 HA LEU 63 HA LEU 63 35.299 36.650 20.990 445 HB2 LEU 63 HB2 LEU 63 33.861 38.487 22.929 446 HB3 LEU 63 HB3 LEU 63 33.923 38.649 21.178 447 HG LEU 63 HG LEU 63 32.740 36.231 22.567 448 HD11 LEU 63 HD11 LEU 63 31.643 38.584 22.961 449 HD12 LEU 63 HD12 LEU 63 30.632 37.209 22.520 450 HD13 LEU 63 HD13 LEU 63 31.096 38.392 21.297 451 HD21 LEU 63 HD21 LEU 63 33.536 36.573 19.961 452 HD22 LEU 63 HD22 LEU 63 31.852 37.087 19.884 453 HD23 LEU 63 HD23 LEU 63 32.256 35.476 20.474 454 HA PRO 64 HA PRO 64 38.967 39.043 21.486 455 HB2 PRO 64 HB2 PRO 64 37.426 41.498 20.685 456 HB3 PRO 64 HB3 PRO 64 38.987 40.905 20.087 457 HG2 PRO 64 HG2 PRO 64 36.775 40.564 18.653 458 HG3 PRO 64 HG3 PRO 64 38.018 39.303 18.735 459 HD2 PRO 64 HD2 PRO 64 35.346 39.383 20.028 460 HD3 PRO 64 HD3 PRO 64 36.272 37.979 19.467 461 H GLY 65 H GLY 65 39.959 40.065 23.244 462 HA2 GLY 65 HA2 GLY 65 38.185 41.578 25.125 463 HA3 GLY 65 HA3 GLY 65 39.283 40.339 25.718 464 H LYS 66 H LYS 66 40.058 42.222 27.010 465 HA LYS 66 HA LYS 66 42.597 43.165 26.216 466 HB2 LYS 66 HB2 LYS 66 42.158 45.557 25.723 467 HB3 LYS 66 HB3 LYS 66 41.327 44.542 24.551 468 HG2 LYS 66 HG2 LYS 66 39.215 44.851 25.646 469 HG3 LYS 66 HG3 LYS 66 39.974 45.579 27.055 470 HD2 LYS 66 HD2 LYS 66 40.788 47.068 24.750 471 HD3 LYS 66 HD3 LYS 66 39.038 46.881 24.688 472 HE2 LYS 66 HE2 LYS 66 40.375 47.706 27.259 473 HE3 LYS 66 HE3 LYS 66 40.043 48.905 26.009 474 HZ1 LYS 66 HZ1 LYS 66 38.009 49.004 26.894 475 HZ2 LYS 66 HZ2 LYS 66 38.229 47.568 27.807 476 HZ3 LYS 66 HZ3 LYS 66 37.729 47.488 26.185 477 H SER 67 H SER 67 42.511 45.713 27.568 478 HA SER 67 HA SER 67 42.336 44.800 30.336 479 HB2 SER 67 HB2 SER 67 43.215 46.925 30.902 480 HB3 SER 67 HB3 SER 67 43.915 46.614 29.314 481 HG SER 67 HG SER 67 41.400 47.851 29.471 482 H GLY 68 H GLY 68 40.081 44.166 30.387 483 HA2 GLY 68 HA2 GLY 68 37.877 44.654 31.160 484 HA3 GLY 68 HA3 GLY 68 38.262 46.378 31.055 485 H ARG 69 H ARG 69 36.837 43.674 29.382 486 HA ARG 69 HA ARG 69 36.299 45.475 27.041 487 HB2 ARG 69 HB2 ARG 69 37.795 43.617 26.405 488 HB3 ARG 69 HB3 ARG 69 36.619 42.458 27.023 489 HG2 ARG 69 HG2 ARG 69 36.050 42.468 24.765 490 HG3 ARG 69 HG3 ARG 69 34.969 43.722 25.367 491 HD2 ARG 69 HD2 ARG 69 36.073 44.571 23.380 492 HD3 ARG 69 HD3 ARG 69 36.712 45.431 24.774 493 HE ARG 69 HE ARG 69 38.345 43.141 24.308 494 HH11 ARG 69 HH11 ARG 69 37.453 46.091 22.795 495 HH12 ARG 69 HH12 ARG 69 38.950 46.206 21.908 496 HH21 ARG 69 HH21 ARG 69 40.282 43.289 23.193 497 HH22 ARG 69 HH22 ARG 69 40.519 44.634 22.116 498 H THR 70 H THR 70 34.234 45.606 26.313 499 HA THR 70 HA THR 70 32.121 44.178 27.902 500 HB THR 70 HB THR 70 30.651 46.003 27.343 501 HG1 THR 70 HG1 THR 70 32.764 46.700 25.558 502 HG21 THR 70 HG21 THR 70 33.331 47.319 27.858 503 HG22 THR 70 HG22 THR 70 32.423 46.461 29.104 504 HG23 THR 70 HG23 THR 70 31.735 47.895 28.341 505 H TRP 71 H TRP 71 30.853 42.698 26.752 506 HA TRP 71 HA TRP 71 30.974 42.895 23.763 507 HB2 TRP 71 HB2 TRP 71 31.368 40.558 25.568 508 HB3 TRP 71 HB3 TRP 71 30.466 40.273 24.074 509 HD1 TRP 71 HD1 TRP 71 33.935 40.716 25.336 510 HE1 TRP 71 HE1 TRP 71 35.595 40.954 23.358 511 HE3 TRP 71 HE3 TRP 71 30.627 41.301 21.503 512 HZ2 TRP 71 HZ2 TRP 71 35.494 41.383 20.544 513 HZ3 TRP 71 HZ3 TRP 71 31.431 41.636 19.182 514 HH2 TRP 71 HH2 TRP 71 33.861 41.672 18.697 515 H ARG 72 H ARG 72 29.066 42.487 22.621 516 HA ARG 72 HA ARG 72 26.564 41.953 24.146 517 HB2 ARG 72 HB2 ARG 72 27.156 44.408 22.487 518 HB3 ARG 72 HB3 ARG 72 25.512 43.883 22.838 519 HG2 ARG 72 HG2 ARG 72 25.706 45.178 24.688 520 HG3 ARG 72 HG3 ARG 72 26.676 43.851 25.338 521 HD2 ARG 72 HD2 ARG 72 28.101 45.696 25.584 522 HD3 ARG 72 HD3 ARG 72 28.645 44.986 24.062 523 HE ARG 72 HE ARG 72 26.629 46.857 23.371 524 HH11 ARG 72 HH11 ARG 72 29.743 46.720 24.803 525 HH12 ARG 72 HH12 ARG 72 30.103 48.379 24.512 526 HH21 ARG 72 HH21 ARG 72 27.080 49.015 22.966 527 HH22 ARG 72 HH22 ARG 72 28.609 49.676 23.441 528 H GLU 73 H GLU 73 24.912 41.022 22.835 529 HA GLU 73 HA GLU 73 25.805 40.452 20.049 530 HB2 GLU 73 HB2 GLU 73 24.681 38.308 20.185 531 HB3 GLU 73 HB3 GLU 73 25.748 38.485 21.578 532 HG2 GLU 73 HG2 GLU 73 23.920 37.972 22.823 533 HG3 GLU 73 HG3 GLU 73 23.404 39.628 22.495 534 H ALA 74 H ALA 74 23.913 39.835 18.538 535 HA ALA 74 HA ALA 74 21.333 41.076 19.127 536 HB1 ALA 74 HB1 ALA 74 23.194 42.807 18.152 537 HB2 ALA 74 HB2 ALA 74 21.462 42.966 17.856 538 HB3 ALA 74 HB3 ALA 74 22.496 42.203 16.647 539 H ASP 75 H ASP 75 19.672 40.326 17.724 540 HA ASP 75 HA ASP 75 20.235 37.856 16.312 541 HB2 ASP 75 HB2 ASP 75 17.888 39.363 17.112 542 HB3 ASP 75 HB3 ASP 75 17.714 38.793 15.457 543 H ILE 76 H ILE 76 19.993 37.441 14.020 544 HA ILE 76 HA ILE 76 20.076 39.860 12.278 545 HB ILE 76 HB ILE 76 22.086 37.601 12.370 546 HG12 ILE 76 HG12 ILE 76 22.433 39.655 13.805 547 HG13 ILE 76 HG13 ILE 76 23.708 39.370 12.624 548 HG21 ILE 76 HG21 ILE 76 23.045 38.823 10.323 549 HG22 ILE 76 HG22 ILE 76 21.453 39.550 10.158 550 HG23 ILE 76 HG23 ILE 76 21.640 37.800 10.053 551 HD11 ILE 76 HD11 ILE 76 23.220 41.252 11.447 552 HD12 ILE 76 HD12 ILE 76 22.429 41.764 12.937 553 HD13 ILE 76 HD13 ILE 76 21.477 41.042 11.637 554 H ASN 77 H ASN 77 19.426 39.459 10.087 555 HA ASN 77 HA ASN 77 18.024 38.521 8.460 556 HB2 ASN 77 HB2 ASN 77 19.273 35.977 9.550 557 HB3 ASN 77 HB3 ASN 77 18.380 36.100 8.035 558 HD21 ASN 77 HD21 ASN 77 21.034 35.273 7.942 559 HD22 ASN 77 HD22 ASN 77 21.990 36.499 7.253 560 H TYR 78 H TYR 78 16.423 39.235 10.408 561 HA TYR 78 HA TYR 78 14.661 36.872 10.868 562 HB2 TYR 78 HB2 TYR 78 15.370 37.587 13.046 563 HB3 TYR 78 HB3 TYR 78 15.110 39.283 12.635 564 HD1 TYR 78 HD1 TYR 78 13.345 36.028 13.123 565 HD2 TYR 78 HD2 TYR 78 12.972 40.302 12.907 566 HE1 TYR 78 HE1 TYR 78 11.004 35.867 13.946 567 HE2 TYR 78 HE2 TYR 78 10.640 40.142 13.727 568 HH TYR 78 HH TYR 78 9.211 38.689 14.907 569 H THR 79 H THR 79 12.366 37.344 10.712 570 HA THR 79 HA THR 79 11.711 39.947 9.369 571 HB THR 79 HB THR 79 10.328 38.831 7.738 572 HG1 THR 79 HG1 THR 79 10.322 36.458 7.798 573 HG21 THR 79 HG21 THR 79 12.779 37.076 7.795 574 HG22 THR 79 HG22 THR 79 12.924 38.808 7.494 575 HG23 THR 79 HG23 THR 79 11.965 37.802 6.405 576 H SER 80 H SER 80 9.716 37.119 10.018 577 HA SER 80 HA SER 80 8.364 38.442 12.298 578 HB2 SER 80 HB2 SER 80 6.690 39.273 10.992 579 HB3 SER 80 HB3 SER 80 7.237 38.372 9.588 580 HG SER 80 HG SER 80 6.297 36.480 10.703 581 H GLY 81 H GLY 81 8.755 36.684 13.662 582 HA2 GLY 81 HA2 GLY 81 7.155 34.501 13.912 583 HA3 GLY 81 HA3 GLY 81 8.255 33.939 12.653 584 H PHE 82 H PHE 82 10.162 33.014 13.324 585 HA PHE 82 HA PHE 82 10.967 33.537 16.165 586 HB2 PHE 82 HB2 PHE 82 10.080 31.167 15.501 587 HB3 PHE 82 HB3 PHE 82 11.667 30.970 14.756 588 HD1 PHE 82 HD1 PHE 82 9.955 31.832 17.959 589 HD2 PHE 82 HD2 PHE 82 13.599 30.554 16.078 590 HE1 PHE 82 HE1 PHE 82 10.959 31.419 20.190 591 HE2 PHE 82 HE2 PHE 82 14.607 30.150 18.310 592 HZ PHE 82 HZ PHE 82 13.287 30.581 20.367 593 H ARG 83 H ARG 83 13.432 32.642 16.348 594 HA ARG 83 HA ARG 83 14.964 34.435 14.602 595 HB2 ARG 83 HB2 ARG 83 16.346 32.621 16.526 596 HB3 ARG 83 HB3 ARG 83 16.602 34.335 16.218 597 HG2 ARG 83 HG2 ARG 83 14.200 34.578 17.296 598 HG3 ARG 83 HG3 ARG 83 14.589 33.012 18.006 599 HD2 ARG 83 HD2 ARG 83 16.107 35.610 18.312 600 HD3 ARG 83 HD3 ARG 83 15.347 34.648 19.581 601 HE ARG 83 HE ARG 83 17.246 32.938 18.434 602 HH11 ARG 83 HH11 ARG 83 17.210 36.051 19.841 603 HH12 ARG 83 HH12 ARG 83 18.833 35.970 20.411 604 HH21 ARG 83 HH21 ARG 83 19.383 32.808 19.174 605 HH22 ARG 83 HH22 ARG 83 20.067 34.120 20.096 606 H ASN 84 H ASN 84 17.408 32.786 14.793 607 HA ASN 84 HA ASN 84 16.977 30.305 13.349 608 HB2 ASN 84 HB2 ASN 84 18.083 31.066 11.230 609 HB3 ASN 84 HB3 ASN 84 16.536 31.861 11.505 610 HD21 ASN 84 HD21 ASN 84 17.980 33.347 9.867 611 HD22 ASN 84 HD22 ASN 84 18.771 34.628 10.649 612 H SER 85 H SER 85 19.750 31.046 11.995 613 HA SER 85 HA SER 85 21.357 30.507 14.465 614 HB2 SER 85 HB2 SER 85 22.814 29.154 13.165 615 HB3 SER 85 HB3 SER 85 21.189 28.707 12.642 616 HG SER 85 HG SER 85 23.227 29.820 11.233 617 H ASP 86 H ASP 86 20.729 32.732 12.031 618 HA ASP 86 HA ASP 86 23.346 33.902 11.669 619 HB2 ASP 86 HB2 ASP 86 20.509 34.738 11.098 620 HB3 ASP 86 HB3 ASP 86 21.824 35.889 10.898 621 H ARG 87 H ARG 87 24.376 34.668 13.504 622 HA ARG 87 HA ARG 87 22.840 36.702 15.084 623 HB2 ARG 87 HB2 ARG 87 24.555 34.449 16.176 624 HB3 ARG 87 HB3 ARG 87 23.980 35.806 17.152 625 HG2 ARG 87 HG2 ARG 87 22.039 34.326 15.474 626 HG3 ARG 87 HG3 ARG 87 22.553 33.558 16.970 627 HD2 ARG 87 HD2 ARG 87 21.582 35.186 18.311 628 HD3 ARG 87 HD3 ARG 87 21.765 36.433 17.088 629 HE ARG 87 HE ARG 87 19.360 35.845 17.337 630 HH11 ARG 87 HH11 ARG 87 20.969 33.272 15.747 631 HH12 ARG 87 HH12 ARG 87 19.991 33.368 14.326 632 HH21 ARG 87 HH21 ARG 87 18.014 35.887 15.541 633 HH22 ARG 87 HH22 ARG 87 18.332 34.783 14.225 634 H ILE 88 H ILE 88 23.989 38.531 15.623 635 HA ILE 88 HA ILE 88 26.810 38.637 14.636 636 HB ILE 88 HB ILE 88 25.191 40.168 13.502 637 HG12 ILE 88 HG12 ILE 88 27.185 41.651 15.248 638 HG13 ILE 88 HG13 ILE 88 27.632 40.740 13.808 639 HG21 ILE 88 HG21 ILE 88 25.054 41.861 15.947 640 HG22 ILE 88 HG22 ILE 88 24.042 40.419 15.923 641 HG23 ILE 88 HG23 ILE 88 23.863 41.643 14.666 642 HD11 ILE 88 HD11 ILE 88 27.006 43.393 13.778 643 HD12 ILE 88 HD12 ILE 88 25.425 42.689 13.437 644 HD13 ILE 88 HD13 ILE 88 26.801 42.325 12.387 645 H LEU 89 H LEU 89 28.389 39.649 15.884 646 HA LEU 89 HA LEU 89 27.642 40.197 18.726 647 HB2 LEU 89 HB2 LEU 89 29.629 38.350 17.582 648 HB3 LEU 89 HB3 LEU 89 30.283 39.409 18.824 649 HG LEU 89 HG LEU 89 29.361 37.260 19.746 650 HD11 LEU 89 HD11 LEU 89 27.532 39.369 20.768 651 HD12 LEU 89 HD12 LEU 89 29.247 39.766 20.774 652 HD13 LEU 89 HD13 LEU 89 28.666 38.348 21.650 653 HD21 LEU 89 HD21 LEU 89 27.431 37.302 18.017 654 HD22 LEU 89 HD22 LEU 89 26.643 38.417 19.136 655 HD23 LEU 89 HD23 LEU 89 27.049 36.784 19.659 656 H TYR 90 H TYR 90 28.243 42.182 19.428 657 HA TYR 90 HA TYR 90 30.469 43.587 17.981 658 HB2 TYR 90 HB2 TYR 90 29.218 45.502 17.616 659 HB3 TYR 90 HB3 TYR 90 27.962 44.280 17.444 660 HD1 TYR 90 HD1 TYR 90 26.342 43.866 19.271 661 HD2 TYR 90 HD2 TYR 90 29.277 46.997 19.503 662 HE1 TYR 90 HE1 TYR 90 25.072 44.931 21.120 663 HE2 TYR 90 HE2 TYR 90 28.006 48.052 21.342 664 HH TYR 90 HH TYR 90 24.858 46.780 22.375 665 H SER 91 H SER 91 31.839 44.782 19.326 666 HA SER 91 HA SER 91 31.374 44.387 22.262 667 HB2 SER 91 HB2 SER 91 33.828 44.787 22.436 668 HB3 SER 91 HB3 SER 91 33.434 43.424 21.390 669 HG SER 91 HG SER 91 34.924 45.407 20.716 670 H SER 92 H SER 92 32.753 46.086 23.539 671 HA SER 92 HA SER 92 31.503 48.620 23.486 672 HB2 SER 92 HB2 SER 92 34.071 49.075 24.487 673 HB3 SER 92 HB3 SER 92 32.665 48.619 25.443 674 HG SER 92 HG SER 92 34.628 46.917 24.236 675 H ASP 93 H ASP 93 34.683 47.681 22.403 676 HA ASP 93 HA ASP 93 35.410 50.157 21.171 677 HB2 ASP 93 HB2 ASP 93 36.972 48.337 19.928 678 HB3 ASP 93 HB3 ASP 93 37.248 48.830 21.602 679 H TRP 94 H TRP 94 32.978 48.157 20.304 680 HA TRP 94 HA TRP 94 31.614 48.055 18.458 681 HB2 TRP 94 HB2 TRP 94 33.577 50.037 17.277 682 HB3 TRP 94 HB3 TRP 94 32.024 49.600 16.569 683 HD1 TRP 94 HD1 TRP 94 33.491 52.091 18.772 684 HE1 TRP 94 HE1 TRP 94 31.696 53.286 20.181 685 HE3 TRP 94 HE3 TRP 94 29.527 48.950 18.041 686 HZ2 TRP 94 HZ2 TRP 94 28.960 52.971 20.898 687 HZ3 TRP 94 HZ3 TRP 94 27.338 49.421 19.107 688 HH2 TRP 94 HH2 TRP 94 27.050 51.430 20.532 689 H LEU 95 H LEU 95 34.260 46.404 18.796 690 HA LEU 95 HA LEU 95 34.956 45.661 16.067 691 HB2 LEU 95 HB2 LEU 95 35.367 44.355 18.775 692 HB3 LEU 95 HB3 LEU 95 35.856 43.556 17.280 693 HG LEU 95 HG LEU 95 36.798 46.261 18.251 694 HD11 LEU 95 HD11 LEU 95 38.320 43.676 17.830 695 HD12 LEU 95 HD12 LEU 95 37.767 44.262 19.400 696 HD13 LEU 95 HD13 LEU 95 38.962 45.182 18.488 697 HD21 LEU 95 HD21 LEU 95 38.423 45.552 16.164 698 HD22 LEU 95 HD22 LEU 95 37.039 46.631 16.013 699 HD23 LEU 95 HD23 LEU 95 36.869 44.920 15.618 700 H ILE 96 H ILE 96 33.681 44.383 14.757 701 HA ILE 96 HA ILE 96 31.439 42.954 16.101 702 HB ILE 96 HB ILE 96 31.489 44.071 13.281 703 HG12 ILE 96 HG12 ILE 96 29.459 45.224 14.874 704 HG13 ILE 96 HG13 ILE 96 30.907 45.235 15.882 705 HG21 ILE 96 HG21 ILE 96 30.065 42.014 13.676 706 HG22 ILE 96 HG22 ILE 96 29.152 43.450 13.220 707 HG23 ILE 96 HG23 ILE 96 29.198 42.933 14.899 708 HD11 ILE 96 HD11 ILE 96 30.593 46.415 13.114 709 HD12 ILE 96 HD12 ILE 96 32.151 46.225 13.916 710 HD13 ILE 96 HD13 ILE 96 30.919 47.275 14.618 711 H TYR 97 H TYR 97 31.097 40.886 15.802 712 HA TYR 97 HA TYR 97 32.691 39.388 13.749 713 HB2 TYR 97 HB2 TYR 97 32.242 38.719 16.667 714 HB3 TYR 97 HB3 TYR 97 32.710 37.493 15.492 715 HD1 TYR 97 HD1 TYR 97 33.677 40.995 16.387 716 HD2 TYR 97 HD2 TYR 97 35.009 37.048 15.346 717 HE1 TYR 97 HE1 TYR 97 36.019 41.751 16.546 718 HE2 TYR 97 HE2 TYR 97 37.368 37.809 15.523 719 HH TYR 97 HH TYR 97 38.680 39.539 16.426 720 H LYS 98 H LYS 98 31.603 37.325 13.077 721 HA LYS 98 HA LYS 98 28.624 37.490 13.622 722 HB2 LYS 98 HB2 LYS 98 28.146 37.287 11.372 723 HB3 LYS 98 HB3 LYS 98 29.614 38.271 11.320 724 HG2 LYS 98 HG2 LYS 98 30.970 36.233 10.952 725 HG3 LYS 98 HG3 LYS 98 29.507 35.249 10.978 726 HD2 LYS 98 HD2 LYS 98 30.344 37.307 8.929 727 HD3 LYS 98 HD3 LYS 98 29.913 35.619 8.672 728 HE2 LYS 98 HE2 LYS 98 28.054 37.908 9.379 729 HE3 LYS 98 HE3 LYS 98 28.020 36.895 7.939 730 HZ1 LYS 98 HZ1 LYS 98 27.057 35.195 9.048 731 HZ2 LYS 98 HZ2 LYS 98 26.495 36.464 10.018 732 HZ3 LYS 98 HZ3 LYS 98 27.832 35.553 10.516 733 H THR 99 H THR 99 27.492 35.574 13.804 734 HA THR 99 HA THR 99 28.976 33.021 13.414 735 HB THR 99 HB THR 99 29.214 33.145 15.750 736 HG1 THR 99 HG1 THR 99 28.232 31.234 15.430 737 HG21 THR 99 HG21 THR 99 27.502 34.013 17.272 738 HG22 THR 99 HG22 THR 99 26.417 34.286 15.911 739 HG23 THR 99 HG23 THR 99 27.908 35.216 16.048 740 H THR 100 H THR 100 27.748 31.649 12.325 741 HA THR 100 HA THR 100 24.829 32.218 11.889 742 HB THR 100 HB THR 100 25.348 30.843 9.719 743 HG1 THR 100 HG1 THR 100 27.618 30.607 10.747 744 HG21 THR 100 HG21 THR 100 26.712 33.345 9.275 745 HG22 THR 100 HG22 THR 100 25.344 33.594 10.364 746 HG23 THR 100 HG23 THR 100 25.089 32.869 8.777 747 H ASP 101 H ASP 101 26.662 30.273 13.683 748 HA ASP 101 HA ASP 101 24.980 27.852 13.071 749 HB2 ASP 101 HB2 ASP 101 26.999 26.922 14.650 750 HB3 ASP 101 HB3 ASP 101 27.069 26.953 12.891 751 H ALA 102 H ALA 102 24.126 30.134 14.689 752 HA ALA 102 HA ALA 102 23.008 30.505 16.700 753 HB1 ALA 102 HB1 ALA 102 23.336 27.559 17.284 754 HB2 ALA 102 HB2 ALA 102 22.207 28.138 16.058 755 HB3 ALA 102 HB3 ALA 102 22.009 28.630 17.739 756 H TYR 103 H TYR 103 25.259 31.508 17.170 757 HA TYR 103 HA TYR 103 26.873 32.014 18.779 758 HB2 TYR 103 HB2 TYR 103 25.389 30.037 20.539 759 HB3 TYR 103 HB3 TYR 103 26.446 31.339 21.063 760 HD1 TYR 103 HD1 TYR 103 25.527 33.609 19.378 761 HD2 TYR 103 HD2 TYR 103 23.284 30.560 21.405 762 HE1 TYR 103 HE1 TYR 103 23.588 35.148 19.561 763 HE2 TYR 103 HE2 TYR 103 21.349 32.096 21.577 764 HH TYR 103 HH TYR 103 21.618 35.492 20.622 765 H GLN 104 H GLN 104 27.630 29.987 16.912 766 HA GLN 104 HA GLN 104 29.222 28.117 18.684 767 HB2 GLN 104 HB2 GLN 104 28.224 27.723 15.858 768 HB3 GLN 104 HB3 GLN 104 29.410 26.679 16.622 769 HG2 GLN 104 HG2 GLN 104 26.879 27.212 18.116 770 HG3 GLN 104 HG3 GLN 104 26.784 26.149 16.713 771 HE21 GLN 104 HE21 GLN 104 26.409 25.194 19.412 772 HE22 GLN 104 HE22 GLN 104 27.681 24.125 19.760 773 H THR 105 H THR 105 29.621 29.036 15.241 774 HA THR 105 HA THR 105 32.483 29.601 15.869 775 HB THR 105 HB THR 105 32.891 29.429 13.524 776 HG1 THR 105 HG1 THR 105 30.123 29.203 12.991 777 HG21 THR 105 HG21 THR 105 31.370 27.288 13.015 778 HG22 THR 105 HG22 THR 105 31.019 27.441 14.738 779 HG23 THR 105 HG23 THR 105 32.684 27.228 14.194 780 H PHE 106 H PHE 106 33.114 31.646 16.244 781 HA PHE 106 HA PHE 106 31.425 33.911 15.309 782 HB2 PHE 106 HB2 PHE 106 33.662 33.854 17.354 783 HB3 PHE 106 HB3 PHE 106 32.661 35.252 16.969 784 HD1 PHE 106 HD1 PHE 106 32.266 31.641 17.897 785 HD2 PHE 106 HD2 PHE 106 30.819 35.665 18.324 786 HE1 PHE 106 HE1 PHE 106 30.566 30.853 19.522 787 HE2 PHE 106 HE2 PHE 106 29.126 34.882 19.955 788 HZ PHE 106 HZ PHE 106 28.995 32.471 20.551 789 H THR 107 H THR 107 32.284 33.822 13.099 790 HA THR 107 HA THR 107 35.115 34.357 12.729 791 HB THR 107 HB THR 107 32.757 34.307 10.838 792 HG1 THR 107 HG1 THR 107 33.686 32.330 11.586 793 HG21 THR 107 HG21 THR 107 35.657 34.813 10.110 794 HG22 THR 107 HG22 THR 107 34.392 36.049 10.113 795 HG23 THR 107 HG23 THR 107 34.295 34.688 8.992 796 H LYS 108 H LYS 108 36.047 36.267 12.178 797 HA LYS 108 HA LYS 108 34.754 38.668 13.204 798 HB2 LYS 108 HB2 LYS 108 37.207 38.268 13.419 799 HB3 LYS 108 HB3 LYS 108 37.359 38.412 11.670 800 HG2 LYS 108 HG2 LYS 108 36.461 40.708 11.761 801 HG3 LYS 108 HG3 LYS 108 36.271 40.574 13.509 802 