NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
518082 | 2l00 | 17024 | cing | 1-original | 11 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLY 12 H GLY 12 6.636 -10.443 -0.699 2 HA2 GLY 12 HA2 GLY 12 9.158 -10.953 0.172 3 HA3 GLY 12 HA3 GLY 12 9.030 -11.954 -1.267 4 HA PRO 13 HA PRO 13 10.346 -8.352 -3.490 5 HB2 PRO 13 HB2 PRO 13 9.559 -9.018 -6.023 6 HB3 PRO 13 HB3 PRO 13 10.993 -9.686 -5.239 7 HG2 PRO 13 HG2 PRO 13 8.294 -10.903 -5.614 8 HG3 PRO 13 HG3 PRO 13 9.889 -11.675 -5.665 9 HD2 PRO 13 HD2 PRO 13 8.185 -11.823 -3.507 10 HD3 PRO 13 HD3 PRO 13 9.948 -11.976 -3.380 11 H MET 14 H MET 14 8.667 -7.136 -2.284 12 HA MET 14 HA MET 14 6.097 -6.705 -3.447 13 HB2 MET 14 HB2 MET 14 7.674 -5.361 -1.259 14 HB3 MET 14 HB3 MET 14 6.158 -4.657 -1.835 15 HG2 MET 14 HG2 MET 14 6.374 -7.544 -0.990 16 HG3 MET 14 HG3 MET 14 5.952 -6.251 0.149 17 HE1 MET 14 HE1 MET 14 2.420 -7.181 0.006 18 HE2 MET 14 HE2 MET 14 3.415 -5.885 0.672 19 HE3 MET 14 HE3 MET 14 3.985 -7.553 0.732 20 H LEU 15 H LEU 15 6.658 -6.244 -5.643 21 HA LEU 15 HA LEU 15 8.238 -3.952 -6.331 22 HB2 LEU 15 HB2 LEU 15 7.148 -6.202 -7.684 23 HB3 LEU 15 HB3 LEU 15 6.481 -4.769 -8.468 24 HG LEU 15 HG LEU 15 8.795 -3.853 -8.712 25 HD11 LEU 15 HD11 LEU 15 10.541 -4.791 -7.654 26 HD12 LEU 15 HD12 LEU 15 10.178 -6.362 -8.368 27 HD13 LEU 15 HD13 LEU 15 9.411 -5.880 -6.851 28 HD21 LEU 15 HD21 LEU 15 7.769 -5.068 -10.559 29 HD22 LEU 15 HD22 LEU 15 8.304 -6.604 -9.874 30 HD23 LEU 15 HD23 LEU 15 9.489 -5.449 -10.479 31 H CYS 16 H CYS 16 7.546 -1.940 -7.077 32 HA CYS 16 HA CYS 16 5.530 -0.622 -5.822 33 HB2 CYS 16 HB2 CYS 16 7.397 0.321 -7.308 34 HB3 CYS 16 HB3 CYS 16 6.259 0.116 -8.650 35 H SER 17 H SER 17 3.414 -0.337 -5.940 36 HA SER 17 HA SER 17 1.776 -2.060 -7.466 37 HB2 SER 17 HB2 SER 17 1.023 0.467 -5.971 38 HB3 SER 17 HB3 SER 17 -0.103 -0.788 -6.507 39 HG SER 17 HG SER 17 1.672 -2.113 -5.212 40 H THR 18 H THR 18 2.859 1.256 -7.974 41 HA THR 18 HA THR 18 0.985 1.848 -10.050 42 HB THR 18 HB THR 18 2.435 3.801 -10.496 43 HG1 THR 18 HG1 THR 18 4.421 2.684 -9.941 44 HG21 THR 18 HG21 THR 18 1.915 3.271 -7.562 45 HG22 THR 18 HG22 THR 18 0.717 3.857 -8.716 46 HG23 THR 18 HG23 THR 18 2.113 4.856 -8.306 47 H GLY 19 H GLY 19 3.820 -0.092 -10.030 48 HA2 GLY 19 HA2 GLY 19 4.755 -1.330 -11.758 49 HA3 GLY 19 HA3 GLY 19 3.587 -0.604 -12.855 50 H CYS 20 H CYS 20 6.046 0.970 -10.802 51 HA CYS 20 HA CYS 20 6.908 2.521 -13.084 52 HB2 CYS 20 HB2 CYS 20 8.212 3.823 -11.508 53 HB3 CYS 20 HB3 CYS 20 6.615 3.538 -10.816 54 H GLY 21 H GLY 21 7.877 -0.457 -11.709 55 HA2 GLY 21 HA2 GLY 21 9.476 -1.870 -12.761 56 HA3 GLY 21 HA3 GLY 21 10.282 -0.447 -13.399 57 H PHE 22 H PHE 22 9.637 0.097 -10.146 58 HA PHE 22 HA PHE 22 12.328 -0.842 -9.385 59 HB2 PHE 22 HB2 PHE 22 10.811 1.642 -8.603 60 HB3 PHE 22 HB3 PHE 22 12.244 1.086 -7.725 61 HD1 PHE 22 HD1 PHE 22 14.427 1.067 -8.759 62 HD2 PHE 22 HD2 PHE 22 11.004 2.509 -10.875 63 HE1 PHE 22 HE1 PHE 22 15.910 2.067 -10.461 64 HE2 PHE 22 HE2 PHE 22 12.481 3.523 -12.578 65 HZ PHE 22 HZ PHE 22 14.937 3.299 -12.372 66 H TYR 23 H TYR 23 12.534 -1.001 -6.895 67 HA TYR 23 HA TYR 23 10.510 -2.878 -6.039 68 HB2 TYR 23 HB2 TYR 23 13.257 -2.168 -5.212 69 HB3 TYR 23 HB3 TYR 23 12.186 -2.724 -3.922 70 HD1 TYR 23 HD1 TYR 23 12.972 -3.624 -7.454 71 HD2 TYR 23 HD2 TYR 23 12.227 -5.003 -3.485 72 HE1 TYR 23 HE1 TYR 23 13.316 -5.942 -8.212 73 HE2 TYR 23 HE2 TYR 23 12.570 -7.336 -4.225 74 HH TYR 23 HH TYR 23 13.940 -8.141 -7.242 75 H GLY 24 H GLY 24 9.629 -2.786 -3.801 76 HA2 GLY 24 HA2 GLY 24 9.162 -0.011 -2.887 77 HA3 GLY 24 HA3 GLY 24 7.835 -1.157 -3.051 78 H ASN 25 H ASN 25 9.169 0.305 -0.694 79 HA ASN 25 HA ASN 25 10.302 -1.731 0.954 80 HB2 ASN 25 HB2 ASN 25 9.839 1.100 1.125 81 HB3 ASN 25 HB3 ASN 25 9.204 0.319 2.575 82 HD21 ASN 25 HD21 ASN 25 10.847 1.139 3.934 83 HD22 ASN 25 HD22 ASN 25 12.474 0.570 3.835 84 HA PRO 26 HA PRO 26 6.281 -3.520 2.051 85 HB2 PRO 26 HB2 PRO 26 7.133 -5.257 3.949 86 HB3 PRO 26 HB3 PRO 26 7.277 -5.572 2.213 87 HG2 PRO 26 HG2 PRO 26 9.329 -4.556 4.142 88 HG3 PRO 26 HG3 PRO 26 9.508 -5.774 2.864 89 HD2 PRO 26 HD2 PRO 26 10.347 -3.213 2.543 90 HD3 PRO 26 HD3 PRO 26 9.706 -4.166 1.190 91 H ARG 27 H ARG 27 8.482 -1.895 4.213 92 HA ARG 27 HA ARG 27 6.716 -1.832 6.483 93 HB2 ARG 27 HB2 ARG 27 9.184 -0.254 5.721 94 HB3 ARG 27 HB3 ARG 27 8.280 0.068 7.203 95 HG2 ARG 27 HG2 ARG 27 8.555 -2.348 7.816 96 HG3 ARG 27 HG3 ARG 27 9.613 -2.528 6.420 97 HD2 ARG 27 HD2 ARG 27 11.177 -2.081 8.079 98 HD3 ARG 27 HD3 ARG 27 10.880 -0.466 7.426 99 HE ARG 27 HE ARG 27 9.289 -1.291 8.910 100 HH11 ARG 27 HH11 ARG 27 12.507 -0.409 9.045 101 HH12 ARG 27 HH12 ARG 27 12.722 0.339 10.593 102 HH21 ARG 27 HH21 ARG 27 9.407 0.038 11.530 103 HH22 ARG 27 HH22 ARG 27 10.985 0.587 11.983 104 H THR 28 H THR 28 7.301 0.151 3.638 105 HA THR 28 HA THR 28 5.633 2.337 4.512 106 HB THR 28 HB THR 28 6.024 3.238 2.259 107 HG1 THR 28 HG1 THR 28 6.386 0.635 1.693 108 HG21 THR 28 HG21 THR 28 8.606 3.042 2.254 109 HG22 THR 28 HG22 THR 28 8.395 2.053 3.697 110 HG23 THR 28 HG23 THR 28 7.833 3.726 3.684 111 H ASN 29 H ASN 29 4.210 2.600 1.887 112 HA ASN 29 HA ASN 29 2.001 0.803 2.499 113 HB2 ASN 29 HB2 ASN 29 2.350 3.297 0.861 114 HB3 ASN 29 HB3 ASN 29 0.935 2.267 0.593 115 HD21 ASN 29 HD21 ASN 29 -0.755 3.193 1.699 116 HD22 ASN 29 HD22 ASN 29 -0.662 3.793 3.317 117 H GLY 30 H GLY 30 4.494 -0.228 1.136 118 HA2 GLY 30 HA2 GLY 30 4.770 -1.993 -0.377 119 HA3 GLY 30 HA3 GLY 30 3.152 -1.682 -1.001 120 H MET 31 H MET 31 4.999 1.184 -0.780 121 HA MET 31 HA MET 31 5.685 1.022 -3.648 122 HB2 MET 31 HB2 MET 31 4.322 3.138 -2.030 123 HB3 MET 31 HB3 MET 31 5.324 3.638 -3.404 124 HG2 MET 31 HG2 MET 31 3.149 3.382 -4.287 125 HG3 MET 31 HG3 MET 31 4.008 1.910 -4.771 126 HE1 MET 31 HE1 MET 31 0.018 1.816 -3.368 127 HE2 MET 31 HE2 MET 31 0.923 2.345 -4.786 128 HE3 MET 31 HE3 MET 31 0.892 3.349 -3.334 129 H CYS 32 H CYS 32 7.415 2.492 -4.323 130 HA CYS 32 HA CYS 32 9.675 2.307 -2.597 131 HB2 CYS 32 HB2 CYS 32 10.847 3.495 -4.490 132 HB3 CYS 32 HB3 CYS 32 9.969 2.050 -4.991 133 H SER 33 H SER 33 11.126 4.517 -2.530 134 HA SER 33 HA SER 33 9.732 6.190 -0.701 135 HB2 SER 33 HB2 SER 33 11.807 7.408 -0.492 136 HB3 SER 33 HB3 SER 33 12.203 5.693 -0.625 137 HG SER 33 HG SER 33 12.920 6.015 -2.650 138 H VAL 34 H VAL 34 10.335 6.448 -4.118 139 HA VAL 34 HA VAL 34 9.926 9.266 -4.318 140 HB VAL 34 HB VAL 34 9.758 7.177 -6.496 141 HG11 VAL 34 HG11 VAL 34 10.265 9.075 -7.993 142 HG12 VAL 34 HG12 VAL 34 10.204 10.163 -6.607 143 HG13 VAL 34 HG13 VAL 34 8.747 9.318 -7.127 144 HG21 VAL 34 HG21 VAL 34 12.091 7.659 -6.942 145 HG22 VAL 34 HG22 VAL 34 11.929 7.174 -5.253 