HD2 LYS 108 HD2 LYS 108 38.641 40.450 13.850 803 HD3 LYS 108 HD3 LYS 108 38.946 40.213 12.132 804 HE2 LYS 108 HE2 LYS 108 39.470 42.508 12.589 805 HE3 LYS 108 HE3 LYS 108 37.914 42.524 11.759 806 HZ1 LYS 108 HZ1 LYS 108 36.817 43.202 13.606 807 HZ2 LYS 108 HZ2 LYS 108 38.362 43.782 14.060 808 HZ3 LYS 108 HZ3 LYS 108 37.810 42.289 14.659 809 H ILE 109 H ILE 109 34.105 40.489 12.017 810 HA ILE 109 HA ILE 109 34.067 40.221 9.041 811 HB ILE 109 HB ILE 109 31.794 41.234 9.032 812 HG12 ILE 109 HG12 ILE 109 32.045 40.861 12.037 813 HG13 ILE 109 HG13 ILE 109 31.880 42.397 11.189 814 HG21 ILE 109 HG21 ILE 109 32.377 38.669 9.224 815 HG22 ILE 109 HG22 ILE 109 30.701 39.203 9.379 816 HG23 ILE 109 HG23 ILE 109 31.645 38.823 10.825 817 HD11 ILE 109 HD11 ILE 109 29.665 42.094 11.680 818 HD12 ILE 109 HD12 ILE 109 29.829 40.346 11.810 819 HD13 ILE 109 HD13 ILE 109 29.702 41.104 10.224 820 H ARG 110 H ARG 110 34.243 42.242 11.894 821 HA ARG 110 HA ARG 110 35.360 44.461 10.233 822 HB2 ARG 110 HB2 ARG 110 33.156 44.764 12.304 823 HB3 ARG 110 HB3 ARG 110 34.049 46.109 11.599 824 HG2 ARG 110 HG2 ARG 110 32.967 44.257 9.596 825 HG3 ARG 110 HG3 ARG 110 31.717 45.025 10.566 826 HD2 ARG 110 HD2 ARG 110 32.908 47.229 10.113 827 HD3 ARG 110 HD3 ARG 110 33.875 46.375 8.915 828 HE ARG 110 HE ARG 110 31.263 47.423 8.486 829 HH11 ARG 110 HH11 ARG 110 32.910 44.398 8.010 830 HH12 ARG 110 HH12 ARG 110 31.782 43.882 6.802 831 HH21 ARG 110 HH21 ARG 110 29.883 46.737 6.942 832 HH22 ARG 110 HH22 ARG 110 30.117 45.172 6.181 Start of MODEL 8 1 H VAL 3 H VAL 3 16.379 49.231 12.633 2 HA VAL 3 HA VAL 3 14.337 48.028 11.823 3 HB VAL 3 HB VAL 3 14.428 49.946 9.510 4 HG11 VAL 3 HG11 VAL 3 13.175 47.946 9.137 5 HG12 VAL 3 HG12 VAL 3 11.980 49.200 9.468 6 HG13 VAL 3 HG13 VAL 3 12.411 48.041 10.727 7 HG21 VAL 3 HG21 VAL 3 13.142 50.428 12.191 8 HG22 VAL 3 HG22 VAL 3 12.312 50.963 10.730 9 HG23 VAL 3 HG23 VAL 3 13.921 51.578 11.105 10 H ILE 4 H ILE 4 16.876 47.348 11.994 11 HA ILE 4 HA ILE 4 17.599 46.519 9.209 12 HB ILE 4 HB ILE 4 19.455 47.789 11.250 13 HG12 ILE 4 HG12 ILE 4 19.359 48.595 8.383 14 HG13 ILE 4 HG13 ILE 4 17.951 49.006 9.359 15 HG21 ILE 4 HG21 ILE 4 21.143 47.338 9.302 16 HG22 ILE 4 HG22 ILE 4 20.002 46.082 8.828 17 HG23 ILE 4 HG23 ILE 4 20.762 46.030 10.417 18 HD11 ILE 4 HD11 ILE 4 19.237 50.283 10.889 19 HD12 ILE 4 HD12 ILE 4 19.851 50.730 9.298 20 HD13 ILE 4 HD13 ILE 4 20.753 49.598 10.302 21 H ASN 5 H ASN 5 18.614 44.467 9.127 22 HA ASN 5 HA ASN 5 19.135 43.035 11.677 23 HB2 ASN 5 HB2 ASN 5 17.636 41.187 11.041 24 HB3 ASN 5 HB3 ASN 5 16.718 42.691 11.157 25 HD21 ASN 5 HD21 ASN 5 15.590 40.718 9.550 26 HD22 ASN 5 HD22 ASN 5 15.758 41.137 7.915 27 H THR 6 H THR 6 20.814 43.923 9.429 28 HA THR 6 HA THR 6 21.625 41.235 8.366 29 HB THR 6 HB THR 6 22.414 42.279 6.366 30 HG1 THR 6 HG1 THR 6 22.162 44.644 6.248 31 HG21 THR 6 HG21 THR 6 20.415 42.941 5.396 32 HG22 THR 6 HG22 THR 6 19.929 43.899 6.793 33 HG23 THR 6 HG23 THR 6 19.813 42.139 6.846 34 H PHE 7 H PHE 7 23.808 40.706 8.456 35 HA PHE 7 HA PHE 7 25.374 41.470 10.597 36 HB2 PHE 7 HB2 PHE 7 26.272 40.530 7.854 37 HB3 PHE 7 HB3 PHE 7 27.364 40.656 9.241 38 HD1 PHE 7 HD1 PHE 7 26.394 39.603 11.499 39 HD2 PHE 7 HD2 PHE 7 25.174 38.536 7.509 40 HE1 PHE 7 HE1 PHE 7 25.474 37.461 12.352 41 HE2 PHE 7 HE2 PHE 7 24.260 36.388 8.359 42 HZ PHE 7 HZ PHE 7 24.401 35.849 10.777 43 H ASP 8 H ASP 8 26.828 42.283 7.541 44 HA ASP 8 HA ASP 8 28.396 44.393 8.356 45 HB2 ASP 8 HB2 ASP 8 27.073 43.759 5.733 46 HB3 ASP 8 HB3 ASP 8 28.021 45.241 5.904 47 H GLY 9 H GLY 9 25.069 44.663 7.087 48 HA2 GLY 9 HA2 GLY 9 24.722 47.438 7.229 49 HA3 GLY 9 HA3 GLY 9 23.421 46.283 7.522 50 H VAL 10 H VAL 10 24.023 45.076 9.902 51 HA VAL 10 HA VAL 10 23.429 47.108 11.850 52 HB VAL 10 HB VAL 10 24.426 44.259 12.154 53 HG11 VAL 10 HG11 VAL 10 25.076 45.439 14.158 54 HG12 VAL 10 HG12 VAL 10 23.597 44.562 14.543 55 HG13 VAL 10 HG13 VAL 10 23.535 46.295 14.223 56 HG21 VAL 10 HG21 VAL 10 21.693 45.533 12.591 57 HG22 VAL 10 HG22 VAL 10 22.076 43.826 12.802 58 HG23 VAL 10 HG23 VAL 10 22.138 44.552 11.195 59 H ALA 11 H ALA 11 26.497 45.377 11.115 60 HA ALA 11 HA ALA 11 28.149 46.504 13.132 61 HB1 ALA 11 HB1 ALA 11 29.892 46.220 11.090 62 HB2 ALA 11 HB2 ALA 11 28.539 45.299 10.452 63 HB3 ALA 11 HB3 ALA 11 29.264 44.845 11.991 64 H ASP 12 H ASP 12 27.821 47.613 9.730 65 HA ASP 12 HA ASP 12 29.301 50.010 9.892 66 HB2 ASP 12 HB2 ASP 12 27.007 49.069 8.211 67 HB3 ASP 12 HB3 ASP 12 27.413 50.784 8.168 68 H TYR 13 H TYR 13 25.835 49.482 10.549 69 HA TYR 13 HA TYR 13 25.094 52.136 11.178 70 HB2 TYR 13 HB2 TYR 13 23.678 49.919 11.082 71 HB3 TYR 13 HB3 TYR 13 24.062 49.805 12.798 72 HD1 TYR 13 HD1 TYR 13 22.385 51.853 10.203 73 HD2 TYR 13 HD2 TYR 13 23.048 51.322 14.419 74 HE1 TYR 13 HE1 TYR 13 20.566 53.469 10.695 75 HE2 TYR 13 HE2 TYR 13 21.228 52.934 14.903 76 HH TYR 13 HH TYR 13 18.918 53.726 13.161 77 H LEU 14 H LEU 14 26.286 49.577 13.342 78 HA LEU 14 HA LEU 14 26.425 51.286 15.654 79 HB2 LEU 14 HB2 LEU 14 27.594 48.591 14.985 80 HB3 LEU 14 HB3 LEU 14 27.856 49.370 16.550 81 HG LEU 14 HG LEU 14 25.108 48.941 15.360 82 HD11 LEU 14 HD11 LEU 14 26.375 46.788 15.818 83 HD12 LEU 14 HD12 LEU 14 24.879 46.990 16.731 84 HD13 LEU 14 HD13 LEU 14 26.433 47.276 17.512 85 HD21 LEU 14 HD21 LEU 14 26.152 50.388 17.614 86 HD22 LEU 14 HD22 LEU 14 25.152 49.058 18.201 87 HD23 LEU 14 HD23 LEU 14 24.481 50.246 17.082 88 H GLN 15 H GLN 15 28.888 50.125 13.346 89 HA GLN 15 HA GLN 15 31.064 51.405 14.675 90 HB2 GLN 15 HB2 GLN 15 30.584 50.512 11.843 91 HB3 GLN 15 HB3 GLN 15 32.068 51.364 12.283 92 HG2 GLN 15 HG2 GLN 15 31.819 49.494 14.314 93 HG3 GLN 15 HG3 GLN 15 31.247 48.607 12.897 94 HE21 GLN 15 HE21 GLN 15 33.692 47.861 14.116 95 HE22 GLN 15 HE22 GLN 15 34.969 48.251 13.069 96 H THR 16 H THR 16 28.576 52.758 12.581 97 HA THR 16 HA THR 16 30.094 55.328 12.413 98 HB THR 16 HB THR 16 27.472 54.672 11.040 99 HG1 THR 16 HG1 THR 16 29.044 53.203 10.342 100 HG21 THR 16 HG21 THR 16 27.804 56.985 10.983 101 HG22 THR 16 HG22 THR 16 28.504 56.444 9.459 102 HG23 THR 16 HG23 THR 16 29.555 56.830 10.824 103 H TYR 17 H TYR 17 26.859 54.136 13.428 104 HA TYR 17 HA TYR 17 26.345 56.795 14.666 105 HB2 TYR 17 HB2 TYR 17 24.482 54.447 14.208 106 HB3 TYR 17 HB3 TYR 17 24.009 56.053 14.765 107 HD1 TYR 17 HD1 TYR 17 24.447 58.048 13.260 108 HD2 TYR 17 HD2 TYR 17 24.765 53.985 11.900 109 HE1 TYR 17 HE1 TYR 17 24.270 58.820 10.910 110 HE2 TYR 17 HE2 TYR 17 24.594 54.757 9.548 111 HH TYR 17 HH TYR 17 25.182 57.624 8.523 112 H HIS 18 H HIS 18 27.223 53.593 15.463 113 HA HIS 18 HA HIS 18 27.591 52.522 17.512 114 HB2 HIS 18 HB2 HIS 18 27.363 55.377 18.491 115 HB3 HIS 18 HB3 HIS 18 27.859 54.026 19.506 116 HD1 HIS 18 HD1 HIS 18 29.180 53.049 16.434 117 HD2 HIS 18 HD2 HIS 18 30.259 56.079 19.104 118 HE1 HIS 18 HE1 HIS 18 31.621 53.596 15.975 119 H LYS 19 H LYS 19 24.786 54.575 17.252 120 HA LYS 19 HA LYS 19 23.409 53.481 19.521 121 HB2 LYS 19 HB2 LYS 19 22.275 55.393 19.000 122 HB3 LYS 19 HB3 LYS 19 22.851 55.365 17.336 123 HG2 LYS 19 HG2 LYS 19 21.151 53.617 16.806 124 HG3 LYS 19 HG3 LYS 19 20.546 53.734 18.457 125 HD2 LYS 19 HD2 LYS 19 19.115 55.200 17.357 126 HD3 LYS 19 HD3 LYS 19 20.382 56.305 17.892 127 HE2 LYS 19 HE2 LYS 19 20.631 56.916 15.732 128 HE3 LYS 19 HE3 LYS 19 21.318 55.320 15.427 129 HZ1 LYS 19 HZ1 LYS 19 19.563 54.903 14.128 130 HZ2 LYS 19 HZ2 LYS 19 18.834 56.386 14.575 131 HZ3 LYS 19 HZ3 LYS 19 18.536 54.983 15.505 132 H LEU 20 H LEU 20 22.594 51.507 19.669 133 HA LEU 20 HA LEU 20 22.737 49.455 17.789 134 HB2 LEU 20 HB2 LEU 20 21.150 49.998 20.218 135 HB3 LEU 20 HB3 LEU 20 20.414 48.827 19.129 136 HG LEU 20 HG LEU 20 23.326 48.591 19.875 137 HD11 LEU 20 HD11 LEU 20 21.054 47.312 21.404 138 HD12 LEU 20 HD12 LEU 20 21.821 48.810 21.928 139 HD13 LEU 20 HD13 LEU 20 22.764 47.326 21.820 140 HD21 LEU 20 HD21 LEU 20 21.241 46.956 18.545 141 HD22 LEU 20 HD22 LEU 20 22.219 46.080 19.724 142 HD23 LEU 20 HD23 LEU 20 22.997 46.899 18.372 143 HA PRO 21 HA PRO 21 20.088 50.659 14.385 144 HB2 PRO 21 HB2 PRO 21 19.271 47.787 14.524 145 HB3 PRO 21 HB3 PRO 21 19.758 48.757 13.120 146 HG2 PRO 21 HG2 PRO 21 21.405 46.994 14.313 147 HG3 PRO 21 HG3 PRO 21 21.982 48.468 13.516 148 HD2 PRO 21 HD2 PRO 21 21.928 47.821 16.397 149 HD3 PRO 21 HD3 PRO 21 22.846 49.085 15.548 150 H ASP 22 H ASP 22 18.103 51.554 14.431 151 HA ASP 22 HA ASP 22 16.334 51.337 16.661 152 HB2 ASP 22 HB2 ASP 22 15.329 52.271 14.001 153 HB3 ASP 22 HB3 ASP 22 15.129 53.004 15.594 154 H ASN 23 H ASN 23 16.124 48.987 16.741 155 HA ASN 23 HA ASN 23 13.612 47.986 15.993 156 HB2 ASN 23 HB2 ASN 23 14.300 46.345 14.181 157 HB3 ASN 23 HB3 ASN 23 14.231 48.030 13.678 158 HD21 ASN 23 HD21 ASN 23 16.458 45.408 14.542 159 HD22 ASN 23 HD22 ASN 23 17.832 46.119 13.843 160 H TYR 24 H TYR 24 16.202 47.785 17.820 161 HA TYR 24 HA TYR 24 16.129 44.809 18.143 162 HB2 TYR 24 HB2 TYR 24 18.285 46.856 18.526 163 HB3 TYR 24 HB3 TYR 24 18.313 45.401 19.525 164 HD1 TYR 24 HD1 TYR 24 18.132 43.142 18.363 165 HD2 TYR 24 HD2 TYR 24 19.023 46.784 16.284 166 HE1 TYR 24 HE1 TYR 24 18.997 41.832 16.448 167 HE2 TYR 24 HE2 TYR 24 19.899 45.472 14.364 168 HH TYR 24 HH TYR 24 19.863 41.888 14.423 169 H ILE 25 H ILE 25 16.491 44.062 20.441 170 HA ILE 25 HA ILE 25 15.706 45.952 22.563 171 HB ILE 25 HB ILE 25 13.985 43.684 22.957 172 HG12 ILE 25 HG12 ILE 25 13.382 45.072 20.337 173 HG13 ILE 25 HG13 ILE 25 14.250 43.540 20.397 174 HG21 ILE 25 HG21 ILE 25 12.246 45.609 22.556 175 HG22 ILE 25 HG22 ILE 25 13.675 46.640 22.464 176 HG23 ILE 25 HG23 ILE 25 13.351 45.713 23.928 177 HD11 ILE 25 HD11 ILE 25 11.404 44.137 21.101 178 HD12 ILE 25 HD12 ILE 25 12.228 42.854 21.985 179 HD13 ILE 25 HD13 ILE 25 12.074 42.760 20.230 180 H THR 26 H THR 26 16.150 45.081 24.696 181 HA THR 26 HA THR 26 18.316 43.094 24.738 182 HB THR 26 HB THR 26 18.152 43.356 27.200 183 HG1 THR 26 HG1 THR 26 15.905 44.977 26.580 184 HG21 THR 26 HG21 THR 26 18.040 46.045 27.108 185 HG22 THR 26 HG22 THR 26 18.179 45.717 25.381 186 HG23 THR 26 HG23 THR 26 19.423 45.139 26.491 187 H LYS 27 H LYS 27 18.146 40.929 25.698 188 HA LYS 27 HA LYS 27 15.846 39.413 25.062 189 HB2 LYS 27 HB2 LYS 27 18.284 39.014 26.625 190 HB3 LYS 27 HB3 LYS 27 16.918 38.140 27.312 191 HG2 LYS 27 HG2 LYS 27 17.092 36.584 25.697 192 HG3 LYS 27 HG3 LYS 27 16.803 37.821 24.474 193 HD2 LYS 27 HD2 LYS 27 19.506 37.917 25.589 194 HD3 LYS 27 HD3 LYS 27 19.161 36.394 24.779 195 HE2 LYS 27 HE2 LYS 27 18.682 37.461 22.717 196 HE3 LYS 27 HE3 LYS 27 18.491 39.039 23.479 197 HZ1 LYS 27 HZ1 LYS 27 20.689 38.463 22.216 198 HZ2 LYS 27 HZ2 LYS 27 21.076 37.639 23.669 199 HZ3 LYS 27 HZ3 LYS 27 20.758 39.323 23.701 200 H SER 28 H SER 28 16.771 40.784 28.234 201 HA SER 28 HA SER 28 14.572 40.085 29.806 202 HB2 SER 28 HB2 SER 28 16.304 41.328 30.851 203 HB3 SER 28 HB3 SER 28 16.185 42.636 29.675 204 HG SER 28 HG SER 28 14.585 43.463 30.775 205 H GLU 29 H GLU 29 14.770 43.216 28.043 206 HA GLU 29 HA GLU 29 12.134 44.077 28.333 207 HB2 GLU 29 HB2 GLU 29 14.043 44.296 25.996 208 HB3 GLU 29 HB3 GLU 29 12.495 45.134 26.031 209 HG2 GLU 29 HG2 GLU 29 13.147 46.493 27.834 210 HG3 GLU 29 HG3 GLU 29 14.476 45.441 28.309 211 H ALA 30 H ALA 30 13.413 42.215 25.526 212 HA ALA 30 HA ALA 30 10.958 41.689 24.246 213 HB1 ALA 30 HB1 ALA 30 13.668 40.629 24.168 214 HB2 ALA 30 HB2 ALA 30 12.484 40.742 22.868 215 HB3 ALA 30 HB3 ALA 30 12.490 39.338 23.932 216 H GLN 31 H GLN 31 12.597 39.688 26.734 217 HA GLN 31 HA GLN 31 10.538 37.696 26.910 218 HB2 GLN 31 HB2 GLN 31 12.604 38.624 28.916 219 HB3 GLN 31 HB3 GLN 31 11.593 37.192 29.133 220 HG2 GLN 31 HG2 GLN 31 12.527 36.129 27.201 221 HG3 GLN 31 HG3 GLN 31 13.327 37.615 26.691 222 HE21 GLN 31 HE21 GLN 31 13.496 34.911 28.930 223 HE22 GLN 31 HE22 GLN 31 15.038 35.270 29.535 224 H ALA 32 H ALA 32 11.151 40.588 28.957 225 HA ALA 32 HA ALA 32 8.860 40.138 30.630 226 HB1 ALA 32 HB1 ALA 32 10.358 41.596 31.617 227 HB2 ALA 32 HB2 ALA 32 9.208 42.752 30.946 228 HB3 ALA 32 HB3 ALA 32 10.711 42.409 30.090 229 H LEU 33 H LEU 33 9.258 41.811 27.577 230 HA LEU 33 HA LEU 33 6.737 43.190 27.634 231 HB2 LEU 33 HB2 LEU 33 8.782 42.496 25.577 232 HB3 LEU 33 HB3 LEU 33 7.175 42.914 24.987 233 HG LEU 33 HG LEU 33 8.230 44.731 27.074 234 HD11 LEU 33 HD11 LEU 33 10.298 44.862 26.129 235 HD12 LEU 33 HD12 LEU 33 9.476 45.823 24.902 236 HD13 LEU 33 HD13 LEU 33 9.770 44.108 24.622 237 HD21 LEU 33 HD21 LEU 33 6.118 44.962 25.601 238 HD22 LEU 33 HD22 LEU 33 7.226 45.385 24.296 239 HD23 LEU 33 HD23 LEU 33 7.153 46.384 25.747 240 H GLY 34 H GLY 34 7.623 39.899 27.120 241 HA2 GLY 34 HA2 GLY 34 5.512 38.446 27.448 242 HA3 GLY 34 HA3 GLY 34 4.893 39.311 26.047 243 H TRP 35 H TRP 35 8.122 39.010 25.393 244 HA TRP 35 HA TRP 35 7.714 37.017 23.377 245 HB2 TRP 35 HB2 TRP 35 9.594 38.629 23.307 246 HB3 TRP 35 HB3 TRP 35 10.305 37.857 24.725 247 HD1 TRP 35 HD1 TRP 35 8.818 36.294 21.510 248 HE1 TRP 35 HE1 TRP 35 10.585 34.701 20.527 249 HE3 TRP 35 HE3 TRP 35 12.623 37.051 24.814 250 HZ2 TRP 35 HZ2 TRP 35 13.263 33.854 21.066 251 HZ3 TRP 35 HZ3 TRP 35 14.773 35.841 24.570 252 HH2 TRP 35 HH2 TRP 35 15.096 34.241 22.696 253 H VAL 36 H VAL 36 7.217 34.884 23.832 254 HA VAL 36 HA VAL 36 8.605 33.597 26.187 255 HB VAL 36 HB VAL 36 5.778 33.237 25.150 256 HG11 VAL 36 HG11 VAL 36 6.719 31.004 25.493 257 HG12 VAL 36 HG12 VAL 36 5.618 31.376 26.818 258 HG13 VAL 36 HG13 VAL 36 7.361 31.486 27.063 259 HG21 VAL 36 HG21 VAL 36 7.012 33.965 27.829 260 HG22 VAL 36 HG22 VAL 36 5.300 33.605 27.612 261 HG23 VAL 36 HG23 VAL 36 6.018 34.998 26.802 262 H ALA 37 H ALA 37 9.470 31.565 25.873 263 HA ALA 37 HA ALA 37 10.328 30.785 23.279 264 HB1 ALA 37 HB1 ALA 37 10.959 28.622 24.436 265 HB2 ALA 37 HB2 ALA 37 10.195 29.263 25.892 266 HB3 ALA 37 HB3 ALA 37 11.592 30.082 25.196 267 H SER 38 H SER 38 7.769 29.342 25.344 268 HA SER 38 HA SER 38 6.990 27.468 23.240 269 HB2 SER 38 HB2 SER 38 5.362 26.674 24.782 270 HB3 SER 38 HB3 SER 38 6.714 27.178 25.803 271 HG SER 38 HG SER 38 4.416 28.729 25.121 272 H LYS 39 H LYS 39 6.977 29.981 22.168 273 HA LYS 39 HA LYS 39 4.293 30.214 21.151 274 HB2 LYS 39 HB2 LYS 39 4.065 31.366 23.382 275 HB3 LYS 39 HB3 LYS 39 5.285 32.529 22.851 276 HG2 LYS 39 HG2 LYS 39 3.907 33.392 21.155 277 HG3 LYS 39 HG3 LYS 39 2.868 31.969 21.145 278 HD2 LYS 39 HD2 LYS 39 2.580 32.848 23.736 279 HD3 LYS 39 HD3 LYS 39 2.745 34.367 22.855 280 HE2 LYS 39 HE2 LYS 39 0.434 33.946 22.746 281 HE3 LYS 39 HE3 LYS 39 1.024 33.332 21.198 282 HZ1 LYS 39 HZ1 LYS 39 0.739 31.622 23.609 283 HZ2 LYS 39 HZ2 LYS 39 1.003 31.123 22.008 284 HZ3 LYS 39 HZ3 LYS 39 -0.493 31.798 22.455 285 H GLY 40 H GLY 40 7.278 32.084 21.753 286 HA2 GLY 40 HA2 GLY 40 8.747 33.089 20.216 287 HA3 GLY 40 HA3 GLY 40 7.951 32.170 18.936 288 H ASN 41 H ASN 41 5.947 34.052 20.989 289 HA ASN 41 HA ASN 41 4.753 35.556 18.917 290 HB2 ASN 41 HB2 ASN 41 4.004 37.103 20.824 291 HB3 ASN 41 HB3 ASN 41 3.576 35.405 20.988 292 HD21 ASN 41 HD21 ASN 41 4.754 37.934 22.762 293 HD22 ASN 41 HD22 ASN 41 5.642 37.064 23.932 294 H LEU 42 H LEU 42 5.432 37.267 17.777 295 HA LEU 42 HA LEU 42 7.084 39.380 18.898 296 HB2 LEU 42 HB2 LEU 42 8.674 37.358 18.345 297 HB3 LEU 42 HB3 LEU 42 8.423 37.829 16.666 298 HG LEU 42 HG LEU 42 8.987 40.242 17.590 299 HD11 LEU 42 HD11 LEU 42 10.729 40.030 19.402 300 HD12 LEU 42 HD12 LEU 42 10.207 38.359 19.626 301 HD13 LEU 42 HD13 LEU 42 9.084 39.684 19.930 302 HD21 LEU 42 HD21 LEU 42 11.557 39.291 17.450 303 HD22 LEU 42 HD22 LEU 42 10.553 39.637 16.043 304 HD23 LEU 42 HD23 LEU 42 10.669 37.989 16.660 305 H ALA 43 H ALA 43 6.391 37.785 15.804 306 HA ALA 43 HA ALA 43 6.247 40.105 14.194 307 HB1 ALA 43 HB1 ALA 43 6.233 37.860 13.217 308 HB2 ALA 43 HB2 ALA 43 4.786 38.726 12.698 309 HB3 ALA 43 HB3 ALA 43 4.677 37.513 13.973 310 H ASP 44 H ASP 44 3.908 38.762 16.466 311 HA ASP 44 HA ASP 44 1.646 40.343 15.535 312 HB2 ASP 44 HB2 ASP 44 0.933 39.766 18.037 313 HB3 ASP 44 HB3 ASP 44 0.982 38.503 16.810 314 H VAL 45 H VAL 45 3.530 40.568 18.532 315 HA VAL 45 HA VAL 45 2.691 43.262 19.131 316 HB VAL 45 HB VAL 45 4.477 43.086 20.919 317 HG11 VAL 45 HG11 VAL 45 3.406 40.764 21.810 318 HG12 VAL 45 HG12 VAL 45 2.246 41.132 20.536 319 HG13 VAL 45 HG13 VAL 45 2.516 42.288 21.838 320 HG21 VAL 45 HG21 VAL 45 6.100 41.719 19.773 321 HG22 VAL 45 HG22 VAL 45 4.924 40.437 19.522 322 HG23 VAL 45 HG23 VAL 45 5.507 40.789 21.146 323 H ALA 46 H ALA 46 5.291 41.903 17.221 324 HA ALA 46 HA ALA 46 6.140 44.666 16.534 325 HB1 ALA 46 HB1 ALA 46 8.407 44.385 17.111 326 HB2 ALA 46 HB2 ALA 46 8.265 42.631 17.214 327 HB3 ALA 46 HB3 ALA 46 7.566 43.646 18.474 328 HA PRO 47 HA PRO 47 5.658 41.625 13.036 329 HB2 PRO 47 HB2 PRO 47 4.742 43.972 11.542 330 HB3 PRO 47 HB3 PRO 47 3.922 42.434 11.840 331 HG2 PRO 47 HG2 PRO 47 3.242 44.834 12.989 332 HG3 PRO 47 HG3 PRO 47 2.813 43.238 13.625 333 HD2 PRO 47 HD2 PRO 47 4.814 45.166 14.623 334 HD3 PRO 47 HD3 PRO 47 4.005 43.845 15.473 