146 HG23 VAL 34 HG23 VAL 34 12.116 8.876 -5.669 147 H CYS 35 H CYS 35 7.857 6.452 -5.002 148 HA CYS 35 HA CYS 35 5.613 8.079 -5.771 149 HB2 CYS 35 HB2 CYS 35 5.865 5.116 -5.247 150 HB3 CYS 35 HB3 CYS 35 4.423 5.896 -5.912 151 H TYR 36 H TYR 36 6.743 6.665 -2.810 152 HA TYR 36 HA TYR 36 4.345 6.446 -1.387 153 HB2 TYR 36 HB2 TYR 36 6.440 5.463 -0.583 154 HB3 TYR 36 HB3 TYR 36 7.128 7.071 -0.349 155 HD1 TYR 36 HD1 TYR 36 3.674 5.893 0.535 156 HD2 TYR 36 HD2 TYR 36 7.525 7.172 1.936 157 HE1 TYR 36 HE1 TYR 36 2.809 5.944 2.861 158 HE2 TYR 36 HE2 TYR 36 6.665 7.227 4.261 159 HH TYR 36 HH TYR 36 3.691 5.822 5.179 160 H LYS 37 H LYS 37 6.583 9.245 -1.558 161 HA LYS 37 HA LYS 37 4.932 10.847 0.139 162 HB2 LYS 37 HB2 LYS 37 6.406 12.725 -0.511 163 HB3 LYS 37 HB3 LYS 37 7.340 11.309 -0.031 164 HG2 LYS 37 HG2 LYS 37 7.652 10.720 -2.408 165 HG3 LYS 37 HG3 LYS 37 6.750 12.173 -2.866 166 HD2 LYS 37 HD2 LYS 37 8.442 13.504 -1.532 167 HD3 LYS 37 HD3 LYS 37 9.404 12.021 -1.433 168 HE2 LYS 37 HE2 LYS 37 9.241 11.904 -3.972 169 HE3 LYS 37 HE3 LYS 37 8.615 13.561 -3.903 170 HZ1 LYS 37 HZ1 LYS 37 10.621 14.244 -2.750 171 HZ2 LYS 37 HZ2 LYS 37 11.012 13.542 -4.239 172 HZ3 LYS 37 HZ3 LYS 37 11.228 12.667 -2.808 173 H GLU 38 H GLU 38 5.416 10.609 -3.354 174 HA GLU 38 HA GLU 38 3.865 12.741 -4.211 175 HB2 GLU 38 HB2 GLU 38 4.554 10.080 -5.430 176 HB3 GLU 38 HB3 GLU 38 3.466 11.192 -6.271 177 HG2 GLU 38 HG2 GLU 38 6.121 12.130 -5.207 178 HG3 GLU 38 HG3 GLU 38 5.976 11.375 -6.803 179 H HIS 39 H HIS 39 2.808 9.449 -3.317 180 HA HIS 39 HA HIS 39 0.082 10.115 -4.046 181 HB2 HIS 39 HB2 HIS 39 -0.492 7.846 -3.740 182 HB3 HIS 39 HB3 HIS 39 1.134 7.810 -4.409 183 HD1 HIS 39 HD1 HIS 39 2.328 5.911 -3.394 184 HD2 HIS 39 HD2 HIS 39 -0.044 7.868 -0.574 185 HE1 HIS 39 HE1 HIS 39 2.608 4.650 -1.221 186 HE2 HIS 39 HE2 HIS 39 1.475 6.070 0.546 187 H LEU 40 H LEU 40 1.978 9.847 -1.122 188 HA LEU 40 HA LEU 40 -0.115 9.809 0.771 189 HB2 LEU 40 HB2 LEU 40 2.371 9.393 1.176 190 HB3 LEU 40 HB3 LEU 40 2.565 11.149 1.175 191 HG LEU 40 HG LEU 40 0.728 11.213 2.960 192 HD11 LEU 40 HD11 LEU 40 -0.034 8.856 2.512 193 HD12 LEU 40 HD12 LEU 40 0.347 9.174 4.206 194 HD13 LEU 40 HD13 LEU 40 1.493 8.295 3.199 195 HD21 LEU 40 HD21 LEU 40 2.365 10.507 4.758 196 HD22 LEU 40 HD22 LEU 40 3.011 11.653 3.581 197 HD23 LEU 40 HD23 LEU 40 3.425 9.943 3.468 198 H GLN 41 H GLN 41 1.323 12.432 -1.056 199 HA GLN 41 HA GLN 41 0.389 14.593 0.517 200 HB2 GLN 41 HB2 GLN 41 1.461 14.241 -2.246 201 HB3 GLN 41 HB3 GLN 41 0.602 15.745 -1.891 202 HG2 GLN 41 HG2 GLN 41 2.078 16.199 -0.013 203 HG3 GLN 41 HG3 GLN 41 2.903 14.652 -0.257 204 HE21 GLN 41 HE21 GLN 41 2.559 17.912 -1.468 205 HE22 GLN 41 HE22 GLN 41 3.850 17.808 -2.610 206 H ARG 42 H ARG 42 -1.042 12.827 -2.209 207 HA ARG 42 HA ARG 42 -3.345 14.557 -2.365 208 HB2 ARG 42 HB2 ARG 42 -2.644 11.912 -3.641 209 HB3 ARG 42 HB3 ARG 42 -4.193 12.722 -3.919 210 HG2 ARG 42 HG2 ARG 42 -3.141 14.616 -4.898 211 HG3 ARG 42 HG3 ARG 42 -1.546 14.099 -4.331 212 HD2 ARG 42 HD2 ARG 42 -1.800 12.048 -5.757 213 HD3 ARG 42 HD3 ARG 42 -3.243 12.789 -6.458 214 HE ARG 42 HE ARG 42 -0.500 13.175 -6.746 215 HH11 ARG 42 HH11 ARG 42 -3.753 14.816 -6.822 216 HH12 ARG 42 HH12 ARG 42 -3.403 16.122 -7.905 217 HH21 ARG 42 HH21 ARG 42 -0.132 15.158 -8.479 218 HH22 ARG 42 HH22 ARG 42 -1.375 