335 H GLY 48 H GLY 48 8.198 42.428 13.661 336 HA2 GLY 48 HA2 GLY 48 9.772 42.304 11.495 337 HA3 GLY 48 HA3 GLY 48 9.229 43.968 11.328 338 H LYS 49 H LYS 49 10.015 42.315 14.387 339 HA LYS 49 HA LYS 49 12.262 44.266 14.681 340 HB2 LYS 49 HB2 LYS 49 10.067 44.369 16.177 341 HB3 LYS 49 HB3 LYS 49 10.902 43.116 17.087 342 HG2 LYS 49 HG2 LYS 49 12.531 44.558 17.838 343 HG3 LYS 49 HG3 LYS 49 12.480 45.548 16.378 344 HD2 LYS 49 HD2 LYS 49 10.277 46.457 17.098 345 HD3 LYS 49 HD3 LYS 49 10.394 45.514 18.584 346 HE2 LYS 49 HE2 LYS 49 12.659 46.697 18.946 347 HE3 LYS 49 HE3 LYS 49 12.127 47.819 17.692 348 HZ1 LYS 49 HZ1 LYS 49 10.599 47.197 20.168 349 HZ2 LYS 49 HZ2 LYS 49 10.171 48.342 18.986 350 HZ3 LYS 49 HZ3 LYS 49 11.557 48.580 19.945 351 H SER 50 H SER 50 14.209 43.494 15.695 352 HA SER 50 HA SER 50 14.318 40.500 15.970 353 HB2 SER 50 HB2 SER 50 16.643 42.249 15.144 354 HB3 SER 50 HB3 SER 50 16.509 40.495 15.029 355 HG SER 50 HG SER 50 14.920 42.409 13.642 356 H ILE 51 H ILE 51 15.173 39.735 17.881 357 HA ILE 51 HA ILE 51 15.539 41.550 20.078 358 HB ILE 51 HB ILE 51 16.684 38.788 20.249 359 HG12 ILE 51 HG12 ILE 51 14.621 38.475 18.915 360 HG13 ILE 51 HG13 ILE 51 14.415 37.842 20.548 361 HG21 ILE 51 HG21 ILE 51 16.697 39.695 22.357 362 HG22 ILE 51 HG22 ILE 51 15.018 39.155 22.369 363 HG23 ILE 51 HG23 ILE 51 15.403 40.832 21.986 364 HD11 ILE 51 HD11 ILE 51 13.604 40.405 20.933 365 HD12 ILE 51 HD12 ILE 51 12.503 39.094 20.508 366 HD13 ILE 51 HD13 ILE 51 13.116 40.174 19.257 367 H GLY 52 H GLY 52 17.456 41.911 21.338 368 HA2 GLY 52 HA2 GLY 52 20.047 41.191 21.055 369 HA3 GLY 52 HA3 GLY 52 19.838 42.169 19.603 370 H GLY 53 H GLY 53 21.499 42.639 22.031 371 HA2 GLY 53 HA2 GLY 53 22.008 45.098 22.448 372 HA3 GLY 53 HA3 GLY 53 20.299 45.273 22.827 373 H ASP 54 H ASP 54 21.708 42.329 23.915 374 HA ASP 54 HA ASP 54 21.234 43.090 26.674 375 HB2 ASP 54 HB2 ASP 54 22.881 40.702 25.944 376 HB3 ASP 54 HB3 ASP 54 21.590 40.858 27.142 377 H ILE 55 H ILE 55 23.250 42.072 28.046 378 HA ILE 55 HA ILE 55 25.689 43.587 27.283 379 HB ILE 55 HB ILE 55 24.318 43.519 29.961 380 HG12 ILE 55 HG12 ILE 55 23.716 45.085 27.835 381 HG13 ILE 55 HG13 ILE 55 23.601 45.672 29.482 382 HG21 ILE 55 HG21 ILE 55 27.018 44.577 29.087 383 HG22 ILE 55 HG22 ILE 55 26.662 43.477 30.421 384 HG23 ILE 55 HG23 ILE 55 26.207 45.175 30.534 385 HD11 ILE 55 HD11 ILE 55 24.935 47.069 27.719 386 HD12 ILE 55 HD12 ILE 55 26.200 45.872 27.994 387 HD13 ILE 55 HD13 ILE 55 25.616 46.862 29.331 388 H PHE 56 H PHE 56 27.601 42.583 27.781 389 HA PHE 56 HA PHE 56 27.657 40.311 29.642 390 HB2 PHE 56 HB2 PHE 56 26.950 39.560 27.227 391 HB3 PHE 56 HB3 PHE 56 28.659 39.782 26.854 392 HD1 PHE 56 HD1 PHE 56 26.389 38.158 29.362 393 HD2 PHE 56 HD2 PHE 56 30.183 38.058 27.333 394 HE1 PHE 56 HE1 PHE 56 26.888 35.954 30.401 395 HE2 PHE 56 HE2 PHE 56 30.684 35.857 28.370 396 HZ PHE 56 HZ PHE 56 29.035 34.805 29.904 397 H SER 57 H SER 57 29.804 39.853 30.352 398 HA SER 57 HA SER 57 31.734 42.022 29.738 399 HB2 SER 57 HB2 SER 57 32.924 40.456 31.670 400 HB3 SER 57 HB3 SER 57 31.933 41.878 31.983 401 HG SER 57 HG SER 57 30.165 40.573 32.288 402 H ASN 58 H ASN 58 31.220 38.689 29.059 403 HA ASN 58 HA ASN 58 32.398 37.245 27.670 404 HB2 ASN 58 HB2 ASN 58 32.820 39.385 26.373 405 HB3 ASN 58 HB3 ASN 58 34.371 39.487 27.203 406 HD21 ASN 58 HD21 ASN 58 35.593 39.124 25.225 407 HD22 ASN 58 HD22 ASN 58 35.633 37.604 24.469 408 H ARG 59 H ARG 59 33.075 37.469 30.554 409 HA ARG 59 HA ARG 59 35.897 37.280 31.001 410 HB2 ARG 59 HB2 ARG 59 33.457 36.310 32.418 411 HB3 ARG 59 HB3 ARG 59 34.975 35.522 32.816 412 HG2 ARG 59 HG2 ARG 59 36.000 37.634 33.421 413 HG3 ARG 59 HG3 ARG 59 34.563 38.523 32.911 414 HD2 ARG 59 HD2 ARG 59 34.876 36.645 35.258 415 HD3 ARG 59 HD3 ARG 59 34.316 38.318 35.276 416 HE ARG 59 HE ARG 59 32.653 36.012 34.974 417 HH11 ARG 59 HH11 ARG 59 33.113 39.141 33.687 418 HH12 ARG 59 HH12 ARG 59 31.646 39.147 32.742 419 HH21 ARG 59 HH21 ARG 59 30.784 35.940 33.698 420 HH22 ARG 59 HH22 ARG 59 30.374 37.309 32.725 421 H GLU 60 H GLU 60 33.503 35.042 29.787 422 HA GLU 60 HA GLU 60 35.004 32.628 29.987 423 HB2 GLU 60 HB2 GLU 60 32.820 33.507 28.071 424 HB3 GLU 60 HB3 GLU 60 33.443 31.859 28.144 425 HG2 GLU 60 HG2 GLU 60 31.399 32.060 29.513 426 HG3 GLU 60 HG3 GLU 60 32.790 31.719 30.538 427 H GLY 61 H GLY 61 35.621 35.402 28.160 428 HA2 GLY 61 HA2 GLY 61 37.159 35.866 26.459 429 HA3 GLY 61 HA3 GLY 61 37.956 34.372 26.940 430 H LYS 62 H LYS 62 34.714 34.853 25.559 431 HA LYS 62 HA LYS 62 35.345 32.819 23.469 432 HB2 LYS 62 HB2 LYS 62 33.081 33.375 25.040 433 HB3 LYS 62 HB3 LYS 62 32.641 33.927 23.427 434 HG2 LYS 62 HG2 LYS 62 34.010 31.299 23.502 435 HG3 LYS 62 HG3 LYS 62 32.436 31.333 24.291 436 HD2 LYS 62 HD2 LYS 62 31.707 30.921 22.149 437 HD3 LYS 62 HD3 LYS 62 31.783 32.679 22.053 438 HE2 LYS 62 HE2 LYS 62 34.388 31.539 21.506 439 HE3 LYS 62 HE3 LYS 62 33.173 30.823 20.444 440 HZ1 LYS 62 HZ1 LYS 62 33.806 32.730 19.327 441 HZ2 LYS 62 HZ2 LYS 62 33.942 33.669 20.752 442 HZ3 LYS 62 HZ3 LYS 62 32.402 33.238 20.132 443 H LEU 63 H LEU 63 35.203 36.184 23.894 444 HA LEU 63 HA LEU 63 35.275 36.637 20.931 445 HB2 LEU 63 HB2 LEU 63 33.846 38.429 22.929 446 HB3 LEU 63 HB3 LEU 63 33.877 38.613 21.177 447 HG LEU 63 HG LEU 63 32.758 36.156 22.543 448 HD11 LEU 63 HD11 LEU 63 30.530 37.143 22.105 449 HD12 LEU 63 HD12 LEU 63 31.307 38.636 21.582 450 HD13 LEU 63 HD13 LEU 63 31.457 38.104 23.256 451 HD21 LEU 63 HD21 LEU 63 33.412 36.807 19.863 452 HD22 LEU 63 HD22 LEU 63 31.653 36.863 19.971 453 HD23 LEU 63 HD23 LEU 63 32.521 35.401 20.436 454 HA PRO 64 HA PRO 64 38.951 39.043 21.483 455 HB2 PRO 64 HB2 PRO 64 37.335 41.470 20.754 456 HB3 PRO 64 HB3 PRO 64 38.938 40.973 20.173 457 HG2 PRO 64 HG2 PRO 64 36.783 40.577 18.673 458 HG3 PRO 64 HG3 PRO 64 38.073 39.365 18.755 459 HD2 PRO 64 HD2 PRO 64 35.345 39.283 19.948 460 HD3 PRO 64 HD3 PRO 64 36.387 37.941 19.421 461 H GLY 65 H GLY 65 39.954 40.097 23.207 462 HA2 GLY 65 HA2 GLY 65 38.213 41.557 25.157 463 HA3 GLY 65 HA3 GLY 65 39.340 40.320 25.712 464 H LYS 66 H LYS 66 40.138 42.208 26.983 465 HA LYS 66 HA LYS 66 42.660 43.163 26.187 466 HB2 LYS 66 HB2 LYS 66 42.259 45.530 25.620 467 HB3 LYS 66 HB3 LYS 66 41.347 44.537 24.497 468 HG2 LYS 66 HG2 LYS 66 39.289 44.954 25.644 469 HG3 LYS 66 HG3 LYS 66 40.122 45.637 27.037 470 HD2 LYS 66 HD2 LYS 66 40.973 47.134 24.779 471 HD3 LYS 66 HD3 LYS 66 39.225 46.972 24.643 472 HE2 LYS 66 HE2 LYS 66 40.504 47.776 27.259 473 HE3 LYS 66 HE3 LYS 66 40.157 48.974 26.011 474 HZ1 LYS 66 HZ1 LYS 66 38.161 49.024 27.032 475 HZ2 LYS 66 HZ2 LYS 66 38.324 47.456 27.707 476 HZ3 LYS 66 HZ3 LYS 66 37.850 47.652 26.083 477 H SER 67 H SER 67 42.561 45.727 27.547 478 HA SER 67 HA SER 67 42.333 44.800 30.304 479 HB2 SER 67 HB2 SER 67 43.099 46.976 30.916 480 HB3 SER 67 HB3 SER 67 43.926 46.626 29.399 481 HG SER 67 HG SER 67 41.407 47.921 29.472 482 H GLY 68 H GLY 68 40.119 44.133 30.381 483 HA2 GLY 68 HA2 GLY 68 37.880 44.523 31.051 484 HA3 GLY 68 HA3 GLY 68 38.216 46.256 31.037 485 H ARG 69 H ARG 69 36.778 43.645 29.295 486 HA ARG 69 HA ARG 69 36.298 45.485 26.975 487 HB2 ARG 69 HB2 ARG 69 37.763 43.621 26.321 488 HB3 ARG 69 HB3 ARG 69 36.581 42.463 26.932 489 HG2 ARG 69 HG2 ARG 69 36.022 42.500 24.669 490 HG3 ARG 69 HG3 ARG 69 34.938 43.744 25.287 491 HD2 ARG 69 HD2 ARG 69 36.062 44.609 23.310 492 HD3 ARG 69 HD3 ARG 69 36.669 45.465 24.724 493 HE ARG 69 HE ARG 69 38.339 43.206 24.296 494 HH11 ARG 69 HH11 ARG 69 37.437 46.134 22.748 495 HH12 ARG 69 HH12 ARG 69 38.932 46.240 21.855 496 HH21 ARG 69 HH21 ARG 69 40.270 43.339 23.167 497 HH22 ARG 69 HH22 ARG 69 40.502 44.674 22.077 498 H THR 70 H THR 70 34.212 45.666 26.258 499 HA THR 70 HA THR 70 32.084 44.317 27.884 500 HB THR 70 HB THR 70 30.665 46.166 27.288 501 HG1 THR 70 HG1 THR 70 32.751 46.742 25.428 502 HG21 THR 70 HG21 THR 70 33.404 47.414 27.638 503 HG22 THR 70 HG22 THR 70 32.522 46.646 28.960 504 HG23 THR 70 HG23 THR 70 31.850 48.066 28.159 505 H TRP 71 H TRP 71 30.791 42.806 26.799 506 HA TRP 71 HA TRP 71 30.880 42.893 23.804 507 HB2 TRP 71 HB2 TRP 71 31.389 40.633 25.686 508 HB3 TRP 71 HB3 TRP 71 30.484 40.254 24.218 509 HD1 TRP 71 HD1 TRP 71 33.955 40.769 25.413 510 HE1 TRP 71 HE1 TRP 71 35.589 40.996 23.413 511 HE3 TRP 71 HE3 TRP 71 30.599 41.293 21.622 512 HZ2 TRP 71 HZ2 TRP 71 35.456 41.394 20.591 513 HZ3 TRP 71 HZ3 TRP 71 31.370 41.600 19.287 514 HH2 TRP 71 HH2 TRP 71 33.793 41.649 18.765 515 H ARG 72 H ARG 72 28.944 42.624 22.718 516 HA ARG 72 HA ARG 72 26.484 41.888 24.234 517 HB2 ARG 72 HB2 ARG 72 26.780 44.430 22.609 518 HB3 ARG 72 HB3 ARG 72 25.262 43.825 23.266 519 HG2 ARG 72 HG2 ARG 72 25.781 45.145 25.046 520 HG3 ARG 72 HG3 ARG 72 26.844 43.806 25.492 521 HD2 ARG 72 HD2 ARG 72 28.389 45.513 25.484 522 HD3 ARG 72 HD3 ARG 72 28.494 45.024 23.793 523 HE ARG 72 HE ARG 72 26.431 46.965 23.954 524 HH11 ARG 72 HH11 ARG 72 29.781 46.670 24.612 525 HH12 ARG 72 HH12 ARG 72 30.125 48.328 24.291 526 HH21 ARG 72 HH21 ARG 72 26.885 49.153 23.508 527 HH22 ARG 72 HH22 ARG 72 28.519 49.706 23.629 528 H GLU 73 H GLU 73 24.817 41.058 22.868 529 HA GLU 73 HA GLU 73 25.762 40.526 20.099 530 HB2 GLU 73 HB2 GLU 73 24.638 38.375 20.220 531 HB3 GLU 73 HB3 GLU 73 25.695 38.560 21.616 532 HG2 GLU 73 HG2 GLU 73 23.864 38.035 22.852 533 HG3 GLU 73 HG3 GLU 73 23.341 39.688 22.525 534 H ALA 74 H ALA 74 23.828 39.790 18.617 535 HA ALA 74 HA ALA 74 21.265 41.076 19.115 536 HB1 ALA 74 HB1 ALA 74 23.251 42.730 18.096 537 HB2 ALA 74 HB2 ALA 74 21.515 43.022 17.993 538 HB3 ALA 74 HB3 ALA 74 22.359 42.231 16.660 539 H ASP 75 H ASP 75 19.642 40.268 17.741 540 HA ASP 75 HA ASP 75 20.222 37.836 16.293 541 HB2 ASP 75 HB2 ASP 75 17.859 39.356 17.054 542 HB3 ASP 75 HB3 ASP 75 17.713 38.757 15.406 543 H ILE 76 H ILE 76 20.012 37.420 14.005 544 HA ILE 76 HA ILE 76 20.136 39.831 12.251 545 HB ILE 76 HB ILE 76 22.106 37.534 12.355 546 HG12 ILE 76 HG12 ILE 76 22.402 39.628 13.789 547 HG13 ILE 76 HG13 ILE 76 23.740 39.240 12.711 548 HG21 ILE 76 HG21 ILE 76 23.082 38.862 10.316 549 HG22 ILE 76 HG22 ILE 76 21.430 39.433 10.121 550 HG23 ILE 76 HG23 ILE 76 21.781 37.708 10.043 551 HD11 ILE 76 HD11 ILE 76 23.447 41.121 11.486 552 HD12 ILE 76 HD12 ILE 76 22.500 41.692 12.858 553 HD13 ILE 76 HD13 ILE 76 21.694 40.952 11.472 554 H ASN 77 H ASN 77 19.445 39.444 10.091 555 HA ASN 77 HA ASN 77 18.081 38.505 8.450 556 HB2 ASN 77 HB2 ASN 77 19.313 35.979 9.575 557 HB3 ASN 77 HB3 ASN 77 18.418 36.072 8.056 558 HD21 ASN 77 HD21 ASN 77 21.088 35.289 7.968 559 HD22 ASN 77 HD22 ASN 77 22.016 36.527 7.262 560 H TYR 78 H TYR 78 16.513 39.213 10.506 561 HA TYR 78 HA TYR 78 14.697 36.879 10.857 562 HB2 TYR 78 HB2 TYR 78 15.395 37.572 13.055 563 HB3 TYR 78 HB3 TYR 78 15.138 39.272 12.656 564 HD1 TYR 78 HD1 TYR 78 13.389 36.018 13.131 565 HD2 TYR 78 HD2 TYR 78 12.969 40.285 12.902 566 HE1 TYR 78 HE1 TYR 78 11.039 35.828 13.914 567 HE2 TYR 78 HE2 TYR 78 10.621 40.098 13.683 568 HH TYR 78 HH TYR 78 9.185 38.615 14.845 569 H THR 79 H THR 79 12.402 37.373 10.670 570 HA THR 79 HA THR 79 11.772 40.012 9.381 571 HB THR 79 HB THR 79 10.377 38.925 7.731 572 HG1 THR 79 HG1 THR 79 10.362 36.582 7.718 573 HG21 THR 79 HG21 THR 79 12.876 37.241 7.740 574 HG22 THR 79 HG22 THR 79 12.967 38.983 7.468 575 HG23 THR 79 HG23 THR 79 12.036 37.973 6.367 576 H SER 80 H SER 80 9.799 37.145 9.960 577 HA SER 80 HA SER 80 8.388 38.398 12.235 578 HB2 SER 80 HB2 SER 80 6.774 39.267 10.879 579 HB3 SER 80 HB3 SER 80 7.300 38.314 9.494 580 HG SER 80 HG SER 80 6.292 36.484 10.628 581 H GLY 81 H GLY 81 8.750 36.636 13.585 582 HA2 GLY 81 HA2 GLY 81 7.184 34.417 13.740 583 HA3 GLY 81 HA3 GLY 81 8.356 33.890 12.531 584 H PHE 82 H PHE 82 10.308 33.111 13.252 585 HA PHE 82 HA PHE 82 10.987 33.634 16.118 586 HB2 PHE 82 HB2 PHE 82 10.066 31.277 15.487 587 HB3 PHE 82 HB3 PHE 82 11.657 31.027 14.769 588 HD1 PHE 82 HD1 PHE 82 9.926 31.989 17.934 589 HD2 PHE 82 HD2 PHE 82 13.541 30.552 16.114 590 HE1 PHE 82 HE1 PHE 82 10.875 31.534 20.180 591 HE2 PHE 82 HE2 PHE 82 14.492 30.102 18.360 592 HZ PHE 82 HZ PHE 82 13.158 30.590 20.394 593 H ARG 83 H ARG 83 13.438 32.651 16.351 594 HA ARG 83 HA ARG 83 15.026 34.398 14.611 595 HB2 ARG 83 HB2 ARG 83 16.397 32.582 16.517 596 HB3 ARG 83 HB3 ARG 83 16.616 34.308 16.254 597 HG2 ARG 83 HG2 ARG 83 14.209 34.469 17.335 598 HG3 ARG 83 HG3 ARG 83 14.637 32.896 18.008 599 HD2 ARG 83 HD2 ARG 83 16.079 35.529 18.373 600 HD3 ARG 83 HD3 ARG 83 15.370 34.499 19.620 601 HE ARG 83 HE ARG 83 17.294 32.878 18.434 602 HH11 ARG 83 HH11 ARG 83 17.221 36.005 19.821 603 HH12 ARG 83 HH12 ARG 83 18.856 35.958 20.359 604 HH21 ARG 83 HH21 ARG 83 19.441 32.798 19.137 605 HH22 ARG 83 HH22 ARG 83 20.119 34.135 20.025 606 H ASN 84 H ASN 84 17.426 32.775 14.767 607 HA ASN 84 HA ASN 84 16.982 30.259 13.383 608 HB2 ASN 84 HB2 ASN 84 18.063 30.998 11.243 609 HB3 ASN 84 HB3 ASN 84 16.522 31.809 11.528 610 HD21 ASN 84 HD21 ASN 84 17.982 33.284 9.868 611 HD22 ASN 84 HD22 ASN 84 18.787 34.558 10.647 612 H SER 85 H SER 85 19.732 31.013 11.994 613 HA SER 85 HA SER 85 21.361 30.462 14.443 614 HB2 SER 85 HB2 SER 85 22.771 29.087 13.129 615 HB3 SER 85 HB3 SER 85 21.138 28.693 12.589 616 HG SER 85 HG SER 85 23.212 29.750 11.199 617 H ASP 86 H ASP 86 20.731 32.719 12.029 618 HA ASP 86 HA ASP 86 23.364 33.868 11.701 619 HB2 ASP 86 HB2 ASP 86 20.544 34.720 11.092 620 HB3 ASP 86 HB3 ASP 86 21.866 35.871 10.923 621 H ARG 87 H ARG 87 24.406 34.677 13.506 622 HA ARG 87 HA ARG 87 22.853 36.715 15.070 623 HB2 ARG 87 HB2 ARG 87 24.584 34.502 16.216 624 HB3 ARG 87 HB3 ARG 87 23.958 35.856 17.160 625 HG2 ARG 87 HG2 ARG 87 22.071 34.308 15.478 626 HG3 ARG 87 HG3 ARG 87 22.596 33.563 16.983 627 HD2 ARG 87 HD2 ARG 87 21.560 35.152 18.305 628 HD3 ARG 87 HD3 ARG 87 21.754 36.416 17.105 629 HE ARG 87 HE ARG 87 19.353 35.833 17.303 630 HH11 ARG 87 HH11 ARG 87 21.000 33.277 15.707 631 HH12 ARG 87 HH12 ARG 87 20.005 33.355 14.295 632 HH21 ARG 87 HH21 ARG 87 17.979 35.826 15.546 633 HH22 ARG 87 HH22 ARG 87 18.299 34.726 14.227 634 H ILE 88 H ILE 88 24.020 38.555 15.639 635 HA ILE 88 HA ILE 88 26.855 38.641 14.689 636 HB ILE 88 HB ILE 88 25.152 40.167 13.549 637 HG12 ILE 88 HG12 ILE 88 27.370 41.618 15.054 638 HG13 ILE 88 HG13 ILE 88 27.644 40.634 13.615 639 HG21 ILE 88 HG21 ILE 88 25.328 41.899 15.980 640 HG22 ILE 88 HG22 ILE 88 24.156 40.581 15.968 641 HG23 ILE 88 HG23 ILE 88 24.083 41.839 14.734 642 HD11 ILE 88 HD11 ILE 88 26.973 43.351 13.654 643 HD12 ILE 88 HD12 ILE 88 25.470 42.540 13.214 644 HD13 ILE 88 HD13 ILE 88 26.921 42.287 12.248 645 H LEU 89 H LEU 89 28.404 39.638 15.982 646 HA LEU 89 HA LEU 89 27.579 40.193 18.801 647 HB2 LEU 89 HB2 LEU 89 29.542 38.310 17.685 648 HB3 LEU 89 HB3 LEU 89 30.238 39.370 18.905 649 HG LEU 89 HG LEU 89 29.319 37.243 19.860 650 HD11 LEU 89 HD11 LEU 89 27.507 39.338 20.921 651 HD12 LEU 89 HD12 LEU 89 29.223 39.727 20.906 652 HD13 LEU 89 HD13 LEU 89 28.652 38.300 21.773 653 HD21 LEU 89 HD21 LEU 89 27.376 37.189 18.194 654 HD22 LEU 89 HD22 LEU 89 26.601 38.396 19.226 655 HD23 LEU 89 HD23 LEU 89 26.982 36.797 19.864 656 H TYR 90 H TYR 90 28.193 42.199 19.511 657 HA TYR 90 HA TYR 90 30.481 43.569 18.100 658 HB2 TYR 90 HB2 TYR 90 29.286 45.619 17.925 659 HB3 TYR 90 HB3 TYR 90 28.224 44.370 17.284 660 HD1 TYR 90 HD1 TYR 90 26.493 43.328 18.913 661 HD2 TYR 90 HD2 TYR 90 28.562 47.022 19.634 662 HE1 TYR 90 HE1 TYR 90 24.732 44.002 20.525 663 HE2 TYR 90 HE2 TYR 90 26.805 47.691 21.244 664 HH TYR 90 HH TYR 90 24.166 45.498 22.106 665 H SER 91 H SER 91 31.819 44.751 19.409 666 HA SER 91 HA SER 91 31.398 44.423 22.356 667 HB2 SER 91 HB2 SER 91 33.856 44.795 22.465 668 HB3 SER 91 HB3 SER 91 33.427 43.445 21.416 669 HG SER 91 HG SER 91 34.865 45.523 20.752 670 H SER 92 H SER 92 32.765 46.127 23.611 671 HA SER 92 HA SER 92 31.547 48.676 23.562 672 HB2 SER 92 HB2 SER 92 34.124 49.149 24.517 673 HB3 SER 92 HB3 SER 92 32.748 48.661 25.499 674 HG SER 92 HG SER 92 34.769 47.052 24.295 675 H ASP 93 H ASP 93 34.666 47.719 22.366 676 HA ASP 93 HA ASP 93 35.383 50.183 21.104 677 HB2 ASP 93 HB2 ASP 93 36.937 48.346 19.876 678 HB3 ASP 93 HB3 ASP 93 37.236 48.875 21.534 679 H TRP 94 H TRP 94 32.905 48.232 20.307 680 HA TRP 94 HA TRP 94 31.556 48.116 18.425 681 HB2 TRP 94 HB2 TRP 94 33.600 49.998 17.204 682 HB3 TRP 94 HB3 TRP 94 32.020 49.617 16.523 683 HD1 TRP 94 HD1 TRP 94 33.566 52.166 18.557 684 HE1 TRP 94 HE1 TRP 94 31.835 53.410 20.009 685 HE3 TRP 94 HE3 TRP 94 29.602 48.974 18.161 686 HZ2 TRP 94 HZ2 TRP 94 29.136 53.107 20.875 687 HZ3 TRP 94 HZ3 TRP 94 27.466 49.476 19.307 688 HH2 TRP 94 HH2 TRP 94 27.223 51.539 20.661 689 H LEU 95 H LEU 95 34.300 46.482 18.757 690 HA LEU 95 HA LEU 95 34.894 45.641 16.051 691 HB2 LEU 95 HB2 LEU 95 35.388 44.428 18.780 692 HB3 LEU 95 HB3 LEU 95 35.837 43.583 17.298 693 HG LEU 95 HG LEU 95 36.787 46.336 18.149 694 HD11 LEU 95 HD11 LEU 95 38.388 43.809 17.676 695 HD12 LEU 95 HD12 LEU 95 37.766 44.255 