16.311 -8.832 219 H GLN 43 H GLN 43 -2.526 11.542 -0.777 220 HA GLN 43 HA GLN 43 -5.221 10.839 -0.090 221 HB2 GLN 43 HB2 GLN 43 -3.082 9.334 -0.251 222 HB3 GLN 43 HB3 GLN 43 -2.809 9.859 1.415 223 HG2 GLN 43 HG2 GLN 43 -4.069 7.963 1.777 224 HG3 GLN 43 HG3 GLN 43 -5.344 9.187 1.708 225 HE21 GLN 43 HE21 GLN 43 -6.908 7.659 0.930 226 HE22 GLN 43 HE22 GLN 43 -6.831 7.036 -0.680 227 H GLN 44 H GLN 44 -2.549 12.544 1.466 228 HA GLN 44 HA GLN 44 -3.817 12.797 4.018 229 HB2 GLN 44 HB2 GLN 44 -1.297 12.958 3.452 230 HB3 GLN 44 HB3 GLN 44 -1.653 14.636 3.014 231 HG2 GLN 44 HG2 GLN 44 -2.447 15.135 5.212 232 HG3 GLN 44 HG3 GLN 44 -2.426 13.426 5.668 233 HE21 GLN 44 HE21 GLN 44 -0.096 15.786 4.300 234 HE22 GLN 44 HE22 GLN 44 1.199 15.297 5.333 235 H ASN 45 H ASN 45 -3.499 14.881 1.166 236 HA ASN 45 HA ASN 45 -4.690 17.187 2.310 237 HB2 ASN 45 HB2 ASN 45 -4.154 16.256 -0.499 238 HB3 ASN 45 HB3 ASN 45 -5.154 17.688 -0.230 239 HD21 ASN 45 HD21 ASN 45 -2.337 17.388 -1.324 240 HD22 ASN 45 HD22 ASN 45 -1.400 18.465 -0.352 241 H SER 46 H SER 46 -6.006 14.474 0.433 242 HA SER 46 HA SER 46 -8.670 15.527 0.351 243 HB2 SER 46 HB2 SER 46 -7.541 13.775 -1.220 244 HB3 SER 46 HB3 SER 46 -8.031 12.608 0.013 245 HG SER 46 HG SER 46 -9.683 14.352 -1.494 246 H1 MET 1 H1 MET 1 22.833 1.121 10.229 247 H2 MET 1 H2 MET 1 23.468 1.584 8.731 248 H3 MET 1 H3 MET 1 24.501 1.335 10.048 249 HA MET 1 HA MET 1 23.962 -0.992 10.092 250 HB2 MET 1 HB2 MET 1 22.545 -1.977 8.398 251 HB3 MET 1 HB3 MET 1 21.650 -0.692 9.195 252 HG2 MET 1 HG2 MET 1 22.117 0.801 7.310 253 HG3 MET 1 HG3 MET 1 23.017 -0.484 6.516 254 HE1 MET 1 HE1 MET 1 20.105 -0.520 4.096 255 HE2 MET 1 HE2 MET 1 21.850 -0.605 4.342 256 HE3 MET 1 HE3 MET 1 20.969 0.864 4.764 257 H GLN 2 H GLN 2 25.382 -2.388 9.045 258 HA GLN 2 HA GLN 2 27.046 -1.114 6.990 259 HB2 GLN 2 HB2 GLN 2 28.746 -2.633 7.513 260 HB3 GLN 2 HB3 GLN 2 28.019 -2.250 9.066 261 HG2 GLN 2 HG2 GLN 2 26.781 -4.347 9.031 262 HG3 GLN 2 HG3 GLN 2 27.434 -4.722 7.438 263 HE21 GLN 2 HE21 GLN 2 30.053 -3.506 8.382 264 HE22 GLN 2 HE22 GLN 2 30.785 -4.769 9.309 265 H ILE 3 H ILE 3 27.359 -1.902 5.014 266 HA ILE 3 HA ILE 3 26.134 -4.459 4.282 267 HB ILE 3 HB ILE 3 25.133 -3.781 2.345 268 HG12 ILE 3 HG12 ILE 3 26.783 -2.320 1.389 269 HG13 ILE 3 HG13 ILE 3 25.172 -1.644 1.242 270 HG21 ILE 3 HG21 ILE 3 23.788 -3.272 4.269 271 HG22 ILE 3 HG22 ILE 3 23.414 -2.203 2.918 272 HG23 ILE 3 HG23 ILE 3 24.386 -1.613 4.266 273 HD11 ILE 3 HD11 ILE 3 27.368 -0.274 2.001 274 HD12 ILE 3 HD12 ILE 3 26.708 -0.716 3.574 275 HD13 ILE 3 HD13 ILE 3 25.715 0.189 2.428 276 H PHE 4 H PHE 4 27.092 -5.322 2.282 277 HA PHE 4 HA PHE 4 29.964 -4.611 2.197 278 HB2 PHE 4 HB2 PHE 4 28.710 -7.305 1.589 279 HB3 PHE 4 HB3 PHE 4 30.437 -6.955 1.793 280 HD1 PHE 4 HD1 PHE 4 31.223 -6.120 4.097 281 HD2 PHE 4 HD2 PHE 4 27.376 -7.858 3.414 282 HE1 PHE 4 HE1 PHE 4 30.957 -6.493 6.526 283 HE2 PHE 4 HE2 PHE 4 27.121 -8.256 5.844 284 HZ PHE 4 HZ PHE 4 28.912 -7.564 7.398 285 H VAL 5 H VAL 5 30.927 -4.289 0.302 286 HA VAL 5 HA VAL 5 29.384 -4.633 -2.199 287 HB VAL 5 HB VAL 5 31.354 -2.416 -1.557 288 HG11 VAL 5 HG11 VAL 5 31.575 -2.901 -3.883 289 HG12 VAL 5 HG12 VAL 5 30.538 -1.479 -3.766 290 HG13 VAL 5 HG13 VAL 5 29.831 -3.065 -4.083 291 HG21 VAL 5 HG21 VAL 5 28.447 -2.057 -2.240 292 HG22 VAL 5 HG22 VAL 5 29.557 -0.907 -1.485 293 HG23 VAL 5 HG23 VAL 5 28.974 -2.301 -0.574 294 H LYS 6 H LYS 6 30.189 -6.472 -2.878 295 HA LYS 6 HA LYS 6 32.973 -7.216 -2.735 296 HB2 LYS 6 HB2 LYS 6 30.605 -8.336 -4.251 297 HB3 LYS 6 HB3 LYS 6 32.199 -9.083 -4.221 298 HG2 LYS 6 HG2 LYS 6 32.032 -9.453 -1.833 299 HG3 LYS 6 HG3 LYS 6 30.479 -8.608 -1.783 300 HD2 LYS 6 HD2 LYS 6 30.161 -11.049 -1.823 301 HD3 LYS 6 HD3 LYS 6 29.507 -10.291 -3.276 302 HE2 LYS 6 HE2 LYS 6 31.705 -10.857 -4.410 303 HE3 LYS 6 HE3 LYS 6 32.078 -11.852 -3.000 304 HZ1 LYS 6 HZ1 LYS 6 29.750 -12.158 -4.794 305 HZ2 LYS 6 HZ2 LYS 6 30.061 -13.101 -3.425 306 HZ3 LYS 6 HZ3 LYS 6 31.114 -13.157 -4.749 307 H THR 7 H THR 7 34.506 -6.832 -4.150 308 HA THR 7 HA THR 7 33.813 -5.759 -6.814 309 HB THR 7 HB THR 7 36.085 -4.972 -6.998 310 HG1 THR 7 HG1 THR 7 36.447 -6.701 -4.843 311 HG21 THR 7 HG21 THR 7 35.406 -4.314 -4.146 312 HG22 THR 7 HG22 THR 7 34.436 -3.679 -5.478 313 HG23 THR 7 HG23 THR 7 36.152 -3.278 -5.361 314 H LEU 8 H LEU 8 35.329 -6.573 -8.567 315 HA LEU 8 HA LEU 8 34.938 -9.415 -8.626 316 HB2 LEU 8 HB2 LEU 8 35.979 -7.604 -10.790 317 HB3 LEU 8 HB3 LEU 8 35.431 -9.266 -11.000 318 HG LEU 8 HG LEU 8 33.757 -6.923 -10.089 319 HD11 LEU 8 HD11 LEU 8 34.356 -7.040 -12.507 320 HD12 LEU 8 HD12 LEU 8 32.625 -7.083 -12.169 321 HD13 LEU 8 HD13 LEU 8 33.480 -8.568 -12.585 322 HD21 LEU 8 HD21 LEU 8 33.085 -9.844 -10.214 323 HD22 LEU 8 HD22 LEU 8 31.842 -8.611 -10.425 324 HD23 LEU 8 HD23 LEU 8 32.765 -8.687 -8.923 325 H THR 9 H THR 9 37.631 -7.434 -8.044 326 HA THR 9 HA THR 9 39.748 -9.260 -8.426 327 HB THR 9 HB THR 9 40.848 -8.048 -6.515 328 HG1 THR 9 HG1 THR 9 38.492 -6.459 -6.605 329 HG21 THR 9 HG21 THR 9 39.730 -6.479 -8.830 330 HG22 THR 9 HG22 THR 9 41.297 -7.284 -8.731 331 HG23 THR 9 HG23 THR 9 40.973 -5.857 -7.745 332 H GLY 10 H GLY 10 37.314 -8.968 -5.945 333 HA2 GLY 10 HA2 GLY 10 36.625 -11.109 -4.863 334 HA3 GLY 10 HA3 GLY 10 38.336 -11.379 -4.551 335 H LYS 11 H LYS 11 38.677 -8.452 -3.979 336 HA LYS 11 HA LYS 11 38.396 -8.437 -1.178 337 HB2 LYS 11 HB2 LYS 11 39.886 -6.951 -2.687 338 HB3 LYS 11 HB3 LYS 11 38.459 -5.920 -2.839 339 HG2 LYS 11 HG2 LYS 11 38.608 -6.384 -0.122 340 HG3 LYS 11 HG3 LYS 11 40.298 -6.223 -0.593 341 HD2 LYS 11 HD2 LYS 11 38.143 -4.230 -1.287 342 HD3 LYS 11 HD3 LYS 11 39.188 -4.096 0.122 343 HE2 LYS 11 HE2 LYS 11 40.227 -4.219 -2.707 344 HE3 LYS 11 HE3 LYS 11 39.859 -2.709 -1.875 345 HZ1 LYS 11 HZ1 LYS 11 41.835 -4.743 -1.034 346 HZ2 LYS 11 HZ2 LYS 11 41.456 -3.338 -0.170 347 HZ3 LYS 11 HZ3 LYS 11 42.175 -3.223 -1.697 348 H THR 12 H THR 12 36.978 -7.395 0.169 349 HA THR 12 HA THR 12 34.353 -6.585 -0.954 350 HB THR 12 HB THR 12 34.951 -8.063 1.623 351 HG1 THR 12 HG1 THR 12 34.854 -9.615 0.165 352 HG21 THR 12 HG21 THR 12 32.276 -7.157 0.542 353 HG22 THR 12 HG22 THR 12 33.062 -6.535 1.993 354 HG23 THR 12 HG23 THR 12 32.506 -8.208 1.936 355 H ILE 13 H ILE 13 33.755 -4.634 -0.498 356 HA ILE 13 HA ILE 13 35.197 -2.983 1.469 357 HB ILE 13 HB ILE 13 32.882 -1.984 -0.126 358 HG12 ILE 13 HG12 ILE 13 34.049 -3.056 -1.908 359 HG13 ILE 13 HG13 ILE 13 34.335 -1.331 -2.029 360 HG21 ILE 13 HG21 ILE 13 33.939 -0.559 1.531 361 HG22 ILE 13 HG22 ILE 13 34.068 0.124 -0.087 362 HG23 ILE 13 HG23 ILE 13 35.468 -0.654 0.656 363 HD11 ILE 13 HD11 ILE 13 36.338 -2.679 -2.548 364 HD12 ILE 13 HD12 ILE 