19.264 696 HD13 LEU 95 HD13 LEU 95 38.929 45.300 18.444 697 HD21 LEU 95 HD21 LEU 95 38.339 45.705 16.045 698 HD22 LEU 95 HD22 LEU 95 36.817 46.571 15.852 699 HD23 LEU 95 HD23 LEU 95 36.883 44.831 15.566 700 H ILE 96 H ILE 96 33.607 44.386 14.787 701 HA ILE 96 HA ILE 96 31.384 42.939 16.132 702 HB ILE 96 HB ILE 96 31.463 43.855 13.260 703 HG12 ILE 96 HG12 ILE 96 29.622 45.332 14.905 704 HG13 ILE 96 HG13 ILE 96 31.228 45.430 15.629 705 HG21 ILE 96 HG21 ILE 96 29.908 41.989 13.962 706 HG22 ILE 96 HG22 ILE 96 29.095 43.414 13.320 707 HG23 ILE 96 HG23 ILE 96 29.145 43.132 15.057 708 HD11 ILE 96 HD11 ILE 96 31.164 45.756 12.691 709 HD12 ILE 96 HD12 ILE 96 32.071 46.656 13.903 710 HD13 ILE 96 HD13 ILE 96 30.376 47.038 13.600 711 H TYR 97 H TYR 97 31.100 40.875 15.916 712 HA TYR 97 HA TYR 97 32.671 39.368 13.853 713 HB2 TYR 97 HB2 TYR 97 32.254 38.750 16.785 714 HB3 TYR 97 HB3 TYR 97 32.696 37.490 15.629 715 HD1 TYR 97 HD1 TYR 97 33.689 40.991 16.535 716 HD2 TYR 97 HD2 TYR 97 34.992 37.076 15.309 717 HE1 TYR 97 HE1 TYR 97 36.041 41.749 16.620 718 HE2 TYR 97 HE2 TYR 97 37.354 37.842 15.419 719 HH TYR 97 HH TYR 97 38.703 39.524 16.300 720 H LYS 98 H LYS 98 31.596 37.340 13.164 721 HA LYS 98 HA LYS 98 28.624 37.481 13.661 722 HB2 LYS 98 HB2 LYS 98 28.210 37.330 11.381 723 HB3 LYS 98 HB3 LYS 98 29.642 38.351 11.431 724 HG2 LYS 98 HG2 LYS 98 31.090 36.420 10.982 725 HG3 LYS 98 HG3 LYS 98 29.693 35.341 10.987 726 HD2 LYS 98 HD2 LYS 98 30.426 37.454 8.962 727 HD3 LYS 98 HD3 LYS 98 30.068 35.751 8.696 728 HE2 LYS 98 HE2 LYS 98 28.110 37.963 9.385 729 HE3 LYS 98 HE3 LYS 98 28.137 36.950 7.943 730 HZ1 LYS 98 HZ1 LYS 98 27.352 35.139 9.091 731 HZ2 LYS 98 HZ2 LYS 98 26.532 36.409 9.851 732 HZ3 LYS 98 HZ3 LYS 98 27.886 35.713 10.599 733 H THR 99 H THR 99 27.519 35.572 13.911 734 HA THR 99 HA THR 99 28.977 33.024 13.396 735 HB THR 99 HB THR 99 29.229 33.033 15.718 736 HG1 THR 99 HG1 THR 99 28.145 31.175 15.360 737 HG21 THR 99 HG21 THR 99 27.400 33.851 17.256 738 HG22 THR 99 HG22 THR 99 26.566 34.451 15.824 739 HG23 THR 99 HG23 THR 99 28.149 35.098 16.256 740 H THR 100 H THR 100 27.744 31.644 12.316 741 HA THR 100 HA THR 100 24.821 32.220 11.885 742 HB THR 100 HB THR 100 25.336 30.879 9.707 743 HG1 THR 100 HG1 THR 100 27.575 30.547 10.739 744 HG21 THR 100 HG21 THR 100 26.777 33.404 9.424 745 HG22 THR 100 HG22 THR 100 25.287 33.590 10.349 746 HG23 THR 100 HG23 THR 100 25.236 32.912 8.723 747 H ASP 101 H ASP 101 26.668 30.277 13.678 748 HA ASP 101 HA ASP 101 25.002 27.848 13.037 749 HB2 ASP 101 HB2 ASP 101 27.015 26.894 14.597 750 HB3 ASP 101 HB3 ASP 101 27.103 26.978 12.837 751 H ALA 102 H ALA 102 24.154 30.118 14.687 752 HA ALA 102 HA ALA 102 23.007 30.454 16.689 753 HB1 ALA 102 HB1 ALA 102 23.333 27.579 17.452 754 HB2 ALA 102 HB2 ALA 102 22.398 27.959 16.006 755 HB3 ALA 102 HB3 ALA 102 21.913 28.619 17.566 756 H TYR 103 H TYR 103 25.253 31.469 17.153 757 HA TYR 103 HA TYR 103 26.859 31.988 18.757 758 HB2 TYR 103 HB2 TYR 103 25.331 30.036 20.509 759 HB3 TYR 103 HB3 TYR 103 26.417 31.310 21.048 760 HD1 TYR 103 HD1 TYR 103 25.590 33.604 19.363 761 HD2 TYR 103 HD2 TYR 103 23.222 30.619 21.340 762 HE1 TYR 103 HE1 TYR 103 23.696 35.201 19.520 763 HE2 TYR 103 HE2 TYR 103 21.332 32.212 21.484 764 HH TYR 103 HH TYR 103 21.719 35.600 20.559 765 H GLN 104 H GLN 104 27.608 29.964 16.903 766 HA GLN 104 HA GLN 104 29.202 28.103 18.668 767 HB2 GLN 104 HB2 GLN 104 28.131 27.690 15.872 768 HB3 GLN 104 HB3 GLN 104 29.332 26.638 16.601 769 HG2 GLN 104 HG2 GLN 104 26.839 27.205 18.160 770 HG3 GLN 104 HG3 GLN 104 26.710 26.120 16.779 771 HE21 GLN 104 HE21 GLN 104 26.390 25.249 19.529 772 HE22 GLN 104 HE22 GLN 104 27.647 24.159 19.863 773 H THR 105 H THR 105 29.596 29.054 15.204 774 HA THR 105 HA THR 105 32.468 29.605 15.854 775 HB THR 105 HB THR 105 32.907 29.468 13.511 776 HG1 THR 105 HG1 THR 105 30.144 29.206 12.963 777 HG21 THR 105 HG21 THR 105 31.399 27.296 12.994 778 HG22 THR 105 HG22 THR 105 31.102 27.433 14.728 779 HG23 THR 105 HG23 THR 105 32.752 27.258 14.126 780 H PHE 106 H PHE 106 33.117 31.651 16.208 781 HA PHE 106 HA PHE 106 31.426 33.910 15.275 782 HB2 PHE 106 HB2 PHE 106 33.677 33.868 17.302 783 HB3 PHE 106 HB3 PHE 106 32.668 35.260 16.915 784 HD1 PHE 106 HD1 PHE 106 32.275 31.649 17.855 785 HD2 PHE 106 HD2 PHE 106 30.860 35.684 18.293 786 HE1 PHE 106 HE1 PHE 106 30.599 30.880 19.515 787 HE2 PHE 106 HE2 PHE 106 29.192 34.919 19.954 788 HZ PHE 106 HZ PHE 106 29.058 32.515 20.564 789 H THR 107 H THR 107 32.242 33.899 13.069 790 HA THR 107 HA THR 107 35.094 34.380 12.672 791 HB THR 107 HB THR 107 32.736 34.383 10.756 792 HG1 THR 107 HG1 THR 107 33.682 32.392 11.478 793 HG21 THR 107 HG21 THR 107 35.642 35.019 10.168 794 HG22 THR 107 HG22 THR 107 34.284 36.135 10.027 795 HG23 THR 107 HG23 THR 107 34.392 34.745 8.952 796 H LYS 108 H LYS 108 36.025 36.336 12.100 797 HA LYS 108 HA LYS 108 34.749 38.699 13.233 798 HB2 LYS 108 HB2 LYS 108 37.195 38.308 13.404 799 HB3 LYS 108 HB3 LYS 108 37.328 38.457 11.654 800 HG2 LYS 108 HG2 LYS 108 36.475 40.761 11.752 801 HG3 LYS 108 HG3 LYS 108 36.256 40.626 13.496 802 HD2 LYS 108 HD2 LYS 108 38.637 40.440 13.853 803 HD3 LYS 108 HD3 LYS 108 38.940 40.287 12.123 804 HE2 LYS 108 HE2 LYS 108 39.461 42.554 12.652 805 HE3 LYS 108 HE3 LYS 108 37.885 42.613 11.878 806 HZ1 LYS 108 HZ1 LYS 108 36.832 43.177 13.799 807 HZ2 LYS 108 HZ2 LYS 108 38.379 43.793 14.191 808 HZ3 LYS 108 HZ3 LYS 108 37.903 42.268 14.779 809 H ILE 109 H ILE 109 34.058 40.534 12.128 810 HA ILE 109 HA ILE 109 33.975 40.348 9.148 811 HB ILE 109 HB ILE 109 31.735 41.459 9.239 812 HG12 ILE 109 HG12 ILE 109 31.751 40.748 12.183 813 HG13 ILE 109 HG13 ILE 109 32.151 42.368 11.606 814 HG21 ILE 109 HG21 ILE 109 32.241 38.858 9.297 815 HG22 ILE 109 HG22 ILE 109 30.588 39.449 9.472 816 HG23 ILE 109 HG23 ILE 109 31.508 38.970 10.901 817 HD11 ILE 109 HD11 ILE 109 29.992 42.863 11.197 818 HD12 ILE 109 HD12 ILE 109 29.603 41.433 12.154 819 HD13 ILE 109 HD13 ILE 109 29.703 41.318 10.403 820 H ARG 110 H ARG 110 34.213 42.351 12.031 821 HA ARG 110 HA ARG 110 35.444 44.518 10.420 822 HB2 ARG 110 HB2 ARG 110 33.246 44.960 12.473 823 HB3 ARG 110 HB3 ARG 110 34.156 46.235 11.664 824 HG2 ARG 110 HG2 ARG 110 33.061 44.362 9.740 825 HG3 ARG 110 HG3 ARG 110 31.786 45.019 10.751 826 HD2 ARG 110 HD2 ARG 110 32.761 47.316 10.286 827 HD3 ARG 110 HD3 ARG 110 33.797 46.564 9.081 828 HE ARG 110 HE ARG 110 31.086 47.370 8.677 829 HH11 ARG 110 HH11 ARG 110 33.014 44.528 8.166 830 HH12 ARG 110 HH12 ARG 110 31.972 43.939 6.916 831 HH21 ARG 110 HH21 ARG 110 29.823 46.609 7.044 832 HH22 ARG 110 HH22 ARG 110 30.221 45.088 6.263 Start of MODEL 9 1 H VAL 3 H VAL 3 16.398 49.235 12.483 2 HA VAL 3 HA VAL 3 14.281 48.045 11.741 3 HB VAL 3 HB VAL 3 14.405 50.058 9.493 4 HG11 VAL 3 HG11 VAL 3 13.256 48.038 8.929 5 HG12 VAL 3 HG12 VAL 3 11.995 49.215 9.297 6 HG13 VAL 3 HG13 VAL 3 12.429 47.988 10.488 7 HG21 VAL 3 HG21 VAL 3 13.084 50.305 12.172 8 HG22 VAL 3 HG22 VAL 3 12.168 50.828 10.759 9 HG23 VAL 3 HG23 VAL 3 13.728 51.567 11.120 10 H ILE 4 H ILE 4 16.867 47.386 11.871 11 HA ILE 4 HA ILE 4 17.556 46.529 9.089 12 HB ILE 4 HB ILE 4 19.370 47.837 11.132 13 HG12 ILE 4 HG12 ILE 4 19.491 48.515 8.248 14 HG13 ILE 4 HG13 ILE 4 17.980 48.940 9.053 15 HG21 ILE 4 HG21 ILE 4 21.143 47.282 9.293 16 HG22 ILE 4 HG22 ILE 4 20.019 46.005 8.835 17 HG23 ILE 4 HG23 ILE 4 20.705 46.037 10.460 18 HD11 ILE 4 HD11 ILE 4 19.128 50.264 10.696 19 HD12 ILE 4 HD12 ILE 4 19.779 50.732 9.125 20 HD13 ILE 4 HD13 ILE 4 20.699 49.653 10.176 21 H ASN 5 H ASN 5 18.641 44.477 9.024 22 HA ASN 5 HA ASN 5 19.154 43.106 11.588 23 HB2 ASN 5 HB2 ASN 5 17.742 41.178 10.946 24 HB3 ASN 5 HB3 ASN 5 16.780 42.649 11.129 25 HD21 ASN 5 HD21 ASN 5 15.585 40.774 9.545 26 HD22 ASN 5 HD22 ASN 5 15.719 41.185 7.904 27 H THR 6 H THR 6 20.881 43.997 9.416 28 HA THR 6 HA THR 6 21.742 41.312 8.383 29 HB THR 6 HB THR 6 22.579 42.353 6.388 30 HG1 THR 6 HG1 THR 6 22.244 44.692 6.195 31 HG21 THR 6 HG21 THR 6 20.568 42.914 5.363 32 HG22 THR 6 HG22 THR 6 20.004 43.846 6.750 33 HG23 THR 6 HG23 THR 6 19.986 42.084 6.808 34 H PHE 7 H PHE 7 23.859 40.738 8.635 35 HA PHE 7 HA PHE 7 25.412 41.551 10.743 36 HB2 PHE 7 HB2 PHE 7 26.387 40.595 8.024 37 HB3 PHE 7 HB3 PHE 7 27.405 40.681 9.473 38 HD1 PHE 7 HD1 PHE 7 26.459 39.564 11.620 39 HD2 PHE 7 HD2 PHE 7 25.111 38.649 7.634 40 HE1 PHE 7 HE1 PHE 7 25.494 37.431 12.436 41 HE2 PHE 7 HE2 PHE 7 24.147 36.508 8.454 42 HZ PHE 7 HZ PHE 7 24.333 35.902 10.854 43 H ASP 8 H ASP 8 26.718 42.424 7.579 44 HA ASP 8 HA ASP 8 28.309 44.541 8.420 45 HB2 ASP 8 HB2 ASP 8 26.859 44.150 5.793 46 HB3 ASP 8 HB3 ASP 8 28.167 45.315 6.042 47 H GLY 9 H GLY 9 24.926 44.787 7.267 48 HA2 GLY 9 HA2 GLY 9 24.630 47.575 7.367 49 HA3 GLY 9 HA3 GLY 9 23.324 46.447 7.718 50 H VAL 10 H VAL 10 24.023 45.254 10.043 51 HA VAL 10 HA VAL 10 23.459 47.247 12.035 52 HB VAL 10 HB VAL 10 24.520 44.409 12.254 53 HG11 VAL 10 HG11 VAL 10 25.128 45.196 14.339 54 HG12 VAL 10 HG12 VAL 10 23.430 44.860 14.672 55 HG13 VAL 10 HG13 VAL 10 23.948 46.508 14.311 56 HG21 VAL 10 HG21 VAL 10 21.786 45.708 12.411 57 HG22 VAL 10 HG22 VAL 10 22.089 44.128 13.130 58 HG23 VAL 10 HG23 VAL 10 22.300 44.362 11.394 59 H ALA 11 H ALA 11 26.455 45.534 11.166 60 HA ALA 11 HA ALA 11 28.185 46.581 13.160 61 HB1 ALA 11 HB1 ALA 11 29.772 46.268 10.922 62 HB2 ALA 11 HB2 ALA 11 28.392 45.246 10.556 63 HB3 ALA 11 HB3 ALA 11 29.320 44.973 12.027 64 H ASP 12 H ASP 12 27.718 47.699 9.779 65 HA ASP 12 HA ASP 12 29.287 50.063 9.952 66 HB2 ASP 12 HB2 ASP 12 27.104 49.047 8.194 67 HB3 ASP 12 HB3 ASP 12 27.424 50.782 8.146 68 H TYR 13 H TYR 13 25.827 49.504 10.560 69 HA TYR 13 HA TYR 13 25.074 52.177 11.166 70 HB2 TYR 13 HB2 TYR 13 23.657 49.979 10.988 71 HB3 TYR 13 HB3 TYR 13 24.018 49.815 12.701 72 HD1 TYR 13 HD1 TYR 13 22.409 51.957 10.152 73 HD2 TYR 13 HD2 TYR 13 23.020 51.253 14.343 74 HE1 TYR 13 HE1 TYR 13 20.600 53.568 10.687 75 HE2 TYR 13 HE2 TYR 13 21.211 52.856 14.878 76 HH TYR 13 HH TYR 13 18.930 53.744 13.125 77 H LEU 14 H LEU 14 26.271 49.573 13.251 78 HA LEU 14 HA LEU 14 26.371 51.184 15.634 79 HB2 LEU 14 HB2 LEU 14 27.565 48.534 14.846 80 HB3 LEU 14 HB3 LEU 14 27.952 49.280 16.397 81 HG LEU 14 HG LEU 14 25.115 48.745 15.432 82 HD11 LEU 14 HD11 LEU 14 26.501 46.658 15.867 83 HD12 LEU 14 HD12 LEU 14 25.083 46.832 16.897 84 HD13 LEU 14 HD13 LEU 14 26.680 47.215 17.537 85 HD21 LEU 14 HD21 LEU 14 26.260 50.280 17.598 86 HD22 LEU 14 HD22 LEU 14 25.313 48.939 18.244 87 HD23 LEU 14 HD23 LEU 14 24.568 50.100 17.147 88 H GLN 15 H GLN 15 28.920 50.230 13.259 89 HA GLN 15 HA GLN 15 30.963 51.654 14.678 90 HB2 GLN 15 HB2 GLN 15 30.797 50.919 11.756 91 HB3 GLN 15 HB3 GLN 15 32.241 51.559 12.543 92 HG2 GLN 15 HG2 GLN 15 31.693 49.589 14.276 93 HG3 GLN 15 HG3 GLN 15 30.951 48.887 12.842 94 HE21 GLN 15 HE21 GLN 15 33.318 47.832 14.129 95 HE22 GLN 15 HE22 GLN 15 34.598 47.963 13.020 96 H THR 16 H THR 16 28.462 52.829 12.543 97 HA THR 16 HA THR 16 29.887 55.425 12.277 98 HB THR 16 HB THR 16 27.195 54.733 11.081 99 HG1 THR 16 HG1 THR 16 28.725 53.201 10.392 100 HG21 THR 16 HG21 THR 16 27.656 57.065 10.983 101 HG22 THR 16 HG22 THR 16 28.061 56.426 9.393 102 HG23 THR 16 HG23 THR 16 29.346 56.781 10.545 103 H TYR 17 H TYR 17 26.766 54.180 13.535 104 HA TYR 17 HA TYR 17 26.314 56.856 14.811 105 HB2 TYR 17 HB2 TYR 17 24.385 54.555 14.364 106 HB3 TYR 17 HB3 TYR 17 23.971 56.181 14.918 107 HD1 TYR 17 HD1 TYR 17 24.307 58.149 13.387 108 HD2 TYR 17 HD2 TYR 17 24.707 54.081 12.058 109 HE1 TYR 17 HE1 TYR 17 24.051 58.887 11.031 110 HE2 TYR 17 HE2 TYR 17 24.460 54.818 9.702 111 HH TYR 17 HH TYR 17 24.910 57.718 8.633 112 H HIS 18 H HIS 18 27.218 53.650 15.565 113 HA HIS 18 HA HIS 18 27.551 52.528 17.578 114 HB2 HIS 18 HB2 HIS 18 27.367 55.373 18.574 115 HB3 HIS 18 HB3 HIS 18 27.740 54.020 19.633 116 HD1 HIS 18 HD1 HIS 18 29.145 53.065 16.521 117 HD2 HIS 18 HD2 HIS 18 30.315 55.786 19.487 118 HE1 HIS 18 HE1 HIS 18 31.642 53.471 16.214 119 H LYS 19 H LYS 19 24.690 54.497 17.291 120 HA LYS 19 HA LYS 19 23.313 53.345 19.542 121 HB2 LYS 19 HB2 LYS 19 22.212 55.292 19.003 122 HB3 LYS 19 HB3 LYS 19 22.657 55.177 17.303 123 HG2 LYS 19 HG2 LYS 19 20.940 53.323 17.061 124 HG3 LYS 19 HG3 LYS 19 20.423 53.667 18.708 125 HD2 LYS 19 HD2 LYS 19 18.950 54.884 17.273 126 HD3 LYS 19 HD3 LYS 19 20.051 56.071 17.965 127 HE2 LYS 19 HE2 LYS 19 20.731 56.673 15.907 128 HE3 LYS 19 HE3 LYS 19 21.246 55.025 15.574 129 HZ1 LYS 19 HZ1 LYS 19 19.600 54.959 14.079 130 HZ2 LYS 19 HZ2 LYS 19 18.925 56.419 14.659 131 HZ3 LYS 19 HZ3 LYS 19 18.486 54.936 15.388 132 H LEU 20 H LEU 20 22.574 51.372 19.640 133 HA LEU 20 HA LEU 20 22.740 49.385 17.688 134 HB2 LEU 20 HB2 LEU 20 21.017 49.761 20.093 135 HB3 LEU 20 HB3 LEU 20 20.581 48.475 18.976 136 HG LEU 20 HG LEU 20 23.441 48.718 19.830 137 HD11 LEU 20 HD11 LEU 20 21.163 47.593 21.477 138 HD12 LEU 20 HD12 LEU 20 22.291 48.863 21.945 139 HD13 LEU 20 HD13 LEU 20 22.857 47.202 21.767 140 HD21 LEU 20 HD21 LEU 20 23.341 46.915 18.424 141 HD22 LEU 20 HD22 LEU 20 21.603 46.724 18.631 142 HD23 LEU 20 HD23 LEU 20 22.716 46.074 19.841 143 HA PRO 21 HA PRO 21 20.101 50.620 14.317 144 HB2 PRO 21 HB2 PRO 21 19.247 47.762 14.501 145 HB3 PRO 21 HB3 PRO 21 19.746 48.706 13.084 146 HG2 PRO 21 HG2 PRO 21 21.368 46.940 14.401 147 HG3 PRO 21 HG3 PRO 21 21.944 48.296 13.419 148 HD2 PRO 21 HD2 PRO 21 22.163 47.943 16.297 149 HD3 PRO 21 HD3 PRO 21 22.832 49.249 15.293 150 H ASP 22 H ASP 22 18.113 51.501 14.314 151 HA ASP 22 HA ASP 22 16.365 51.400 16.563 152 HB2 ASP 22 HB2 ASP 22 15.403 52.244 13.847 153 HB3 ASP 22 HB3 ASP 22 15.141 53.014 15.416 154 H ASN 23 H ASN 23 16.218 48.992 16.655 155 HA ASN 23 HA ASN 23 13.664 48.013 15.992 156 HB2 ASN 23 HB2 ASN 23 14.270 46.396 14.145 157 HB3 ASN 23 HB3 ASN 23 14.248 48.089 13.660 158 HD21 ASN 23 HD21 ASN 23 16.423 45.414 14.527 159 HD22 ASN 23 HD22 ASN 23 17.800 46.077 13.786 160 H TYR 24 H TYR 24 16.200 47.843 17.796 161 HA TYR 24 HA TYR 24 16.207 44.868 18.127 162 HB2 TYR 24 HB2 TYR 24 18.314 46.967 18.441 163 HB3 TYR 24 HB3 TYR 24 18.390 45.554 19.497 164 HD1 TYR 24 HD1 TYR 24 18.157 43.235 18.363 165 HD2 TYR 24 HD2 TYR 24 19.122 46.837 16.250 166 HE1 TYR 24 HE1 TYR 24 19.045 41.887 16.480 167 HE2 TYR 24 HE2 TYR 24 20.018 45.490 14.365 168 HH TYR 24 HH TYR 24 19.944 41.908 14.465 169 H ILE 25 H ILE 25 16.514 44.132 20.424 170 HA ILE 25 HA ILE 25 15.722 46.002 22.554 171 HB ILE 25 HB ILE 25 13.846 44.047 23.067 172 HG12 ILE 25 HG12 ILE 25 13.555 44.606 20.114 173 HG13 ILE 25 HG13 ILE 25 14.453 43.200 20.681 174 HG21 ILE 25 HG21 ILE 25 12.208 45.748 22.058 175 HG22 ILE 25 HG22 ILE 25 13.632 46.681 21.585 176 HG23 ILE 25 HG23 ILE 25 13.313 46.364 23.286 177 HD11 ILE 25 HD11 ILE 25 11.560 43.874 21.282 178 HD12 ILE 25 HD12 ILE 25 12.451 42.568 22.066 179 HD13 ILE 25 HD13 ILE 25 12.162 42.517 20.327 180 H THR 26 H THR 26 16.155 45.117 24.651 181 HA THR 26 HA THR 26 18.237 43.080 24.689 182 HB THR 26 HB THR 26 18.034 43.270 27.152 183 HG1 THR 26 HG1 THR 26 15.853 44.979 26.537 184 HG21 THR 26 HG21 THR 26 17.930 45.991 27.071 185 HG22 THR 26 HG22 THR 26 18.232 45.632 25.376 186 HG23 THR 26 HG23 THR 26 19.351 45.056 26.613 187 H LYS 27 H LYS 27 18.096 40.961 25.669 188 HA LYS 27 HA LYS 27 15.844 39.365 25.004 189 HB2 LYS 27 HB2 LYS 27 18.335 39.054 26.480 190 HB3 LYS 27 HB3 LYS 27 17.035 38.205 27.310 191 HG2 LYS 27 HG2 LYS 27 17.156 36.546 25.796 192 HG3 LYS 27 HG3 LYS 27 16.744 37.683 24.513 193 HD2 LYS 27 HD2 LYS 27 19.553 37.714 25.523 194 HD3 LYS 27 HD3 LYS 27 19.080 36.339 24.533 195 HE2 LYS 27 HE2 LYS 27 18.554 37.711 22.671 196 HE3 LYS 27 HE3 LYS 27 18.517 39.177 23.659 197 HZ1 LYS 27 HZ1 LYS 27 20.640 38.455 22.195 198 HZ2 LYS 27 HZ2 LYS 27 21.013 37.675 23.676 199 HZ3 LYS 27 HZ3 LYS 27 20.758 39.368 23.646 200 H SER 28 H SER 28 16.754 40.813 28.156 201 HA SER 28 HA SER 28 14.551 40.094 29.744 202 HB2 SER 28 HB2 SER 28 16.310 41.357 30.756 203 HB3 SER 28 HB3 SER 28 16.111 42.691 29.622 204 HG SER 28 HG SER 28 14.379 43.360 30.694 205 H GLU 29 H GLU 29 14.733 43.211 27.931 206 HA GLU 29 HA GLU 29 12.093 44.048 28.229 207 HB2 GLU 29 HB2 GLU 29 13.967 44.264 25.864 208 HB3 GLU 29 HB3 GLU 29 12.414 45.098 25.928 209 HG2 GLU 29 HG2 GLU 29 13.098 46.451 27.725 210 HG3 GLU 29 HG3 GLU 29 14.462 45.424 28.152 211 H ALA 30 H ALA 30 13.374 42.151 25.453 212 HA ALA 30 HA ALA 30 10.916 41.597 24.179 213 HB1 ALA 30 HB1 ALA 30 13.562 40.838 23.859 214 HB2 ALA 30 HB2 ALA 30 12.222 40.315 22.839 215 HB3 ALA 30 HB3 ALA 30 12.748 39.311 24.191 216 H GLN 31 H GLN 31 12.587 39.650 26.667 217 HA GLN 31 HA GLN 31 10.565 37.636 26.896 218 HB2 GLN 31 HB2 GLN 31 12.634 38.637 28.878 219 HB3 GLN 31 HB3 GLN 31 11.653 37.188 29.122 220 HG2 GLN 31 HG2 GLN 31 12.612 36.103 27.212 221 HG3 GLN 31 HG3 GLN 31 13.363 37.597 26.657 222 HE21 GLN 31 HE21 GLN 31 13.726 34.871 28.808 223 HE22 GLN 31 HE22 GLN 31 15.244 35.310 29.423 224 H ALA 32 