13 36.279 -3.348 -0.919 365 HD13 ILE 13 HD13 ILE 13 36.589 -1.627 -1.147 366 H THR 14 H THR 14 34.325 -2.610 3.426 367 HA THR 14 HA THR 14 31.460 -3.197 3.885 368 HB THR 14 HB THR 14 33.690 -2.701 5.880 369 HG1 THR 14 HG1 THR 14 33.893 -4.720 4.901 370 HG21 THR 14 HG21 THR 14 31.463 -2.007 6.730 371 HG22 THR 14 HG22 THR 14 32.109 -3.400 7.598 372 HG23 THR 14 HG23 THR 14 30.854 -3.624 6.380 373 H LEU 15 H LEU 15 30.090 -1.605 4.139 374 HA LEU 15 HA LEU 15 31.093 1.135 4.631 375 HB2 LEU 15 HB2 LEU 15 28.786 0.288 2.882 376 HB3 LEU 15 HB3 LEU 15 29.223 1.959 3.218 377 HG LEU 15 HG LEU 15 31.030 -0.031 1.826 378 HD11 LEU 15 HD11 LEU 15 29.422 2.221 0.629 379 HD12 LEU 15 HD12 LEU 15 28.936 0.525 0.563 380 HD13 LEU 15 HD13 LEU 15 30.426 1.058 -0.235 381 HD21 LEU 15 HD21 LEU 15 31.295 2.816 2.650 382 HD22 LEU 15 HD22 LEU 15 31.963 2.353 1.082 383 HD23 LEU 15 HD23 LEU 15 32.520 1.548 2.551 384 H GLU 16 H GLU 16 30.055 2.362 6.043 385 HA GLU 16 HA GLU 16 27.742 1.320 7.541 386 HB2 GLU 16 HB2 GLU 16 29.660 2.112 8.870 387 HB3 GLU 16 HB3 GLU 16 29.588 3.674 8.062 388 HG2 GLU 16 HG2 GLU 16 28.586 3.803 10.280 389 HG3 GLU 16 HG3 GLU 16 27.385 4.092 9.026 390 H VAL 17 H VAL 17 25.877 1.840 6.695 391 HA VAL 17 HA VAL 17 25.486 4.498 5.493 392 HB VAL 17 HB VAL 17 24.192 3.534 3.689 393 HG11 VAL 17 HG11 VAL 17 26.685 3.876 3.480 394 HG12 VAL 17 HG12 VAL 17 25.951 2.765 2.318 395 HG13 VAL 17 HG13 VAL 17 26.840 2.128 3.704 396 HG21 VAL 17 HG21 VAL 17 25.004 0.817 4.700 397 HG22 VAL 17 HG22 VAL 17 24.052 1.160 3.252 398 HG23 VAL 17 HG23 VAL 17 23.395 1.527 4.850 399 H GLU 18 H GLU 18 23.154 4.858 5.006 400 HA GLU 18 HA GLU 18 21.258 3.666 6.938 401 HB2 GLU 18 HB2 GLU 18 21.318 6.466 5.756 402 HB3 GLU 18 HB3 GLU 18 20.027 5.836 6.773 403 HG2 GLU 18 HG2 GLU 18 22.900 6.241 7.585 404 HG3 GLU 18 HG3 GLU 18 21.534 7.232 8.073 405 H SER 19 H SER 19 19.154 3.236 6.081 406 HA SER 19 HA SER 19 18.960 2.342 3.425 407 HB2 SER 19 HB2 SER 19 16.687 3.133 5.266 408 HB3 SER 19 HB3 SER 19 16.542 2.153 3.804 409 HG SER 19 HG SER 19 16.841 1.103 6.030 410 H SER 20 H SER 20 18.210 5.415 4.847 411 HA SER 20 HA SER 20 16.869 6.595 2.642 412 HB2 SER 20 HB2 SER 20 17.202 8.729 3.869 413 HB3 SER 20 HB3 SER 20 16.475 7.453 4.848 414 HG SER 20 HG SER 20 19.277 7.865 4.835 415 H ASP 21 H ASP 21 20.172 5.945 3.033 416 HA ASP 21 HA ASP 21 21.310 8.191 1.736 417 HB2 ASP 21 HB2 ASP 21 22.263 5.340 1.957 418 HB3 ASP 21 HB3 ASP 21 23.215 6.606 1.187 419 H THR 22 H THR 22 21.373 8.825 -0.239 420 HA THR 22 HA THR 22 20.084 7.466 -2.407 421 HB THR 22 HB THR 22 20.952 9.221 -3.835 422 HG1 THR 22 HG1 THR 22 22.532 10.624 -3.177 423 HG21 THR 22 HG21 THR 22 20.082 10.328 -1.166 424 HG22 THR 22 HG22 THR 22 19.029 9.851 -2.497 425 HG23 THR 22 HG23 THR 22 20.106 11.237 -2.676 426 H ILE 23 H ILE 23 21.102 6.559 -4.267 427 HA ILE 23 HA ILE 23 23.298 4.862 -3.818 428 HB ILE 23 HB ILE 23 22.093 5.837 -6.386 429 HG12 ILE 23 HG12 ILE 23 20.494 4.680 -5.054 430 HG13 ILE 23 HG13 ILE 23 20.949 3.639 -6.396 431 HG21 ILE 23 HG21 ILE 23 23.085 3.870 -7.503 432 HG22 ILE 23 HG22 ILE 23 24.029 3.553 -6.042 433 HG23 ILE 23 HG23 ILE 23 24.272 5.049 -6.946 434 HD11 ILE 23 HD11 ILE 23 20.774 2.246 -4.497 435 HD12 ILE 23 HD12 ILE 23 21.681 3.374 -3.489 436 HD13 ILE 23 HD13 ILE 23 22.508 2.463 -4.754 437 H ASP 24 