H ALA 32 11.158 40.572 28.892 225 HA ALA 32 HA ALA 32 8.828 40.140 30.538 226 HB1 ALA 32 HB1 ALA 32 10.294 41.578 31.578 227 HB2 ALA 32 HB2 ALA 32 9.217 42.766 30.847 228 HB3 ALA 32 HB3 ALA 32 10.750 42.369 30.069 229 H LEU 33 H LEU 33 9.286 41.756 27.438 230 HA LEU 33 HA LEU 33 6.783 43.172 27.448 231 HB2 LEU 33 HB2 LEU 33 8.780 42.367 25.377 232 HB3 LEU 33 HB3 LEU 33 7.169 42.817 24.821 233 HG LEU 33 HG LEU 33 8.473 44.624 26.811 234 HD11 LEU 33 HD11 LEU 33 10.306 44.959 25.541 235 HD12 LEU 33 HD12 LEU 33 9.243 45.607 24.294 236 HD13 LEU 33 HD13 LEU 33 9.692 43.904 24.270 237 HD21 LEU 33 HD21 LEU 33 6.132 44.742 25.537 238 HD22 LEU 33 HD22 LEU 33 7.123 45.461 24.268 239 HD23 LEU 33 HD23 LEU 33 7.059 46.205 25.866 240 H GLY 34 H GLY 34 7.612 39.861 27.070 241 HA2 GLY 34 HA2 GLY 34 5.472 38.442 27.414 242 HA3 GLY 34 HA3 GLY 34 4.877 39.274 25.984 243 H TRP 35 H TRP 35 8.125 38.873 25.421 244 HA TRP 35 HA TRP 35 7.731 36.884 23.401 245 HB2 TRP 35 HB2 TRP 35 9.625 38.503 23.440 246 HB3 TRP 35 HB3 TRP 35 10.298 37.658 24.831 247 HD1 TRP 35 HD1 TRP 35 8.812 36.177 21.582 248 HE1 TRP 35 HE1 TRP 35 10.585 34.627 20.539 249 HE3 TRP 35 HE3 TRP 35 12.674 36.933 24.835 250 HZ2 TRP 35 HZ2 TRP 35 13.287 33.805 21.022 251 HZ3 TRP 35 HZ3 TRP 35 14.833 35.748 24.536 252 HH2 TRP 35 HH2 TRP 35 15.142 34.182 22.631 253 H VAL 36 H VAL 36 7.194 34.756 23.816 254 HA VAL 36 HA VAL 36 8.517 33.394 26.192 255 HB VAL 36 HB VAL 36 5.696 33.166 25.102 256 HG11 VAL 36 HG11 VAL 36 6.587 30.884 25.431 257 HG12 VAL 36 HG12 VAL 36 5.395 31.270 26.667 258 HG13 VAL 36 HG13 VAL 36 7.115 31.322 27.056 259 HG21 VAL 36 HG21 VAL 36 6.929 33.809 27.794 260 HG22 VAL 36 HG22 VAL 36 5.210 33.486 27.576 261 HG23 VAL 36 HG23 VAL 36 5.952 34.874 26.782 262 H ALA 37 H ALA 37 9.419 31.402 25.799 263 HA ALA 37 HA ALA 37 10.209 30.643 23.183 264 HB1 ALA 37 HB1 ALA 37 10.787 28.421 24.336 265 HB2 ALA 37 HB2 ALA 37 10.144 29.144 25.811 266 HB3 ALA 37 HB3 ALA 37 11.538 29.870 25.007 267 H SER 38 H SER 38 7.696 29.204 25.297 268 HA SER 38 HA SER 38 6.834 27.374 23.196 269 HB2 SER 38 HB2 SER 38 5.223 26.593 24.771 270 HB3 SER 38 HB3 SER 38 6.620 27.051 25.748 271 HG SER 38 HG SER 38 4.318 28.638 25.205 272 H LYS 39 H LYS 39 6.846 29.875 22.101 273 HA LYS 39 HA LYS 39 4.152 30.163 21.116 274 HB2 LYS 39 HB2 LYS 39 3.927 31.299 23.331 275 HB3 LYS 39 HB3 LYS 39 5.200 32.425 22.851 276 HG2 LYS 39 HG2 LYS 39 3.881 33.358 21.120 277 HG3 LYS 39 HG3 LYS 39 2.739 32.014 21.150 278 HD2 LYS 39 HD2 LYS 39 2.673 32.984 23.763 279 HD3 LYS 39 HD3 LYS 39 2.780 34.445 22.780 280 HE2 LYS 39 HE2 LYS 39 0.450 33.980 22.976 281 HE3 LYS 39 HE3 LYS 39 0.900 33.447 21.352 282 HZ1 LYS 39 HZ1 LYS 39 0.788 31.665 23.731 283 HZ2 LYS 39 HZ2 LYS 39 1.061 31.196 22.124 284 HZ3 LYS 39 HZ3 LYS 39 -0.455 31.806 22.587 285 H GLY 40 H GLY 40 7.199 31.978 21.656 286 HA2 GLY 40 HA2 GLY 40 8.648 32.945 20.060 287 HA3 GLY 40 HA3 GLY 40 7.771 32.065 18.811 288 H ASN 41 H ASN 41 5.834 33.945 20.901 289 HA ASN 41 HA ASN 41 4.710 35.537 18.839 290 HB2 ASN 41 HB2 ASN 41 3.988 37.094 20.731 291 HB3 ASN 41 HB3 ASN 41 3.491 35.411 20.901 292 HD21 ASN 41 HD21 ASN 41 4.683 37.885 22.709 293 HD22 ASN 41 HD22 ASN 41 5.549 36.996 23.879 294 H LEU 42 H LEU 42 5.399 37.335 17.820 295 HA LEU 42 HA LEU 42 7.128 39.318 19.024 296 HB2 LEU 42 HB2 LEU 42 8.655 37.243 18.417 297 HB3 LEU 42 HB3 LEU 42 8.469 37.823 16.765 298 HG LEU 42 HG LEU 42 9.093 40.159 17.993 299 HD11 LEU 42 HD11 LEU 42 10.978 39.666 19.550 300 HD12 LEU 42 HD12 LEU 42 10.521 37.961 19.529 301 HD13 LEU 42 HD13 LEU 42 9.417 39.166 20.194 302 HD21 LEU 42 HD21 LEU 42 11.598 39.194 17.461 303 HD22 LEU 42 HD22 LEU 42 10.488 39.794 16.231 304 HD23 LEU 42 HD23 LEU 42 10.601 38.061 16.548 305 H ALA 43 H ALA 43 6.431 37.826 15.864 306 HA ALA 43 HA ALA 43 6.358 40.207 14.311 307 HB1 ALA 43 HB1 ALA 43 6.274 37.794 13.467 308 HB2 ALA 43 HB2 ALA 43 5.181 38.923 12.662 309 HB3 ALA 43 HB3 ALA 43 4.555 37.810 13.884 310 H ASP 44 H ASP 44 4.006 38.807 16.495 311 HA ASP 44 HA ASP 44 1.731 40.353 15.518 312 HB2 ASP 44 HB2 ASP 44 0.914 39.608 17.928 313 HB3 ASP 44 HB3 ASP 44 1.074 38.426 16.632 314 H VAL 45 H VAL 45 3.616 40.482 18.503 315 HA VAL 45 HA VAL 45 2.609 43.083 19.243 316 HB VAL 45 HB VAL 45 4.484 42.927 20.963 317 HG11 VAL 45 HG11 VAL 45 3.383 41.174 22.226 318 HG12 VAL 45 HG12 VAL 45 2.747 40.446 20.752 319 HG13 VAL 45 HG13 VAL 45 2.150 42.017 21.288 320 HG21 VAL 45 HG21 VAL 45 5.961 41.493 19.473 321 HG22 VAL 45 HG22 VAL 45 4.860 40.144 19.799 322 HG23 VAL 45 HG23 VAL 45 5.768 40.888 21.120 323 H ALA 46 H ALA 46 5.356 41.817 17.410 324 HA ALA 46 HA ALA 46 6.035 44.618 16.661 325 HB1 ALA 46 HB1 ALA 46 8.303 44.364 17.229 326 HB2 ALA 46 HB2 ALA 46 8.189 42.607 17.274 327 HB3 ALA 46 HB3 ALA 46 7.478 43.572 18.570 328 HA PRO 47 HA PRO 47 5.703 41.656 13.017 329 HB2 PRO 47 HB2 PRO 47 4.838 44.104 11.611 330 HB3 PRO 47 HB3 PRO 47 4.056 42.520 11.703 331 HG2 PRO 47 HG2 PRO 47 3.149 44.729 12.980 332 HG3 PRO 47 HG3 PRO 47 2.847 43.089 13.551 333 HD2 PRO 47 HD2 PRO 47 4.722 45.154 14.607 334 HD3 PRO 47 HD3 PRO 47 3.925 43.807 15.468 335 H GLY 48 H GLY 48 8.229 42.440 13.736 336 HA2 GLY 48 HA2 GLY 48 9.874 42.405 11.631 337 HA3 GLY 48 HA3 GLY 48 9.314 44.061 11.482 338 H LYS 49 H LYS 49 10.073 42.301 14.497 339 HA LYS 49 HA LYS 49 12.278 44.295 14.900 340 HB2 LYS 49 HB2 LYS 49 10.077 44.437 16.346 341 HB3 LYS 49 HB3 LYS 49 10.817 43.113 17.249 342 HG2 LYS 49 HG2 LYS 49 12.519 44.440 18.071 343 HG3 LYS 49 HG3 LYS 49 12.558 45.458 16.629 344 HD2 LYS 49 HD2 LYS 49 10.317 46.403 17.351 345 HD3 LYS 49 HD3 LYS 49 10.525 45.544 18.876 346 HE2 LYS 49 HE2 LYS 49 12.864 46.781 18.905 347 HE3 LYS 49 HE3 LYS 49 12.056 47.893 17.797 348 HZ1 LYS 49 HZ1 LYS 49 11.260 47.178 20.562 349 HZ2 LYS 49 HZ2 LYS 49 10.206 47.968 19.487 350 HZ3 LYS 49 HZ3 LYS 49 11.660 48.712 19.958 351 H SER 50 H SER 50 14.253 43.502 15.628 352 HA SER 50 HA SER 50 14.390 40.515 15.950 353 HB2 SER 50 HB2 SER 50 16.651 42.354 15.112 354 HB3 SER 50 HB3 SER 50 16.619 40.592 15.044 355 HG SER 50 HG SER 50 15.005 42.422 13.576 356 H ILE 51 H ILE 51 15.178 39.736 17.857 357 HA ILE 51 HA ILE 51 15.501 41.474 20.103 358 HB ILE 51 HB ILE 51 16.744 38.743 20.135 359 HG12 ILE 51 HG12 ILE 51 14.634 38.454 18.859 360 HG13 ILE 51 HG13 ILE 51 14.518 37.724 20.460 361 HG21 ILE 51 HG21 ILE 51 16.827 39.737 22.247 362 HG22 ILE 51 HG22 ILE 51 15.293 38.867 22.345 363 HG23 ILE 51 HG23 ILE 51 15.302 40.599 22.013 364 HD11 ILE 51 HD11 ILE 51 13.670 40.268 20.984 365 HD12 ILE 51 HD12 ILE 51 12.598 38.914 20.622 366 HD13 ILE 51 HD13 ILE 51 13.069 40.037 19.343 367 H GLY 52 H GLY 52 17.410 42.012 21.302 368 HA2 GLY 52 HA2 GLY 52 20.014 41.313 20.970 369 HA3 GLY 52 HA3 GLY 52 19.755 42.297 19.534 370 H GLY 53 H GLY 53 21.406 42.700 22.015 371 HA2 GLY 53 HA2 GLY 53 21.931 45.174 22.415 372 HA3 GLY 53 HA3 GLY 53 20.227 45.331 22.839 373 H ASP 54 H ASP 54 21.665 42.367 23.871 374 HA ASP 54 HA ASP 54 21.251 43.089 26.644 375 HB2 ASP 54 HB2 ASP 54 22.940 40.763 25.813 376 HB3 ASP 54 HB3 ASP 54 21.684 40.852 27.057 377 H ILE 55 H ILE 55 23.294 42.153 27.984 378 HA ILE 55 HA ILE 55 25.725 43.672 27.198 379 HB ILE 55 HB ILE 55 24.334 43.655 29.861 380 HG12 ILE 55 HG12 ILE 55 23.606 45.184 27.839 381 HG13 ILE 55 HG13 ILE 55 23.793 45.920 29.413 382 HG21 ILE 55 HG21 ILE 55 27.102 44.496 29.042 383 HG22 ILE 55 HG22 ILE 55 26.564 43.743 30.543 384 HG23 ILE 55 HG23 ILE 55 26.265 45.456 30.261 385 HD11 ILE 55 HD11 ILE 55 24.981 46.863 27.160 386 HD12 ILE 55 HD12 ILE 55 26.257 45.818 27.784 387 HD13 ILE 55 HD13 ILE 55 25.620 47.118 28.781 388 H PHE 56 H PHE 56 27.627 42.642 27.671 389 HA PHE 56 HA PHE 56 27.670 40.411 29.606 390 HB2 PHE 56 HB2 PHE 56 27.005 39.612 27.198 391 HB3 PHE 56 HB3 PHE 56 28.716 39.858 26.841 392 HD1 PHE 56 HD1 PHE 56 26.455 38.251 29.360 393 HD2 PHE 56 HD2 PHE 56 30.261 38.171 27.361 394 HE1 PHE 56 HE1 PHE 56 26.996 36.100 30.476 395 HE2 PHE 56 HE2 PHE 56 30.805 36.018 28.477 396 HZ PHE 56 HZ PHE 56 29.172 34.986 30.037 397 H SER 57 H SER 57 29.806 39.940 30.337 398 HA SER 57 HA SER 57 31.775 42.063 29.705 399 HB2 SER 57 HB2 SER 57 32.925 40.512 31.671 400 HB3 SER 57 HB3 SER 57 31.943 41.949 31.955 401 HG SER 57 HG SER 57 30.118 40.603 32.107 402 H ASN 58 H ASN 58 31.250 38.693 29.067 403 HA ASN 58 HA ASN 58 32.446 37.242 27.664 404 HB2 ASN 58 HB2 ASN 58 32.877 39.394 26.378 405 HB3 ASN 58 HB3 ASN 58 34.421 39.491 27.219 406 HD21 ASN 58 HD21 ASN 58 35.696 39.116 25.293 407 HD22 ASN 58 HD22 ASN 58 35.725 37.613 24.504 408 H ARG 59 H ARG 59 33.128 37.577 30.575 409 HA ARG 59 HA ARG 59 35.928 37.346 31.050 410 HB2 ARG 59 HB2 ARG 59 33.454 36.408 32.435 411 HB3 ARG 59 HB3 ARG 59 34.962 35.631 32.893 412 HG2 ARG 59 HG2 ARG 59 35.959 37.800 33.449 413 HG3 ARG 59 HG3 ARG 59 34.493 38.632 32.929 414 HD2 ARG 59 HD2 ARG 59 34.843 36.769 35.289 415 HD3 ARG 59 HD3 ARG 59 34.283 38.443 35.312 416 HE ARG 59 HE ARG 59 32.611 36.146 35.006 417 HH11 ARG 59 HH11 ARG 59 33.081 39.276 33.760 418 HH12 ARG 59 HH12 ARG 59 31.653 39.278 32.757 419 HH21 ARG 59 HH21 ARG 59 30.779 36.061 33.655 420 HH22 ARG 59 HH22 ARG 59 30.396 37.435 32.678 421 H GLU 60 H GLU 60 33.526 35.086 29.873 422 HA GLU 60 HA GLU 60 35.036 32.678 30.104 423 HB2 GLU 60 HB2 GLU 60 32.809 33.531 28.233 424 HB3 GLU 60 HB3 GLU 60 33.451 31.887 28.278 425 HG2 GLU 60 HG2 GLU 60 31.473 32.011 29.719 426 HG3 GLU 60 HG3 GLU 60 32.905 31.776 30.717 427 H GLY 61 H GLY 61 35.597 35.413 28.208 428 HA2 GLY 61 HA2 GLY 61 37.135 35.838 26.487 429 HA3 GLY 61 HA3 GLY 61 37.907 34.322 26.947 430 H LYS 62 H LYS 62 34.648 34.910 25.645 431 HA LYS 62 HA LYS 62 35.163 32.844 23.571 432 HB2 LYS 62 HB2 LYS 62 32.913 33.572 25.120 433 HB3 LYS 62 HB3 LYS 62 32.521 34.065 23.476 434 HG2 LYS 62 HG2 LYS 62 33.754 31.365 23.794 435 HG3 LYS 62 HG3 LYS 62 32.107 31.556 24.393 436 HD2 LYS 62 HD2 LYS 62 31.650 31.007 22.190 437 HD3 LYS 62 HD3 LYS 62 31.745 32.760 22.050 438 HE2 LYS 62 HE2 LYS 62 34.399 31.721 21.812 439 HE3 LYS 62 HE3 LYS 62 33.349 30.794 20.733 440 HZ1 LYS 62 HZ1 LYS 62 33.878 32.600 19.435 441 HZ2 LYS 62 HZ2 LYS 62 33.930 33.691 20.755 442 HZ3 LYS 62 HZ3 LYS 62 32.430 33.135 20.140 443 H LEU 63 H LEU 63 35.198 36.204 23.977 444 HA LEU 63 HA LEU 63 35.317 36.592 21.029 445 HB2 LEU 63 HB2 LEU 63 33.829 38.406 22.954 446 HB3 LEU 63 HB3 LEU 63 34.008 38.669 21.224 447 HG LEU 63 HG LEU 63 32.717 36.173 22.343 448 HD11 LEU 63 HD11 LEU 63 31.563 38.285 23.083 449 HD12 LEU 63 HD12 LEU 63 30.580 37.221 22.078 450 HD13 LEU 63 HD13 LEU 63 31.314 38.665 21.381 451 HD21 LEU 63 HD21 LEU 63 33.593 36.844 19.798 452 HD22 LEU 63 HD22 LEU 63 31.884 37.273 19.756 453 HD23 LEU 63 HD23 LEU 63 32.369 35.630 20.170 454 HA PRO 64 HA PRO 64 38.972 39.001 21.560 455 HB2 PRO 64 HB2 PRO 64 37.432 41.454 20.762 456 HB3 PRO 64 HB3 PRO 64 39.012 40.878 20.184 457 HG2 PRO 64 HG2 PRO 64 36.848 40.546 18.709 458 HG3 PRO 64 HG3 PRO 64 38.070 39.266 18.822 459 HD2 PRO 64 HD2 PRO 64 35.367 39.388 20.070 460 HD3 PRO 64 HD3 PRO 64 36.276 37.971 19.504 461 H GLY 65 H GLY 65 39.931 39.901 23.334 462 HA2 GLY 65 HA2 GLY 65 38.221 41.470 25.226 463 HA3 GLY 65 HA3 GLY 65 39.350 40.242 25.788 464 H LYS 66 H LYS 66 40.116 42.209 27.009 465 HA LYS 66 HA LYS 66 42.645 43.097 26.133 466 HB2 LYS 66 HB2 LYS 66 42.265 45.427 25.479 467 HB3 LYS 66 HB3 LYS 66 41.261 44.414 24.459 468 HG2 LYS 66 HG2 LYS 66 39.282 44.988 25.627 469 HG3 LYS 66 HG3 LYS 66 40.181 45.626 27.004 470 HD2 LYS 66 HD2 LYS 66 41.120 47.102 24.809 471 HD3 LYS 66 HD3 LYS 66 39.381 46.981 24.553 472 HE2 LYS 66 HE2 LYS 66 40.589 47.817 27.201 473 HE3 LYS 66 HE3 LYS 66 40.145 48.973 25.946 474 HZ1 LYS 66 HZ1 LYS 66 38.161 48.912 26.990 475 HZ2 LYS 66 HZ2 LYS 66 38.445 47.384 27.708 476 HZ3 LYS 66 HZ3 LYS 66 37.928 47.494 26.090 477 H SER 67 H SER 67 42.526 45.722 27.498 478 HA SER 67 HA SER 67 42.393 44.727 30.253 479 HB2 SER 67 HB2 SER 67 43.240 46.857 30.893 480 HB3 SER 67 HB3 SER 67 44.003 46.533 29.339 481 HG SER 67 HG SER 67 41.520 47.874 29.501 482 H GLY 68 H GLY 68 40.170 44.098 30.370 483 HA2 GLY 68 HA2 GLY 68 37.954 44.528 31.118 484 HA3 GLY 68 HA3 GLY 68 38.316 46.259 31.089 485 H ARG 69 H ARG 69 36.777 43.691 29.398 486 HA ARG 69 HA ARG 69 36.340 45.510 27.053 487 HB2 ARG 69 HB2 ARG 69 37.826 43.664 26.411 488 HB3 ARG 69 HB3 ARG 69 36.665 42.495 27.034 489 HG2 ARG 69 HG2 ARG 69 36.077 42.474 24.791 490 HG3 ARG 69 HG3 ARG 69 35.013 43.756 25.359 491 HD2 ARG 69 HD2 ARG 69 36.118 44.589 23.385 492 HD3 ARG 69 HD3 ARG 69 36.842 45.408 24.763 493 HE ARG 69 HE ARG 69 38.342 43.041 24.261 494 HH11 ARG 69 HH11 ARG 69 37.539 46.003 22.713 495 HH12 ARG 69 HH12 ARG 69 39.028 46.049 21.810 496 HH21 ARG 69 HH21 ARG 69 40.269 43.102 23.132 497 HH22 ARG 69 HH22 ARG 69 40.549 44.417 22.031 498 H THR 70 H THR 70 34.262 45.633 26.260 499 HA THR 70 HA THR 70 32.130 44.254 27.874 500 HB THR 70 HB THR 70 30.696 46.089 27.282 501 HG1 THR 70 HG1 THR 70 32.811 46.729 25.472 502 HG21 THR 70 HG21 THR 70 33.360 47.458 27.660 503 HG22 THR 70 HG22 THR 70 32.615 46.525 28.961 504 HG23 THR 70 HG23 THR 70 31.782 47.930 28.295 505 H TRP 71 H TRP 71 30.855 42.754 26.764 506 HA TRP 71 HA TRP 71 30.951 42.879 23.768 507 HB2 TRP 71 HB2 TRP 71 31.425 40.600 25.630 508 HB3 TRP 71 HB3 TRP 71 30.517 40.245 24.154 509 HD1 TRP 71 HD1 TRP 71 33.995 40.754 25.364 510 HE1 TRP 71 HE1 TRP 71 35.628 40.997 23.362 511 HE3 TRP 71 HE3 TRP 71 30.634 41.264 21.574 512 HZ2 TRP 71 HZ2 TRP 71 35.484 41.410 20.537 513 HZ3 TRP 71 HZ3 TRP 71 31.395 41.591 19.242 514 HH2 TRP 71 HH2 TRP 71 33.814 41.660 18.716 515 H ARG 72 H ARG 72 29.015 42.522 22.656 516 HA ARG 72 HA ARG 72 26.557 41.862 24.199 517 HB2 ARG 72 HB2 ARG 72 26.977 44.418 22.583 518 HB3 ARG 72 HB3 ARG 72 25.398 43.837 23.139 519 HG2 ARG 72 HG2 ARG 72 25.835 45.063 25.011 520 HG3 ARG 72 HG3 ARG 72 26.869 43.703 25.460 521 HD2 ARG 72 HD2 ARG 72 28.288 45.592 25.620 522 HD3 ARG 72 HD3 ARG 72 28.694 44.863 24.063 523 HE ARG 72 HE ARG 72 26.609 46.717 23.572 524 HH11 ARG 72 HH11 ARG 72 29.881 46.654 24.640 525 HH12 ARG 72 HH12 ARG 72 30.171 48.303 24.226 526 HH21 ARG 72 HH21 ARG 72 26.982 48.843 23.032 527 HH22 ARG 72 HH22 ARG 72 28.551 49.529 23.286 528 H GLU 73 H GLU 73 24.879 40.988 22.862 529 HA GLU 73 HA GLU 73 25.771 40.452 20.079 530 HB2 GLU 73 HB2 GLU 73 24.592 38.327 20.192 531 HB3 GLU 73 HB3 GLU 73 25.687 38.455 21.564 532 HG2 GLU 73 HG2 GLU 73 23.907 38.050 22.895 533 HG3 GLU 73 HG3 GLU 73 23.313 39.652 22.457 534 H ALA 74 H ALA 74 23.912 39.907 18.560 535 HA ALA 74 HA ALA 74 21.329 41.163 19.141 536 HB1 ALA 74 HB1 ALA 74 23.257 42.854 18.179 537 HB2 ALA 74 HB2 ALA 74 21.527 43.067 17.888 538 HB3 ALA 74 HB3 ALA 74 22.534 42.280 16.675 539 H ASP 75 H ASP 75 19.684 40.381 17.721 540 HA ASP 75 HA ASP 75 20.268 37.907 16.330 541 HB2 ASP 75 HB2 ASP 75 17.887 39.424 17.051 542 HB3 ASP 75 HB3 ASP 75 17.762 38.819 15.405 543 H ILE 76 H ILE 76 20.016 37.462 14.034 544 HA ILE 76 HA ILE 76 20.155 39.860 12.267 545 HB ILE 76 HB ILE 76 22.112 37.549 12.350 546 HG12 ILE 76 HG12 ILE 76 22.475 39.609 13.801 547 HG13 ILE 76 HG13 ILE 76 23.771 39.259 12.659 548 HG21 ILE 76 HG21 ILE 76 23.088 38.849 10.317 549 HG22 ILE 76 HG22 ILE 76 21.463 39.503 10.149 550 HG23 ILE 76 HG23 ILE 76 21.729 37.766 10.038 551 HD11 ILE 76 HD11 ILE 76 23.446 41.191 11.542 552 HD12 ILE 76 HD12 ILE 76 22.451 41.690 12.908 553 HD13 ILE 76 HD13 ILE 76 21.699 40.962 11.491 554 H ASN 77 H ASN 77 19.481 39.458 10.098 555 HA ASN 77 HA ASN 77 18.080 38.526 8.465 556 HB2 ASN 77 HB2 ASN 77 19.284 35.987 9.611 557 HB3 ASN 77 HB3 ASN 77 18.402 36.089 8.089 558 HD21 ASN 77 HD21 ASN 77 21.060 35.248 8.003 559 HD22 ASN 77 HD22 ASN 77 22.021 36.469 7.311 560 H TYR 78 H TYR 78 16.491 39.305 10.434 561 HA TYR 78 HA TYR 78 14.645 36.989 10.881 562 HB2 TYR 78 HB2 TYR 78 15.376 37.701 13.064 563 HB3 TYR 78 HB3 TYR 78 15.124 39.400 12.657 564 HD1 TYR 78 HD1 TYR 78 13.331 36.143 13.042 565 HD2 TYR 78 HD2 TYR 78 12.996 40.424 12.992 566 HE1 TYR 78 HE1 TYR 78 10.980 35.969 13.824 567 HE2 TYR 78 HE2 TYR 78 10.647 40.250 13.773 568 HH TYR 78 HH TYR 78 9.190 38.732 14.893 569 H THR 79 H THR 79 12.375 37.485 10.680 570 HA THR 79 HA THR 79 11.771 40.097 9.363 571 HB THR 79 HB THR 79 10.398 39.032 7.690 572 HG1 THR 79 HG1 THR 79 10.279 36.699 7.691 573 HG21 THR 79 HG21 THR 79 12.829 37.250 7.765 574 HG22 THR 79 HG22 THR 79 12.984 38.988 7.461 575 HG23 THR 79 HG23 THR 79 12.034 37.979 6.368 576 H SER 80 H SER 80 9.779 37.254 9.970 577 HA SER 80 HA SER 80 8.377 38.527 12.247 578 HB2 SER 80 HB2 SER 80 6.743 39.394 10.896 579 HB3 SER 80 HB3 SER 80 7.276 38.444 9.511 580 HG SER 80 HG SER 80 6.311 36.596 10.682 581 H GLY 81 H GLY 81 8.763 36.737 13.576 582 HA2 GLY 81 HA2 GLY 81 7.156 34.530 13.702 583 HA3 GLY 81 HA3 GLY 81 8.341 34.015 12.500 584 H PHE 82 H PHE 82 10.297 33.229 13.219 585 HA PHE 82 HA PHE 82 10.958 33.699 16.110 586 HB2 PHE 82 HB2 PHE 82 10.062 31.331 15.464 