H ASP 24 23.118 8.018 -5.347 438 HA ASP 24 HA ASP 24 25.771 8.330 -6.181 439 HB2 ASP 24 HB2 ASP 24 23.972 9.873 -6.819 440 HB3 ASP 24 HB3 ASP 24 23.839 10.417 -5.144 441 H ASN 25 H ASN 25 24.273 8.960 -3.059 442 HA ASN 25 HA ASN 25 26.488 10.050 -1.701 443 HB2 ASN 25 HB2 ASN 25 24.222 10.288 -0.875 444 HB3 ASN 25 HB3 ASN 25 24.070 8.543 -0.700 445 HD21 ASN 25 HD21 ASN 25 24.051 8.018 1.281 446 HD22 ASN 25 HD22 ASN 25 25.040 8.645 2.550 447 H VAL 26 H VAL 26 25.372 6.714 -2.057 448 HA VAL 26 HA VAL 26 27.281 5.448 -0.396 449 HB VAL 26 HB VAL 26 25.711 4.425 -2.763 450 HG11 VAL 26 HG11 VAL 26 26.240 2.133 -1.917 451 HG12 VAL 26 HG12 VAL 26 27.438 2.849 -0.839 452 HG13 VAL 26 HG13 VAL 26 27.644 2.965 -2.587 453 HG21 VAL 26 HG21 VAL 26 25.293 3.477 0.016 454 HG22 VAL 26 HG22 VAL 26 24.121 3.769 -1.274 455 HG23 VAL 26 HG23 VAL 26 24.785 5.125 -0.359 456 H LYS 27 H LYS 27 27.291 6.060 -3.900 457 HA LYS 27 HA LYS 27 29.764 4.904 -4.516 458 HB2 LYS 27 HB2 LYS 27 28.286 7.184 -5.845 459 HB3 LYS 27 HB3 LYS 27 29.724 6.417 -6.523 460 HG2 LYS 27 HG2 LYS 27 28.578 4.256 -6.541 461 HG3 LYS 27 HG3 LYS 27 27.128 5.014 -5.871 462 HD2 LYS 27 HD2 LYS 27 26.919 6.420 -7.842 463 HD3 LYS 27 HD3 LYS 27 28.409 5.740 -8.518 464 HE2 LYS 27 HE2 LYS 27 27.388 3.539 -8.608 465 HE3 LYS 27 HE3 LYS 27 25.899 4.155 -7.875 466 HZ1 LYS 27 HZ1 LYS 27 27.057 4.989 -10.470 467 HZ2 LYS 27 HZ2 LYS 27 25.627 5.587 -9.793 468 HZ3 LYS 27 HZ3 LYS 27 25.727 3.965 -10.267 469 H SER 28 H SER 28 28.984 8.151 -3.432 470 HA SER 28 HA SER 28 31.567 9.287 -3.474 471 HB2 SER 28 HB2 SER 28 29.490 10.611 -3.182 472 HB3 SER 28 HB3 SER 28 29.302 9.914 -1.567 473 HG SER 28 HG SER 28 30.522 11.551 -0.996 474 H LYS 29 H LYS 29 29.877 7.427 -0.990 475 HA LYS 29 HA LYS 29 31.870 7.480 1.014 476 HB2 LYS 29 HB2 LYS 29 29.765 5.394 0.428 477 HB3 LYS 29 HB3 LYS 29 30.799 5.375 1.851 478 HG2 LYS 29 HG2 LYS 29 29.871 7.522 2.569 479 HG3 LYS 29 HG3 LYS 29 28.838 7.554 1.132 480 HD2 LYS 29 HD2 LYS 29 27.810 5.425 1.855 481 HD3 LYS 29 HD3 LYS 29 28.800 5.468 3.312 482 HE2 LYS 29 HE2 LYS 29 26.828 7.619 2.573 483 HE3 LYS 29 HE3 LYS 29 26.427 6.249 3.607 484 HZ1 LYS 29 HZ1 LYS 29 26.988 8.184 4.894 485 HZ2 LYS 29 HZ2 LYS 29 28.496 8.297 4.134 486 HZ3 LYS 29 HZ3 LYS 29 28.149 6.977 5.131 487 H ILE 30 H ILE 30 31.432 5.407 -1.789 488 HA ILE 30 HA ILE 30 33.527 3.555 -1.246 489 HB ILE 30 HB ILE 30 32.124 4.323 -3.789 490 HG12 ILE 30 HG12 ILE 30 32.024 1.823 -2.101 491 HG13 ILE 30 HG13 ILE 30 30.855 3.132 -2.038 492 HG21 ILE 30 HG21 ILE 30 34.515 3.514 -4.183 493 HG22 ILE 30 HG22 ILE 30 33.231 2.660 -5.038 494 HG23 ILE 30 HG23 ILE 30 33.961 1.946 -3.598 495 HD11 ILE 30 HD11 ILE 30 29.907 1.352 -3.320 496 HD12 ILE 30 HD12 ILE 30 31.350 1.236 -4.328 497 HD13 ILE 30 HD13 ILE 30 30.307 2.657 -4.439 498 H GLN 31 H GLN 31 33.372 6.534 -3.154 499 HA GLN 31 HA GLN 31 36.038 6.677 -4.009 500 HB2 GLN 31 HB2 GLN 31 34.203 8.135 -4.806 501 HB3 GLN 31 HB3 GLN 31 34.189 8.945 -3.238 502 HG2 GLN 31 HG2 GLN 31 36.508 9.667 -3.582 503 HG3 GLN 31 HG3 GLN 31 36.516 8.875 -5.160 504 HE21 GLN 31 HE21 GLN 31 36.888 10.719 -6.268 505 HE22 GLN 31 HE22 GLN 31 35.717 11.974 -6.467 506 H ASP 32 H ASP 32 34.526 7.610 -0.983 507 HA ASP 32 HA ASP 32 36.773 8.844 0.196 508 HB2 ASP 32 HB2 ASP 32 34.206 7.790 1.324 509 HB3 ASP 32 HB3 ASP 32 