587 HB3 PHE 82 HB3 PHE 82 11.644 31.108 14.718 588 HD1 PHE 82 HD1 PHE 82 9.972 32.023 17.942 589 HD2 PHE 82 HD2 PHE 82 13.546 30.596 16.031 590 HE1 PHE 82 HE1 PHE 82 10.968 31.546 20.163 591 HE2 PHE 82 HE2 PHE 82 14.544 30.124 18.252 592 HZ PHE 82 HZ PHE 82 13.257 30.599 20.319 593 H ARG 83 H ARG 83 13.421 32.731 16.330 594 HA ARG 83 HA ARG 83 14.994 34.505 14.605 595 HB2 ARG 83 HB2 ARG 83 16.375 32.665 16.487 596 HB3 ARG 83 HB3 ARG 83 16.596 34.393 16.238 597 HG2 ARG 83 HG2 ARG 83 14.188 34.547 17.324 598 HG3 ARG 83 HG3 ARG 83 14.623 32.972 17.987 599 HD2 ARG 83 HD2 ARG 83 16.065 35.601 18.356 600 HD3 ARG 83 HD3 ARG 83 15.362 34.567 19.602 601 HE ARG 83 HE ARG 83 17.276 32.958 18.355 602 HH11 ARG 83 HH11 ARG 83 17.196 36.013 19.885 603 HH12 ARG 83 HH12 ARG 83 18.833 35.946 20.415 604 HH21 ARG 83 HH21 ARG 83 19.427 32.850 19.052 605 HH22 ARG 83 HH22 ARG 83 20.101 34.154 19.991 606 H ASN 84 H ASN 84 17.395 32.810 14.783 607 HA ASN 84 HA ASN 84 16.914 30.348 13.319 608 HB2 ASN 84 HB2 ASN 84 18.023 31.102 11.207 609 HB3 ASN 84 HB3 ASN 84 16.509 31.960 11.502 610 HD21 ASN 84 HD21 ASN 84 18.099 33.354 9.860 611 HD22 ASN 84 HD22 ASN 84 18.905 34.612 10.663 612 H SER 85 H SER 85 19.703 31.109 11.988 613 HA SER 85 HA SER 85 21.294 30.488 14.447 614 HB2 SER 85 HB2 SER 85 22.699 29.096 13.152 615 HB3 SER 85 HB3 SER 85 21.073 28.728 12.577 616 HG SER 85 HG SER 85 23.187 29.752 11.235 617 H ASP 86 H ASP 86 20.720 32.780 12.054 618 HA ASP 86 HA ASP 86 23.379 33.889 11.736 619 HB2 ASP 86 HB2 ASP 86 20.576 34.828 11.138 620 HB3 ASP 86 HB3 ASP 86 21.956 35.904 10.926 621 H ARG 87 H ARG 87 24.405 34.707 13.558 622 HA ARG 87 HA ARG 87 22.844 36.762 15.091 623 HB2 ARG 87 HB2 ARG 87 24.540 34.537 16.271 624 HB3 ARG 87 HB3 ARG 87 23.904 35.895 17.201 625 HG2 ARG 87 HG2 ARG 87 22.034 34.376 15.480 626 HG3 ARG 87 HG3 ARG 87 22.533 33.604 16.983 627 HD2 ARG 87 HD2 ARG 87 21.525 35.218 18.316 628 HD3 ARG 87 HD3 ARG 87 21.700 36.467 17.096 629 HE ARG 87 HE ARG 87 19.304 35.852 17.328 630 HH11 ARG 87 HH11 ARG 87 20.976 33.323 15.709 631 HH12 ARG 87 HH12 ARG 87 19.971 33.399 14.305 632 HH21 ARG 87 HH21 ARG 87 17.934 35.848 15.576 633 HH22 ARG 87 HH22 ARG 87 18.254 34.754 14.251 634 H ILE 88 H ILE 88 24.017 38.591 15.641 635 HA ILE 88 HA ILE 88 26.858 38.649 14.672 636 HB ILE 88 HB ILE 88 25.179 40.204 13.564 637 HG12 ILE 88 HG12 ILE 88 27.447 41.536 15.095 638 HG13 ILE 88 HG13 ILE 88 27.636 40.658 13.575 639 HG21 ILE 88 HG21 ILE 88 25.376 41.949 15.978 640 HG22 ILE 88 HG22 ILE 88 24.212 40.622 16.024 641 HG23 ILE 88 HG23 ILE 88 24.098 41.849 14.766 642 HD11 ILE 88 HD11 ILE 88 26.889 43.397 13.956 643 HD12 ILE 88 HD12 ILE 88 25.512 42.548 13.237 644 HD13 ILE 88 HD13 ILE 88 27.085 42.520 12.432 645 H LEU 89 H LEU 89 28.437 39.624 15.944 646 HA LEU 89 HA LEU 89 27.653 40.177 18.785 647 HB2 LEU 89 HB2 LEU 89 29.616 38.298 17.655 648 HB3 LEU 89 HB3 LEU 89 30.300 39.354 18.879 649 HG LEU 89 HG LEU 89 29.371 37.255 19.858 650 HD11 LEU 89 HD11 LEU 89 27.467 39.306 20.840 651 HD12 LEU 89 HD12 LEU 89 29.149 39.817 20.797 652 HD13 LEU 89 HD13 LEU 89 28.685 38.397 21.730 653 HD21 LEU 89 HD21 LEU 89 27.477 37.235 18.081 654 HD22 LEU 89 HD22 LEU 89 26.634 38.315 19.192 655 HD23 LEU 89 HD23 LEU 89 27.094 36.700 19.716 656 H TYR 90 H TYR 90 28.275 42.158 19.494 657 HA TYR 90 HA TYR 90 30.492 43.569 18.056 658 HB2 TYR 90 HB2 TYR 90 29.218 45.468 17.689 659 HB3 TYR 90 HB3 TYR 90 28.020 44.203 17.444 660 HD1 TYR 90 HD1 TYR 90 26.297 43.720 19.203 661 HD2 TYR 90 HD2 TYR 90 29.120 46.954 19.575 662 HE1 TYR 90 HE1 TYR 90 24.870 44.778 20.955 663 HE2 TYR 90 HE2 TYR 90 27.694 47.999 21.305 664 HH TYR 90 HH TYR 90 24.720 46.435 22.460 665 H SER 91 H SER 91 31.842 44.766 19.376 666 HA SER 91 HA SER 91 31.406 44.442 22.327 667 HB2 SER 91 HB2 SER 91 33.858 44.817 22.457 668 HB3 SER 91 HB3 SER 91 33.449 43.465 21.402 669 HG SER 91 HG SER 91 34.922 45.467 20.727 670 H SER 92 H SER 92 32.807 46.164 23.550 671 HA SER 92 HA SER 92 31.580 48.724 23.465 672 HB2 SER 92 HB2 SER 92 34.110 49.191 24.506 673 HB3 SER 92 HB3 SER 92 32.720 48.658 25.441 674 HG SER 92 HG SER 92 34.756 47.061 24.209 675 H ASP 93 H ASP 93 34.706 47.681 22.313 676 HA ASP 93 HA ASP 93 35.503 50.142 21.074 677 HB2 ASP 93 HB2 ASP 93 36.992 48.237 19.830 678 HB3 ASP 93 HB3 ASP 93 37.327 48.782 21.474 679 H TRP 94 H TRP 94 33.027 48.160 20.284 680 HA TRP 94 HA TRP 94 31.611 48.041 18.473 681 HB2 TRP 94 HB2 TRP 94 33.533 49.969 17.131 682 HB3 TRP 94 HB3 TRP 94 31.914 49.556 16.571 683 HD1 TRP 94 HD1 TRP 94 33.661 52.023 18.620 684 HE1 TRP 94 HE1 TRP 94 32.015 53.355 20.084 685 HE3 TRP 94 HE3 TRP 94 29.478 49.123 18.149 686 HZ2 TRP 94 HZ2 TRP 94 29.308 53.232 20.936 687 HZ3 TRP 94 HZ3 TRP 94 27.374 49.760 19.304 688 HH2 TRP 94 HH2 TRP 94 27.283 51.813 20.694 689 H LEU 95 H LEU 95 34.257 46.403 18.779 690 HA LEU 95 HA LEU 95 34.930 45.630 16.054 691 HB2 LEU 95 HB2 LEU 95 35.389 44.375 18.772 692 HB3 LEU 95 HB3 LEU 95 35.841 43.535 17.293 693 HG LEU 95 HG LEU 95 36.821 46.266 18.155 694 HD11 LEU 95 HD11 LEU 95 38.355 43.681 17.805 695 HD12 LEU 95 HD12 LEU 95 37.786 44.286 19.364 696 HD13 LEU 95 HD13 LEU 95 38.973 45.206 18.439 697 HD21 LEU 95 HD21 LEU 95 38.425 45.508 16.093 698 HD22 LEU 95 HD22 LEU 95 37.001 46.527 15.888 699 HD23 LEU 95 HD23 LEU 95 36.898 44.794 15.583 700 H ILE 96 H ILE 96 33.655 44.377 14.768 701 HA ILE 96 HA ILE 96 31.418 42.935 16.095 702 HB ILE 96 HB ILE 96 31.513 43.977 13.259 703 HG12 ILE 96 HG12 ILE 96 29.547 45.241 14.908 704 HG13 ILE 96 HG13 ILE 96 31.086 45.305 15.772 705 HG21 ILE 96 HG21 ILE 96 30.003 41.948 14.068 706 HG22 ILE 96 HG22 ILE 96 29.322 43.213 13.051 707 HG23 ILE 96 HG23 ILE 96 29.047 43.235 14.788 708 HD11 ILE 96 HD11 ILE 96 30.759 46.133 12.878 709 HD12 ILE 96 HD12 ILE 96 32.180 46.348 13.891 710 HD13 ILE 96 HD13 ILE 96 30.710 47.257 14.232 711 H TYR 97 H TYR 97 31.112 40.875 15.847 712 HA TYR 97 HA TYR 97 32.694 39.361 13.778 713 HB2 TYR 97 HB2 TYR 97 32.238 38.719 16.706 714 HB3 TYR 97 HB3 TYR 97 32.717 37.486 15.538 715 HD1 TYR 97 HD1 TYR 97 33.672 41.002 16.455 716 HD2 TYR 97 HD2 TYR 97 34.999 37.068 15.332 717 HE1 TYR 97 HE1 TYR 97 36.021 41.753 16.593 718 HE2 TYR 97 HE2 TYR 97 37.357 37.826 15.496 719 HH TYR 97 HH TYR 97 38.696 39.511 16.295 720 H LYS 98 H LYS 98 31.597 37.307 13.122 721 HA LYS 98 HA LYS 98 28.625 37.469 13.635 722 HB2 LYS 98 HB2 LYS 98 28.177 37.300 11.389 723 HB3 LYS 98 HB3 LYS 98 29.655 38.258 11.354 724 HG2 LYS 98 HG2 LYS 98 30.991 36.221 10.964 725 HG3 LYS 98 HG3 LYS 98 29.533 35.236 11.015 726 HD2 LYS 98 HD2 LYS 98 30.342 37.269 8.934 727 HD3 LYS 98 HD3 LYS 98 29.942 35.571 8.703 728 HE2 LYS 98 HE2 LYS 98 28.051 37.849 9.341 729 HE3 LYS 98 HE3 LYS 98 28.028 36.780 7.943 730 HZ1 LYS 98 HZ1 LYS 98 27.021 35.154 9.090 731 HZ2 LYS 98 HZ2 LYS 98 26.539 36.419 10.109 732 HZ3 LYS 98 HZ3 LYS 98 27.883 35.468 10.518 733 H THR 99 H THR 99 27.503 35.567 13.905 734 HA THR 99 HA THR 99 28.955 33.007 13.444 735 HB THR 99 HB THR 99 29.183 33.049 15.766 736 HG1 THR 99 HG1 THR 99 28.123 31.186 15.451 737 HG21 THR 99 HG21 THR 99 27.543 33.972 17.318 738 HG22 THR 99 HG22 THR 99 26.441 34.301 15.982 739 HG23 THR 99 HG23 THR 99 27.970 35.173 16.097 740 H THR 100 H THR 100 27.735 31.619 12.353 741 HA THR 100 HA THR 100 24.824 32.201 11.878 742 HB THR 100 HB THR 100 25.384 30.770 9.737 743 HG1 THR 100 HG1 THR 100 27.649 30.611 10.785 744 HG21 THR 100 HG21 THR 100 26.678 33.298 9.247 745 HG22 THR 100 HG22 THR 100 25.295 33.532 10.320 746 HG23 THR 100 HG23 THR 100 25.073 32.760 8.750 747 H ASP 101 H ASP 101 26.664 30.246 13.682 748 HA ASP 101 HA ASP 101 25.002 27.815 13.056 749 HB2 ASP 101 HB2 ASP 101 26.998 26.917 14.677 750 HB3 ASP 101 HB3 ASP 101 27.110 26.954 12.919 751 H ALA 102 H ALA 102 24.153 30.132 14.705 752 HA ALA 102 HA ALA 102 22.969 30.451 16.689 753 HB1 ALA 102 HB1 ALA 102 23.342 27.512 17.267 754 HB2 ALA 102 HB2 ALA 102 22.228 28.070 16.021 755 HB3 ALA 102 HB3 ALA 102 21.986 28.555 17.699 756 H TYR 103 H TYR 103 25.204 31.484 17.187 757 HA TYR 103 HA TYR 103 26.787 32.011 18.817 758 HB2 TYR 103 HB2 TYR 103 25.250 30.035 20.532 759 HB3 TYR 103 HB3 TYR 103 26.330 31.300 21.101 760 HD1 TYR 103 HD1 TYR 103 25.533 33.600 19.405 761 HD2 TYR 103 HD2 TYR 103 23.135 30.622 21.359 762 HE1 TYR 103 HE1 TYR 103 23.644 35.201 19.537 763 HE2 TYR 103 HE2 TYR 103 21.248 32.223 21.481 764 HH TYR 103 HH TYR 103 21.671 35.610 20.582 765 H GLN 104 H GLN 104 27.587 29.998 16.962 766 HA GLN 104 HA GLN 104 29.174 28.158 18.755 767 HB2 GLN 104 HB2 GLN 104 28.186 27.731 15.932 768 HB3 GLN 104 HB3 GLN 104 29.363 26.691 16.710 769 HG2 GLN 104 HG2 GLN 104 26.841 27.237 18.208 770 HG3 GLN 104 HG3 GLN 104 26.720 26.190 16.795 771 HE21 GLN 104 HE21 GLN 104 26.311 25.130 19.411 772 HE22 GLN 104 HE22 GLN 104 27.594 24.074 19.766 773 H THR 105 H THR 105 29.587 29.061 15.303 774 HA THR 105 HA THR 105 32.451 29.631 15.942 775 HB THR 105 HB THR 105 32.881 29.448 13.602 776 HG1 THR 105 HG1 THR 105 30.107 29.251 13.073 777 HG21 THR 105 HG21 THR 105 31.317 27.316 13.087 778 HG22 THR 105 HG22 THR 105 31.028 27.456 14.820 779 HG23 THR 105 HG23 THR 105 32.670 27.240 14.213 780 H PHE 106 H PHE 106 33.095 31.693 16.254 781 HA PHE 106 HA PHE 106 31.370 33.932 15.294 782 HB2 PHE 106 HB2 PHE 106 33.630 33.941 17.317 783 HB3 PHE 106 HB3 PHE 106 32.584 35.305 16.928 784 HD1 PHE 106 HD1 PHE 106 32.297 31.692 17.902 785 HD2 PHE 106 HD2 PHE 106 30.758 35.689 18.326 786 HE1 PHE 106 HE1 PHE 106 30.657 30.884 19.579 787 HE2 PHE 106 HE2 PHE 106 29.125 34.878 20.005 788 HZ PHE 106 HZ PHE 106 29.074 32.473 20.630 789 H THR 107 H THR 107 32.235 33.846 13.068 790 HA THR 107 HA THR 107 35.077 34.365 12.710 791 HB THR 107 HB THR 107 32.748 34.336 10.778 792 HG1 THR 107 HG1 THR 107 33.692 32.356 11.600 793 HG21 THR 107 HG21 THR 107 35.660 34.989 10.271 794 HG22 THR 107 HG22 THR 107 34.257 36.010 9.927 795 HG23 THR 107 HG23 THR 107 34.527 34.532 9.001 796 H LYS 108 H LYS 108 36.024 36.303 12.199 797 HA LYS 108 HA LYS 108 34.705 38.680 13.235 798 HB2 LYS 108 HB2 LYS 108 37.154 38.313 13.448 799 HB3 LYS 108 HB3 LYS 108 37.313 38.432 11.699 800 HG2 LYS 108 HG2 LYS 108 36.477 40.748 11.747 801 HG3 LYS 108 HG3 LYS 108 36.227 40.641 13.490 802 HD2 LYS 108 HD2 LYS 108 38.590 40.428 13.902 803 HD3 LYS 108 HD3 LYS 108 38.931 40.207 12.188 804 HE2 LYS 108 HE2 LYS 108 39.520 42.469 12.683 805 HE3 LYS 108 HE3 LYS 108 37.981 42.555 11.825 806 HZ1 LYS 108 HZ1 LYS 108 36.858 43.213 13.672 807 HZ2 LYS 108 HZ2 LYS 108 38.405 43.799 14.115 808 HZ3 LYS 108 HZ3 LYS 108 37.857 42.313 14.734 809 H ILE 109 H ILE 109 33.916 40.452 12.092 810 HA ILE 109 HA ILE 109 33.899 40.216 9.112 811 HB ILE 109 HB ILE 109 31.637 41.308 9.150 812 HG12 ILE 109 HG12 ILE 109 31.706 40.639 12.109 813 HG13 ILE 109 HG13 ILE 109 31.905 42.272 11.471 814 HG21 ILE 109 HG21 ILE 109 32.121 38.753 9.125 815 HG22 ILE 109 HG22 ILE 109 30.478 39.283 9.489 816 HG23 ILE 109 HG23 ILE 109 31.556 38.780 10.796 817 HD11 ILE 109 HD11 ILE 109 29.699 42.411 10.763 818 HD12 ILE 109 HD12 ILE 109 29.514 41.397 12.191 819 HD13 ILE 109 HD13 ILE 109 29.534 40.664 10.588 820 H ARG 110 H ARG 110 34.125 42.264 11.964 821 HA ARG 110 HA ARG 110 35.304 44.409 10.260 822 HB2 ARG 110 HB2 ARG 110 33.170 44.874 12.375 823 HB3 ARG 110 HB3 ARG 110 34.085 46.145 11.570 824 HG2 ARG 110 HG2 ARG 110 32.938 44.325 9.630 825 HG3 ARG 110 HG3 ARG 110 31.686 44.972 10.679 826 HD2 ARG 110 HD2 ARG 110 32.632 47.273 10.253 827 HD3 ARG 110 HD3 ARG 110 33.694 46.557 9.043 828 HE ARG 110 HE ARG 110 30.987 47.326 8.603 829 HH11 ARG 110 HH11 ARG 110 33.052 44.608 8.025 830 HH12 ARG 110 HH12 ARG 110 31.961 43.890 6.888 831 HH21 ARG 110 HH21 ARG 110 29.618 46.390 7.130 832 HH22 ARG 110 HH22 ARG 110 30.052 44.875 6.372 Start of MODEL 10 1 H VAL 3 H VAL 3 16.368 49.170 12.575 2 HA VAL 3 HA VAL 3 14.286 48.010 11.764 3 HB VAL 3 HB VAL 3 14.392 49.905 9.440 4 HG11 VAL 3 HG11 VAL 3 12.965 47.981 9.183 5 HG12 VAL 3 HG12 VAL 3 11.901 49.353 9.498 6 HG13 VAL 3 HG13 VAL 3 12.265 48.203 10.786 7 HG21 VAL 3 HG21 VAL 3 13.211 50.492 12.154 8 HG22 VAL 3 HG22 VAL 3 12.454 51.135 10.697 9 HG23 VAL 3 HG23 VAL 3 14.120 51.564 11.087 10 H ILE 4 H ILE 4 16.865 47.354 11.933 11 HA ILE 4 HA ILE 4 17.544 46.474 9.140 12 HB ILE 4 HB ILE 4 19.445 47.756 11.146 13 HG12 ILE 4 HG12 ILE 4 19.352 48.597 8.308 14 HG13 ILE 4 HG13 ILE 4 17.908 48.967 9.250 15 HG21 ILE 4 HG21 ILE 4 21.097 47.310 9.179 16 HG22 ILE 4 HG22 ILE 4 19.929 46.088 8.680 17 HG23 ILE 4 HG23 ILE 4 20.704 45.973 10.259 18 HD11 ILE 4 HD11 ILE 4 19.089 50.306 10.778 19 HD12 ILE 4 HD12 ILE 4 19.862 50.693 9.243 20 HD13 ILE 4 HD13 ILE 4 20.639 49.572 10.363 21 H ASN 5 H ASN 5 18.579 44.446 9.073 22 HA ASN 5 HA ASN 5 19.130 43.048 11.641 23 HB2 ASN 5 HB2 ASN 5 17.687 41.157 10.991 24 HB3 ASN 5 HB3 ASN 5 16.736 42.638 11.104 25 HD21 ASN 5 HD21 ASN 5 15.614 40.689 9.494 26 HD22 ASN 5 HD22 ASN 5 15.798 41.098 7.857 27 H THR 6 H THR 6 20.806 43.935 9.365 28 HA THR 6 HA THR 6 21.684 41.268 8.351 29 HB THR 6 HB THR 6 22.407 42.290 6.341 30 HG1 THR 6 HG1 THR 6 22.291 44.636 6.181 31 HG21 THR 6 HG21 THR 6 20.435 43.197 5.424 32 HG22 THR 6 HG22 THR 6 19.949 43.929 6.951 33 HG23 THR 6 HG23 THR 6 19.861 42.177 6.743 34 H PHE 7 H PHE 7 23.823 40.732 8.541 35 HA PHE 7 HA PHE 7 25.406 41.488 10.653 36 HB2 PHE 7 HB2 PHE 7 26.281 40.566 7.894 37 HB3 PHE 7 HB3 PHE 7 27.376 40.647 9.281 38 HD1 PHE 7 HD1 PHE 7 26.430 39.597 11.521 39 HD2 PHE 7 HD2 PHE 7 25.076 38.596 7.538 40 HE1 PHE 7 HE1 PHE 7 25.487 37.455 12.370 41 HE2 PHE 7 HE2 PHE 7 24.148 36.454 8.392 42 HZ PHE 7 HZ PHE 7 24.345 35.884 10.802 43 H ASP 8 H ASP 8 26.833 42.339 7.616 44 HA ASP 8 HA ASP 8 28.448 44.422 8.391 45 HB2 ASP 8 HB2 ASP 8 27.063 43.745 5.811 46 HB3 ASP 8 HB3 ASP 8 27.918 45.285 5.928 47 H GLY 9 H GLY 9 25.105 44.707 7.183 48 HA2 GLY 9 HA2 GLY 9 24.773 47.474 7.278 49 HA3 GLY 9 HA3 GLY 9 23.467 46.336 7.610 50 H VAL 10 H VAL 10 24.067 45.191 9.958 51 HA VAL 10 HA VAL 10 23.480 47.214 11.920 52 HB VAL 10 HB VAL 10 24.470 44.356 12.193 53 HG11 VAL 10 HG11 VAL 10 24.997 45.021 14.314 54 HG12 VAL 10 HG12 VAL 10 23.257 44.922 14.572 55 HG13 VAL 10 HG13 VAL 10 24.005 46.479 14.220 56 HG21 VAL 10 HG21 VAL 10 21.739 45.670 12.447 57 HG22 VAL 10 HG22 VAL 10 22.076 44.001 12.915 58 HG23 VAL 10 HG23 VAL 10 22.246 44.491 11.233 59 H ALA 11 H ALA 11 26.502 45.448 11.163 60 HA ALA 11 HA ALA 11 28.125 46.543 13.218 61 HB1 ALA 11 HB1 ALA 11 29.744 46.255 10.956 62 HB2 ALA 11 HB2 ALA 11 28.430 45.104 10.731 63 HB3 ALA 11 HB3 ALA 11 29.429 45.037 12.181 64 H ASP 12 H ASP 12 27.796 47.641 9.814 65 HA ASP 12 HA ASP 12 29.390 49.962 10.005 66 HB2 ASP 12 HB2 ASP 12 27.216 48.994 8.246 67 HB3 ASP 12 HB3 ASP 12 27.433 50.750 8.266 68 H TYR 13 H TYR 13 25.939 49.537 10.615 69 HA TYR 13 HA TYR 13 25.222 52.208 11.241 70 HB2 TYR 13 HB2 TYR 13 23.812 49.992 11.039 71 HB3 TYR 13 HB3 TYR 13 24.153 49.821 12.757 72 HD1 TYR 13 HD1 TYR 13 22.509 51.940 10.192 73 HD2 TYR 13 HD2 TYR 13 23.107 51.273 14.413 74 HE1 TYR 13 HE1 TYR 13 20.684 53.545 10.714 75 HE2 TYR 13 HE2 TYR 13 21.279 52.880 14.913 76 HH TYR 13 HH TYR 13 19.014 53.690 13.178 77 H LEU 14 H LEU 14 26.289 49.540 13.325 78 HA LEU 14 HA LEU 14 26.436 51.154 15.696 79 HB2 LEU 14 HB2 LEU 14 27.510 48.456 14.899 80 HB3 LEU 14 HB3 LEU 14 27.946 49.173 16.452 81 HG LEU 14 HG LEU 14 25.089 48.789 15.491 82 HD11 LEU 14 HD11 LEU 14 26.395 46.662 15.905 83 HD12 LEU 14 HD12 LEU 14 24.972 46.875 16.930 84 HD13 LEU 14 HD13 LEU 14 26.584 47.198 17.571 85 HD21 LEU 14 HD21 LEU 14 26.320 50.237 17.721 86 HD22 LEU 14 HD22 LEU 14 25.188 49.001 18.297 87 HD23 LEU 14 HD23 LEU 14 24.643 50.255 17.174 88 H GLN 15 H GLN 15 28.957 50.149 13.309 89 HA GLN 15 HA GLN 15 31.086 51.455 14.727 90 HB2 GLN 15 HB2 GLN 15 30.703 50.641 11.853 91 HB3 GLN 15 HB3 GLN 15 32.188 51.405 12.427 92 HG2 GLN 15 HG2 GLN 15 31.822 49.450 14.333 93 HG3 GLN 15 HG3 GLN 15 31.180 48.668 12.892 94 HE21 GLN 15 HE21 GLN 15 33.710 47.992 14.274 95 HE22 GLN 15 HE22 GLN 15 34.932 48.205 13.113 96 H THR 16 H THR 16 28.588 52.762 12.643 97 HA THR 16 HA THR 16 30.037 55.377 12.428 98 HB THR 16 HB THR 16 27.367 54.742 11.123 99 HG1 THR 16 HG1 THR 16 29.089 53.301 10.439 100 HG21 THR 16 HG21 THR 16 27.786 57.068 11.184 101 HG22 THR 16 HG22 THR 16 28.346 56.574 9.581 102 HG23 THR 16 HG23 THR 16 29.507 56.843 10.884 103 H TYR 17 H TYR 17 26.806 54.198 13.411 104 HA TYR 17 HA TYR 17 26.350 56.773 14.771 105 HB2 TYR 17 HB2 TYR 17 24.491 54.434 14.309 106 HB3 TYR 17 HB3 TYR 17 24.028 56.023 14.907 107 HD1 TYR 17 HD1 TYR 17 24.384 58.056 13.450 108 HD2 TYR 17 HD2 TYR 17 24.773 54.040 11.957 109 HE1 TYR 17 HE1 TYR 17 24.131 58.883 11.126 110 HE2 TYR 17 HE2 TYR 17 24.523 54.872 9.635 111 HH TYR 17 HH TYR 17 24.988 57.673 8.627 112 H HIS 18 H HIS 18 27.219 53.579 15.524 113 HA HIS 18 HA HIS 18 27.585 52.487 17.563 114 HB2 HIS 18 HB2 HIS 18 27.345 55.323 18.481 115 HB3 HIS 18 HB3 HIS 18 27.758 53.992 19.564 116 HD1 HIS 18 HD1 HIS 18 29.103 53.092 16.390 117 HD2 HIS 18 HD2 HIS 18 30.369 55.806 19.314 118 HE1 HIS 18 HE1 HIS 18 31.548 53.583 15.922 119 H LYS 19 H LYS 19 24.770 54.384 17.112 120 HA LYS 19 HA LYS 19 23.346 53.461 19.432 121 HB2 LYS 19 HB2 LYS 19 22.265 55.355 18.723 122 HB3 LYS 19 HB3 LYS 19 22.796 55.121 17.061 123 HG2 LYS 19 HG2 LYS 19 21.061 53.420 16.731 124 HG3 LYS 19 HG3 LYS 19 20.557 53.579 18.416 125 HD2 LYS 19 HD2 LYS 19 19.062 54.982 17.200 126 HD3 LYS 19 HD3 LYS 19 20.248 56.076 17.912 127 HE2 LYS 19 HE2 LYS 19 20.687 56.860 15.840 128 HE3 LYS 19 HE3 LYS 19 21.356 55.281 15.433 129 HZ1 LYS 19 HZ1 LYS 19 19.669 54.985 14.030 130 HZ2 LYS 19 HZ2 LYS 19 18.980 56.473 14.511 131 HZ3 LYS 19 HZ3 LYS 19 18.564 55.040 15.344 132 H LEU 20 H LEU 20 22.657 51.440 19.712 133 HA LEU 20 HA LEU 20 22.748 49.307 17.920 134 HB2 LEU 20 HB2 LEU 20 21.147 49.942 20.323 135 HB3 LEU 20 HB3 LEU 20 20.414 48.738 19.269 136 HG LEU 20 HG LEU 20 23.279 48.586 20.229 137 HD11 LEU 20 HD11 LEU 20 20.890 47.093 21.311 138 HD12 LEU 20 HD12 LEU 20 21.489 48.582 22.043 139 HD13 LEU 20 HD13 LEU 20 22.521 47.152 21.980 140 HD21 LEU 20 HD21 LEU 20 23.235 47.027 18.544 141 HD22 LEU 20 HD22 LEU 20 21.475 46.917 18.553 142 HD23 LEU 20 HD23 LEU 20 22.423 46.045 19.757 143 HA PRO 21 HA PRO 21 20.210 50.597 14.432 144 HB2 PRO 21 HB2 PRO 21 19.231 47.776 14.539 145 HB3 PRO 21 HB3 PRO 21 19.865 48.702 13.165 146 HG2 PRO 21 HG2 PRO 21 21.321 46.843 14.561 147 HG3 PRO 21 HG3 PRO 21 22.015 48.175 13.625 148 HD2 PRO 21 HD2 PRO 21 22.031 47.801 16.518 149 HD3 PRO 21 HD3 PRO 21 22.868 49.037 15.554 150 H ASP 22 H ASP 22 18.211 51.536 14.366 151 HA ASP 22 HA ASP 22 16.427 51.449 16.606 152 HB2 ASP 22 HB2 ASP 22 15.484 52.292 13.882 153 HB3 ASP 22 HB3 ASP 22 15.213 53.069 15.445 154 H ASN 23 H ASN 23 16.155 49.047 16.759 155 HA ASN 23 HA ASN 23 13.628 48.087 15.996 156 HB2 ASN 23 HB2 ASN 23 14.256 46.489 14.134 157 HB3 ASN 23 HB3 ASN 23 14.284 48.191 13.672 158 HD21 ASN 23 HD21 ASN 23 16.399 45.468 14.583 159 HD22 ASN 23 HD22 ASN 23 17.792 46.098 13.850 160 H TYR 24 H TYR 24 16.187 47.845 17.804 161 HA TYR 24 HA TYR 24 16.112 44.866 18.126 162 HB2 TYR 24 HB2 TYR 24 18.286 46.902 18.465 163 HB3 TYR 24 HB3 TYR 24 18.322 45.463 19.482 164 HD1 TYR 24 HD1 TYR 24 18.027 43.175 18.298 165 HD2 TYR 24 HD2 TYR 24 19.111 46.786 16.256 166 HE1 TYR 24 HE1 TYR 24 18.924 41.837 16.412 167 HE2 TYR 24 HE2 TYR 24 20.006 45.438 14.369 168 HH TYR 24 HH TYR 24 19.939 41.862 14.447 169 H ILE 25 H ILE 25 16.459 44.112 20.409 170 HA ILE 25 HA ILE 25 15.724 45.989 22.555 171 HB ILE 25 HB ILE 25 13.848 44.130 23.164 172 HG12 ILE 25 HG12 ILE 25 13.603 44.372 20.166 173 HG13 ILE 25 HG13 ILE 25 14.470 43.034 20.917 174 HG21 ILE 25 HG21 ILE 25 12.697 46.068 23.138 175 HG22 ILE 25 HG22 ILE 25 12.478 45.864 21.400 176 HG23 ILE 25 HG23 ILE 25 13.847 46.797 22.016 177 HD11 ILE 25 HD11 ILE 25 11.688 43.240 20.521 178 HD12 ILE 25 HD12 ILE 25 11.944 43.442 22.253 179 HD13 ILE 25 HD13 ILE 25 12.549 42.002 21.435 180 H THR 26 H THR 26 16.133 45.095 24.646 181 HA THR 26 HA THR 26 18.183 43.039 24.661 182 HB THR 26 HB THR 26 18.074 43.269 27.104 183 HG1 THR 26 HG1 THR 26 15.883 45.005 26.607 184 HG21 THR 26 HG21 THR 26 17.979 45.976 27.020 185 HG22 THR 26 HG22 THR 26 18.171 45.619 25.302 186 HG23 THR 26 HG23 THR 26 19.364 45.039 26.465 187 H LYS 27 H LYS 27 18.057 40.939 25.676 188 HA LYS 27 HA LYS 27 15.789 39.349 25.045 189 HB2 LYS 27 HB2 LYS 27 18.264 39.049 26.567 190 HB3 LYS 27 HB3 LYS 27 16.944 38.182 27.337 191 HG2 LYS 27 HG2 LYS 27 17.112 36.547 25.800 192 HG3 LYS 27 HG3 LYS 27 16.757 37.708 24.521 193 HD2 LYS 27 HD2 LYS 27 19.516 37.793 25.613 194 HD3 LYS 27 HD3 LYS 27 19.118 36.354 24.685 195 HE2 LYS 27 HE2 LYS 27 18.585 37.625 22.747 196 HE3 LYS 27 HE3 LYS 27 18.529 39.134 23.655 197 HZ1 LYS 27 HZ1 LYS 27 20.668 38.391 22.264 198 HZ2 LYS 27 HZ2 LYS 27 21.024 37.617 23.755 199 HZ3 LYS 27 HZ3 LYS 27 20.776 39.312 23.709 200 H SER 28 H SER 28 16.721 40.806 28.178 201 HA SER 28 HA SER 28 14.524 40.119 29.770 202 HB2 SER 28 HB2 SER 28 16.320 41.369 30.736 203 HB3 SER 28 HB3 SER 28 16.105 42.698 29.602 204 HG SER 28 HG SER 28 14.419 43.393 30.725 205 H GLU 29 H GLU 29 14.710 43.218 27.940 206 HA GLU 29 HA GLU 29 12.077 44.073 28.181 207 HB2 GLU 29 HB2 GLU 29 14.007 44.207 25.865 208 HB3 GLU 29 HB3 GLU 29 12.431 44.993 25.807 209 HG2 GLU 29 HG2 GLU 29 12.974 46.464 27.568 210 HG3 GLU 29 HG3 GLU 29 14.344 45.495 28.097 211 H ALA 30 H ALA 30 13.338 42.120 25.468 212 HA ALA 30 HA ALA 30 10.872 41.576 24.240 213 HB1 ALA 30 HB1 ALA 30 13.530 40.729 23.964 214 HB2 ALA 30 HB2 ALA 30 12.190 40.340 22.886 215 HB3 ALA 30 HB3 ALA 30 12.603 39.246 24.205 216 H GLN 31 H GLN 31 12.550 39.650 26.717 217 HA GLN 31 HA GLN 31 10.518 37.666 26.977 218 HB2 GLN 31 HB2 GLN 31 12.605 38.651 28.936 219 HB3 GLN 31 HB3 GLN 31 11.601 37.228 29.204 220 HG2 GLN 31 HG2 GLN 31 12.527 36.096 27.293 221 HG3 GLN 31 HG3 GLN 31 13.317 37.564 26.723 222 HE21 GLN 31 HE21 GLN 31 13.581 34.870 28.951 223 HE22 GLN 31 HE22 GLN 31 15.133 35.248 29.519 224 H ALA 32 H ALA 32 11.108 40.599 28.989 225 HA ALA 32 HA ALA 32 8.783 40.165 30.645 226 HB1 ALA 32 HB1 ALA 32 10.343 41.589 31.634 227 HB2 ALA 32 HB2 ALA 32 9.136 42.736 31.052 228 HB3 ALA 32 HB3 ALA 32 10.619 42.477 30.140 229 H LEU 33 H LEU 33 9.213 41.788 27.511 230 HA LEU 33 HA LEU 33 6.682 43.181 27.565 231 HB2 LEU 33 HB2 LEU 33 8.668 42.418 25.466 232 HB3 LEU 33 HB3 LEU 33 7.049 42.862 24.938 233 HG LEU 33 HG LEU 33 8.287 44.677 26.940 234 HD11 LEU 33 HD11 LEU 33 10.186 45.055 25.798 235 HD12 LEU 33 HD12 LEU 33 9.219 45.593 24.429 236 HD13 LEU 33 HD13 LEU 33 9.712 43.904 24.549 237 HD21 LEU 33 HD21 LEU 33 6.058 45.060 25.858 238 HD22 LEU 33 HD22 LEU 33 6.866 45.172 24.296 239 HD23 LEU 33 HD23 LEU 33 7.198 46.370 25.546 240 H GLY 34 H GLY 34 7.548 39.875 27.209 241 HA2 GLY 34 HA2 GLY 34 5.478 38.390 27.480 242 HA3 GLY 34 HA3 GLY 34 4.840 39.255 26.085 243 H TRP 35 H TRP 35 8.138 38.886 25.531 244 HA TRP 35 HA TRP 35 7.739 36.948 23.438 245 HB2 TRP 35 HB2 TRP 35 9.615 38.558 23.424 246 HB3 TRP 35 HB3 TRP 35 10.305 37.768 24.842 247 HD1 TRP 35 HD1 TRP 35 8.852 36.218 21.610 248 HE1 TRP 35 HE1 TRP 35 10.634 34.662 20.604 249 HE3 TRP 35 HE3 TRP 35 12.664 36.979 24.918 250 HZ2 TRP 35 HZ2 TRP 35 13.308 33.848 21.119 251 HZ3 TRP 35 HZ3 TRP 35 14.821 35.788 24.639 252 HH2 TRP 35 HH2 TRP 35 15.144 34.221 22.739 253 H VAL 36 H VAL 36 7.271 34.814 23.810 254 HA VAL 36 HA VAL 36 8.607 33.474 26.147 255 HB VAL 36 HB VAL 36 5.815 33.173 25.021 256 HG11 VAL 36 HG11 VAL 36 6.806 30.924 25.494 257 HG12 VAL 36 HG12 VAL 36 5.487 31.325 26.588 258 HG13 VAL 36 HG13 VAL 36 7.155 31.459 27.141 259 HG21 VAL 36 HG21 VAL 36 6.976 33.965 27.708 260 HG22 VAL 36 HG22 VAL 36 5.272 33.577 27.478 261 HG23 VAL 36 HG23 VAL 36 5.982 34.952 26.633 262 H ALA 37 H ALA 37 9.461 31.443 25.795 263 HA ALA 37 HA ALA 37 10.346 30.744 23.173 264 HB1 ALA 37 HB1 ALA 37 10.886 28.496 24.378 265 HB2 ALA 37 HB2 ALA 37 10.333 29.328 25.835 266 HB3 ALA 37 HB3 ALA 37 11.705 29.962 24.928 267 H SER 38 H SER 38 7.846 29.254 25.253 268 HA SER 38 HA SER 38 7.035 27.441 23.109 269 HB2 SER 38 HB2 SER 38 5.509 26.548 24.679 270 HB3 SER 38 HB3 SER 38 6.862 27.081 25.675 271 HG SER 38 HG SER 38 4.505 28.578 25.110 272 H LYS 39 H LYS 39 6.995 29.891 22.041 273 HA LYS 39 HA LYS 39 4.303 30.210 21.111 274 HB2 LYS 39 HB2 LYS 39 4.137 31.319 23.379 275 HB3 LYS 39 HB3 LYS 39 5.326 32.493 22.823 276 HG2 LYS 39 HG2 LYS 39 3.886 33.356 21.168 277 HG3 LYS 39 HG3 LYS 39 2.836 31.944 21.218 278 HD2 LYS 39 HD2 LYS 39 2.712 32.858 23.827 279 HD3 LYS 39 HD3 LYS 39 2.805 34.358 22.907 280 HE2 LYS 39 HE2 LYS 39 0.477 33.866 23.035 281 HE3 LYS 39 HE3 LYS 39 0.961 33.374 21.409 282 HZ1 LYS 39 HZ1 LYS 39 0.867 31.506 23.725 283 HZ2 LYS 39 HZ2 LYS 39 1.065 31.108 22.088 284 HZ3 LYS 39 HZ3 LYS 39 -0.425 31.711 22.641 285 H GLY 40 H GLY 40 7.320 32.081 21.689 286 HA2 GLY 40 HA2 GLY 40 8.759 33.096 20.121 287 HA3 GLY 40 HA3 GLY 40 7.946 32.163 18.858 288 H ASN 41 H ASN 41 5.995 34.023 20.949 289 HA ASN 41 HA ASN 41 4.772 35.517 18.887 290 HB2 ASN 41 HB2 ASN 41 4.045 37.062 20.804 291 HB3 ASN 41 HB3 ASN 41 3.596 35.369 20.948 292 HD21 ASN 41 HD21 ASN 41 4.733 37.843 22.769 293 HD22 ASN 41 HD22 ASN 41 5.609 36.964 23.940 294 H LEU 42 H LEU 42 5.424 37.241 17.760 295 HA LEU 42 HA LEU 42 7.126 39.323 18.844 296 HB2 LEU 42 HB2 LEU 42 8.670 37.273 18.196 297 HB3 LEU 42 HB3 LEU 42 8.416 37.860 16.556 298 HG LEU 42 HG LEU 42 9.010 40.201 17.596 299 HD11 LEU 42 HD11 LEU 42 10.738 39.923 19.410 300 HD12 LEU 42 HD12 LEU 42 10.202 38.250 19.586 301 HD13 LEU 42 HD13 LEU 42 9.087 39.575 19.918 302 HD21 LEU 42 HD21 LEU 42 11.579 39.115 17.485 303 HD22 LEU 42 HD22 LEU 42 10.658 39.747 16.123 304 HD23 LEU 42 HD23 LEU 42 10.619 38.022 16.486 305 H ALA 43 H ALA 43 6.374 37.786 15.746 306 HA ALA 43 HA ALA 43 6.236 40.143 14.189 307 HB1 ALA 43 HB1 ALA 43 6.198 38.228 12.886 308 HB2 ALA 43 HB2 ALA 43 4.476 38.616 12.878 309 HB3 ALA 43 HB3 ALA 43 5.100 37.378 13.968 310 H ASP 44 H ASP 44 3.912 38.757 16.421 311 HA ASP 44 HA ASP 44 1.626 40.325 15.515 312 HB2 ASP 44 HB2 ASP 44 0.908 39.635 17.979 313 HB3 ASP 44 HB3 ASP 44 1.005 38.421 16.708 314 H VAL 45 H VAL 45 3.505 40.462 18.539 315 HA VAL 45 HA VAL 45 2.621 43.104 19.261 316 HB VAL 45 HB VAL 45 4.512 42.906 20.944 317 HG11 VAL 45 HG11 VAL 45 3.364 40.521 21.722 318 HG12 VAL 45 HG12 VAL 45 2.152 41.177 20.616 319 HG13 VAL 45 HG13 VAL 45 2.674 42.115 22.013 320 HG21 VAL 45 HG21 VAL 45 5.931 41.433 19.467 321 HG22 VAL 45 HG22 VAL 45 4.768 40.125 19.732 322 HG23 VAL 45 HG23 VAL 45 5.687 40.783 21.088 323 H ALA 46 H ALA 46 5.322 41.850 17.418 324 HA ALA 46 HA ALA 46 6.055 44.646 16.702 325 HB1 ALA 46 HB1 ALA 46 8.373 44.335 17.203 326 HB2 ALA 46 HB2 ALA 46 8.187 42.591 17.413 327 HB3 ALA 46 HB3 ALA 46 7.519 43.702 18.618 328 HA PRO 47 HA PRO 47 5.536 41.703 13.109 329 HB2 PRO 47 HB2 PRO 47 4.835 44.225 11.743 330 HB3 PRO 47 HB3 PRO 47 3.976 42.677 11.777 331 HG2 PRO 47 HG2 PRO 47 3.145 44.869 13.103 332 HG3 PRO 47 HG3 PRO 47 2.814 43.218 13.648 333 HD2 PRO 47 HD2 PRO 47 4.736 45.212 14.748 334 HD3 PRO 47 HD3 PRO 47 3.909 43.872 15.571 335 H GLY 48 H GLY 48 8.162 42.398 13.796 336 HA2 GLY 48 HA2 GLY 48 9.761 42.162 11.682 337 HA3 GLY 48 HA3 GLY 48 9.232 43.812 11.386 338 H LYS 49 H LYS 49 10.106 42.216 14.462 339 HA LYS 49 HA LYS 49 12.234 44.248 14.712 340 HB2 LYS 49 HB2 LYS 49 10.026 44.305 16.225 341 HB3 LYS 49 HB3 LYS 49 10.963 43.166 17.186 342 HG2 LYS 49 HG2 LYS 49 12.642 44.737 17.641 343 HG3 LYS 49 HG3 LYS 49 12.219 45.740 16.255 344 HD2 LYS 49 HD2 LYS 49 10.123 46.411 17.355 345 HD3 LYS 49 HD3 LYS 49 10.507 45.382 18.736 346 HE2 LYS 49 HE2 LYS 49 12.726 46.745 18.847 347 HE3 LYS 49 HE3 LYS 49 11.867 47.916 17.840 348 HZ1 LYS 49 HZ1 LYS 49 11.038 46.914 20.514 349 HZ2 LYS 49 HZ2 LYS 49 10.072 47.904 19.526 350 HZ3 LYS 49 HZ3 LYS 49 11.548 48.487 20.130 351 H SER 50 H SER 50 14.227 43.542 15.682 352 HA SER 50 HA SER 50 14.368 40.550 15.956 353 HB2 SER 50 HB2 SER 50 16.662 42.340 15.144 354 HB3 SER 50 HB3 SER 50 16.580 40.581 15.059 355 HG SER 50 HG SER 50 15.020 42.457 13.593 356 H ILE 51 H ILE 51 15.107 39.751 17.825 357 HA ILE 51 HA ILE 51 15.484 41.350 20.152 358 HB ILE 51 HB ILE 51 16.717 38.629 19.865 359 HG12 ILE 51 HG12 ILE 51 14.529 38.449 18.753 360 HG13 ILE 51 HG13 ILE 51 14.479 37.643 20.319 361 HG21 ILE 51 HG21 ILE 51 17.001 39.431 22.036 362 HG22 ILE 51 HG22 ILE 51 15.474 38.549 22.188 363 HG23 ILE 51 HG23 ILE 51 15.466 40.308 22.017 364 HD11 ILE 51 HD11 ILE 51 13.747 40.165 21.039 365 HD12 ILE 51 HD12 ILE 51 12.603 38.888 20.632 366 HD13 ILE 51 HD13 ILE 51 13.069 40.080 19.417 367 H GLY 52 H GLY 52 17.388 41.909 21.327 368 HA2 GLY 52 HA2 GLY 52 19.995 41.238 21.038 369 HA3 GLY 52 HA3 GLY 52 19.759 42.236 19.595 370 H GLY 53 H GLY 53 21.409 42.659 22.030 371 HA2 GLY 53 HA2 GLY 53 21.949 45.088 22.492 372 HA3 GLY 53 HA3 GLY 53 20.246 45.287 22.889 373 H ASP 54 H ASP 54 21.692 42.300 23.936 374 HA ASP 54 HA ASP 54 21.200 42.985 26.712 375 HB2 ASP 54 HB2 ASP 54 22.889 40.674 25.805 376 HB3 ASP 54 HB3 ASP 54 21.684 40.730 27.100 377 H ILE 55 H ILE 55 23.262 42.019 28.083 378 HA ILE 55 HA ILE 55 25.639 43.610 27.282 379 HB ILE 55 HB ILE 55 24.280 43.521 29.969 380 HG12 ILE 55 HG12 ILE 55 23.550 45.099 27.946 381 HG13 ILE 55 HG13 ILE 55 23.646 45.752 29.570 382 HG21 ILE 55 HG21 ILE 55 27.022 44.487 29.153 383 HG22 ILE 55 HG22 ILE 55 26.538 43.618 30.608 384 HG23 ILE 55 HG23 ILE 55 26.151 45.325 30.435 385 HD11 ILE 55 HD11 ILE 55 24.862 46.947 27.513 386 HD12 ILE 55 HD12 ILE 55 26.130 45.793 27.916 387 HD13 ILE 55 HD13 ILE 55 25.573 46.941 29.126 388 H PHE 56 H PHE 56 27.561 42.639 27.705 389 HA PHE 56 HA PHE 56 27.688 40.380 29.590 390 HB2 PHE 56 HB2 PHE 56 27.053 39.682 27.121 391 HB3 PHE 56 HB3 PHE 56 28.784 39.897 26.850 392 HD1 PHE 56 HD1 PHE 56 26.398 38.344 29.280 393 HD2 PHE 56 HD2 PHE 56 30.234 38.161 27.353 394 HE1 PHE 56 HE1 PHE 56 26.853 36.174 30.397 395 HE2 PHE 56 HE2 PHE 56 30.696 35.992 28.460 396 HZ PHE 56 HZ PHE 56 29.008 34.998 29.990 397 H SER 57 H SER 57 29.807 39.986 30.319 398 HA SER 57 HA SER 57 31.742 42.148 29.693 399 HB2 SER 57 HB2 SER 57 32.885 40.682 31.710 400 HB3 SER 57 HB3 SER 57 31.818 42.064 31.953 401 HG SER 57 HG SER 57 30.054 40.588 31.999 402 H ASN 58 H ASN 58 31.185 38.844 28.986 403 HA ASN 58 HA ASN 58 32.369 37.354 27.643 404 HB2 ASN 58 HB2 ASN 58 32.835 39.478 26.342 405 HB3 ASN 58 HB3 ASN 58 34.370 39.581 27.197 406 HD21 ASN 58 HD21 ASN 58 35.689 39.191 25.312 407 HD22 ASN 58 HD22 ASN 58 35.707 37.698 24.499 408 H ARG 59 H ARG 59 33.043 37.665 30.553 409 HA ARG 59 HA ARG 59 35.839 37.398 31.024 410 HB2 ARG 59 HB2 ARG 59 33.365 36.507 32.412 411 HB3 ARG 59 HB3 ARG 59 34.856 35.687 32.852 412 HG2 ARG 59 HG2 ARG 59 35.927 37.812 33.394 413 HG3 ARG 59 HG3 ARG 59 34.487 38.695 32.879 414 HD2 ARG 59 HD2 ARG 59 34.809 36.862 35.261 415 HD3 ARG 59 HD3 ARG 59 34.255 38.538 35.248 416 HE ARG 59 HE ARG 59 32.567 36.247 35.007 417 HH11 ARG 59 HH11 ARG 59 33.088 39.317 33.641 418 HH12 ARG 59 HH12 ARG 59 31.630 39.327 32.681 419 HH21 ARG 59 HH21 ARG 59 30.678 36.177 33.742 420 HH22 ARG 59 HH22 ARG 59 30.306 37.520 32.718 421 H GLU 60 H GLU 60 33.427 35.160 29.824 422 HA GLU 60 HA GLU 60 34.907 32.739 30.069 423 HB2 GLU 60 HB2 GLU 60 32.753 33.629 28.128 424 HB3 GLU 60 HB3 GLU 60 33.380 31.978 28.185 425 HG2 GLU 60 HG2 GLU 60 31.340 32.145 29.557 426 HG3 GLU 60 HG3 GLU 60 32.736 31.824 30.581 427 H GLY 61 H GLY 61 35.464 35.482 28.131 428 HA2 GLY 61 HA2 GLY 61 37.061 35.933 26.489 429 HA3 GLY 61 HA3 GLY 61 37.855 34.440 26.986 430 H LYS 62 H LYS 62 34.625 34.929 25.608 431 HA LYS 62 HA LYS 62 35.250 32.880 23.552 432 HB2 LYS 62 HB2 LYS 62 32.963 33.494 25.085 433 HB3 LYS 62 HB3 LYS 62 32.560 33.992 23.445 434 HG2 LYS 62 HG2 LYS 62 33.949 31.394 23.593 435 HG3 LYS 62 HG3 LYS 62 32.385 31.410 24.401 436 HD2 LYS 62 HD2 LYS 62 31.615 30.953 22.292 437 HD3 LYS 62 HD3 LYS 62 31.708 32.705 22.125 438 HE2 LYS 62 HE2 LYS 62 34.288 31.453 21.601 439 HE3 LYS 62 HE3 LYS 62 33.033 30.810 20.543 440 HZ1 LYS 62 HZ1 LYS 62 33.782 32.684 19.430 441 HZ2 LYS 62 HZ2 LYS 62 33.945 33.620 20.856 442 HZ3 LYS 62 HZ3 LYS 62 32.395 33.253 20.220 443 H LEU 63 H LEU 63 35.161 36.259 23.956 444 HA LEU 63 HA LEU 63 35.261 36.652 21.006 445 HB2 LEU 63 HB2 LEU 63 33.827 38.489 22.946 446 HB3 LEU 63 HB3 LEU 63 33.906 38.672 21.197 447 HG LEU 63 HG LEU 63 32.697 36.237 22.540 448 HD11 LEU 63 HD11 LEU 63 31.569 38.476 23.067 449 HD12 LEU 63 HD12 LEU 63 30.561 37.213 22.370 450 HD13 LEU 63 HD13 LEU 63 31.148 38.531 21.355 451 HD21 LEU 63 HD21 LEU 63 33.319 36.994 19.817 452 HD22 LEU 63 HD22 LEU 63 31.578 36.798 20.007 453 HD23 LEU 63 HD23 LEU 63 32.661 35.474 20.423 454 HA PRO 64 HA PRO 64 38.939 39.063 21.478 455 HB2 PRO 64 HB2 PRO 64 37.355 41.502 20.709 456 HB3 PRO 64 HB3 PRO 64 38.944 40.953 20.123 457 HG2 PRO 64 HG2 PRO 64 36.757 40.577 18.664 458 HG3 PRO 64 HG3 PRO 64 38.027 39.342 18.735 459 HD2 PRO 64 HD2 PRO 64 35.338 39.334 19.981 460 HD3 PRO 64 HD3 PRO 64 36.328 37.966 19.452 461 H GLY 65 H GLY 65 39.929 39.991 23.227 462 HA2 GLY 65 HA2 GLY 65 38.233 41.534 25.147 463 HA3 GLY 65 HA3 GLY 65 39.313 40.260 25.701 464 H LYS 66 H LYS 66 40.090 42.187 26.977 465 HA LYS 66 HA LYS 66 42.666 43.045 26.208 466 HB2 LYS 66 HB2 LYS 66 42.295 45.437 25.675 467 HB3 LYS 66 HB3 LYS 66 41.449 44.437 24.501 468 HG2 LYS 66 HG2 LYS 66 39.333 44.799 25.593 469 HG3 LYS 66 HG3 LYS 66 40.110 45.569 26.974 470 HD2 LYS 66 HD2 LYS 66 40.951 46.912 24.577 471 HD3 LYS 66 HD3 LYS 66 39.194 46.805 24.579 472 HE2 LYS 66 HE2 LYS 66 40.682 47.711 27.046 473 HE3 LYS 66 HE3 LYS 66 40.291 48.847 25.754 474 HZ1 LYS 66 HZ1 LYS 66 38.382 49.031 26.925 475 HZ2 LYS 66 HZ2 LYS 66 38.515 47.476 27.637 476 HZ3 LYS 66 HZ3 LYS 66 37.950 47.648 26.039 477 H SER 67 H SER 67 42.626 45.592 27.542 478 HA SER 67 HA SER 67 42.340 44.694 30.300 479 HB2 SER 67 HB2 SER 67 43.267 46.787 30.894 480 HB3 SER 67 HB3 SER 67 44.004 46.448 29.326 481 HG SER 67 HG SER 67 41.534 47.787 29.410 482 H GLY 68 H GLY 68 40.123 44.138 30.395 483 HA2 GLY 68 HA2 GLY 68 37.901 44.600 31.035 484 HA3 GLY 68 HA3 GLY 68 38.285 46.322 31.012 485 H ARG 69 H ARG 69 36.809 43.743 29.306 486 HA ARG 69 HA ARG 69 36.358 45.525 26.936 487 HB2 ARG 69 HB2 ARG 69 37.798 43.599 26.318 488 HB3 ARG 69 HB3 ARG 69 36.568 42.493 26.939 489 HG2 ARG 69 HG2 ARG 69 35.997 42.526 24.678 490 HG3 ARG 69 HG3 ARG 69 34.976 43.830 25.282 491 HD2 ARG 69 HD2 ARG 69 36.134 44.602 23.279 492 HD3 ARG 69 HD3 ARG 69 36.766 45.464 24.676 493 HE ARG 69 HE ARG 69 38.349 43.132 24.290 494 HH11 ARG 69 HH11 ARG 69 37.543 46.047 22.669 495 HH12 ARG 69 HH12 ARG 69 39.062 46.113 21.815 496 HH21 ARG 69 HH21 ARG 69 40.330 43.230 23.231 497 HH22 ARG 69 HH22 ARG 69 40.612 44.542 22.129 498 H THR 70 H THR 70 34.280 45.641 26.169 499 HA THR 70 HA THR 70 32.178 44.281 27.839 500 HB THR 70 HB THR 70 30.704 46.103 27.234 501 HG1 THR 70 HG1 THR 70 32.839 46.729 25.463 502 HG21 THR 70 HG21 THR 70 33.360 47.458 27.780 503 HG22 THR 70 HG22 THR 70 32.490 46.544 29.020 504 HG23 THR 70 HG23 THR 70 31.750 47.967 28.293 505 H TRP 71 H TRP 71 30.806 42.854 26.747 506 HA TRP 71 HA TRP 71 30.906 42.921 23.748 507 HB2 TRP 71 HB2 TRP 71 31.416 40.627 25.599 508 HB3 TRP 71 HB3 TRP 71 30.497 40.286 24.134 509 HD1 TRP 71 HD1 TRP 71 33.991 40.798 25.313 510 HE1 TRP 71 HE1 TRP 71 35.609 41.021 23.297 511 HE3 TRP 71 HE3 TRP 71 30.601 41.248 21.554 512 HZ2 TRP 71 HZ2 TRP 71 35.440 41.378 20.454 513 HZ3 TRP 71 HZ3 TRP 71 31.331 41.529 19.210 514 HH2 TRP 71 HH2 TRP 71 33.744 41.591 18.648 515 H ARG 72 H ARG 72 28.979 42.610 22.689 516 HA ARG 72 HA ARG 72 26.537 41.869 24.220 517 HB2 ARG 72 HB2 ARG 72 26.893 44.446 22.635 518 HB3 ARG 72 HB3 ARG 72 25.345 43.845 23.227 519 HG2 ARG 72 HG2 ARG 72 25.826 45.121 25.054 520 HG3 ARG 72 HG3 ARG 72 26.828 43.742 25.518 521 HD2 ARG 72 HD2 ARG 72 28.402 45.452 25.614 522 HD3 ARG 72 HD3 ARG 72 28.607 44.910 23.949 523 HE ARG 72 HE ARG 72 26.564 46.924 23.992 524 HH11 ARG 72 HH11 ARG 72 29.919 46.491 24.436 525 HH12 ARG 72 HH12 ARG 72 30.304 48.150 24.175 526 HH21 ARG 72 HH21 ARG 72 27.077 49.124 23.601 527 HH22 ARG 72 HH22 ARG 72 28.737 49.610 23.685 528 H GLU 73 H GLU 73 24.915 40.939 22.883 529 HA GLU 73 HA GLU 73 25.771 40.479 20.057 530 HB2 GLU 73 HB2 GLU 73 24.642 38.339 20.163 531 HB3 GLU 73 HB3 GLU 73 25.725 38.483 21.547 532 HG2 GLU 73 HG2 GLU 73 23.922 37.976 22.823 533 HG3 GLU 73 HG3 GLU 73 23.375 39.622 22.492 534 H ALA 74 H ALA 74 23.858 39.829 18.589 535 HA ALA 74 HA ALA 74 21.276 41.065 19.166 536 HB1 ALA 74 HB1 ALA 74 23.214 42.745 18.126 537 HB2 ALA 74 HB2 ALA 74 21.475 42.991 17.982 538 HB3 ALA 74 HB3 ALA 74 22.363 42.197 16.680 539 H ASP 75 H ASP 75 19.646 40.251 17.779 540 HA ASP 75 HA ASP 75 20.232 37.813 16.350 541 HB2 ASP 75 HB2 ASP 75 17.869 39.366 17.057 542 HB3 ASP 75 HB3 ASP 75 17.742 38.717 15.426 543 H ILE 76 H ILE 76 19.945 37.411 14.048 544 HA ILE 76 HA ILE 76 20.127 39.822 12.316 545 HB ILE 76 HB ILE 76 22.112 37.536 12.409 546 HG12 ILE 76 HG12 ILE 76 22.447 39.628 13.818 547 HG13 ILE 76 HG13 ILE 76 23.745 39.257 12.691 548 HG21 ILE 76 HG21 ILE 76 23.069 38.834 10.350 549 HG22 ILE 76 HG22 ILE 76 21.422 39.424 10.166 550 HG23 ILE 76 HG23 ILE 76 21.750 37.695 10.094 551 HD11 ILE 76 HD11 ILE 76 23.394 41.136 11.476 552 HD12 ILE 76 HD12 ILE 76 22.501 41.702 12.882 553 HD13 ILE 76 HD13 ILE 76 21.642 40.963 11.527 554 H ASN 77 H ASN 77 19.477 39.443 10.160 555 HA ASN 77 HA ASN 77 18.088 38.554 8.522 556 HB2 ASN 77 HB2 ASN 77 19.268 35.957 9.559 557 HB3 ASN 77 HB3 ASN 77 18.399 36.146 8.037 558 HD21 ASN 77 HD21 ASN 77 21.086 35.292 8.041 559 HD22 ASN 77 HD22 ASN 77 22.041 36.517 7.352 560 H TYR 78 H TYR 78 16.519 39.266 10.554 561 HA TYR 78 HA TYR 78 14.674 36.930 10.934 562 HB2 TYR 78 HB2 TYR 78 15.327 37.655 13.133 563 HB3 TYR 78 HB3 TYR 78 15.129 39.352 12.703 564 HD1 TYR 78 HD1 TYR 78 13.258 36.148 13.131 565 HD2 TYR 78 HD2 TYR 78 12.999 40.431 12.943 566 HE1 TYR 78 HE1 TYR 78 10.894 36.041 13.875 567 HE2 TYR 78 HE2 TYR 78 10.637 40.318 13.685 568 HH TYR 78 HH TYR 78 9.158 38.830 14.868 569 H THR 79 H THR 79 12.380 37.437 10.721 570 HA THR 79 HA THR 79 11.819 40.027 9.356 571 HB THR 79 HB THR 79 10.425 38.958 7.700 572 HG1 THR 79 HG1 THR 79 10.514 36.528 7.771 573 HG21 THR 79 HG21 THR 79 12.834 37.161 7.766 574 HG22 THR 79 HG22 THR 79 13.033 38.902 7.528 575 HG23 THR 79 HG23 THR 79 12.075 37.956 6.384 576 H SER 80 H SER 80 9.802 37.224 9.986 577 HA SER 80 HA SER 80 8.355 38.529 12.216 578 HB2 SER 80 HB2 SER 80 6.668 39.312 10.872 579 HB3 SER 80 HB3 SER 80 7.300 38.468 9.474 580 HG SER 80 HG SER 80 6.391 36.514 10.455 581 H GLY 81 H GLY 81 8.706 36.760 13.577 582 HA2 GLY 81 HA2 GLY 81 7.150 34.543 13.733 583 HA3 GLY 81 HA3 GLY 81 8.311 34.018 12.516 584 H PHE 82 H PHE 82 10.230 33.152 13.241 585 HA PHE 82 HA PHE 82 10.960 33.708 16.099 586 HB2 PHE 82 HB2 PHE 82 9.999 31.356 15.532 587 HB3 PHE 82 HB3 PHE 82 11.555 31.069 14.757 588 HD1 PHE 82 HD1 PHE 82 9.907 31.915 17.993 589 HD2 PHE 82 HD2 PHE 82 13.543 30.717 16.043 590 HE1 PHE 82 HE1 PHE 82 10.948 31.468 20.200 591 HE2 PHE 82 HE2 PHE 82 14.581 30.279 18.249 592 HZ PHE 82 HZ PHE 82 13.285 30.655 20.327 593 H ARG 83 H ARG 83 13.394 32.767 16.334 594 HA ARG 83 HA ARG 83 14.961 34.456 14.532 595 HB2 ARG 83 HB2 ARG 83 16.447 32.736 16.406 596 HB3 ARG 83 HB3 ARG 83 16.506 34.477 16.187 597 HG2 ARG 83 HG2 ARG 83 14.143 34.414 17.366 598 HG3 ARG 83 HG3 ARG 83 14.720 32.857 17.961 599 HD2 ARG 83 HD2 ARG 83 16.080 35.547 18.312 600 HD3 ARG 83 HD3 ARG 83 15.348 34.561 19.580 601 HE ARG 83 HE ARG 83 17.283 32.906 18.398 602 HH11 ARG 83 HH11 ARG 83 17.209 35.993 19.895 603 HH12 ARG 83 HH12 ARG 83 18.832 35.905 20.467 604 HH21 ARG 83 HH21 ARG 83 19.410 32.780 19.151 605 HH22 ARG 83 HH22 ARG 83 20.079 34.082 20.096 606 H ASN 84 H ASN 84 17.362 32.812 14.765 607 HA ASN 84 HA ASN 84 16.919 30.298 13.368 608 HB2 ASN 84 HB2 ASN 84 18.015 31.039 11.242 609 HB3 ASN 84 HB3 ASN 84 16.485 31.865 11.520 610 HD21 ASN 84 HD21 ASN 84 17.939 33.327 9.866 611 HD22 ASN 84 HD22 ASN 84 18.769 34.592 10.633 612 H SER 85 H SER 85 19.691 31.088 12.009 613 HA SER 85 HA SER 85 21.269 30.519 14.488 614 HB2 SER 85 HB2 SER 85 22.685 29.110 13.233 615 HB3 SER 85 HB3 SER 85 21.068 28.737 12.633 616 HG SER 85 HG SER 85 23.211 29.800 11.335 617 H ASP 86 H ASP 86 20.723 32.779 12.058 618 HA ASP 86 HA ASP 86 23.389 33.888 11.735 619 HB2 ASP 86 HB2 ASP 86 20.577 34.778 11.121 620 HB3 ASP 86 HB3 ASP 86 21.931 35.882 10.902 621 H ARG 87 H ARG 87 24.418 34.779 13.520 622 HA ARG 87 HA ARG 87 22.848 36.797 15.077 623 HB2 ARG 87 HB2 ARG 87 24.564 34.588 16.249 624 HB3 ARG 87 HB3 ARG 87 23.923 35.944 17.181 625 HG2 ARG 87 HG2 ARG 87 22.062 34.395 15.473 626 HG3 ARG 87 HG3 ARG 87 22.566 33.650 16.987 627 HD2 ARG 87 HD2 ARG 87 21.573 35.301 18.294 628 HD3 ARG 87 HD3 ARG 87 21.686 36.505 17.026 629 HE ARG 87 HE ARG 87 19.314 35.783 17.362 630 HH11 ARG 87 HH11 ARG 87 21.030 33.314 15.694 631 HH12 ARG 87 HH12 ARG 87 20.006 33.381 14.303 632 HH21 ARG 87 HH21 ARG 87 17.926 35.765 15.636 633 HH22 ARG 87 HH22 ARG 87 18.246 34.686 14.298 634 H ILE 88 H ILE 88 23.994 38.622 15.618 635 HA ILE 88 HA ILE 88 26.822 38.703 14.655 636 HB ILE 88 HB ILE 88 25.144 40.211 13.534 637 HG12 ILE 88 HG12 ILE 88 27.380 41.568 15.072 638 HG13 ILE 88 HG13 ILE 88 27.558 40.740 13.516 639 HG21 ILE 88 HG21 ILE 88 25.275 41.968 15.943 640 HG22 ILE 88 HG22 ILE 88 24.122 40.627 15.966 641 HG23 ILE 88 HG23 ILE 88 24.020 41.862 14.709 642 HD11 ILE 88 HD11 ILE 88 27.145 43.391 13.665 643 HD12 ILE 88 HD12 ILE 88 25.464 42.864 13.711 644 HD13 ILE 88 HD13 ILE 88 26.489 42.421 12.346 645 H LEU 89 H LEU 89 28.378 39.700 15.909 646 HA LEU 89 HA LEU 89 27.651 40.244 18.745 647 HB2 LEU 89 HB2 LEU 89 29.585 38.365 17.542 648 HB3 LEU 89 HB3 LEU 89 30.285 39.379 18.805 649 HG LEU 89 HG LEU 89 29.353 37.251 19.709 650 HD11 LEU 89 HD11 LEU 89 27.494 39.327 20.735 651 HD12 LEU 89 HD12 LEU 89 29.206 39.727 20.763 652 HD13 LEU 89 HD13 LEU 89 28.624 38.292 21.612 653 HD21 LEU 89 HD21 LEU 89 27.439 37.291 17.944 654 HD22 LEU 89 HD22 LEU 89 26.617 38.354 19.089 655 HD23 LEU 89 HD23 LEU 89 27.058 36.714 19.567 656 H TYR 90 H TYR 90 28.286 42.241 19.444 657 HA TYR 90 HA TYR 90 30.540 43.603 18.013 658 HB2 TYR 90 HB2 TYR 90 29.328 45.660 17.898 659 HB3 TYR 90 HB3 TYR 90 28.260 44.410 17.266 660 HD1 TYR 90 HD1 TYR 90 26.585 43.325 18.921 661 HD2 TYR 90 HD2 TYR 90 28.616 47.032 19.655 662 HE1 TYR 90 HE1 TYR 90 24.847 43.943 20.571 663 HE2 TYR 90 HE2 TYR 90 26.883 47.658 21.305 664 HH TYR 90 HH TYR 90 24.343 45.385 22.237 665 H SER 91 H SER 91 31.887 44.789 19.323 666 HA SER 91 HA SER 91 31.520 44.407 22.270 667 HB2 SER 91 HB2 SER 91 33.959 44.662 22.359 668 HB3 SER 91 HB3 SER 91 33.511 43.439 21.173 669 HG SER 91 HG SER 91 35.030 45.451 20.679 670 H SER 92 H SER 92 32.867 46.098 23.537 671 HA SER 92 HA SER 92 31.673 48.656 23.520 672 HB2 SER 92 HB2 SER 92 34.262 49.087 24.480 673 HB3 SER 92 HB3 SER 92 32.877 48.633 25.461 674 HG SER 92 HG SER 92 34.827 46.947 24.221 675 H ASP 93 H ASP 93 34.792 47.677 22.307 676 HA ASP 93 HA ASP 93 35.503 50.175 21.080 677 HB2 ASP 93 HB2 ASP 93 37.033 48.334 19.798 678 HB3 ASP 93 HB3 ASP 93 37.367 48.850 21.455 679 H TRP 94 H TRP 94 33.017 48.241 20.301 680 HA TRP 94 HA TRP 94 31.628 48.062 18.464 681 HB2 TRP 94 HB2 TRP 94 33.548 50.002 17.161 682 HB3 TRP 94 HB3 TRP 94 31.953 49.561 16.555 683 HD1 TRP 94 HD1 TRP 94 33.580 52.079 18.602 684 HE1 TRP 94 HE1 TRP 94 31.874 53.354 20.057 685 HE3 TRP 94 HE3 TRP 94 29.537 49.009 18.123 686 HZ2 TRP 94 HZ2 TRP 94 29.157 53.108 20.911 687 HZ3 TRP 94 HZ3 TRP 94 27.401 49.540 19.268 688 HH2 TRP 94 HH2 TRP 94 27.204 51.587 20.661 689 H LEU 95 H LEU 95 34.236 46.386 18.773 690 HA LEU 95 HA LEU 95 34.899 45.686 16.017 691 HB2 LEU 95 HB2 LEU 95 35.420 44.363 18.698 692 HB3 LEU 95 HB3 LEU 95 35.840 43.571 17.182 693 HG LEU 95 HG LEU 95 36.839 46.266 18.123 694 HD11 LEU 95 HD11 LEU 95 38.390 43.735 17.575 695 HD12 LEU 95 HD12 LEU 95 37.841 44.203 19.183 696 HD13 LEU 95 HD13 LEU 95 38.989 45.220 18.307 697 HD21 LEU 95 HD21 LEU 95 38.369 45.641 15.981 698 HD22 LEU 95 HD22 LEU 95 36.911 46.623 15.859 699 HD23 LEU 95 HD23 LEU 95 36.851 44.897 15.488 700 H ILE 96 H ILE 96 33.658 44.398 14.768 701 HA ILE 96 HA ILE 96 31.410 42.978 16.091 702 HB ILE 96 HB ILE 96 31.553 43.928 13.237 703 HG12 ILE 96 HG12 ILE 96 29.602 45.329 14.808 704 HG13 ILE 96 HG13 ILE 96 31.151 45.423 15.646 705 HG21 ILE 96 HG21 ILE 96 29.995 41.973 14.033 706 HG22 ILE 96 HG22 ILE 96 29.312 43.266 13.049 707 HG23 ILE 96 HG23 ILE 96 29.063 43.265 14.794 708 HD11 ILE 96 HD11 ILE 96 31.231 45.877 12.708 709 HD12 ILE 96 HD12 ILE 96 32.122 46.679 13.997 710 HD13 ILE 96 HD13 ILE 96 30.452 47.123 13.670 711 H TYR 97 H TYR 97 31.090 40.900 15.790 712 HA TYR 97 HA TYR 97 32.710 39.396 13.802 713 HB2 TYR 97 HB2 TYR 97 32.222 38.788 16.724 714 HB3 TYR 97 HB3 TYR 97 32.677 37.524 15.580 715 HD1 TYR 97 HD1 TYR 97 33.707 41.028 16.447 716 HD2 TYR 97 HD2 TYR 97 34.956 37.060 15.381 717 HE1 TYR 97 HE1 TYR 97 36.067 41.743 16.560 718 HE2 TYR 97 HE2 TYR 97 37.325 37.782 15.503 719 HH TYR 97 HH TYR 97 38.681 39.463 16.376 720 H LYS 98 H LYS 98 31.591 37.357 13.096 721 HA LYS 98 HA LYS 98 28.616 37.518 13.601 722 HB2 LYS 98 HB2 LYS 98 28.183 37.357 11.316 723 HB3 LYS 98 HB3 LYS 98 29.642 38.346 11.345 724 HG2 LYS 98 HG2 LYS 98 31.034 36.364 10.924 725 HG3 LYS 98 HG3 LYS 98 29.599 35.334 10.937 726 HD2 LYS 98 HD2 LYS 98 30.358 37.454 8.926 727 HD3 LYS 98 HD3 LYS 98 30.021 35.751 8.639 728 HE2 LYS 98 HE2 LYS 98 28.044 37.936 9.346 729 HE3 LYS 98 HE3 LYS 98 28.073 36.931 7.907 730 HZ1 LYS 98 HZ1 LYS 98 27.227 35.145 9.014 731 HZ2 LYS 98 HZ2 LYS 98 26.502 36.397 9.898 732 HZ3 LYS 98 HZ3 LYS 98 27.872 35.612 10.516 733 H THR 99 H THR 99 27.501 35.624 13.852 734 HA THR 99 HA THR 99 28.957 33.054 13.451 735 HB THR 99 HB THR 99 29.200 33.208 15.786 736 HG1 THR 99 HG1 THR 99 28.240 31.287 15.485 737 HG21 THR 99 HG21 THR 99 27.714 34.231 17.302 738 HG22 THR 99 HG22 THR 99 26.364 34.137 16.177 739 HG23 THR 99 HG23 THR 99 27.670 35.282 15.888 740 H THR 100 H THR 100 27.732 31.671 12.377 741 HA THR 100 HA THR 100 24.814 32.247 11.919 742 HB THR 100 HB THR 100 25.342 30.876 9.747 743 HG1 THR 100 HG1 THR 100 27.567 30.540 10.722 744 HG21 THR 100 HG21 THR 100 26.736 33.450 9.500 745 HG22 THR 100 HG22 THR 100 25.168 33.566 10.298 746 HG23 THR 100 HG23 THR 100 25.286 32.873 8.680 747 H ASP 101 H ASP 101 26.661 30.282 13.708 748 HA ASP 101 HA ASP 101 24.983 27.868 13.062 749 HB2 ASP 101 HB2 ASP 101 26.989 26.934 14.661 750 HB3 ASP 101 HB3 ASP 101 27.082 26.981 12.901 751 H ALA 102 H ALA 102 24.117 30.150 14.699 752 HA ALA 102 HA ALA 102 22.942 30.454 16.702 753 HB1 ALA 102 HB1 ALA 102 23.341 27.540 17.348 754 HB2 ALA 102 HB2 ALA 102 22.306 28.009 16.001 755 HB3 ALA 102 HB3 ALA 102 21.930 28.562 17.632 756 H TYR 103 H TYR 103 25.184 31.494 17.158 757 HA TYR 103 HA TYR 103 26.794 32.045 18.749 758 HB2 TYR 103 HB2 TYR 103 25.300 30.087 20.532 759 HB3 TYR 103 HB3 TYR 103 26.401 31.359 21.055 760 HD1 TYR 103 HD1 TYR 103 25.542 33.615 19.332 761 HD2 TYR 103 HD2 TYR 103 23.224 30.703 21.462 762 HE1 TYR 103 HE1 TYR 103 23.657 35.217 19.478 763 HE2 TYR 103 HE2 TYR 103 21.337 32.301 21.600 764 HH TYR 103 HH TYR 103 21.695 35.652 20.537 765 H GLN 104 H GLN 104 27.559 29.987 16.917 766 HA GLN 104 HA GLN 104 29.170 28.169 18.717 767 HB2 GLN 104 HB2 GLN 104 28.145 27.709 15.909 768 HB3 GLN 104 HB3 GLN 104 29.302 26.657 16.701 769 HG2 GLN 104 HG2 GLN 104 26.798 27.311 18.193 770 HG3 GLN 104 HG3 GLN 104 26.653 26.212 16.824 771 HE21 GLN 104 HE21 GLN 104 26.192 25.214 19.401 772 HE22 GLN 104 HE22 GLN 104 27.460 24.173 19.835 773 H THR 105 H THR 105 29.594 29.049 15.252 774 HA THR 105 HA THR 105 32.450 29.604 15.900 775 HB THR 105 HB THR 105 32.881 29.441 13.558 776 HG1 THR 105 HG1 THR 105 30.095 29.314 13.046 777 HG21 THR 105 HG21 THR 105 31.247 27.351 13.026 778 HG22 THR 105 HG22 THR 105 31.026 27.465 14.772 779 HG23 THR 105 HG23 THR 105 32.642 27.229 14.099 780 H PHE 106 H PHE 106 33.091 31.654 16.285 781 HA PHE 106 HA PHE 106 31.386 33.910 15.348 782 HB2 PHE 106 HB2 PHE 106 33.633 33.873 17.384 783 HB3 PHE 106 HB3 PHE 106 32.620 35.261 17.000 784 HD1 PHE 106 HD1 PHE 106 32.267 31.654 17.943 785 HD2 PHE 106 HD2 PHE 106 30.775 35.666 18.359 786 HE1 PHE 106 HE1 PHE 106 30.611 30.864 19.609 787 HE2 PHE 106 HE2 PHE 106 29.122 34.870 20.029 788 HZ PHE 106 HZ PHE 106 29.042 32.469 20.651 789 H THR 107 H THR 107 32.246 33.833 13.123 790 HA THR 107 HA THR 107 35.061 34.385 12.725 791 HB THR 107 HB THR 107 32.695 34.382 10.837 792 HG1 THR 107 HG1 THR 107 33.737 32.396 11.598 793 HG21 THR 107 HG21 THR 107 35.580 35.100 10.272 794 HG22 THR 107 HG22 THR 107 34.144 36.088 9.981 795 HG23 THR 107 HG23 THR 107 34.424 34.640 9.020 796 H LYS 108 H LYS 108 36.024 36.282 12.195 797 HA LYS 108 HA LYS 108 34.728 38.656 13.263 798 HB2 LYS 108 HB2 LYS 108 37.161 38.303 13.520 799 HB3 LYS 108 HB3 LYS 108 37.357 38.373 11.773 800 HG2 LYS 108 HG2 LYS 108 36.476 40.677 11.746 801 HG3 LYS 108 HG3 LYS 108 36.242 40.615 13.493 802 HD2 LYS 108 HD2 LYS 108 38.610 40.436 13.884 803 HD3 LYS 108 HD3 LYS 108 38.935 40.192 12.168 804 HE2 LYS 108 HE2 LYS 108 39.473 42.478 12.617 805 HE3 LYS 108 HE3 LYS 108 37.921 42.510 11.778 806 HZ1 LYS 108 HZ1 LYS 108 36.826 43.215 13.618 807 HZ2 LYS 108 HZ2 LYS 108 38.375 43.765 14.088 808 HZ3 LYS 108 HZ3 LYS 108 37.790 42.284 14.678 809 H ILE 109 H ILE 109 34.061 40.476 12.122 810 HA ILE 109 HA ILE 109 33.994 40.215 9.148 811 HB ILE 109 HB ILE 109 31.763 41.303 9.171 812 HG12 ILE 109 HG12 ILE 109 31.876 40.814 12.161 813 HG13 ILE 109 HG13 ILE 109 31.967 42.403 11.393 814 HG21 ILE 109 HG21 ILE 109 32.200 38.730 9.276 815 HG22 ILE 109 HG22 ILE 109 30.565 39.334 9.543 816 HG23 ILE 109 HG23 ILE 109 31.567 38.864 10.917 817 HD11 ILE 109 HD11 ILE 109 29.727 42.470 11.031 818 HD12 ILE 109 HD12 ILE 109 29.627 41.139 12.182 819 HD13 ILE 109 HD13 ILE 109 29.690 40.808 10.451 820 H ARG 110 H ARG 110 34.170 42.296 11.978 821 HA ARG 110 HA ARG 110 35.364 44.444 10.285 822 HB2 ARG 110 HB2 ARG 110 33.172 44.882 12.355 823 HB3 ARG 110 HB3 ARG 110 34.111 46.169 11.602 824 HG2 ARG 110 HG2 ARG 110 33.013 44.340 9.627 825 HG3 ARG 110 HG3 ARG 110 31.743 45.070 10.602 826 HD2 ARG 110 HD2 ARG 110 32.863 47.303 10.192 827 HD3 ARG 110 HD3 ARG 110 33.899 46.502 9.016 828 HE ARG 110 HE ARG 110 31.311 47.492 8.476 829 HH11 ARG 110 HH11 ARG 110 32.990 44.468 8.078 830 HH12 ARG 110 HH12 ARG 110 31.882 43.920 6.867 831 HH21 ARG 110 HH21 ARG 110 29.961 46.768 6.930 832 HH22 ARG 110 HH22 ARG 110 30.224 45.205 6.186
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