35.471 8.444 2.365 510 H LYS 33 H LYS 33 35.959 5.484 -0.057 511 HA LYS 33 HA LYS 33 38.076 4.831 1.864 512 HB2 LYS 33 HB2 LYS 33 35.880 3.154 0.699 513 HB3 LYS 33 HB3 LYS 33 37.256 2.437 1.539 514 HG2 LYS 33 HG2 LYS 33 36.654 4.105 3.438 515 HG3 LYS 33 HG3 LYS 33 35.085 4.189 2.631 516 HD2 LYS 33 HD2 LYS 33 34.946 2.500 4.343 517 HD3 LYS 33 HD3 LYS 33 34.962 1.691 2.775 518 HE2 LYS 33 HE2 LYS 33 37.350 1.214 3.026 519 HE3 LYS 33 HE3 LYS 33 37.361 2.052 4.578 520 HZ1 LYS 33 HZ1 LYS 33 35.845 0.413 5.436 521 HZ2 LYS 33 HZ2 LYS 33 37.249 -0.323 4.847 522 HZ3 LYS 33 HZ3 LYS 33 35.818 -0.385 3.946 523 H GLU 34 H GLU 34 37.273 4.374 -1.519 524 HA GLU 34 HA GLU 34 39.701 2.768 -1.889 525 HB2 GLU 34 HB2 GLU 34 37.184 2.967 -3.531 526 HB3 GLU 34 HB3 GLU 34 38.628 2.112 -4.065 527 HG2 GLU 34 HG2 GLU 34 37.098 1.517 -1.535 528 HG3 GLU 34 HG3 GLU 34 37.001 0.591 -3.030 529 H GLY 35 H GLY 35 38.210 5.715 -2.937 530 HA2 GLY 35 HA2 GLY 35 39.327 7.574 -3.892 531 HA3 GLY 35 HA3 GLY 35 40.625 6.507 -4.407 532 H ILE 36 H ILE 36 37.799 5.007 -5.156 533 HA ILE 36 HA ILE 36 38.058 5.377 -7.976 534 HB ILE 36 HB ILE 36 35.809 4.023 -6.474 535 HG12 ILE 36 HG12 ILE 36 38.257 2.782 -7.753 536 HG13 ILE 36 HG13 ILE 36 38.109 3.107 -6.028 537 HG21 ILE 36 HG21 ILE 36 35.360 2.874 -8.595 538 HG22 ILE 36 HG22 ILE 36 36.676 3.764 -9.365 539 HG23 ILE 36 HG23 ILE 36 35.244 4.623 -8.801 540 HD11 ILE 36 HD11 ILE 36 36.590 1.101 -7.682 541 HD12 ILE 36 HD12 ILE 36 36.042 1.611 -6.081 542 HD13 ILE 36 HD13 ILE 36 37.610 0.829 -6.267 543 HA PRO 37 HA PRO 37 35.540 9.076 -8.397 544 HB2 PRO 37 HB2 PRO 37 35.598 8.010 -11.198 545 HB3 PRO 37 HB3 PRO 37 35.835 9.674 -10.634 546 HG2 PRO 37 HG2 PRO 37 37.988 8.252 -11.314 547 HG3 PRO 37 HG3 PRO 37 38.028 9.190 -9.801 548 HD2 PRO 37 HD2 PRO 37 37.540 6.233 -10.170 549 HD3 PRO 37 HD3 PRO 37 38.549 7.052 -8.965 550 HA PRO 38 HA PRO 38 31.586 7.011 -7.963 551 HB2 PRO 38 HB2 PRO 38 30.680 9.807 -8.499 552 HB3 PRO 38 HB3 PRO 38 30.132 8.675 -7.248 553 HG2 PRO 38 HG2 PRO 38 31.837 10.606 -6.550 554 HG3 PRO 38 HG3 PRO 38 32.149 8.947 -5.980 555 HD2 PRO 38 HD2 PRO 38 33.425 10.412 -8.293 556 HD3 PRO 38 HD3 PRO 38 34.191 9.396 -7.059 557 H ASP 39 H ASP 39 32.141 9.307 -10.573 558 HA ASP 39 HA ASP 39 29.983 8.389 -12.215 559 HB2 ASP 39 HB2 ASP 39 30.906 9.979 -13.871 560 HB3 ASP 39 HB3 ASP 39 30.615 10.696 -12.298 561 H GLN 40 H GLN 40 32.422 6.621 -11.473 562 HA GLN 40 HA GLN 40 32.563 5.325 -14.091 563 HB2 GLN 40 HB2 GLN 40 34.707 6.495 -13.383 564 HB3 GLN 40 HB3 GLN 40 34.787 5.307 -12.081 565 HG2 GLN 40 HG2 GLN 40 34.597 3.539 -13.920 566 HG3 GLN 40 HG3 GLN 40 35.001 4.836 -15.044 567 HE21 GLN 40 HE21 GLN 40 36.303 4.643 -11.801 568 HE22 GLN 40 HE22 GLN 40 37.925 4.275 -12.270 569 H GLN 41 H GLN 41 31.263 5.068 -11.217 570 HA GLN 41 HA GLN 41 31.702 2.235 -10.737 571 HB2 GLN 41 HB2 GLN 41 30.160 4.336 -9.189 572 HB3 GLN 41 HB3 GLN 41 30.470 2.693 -8.634 573 HG2 GLN 41 HG2 GLN 41 32.880 3.175 -8.574 574 HG3 GLN 41 HG3 GLN 41 32.552 4.826 -9.126 575 HE21 GLN 41 HE21 GLN 41 33.186 5.924 -7.356 576 HE22 GLN 41 HE22 GLN 41 32.444 5.793 -5.801 577 H ARG 42 H ARG 42 30.245 0.790 -11.282 578 HA ARG 42 HA ARG 42 27.412 1.552 -11.680 579 HB2 ARG 42 HB2 ARG 42 29.033 -0.568 -13.117 580 HB3 ARG 42 HB3 ARG 42 27.278 -0.433 -13.247 581 HG2 ARG 42 HG2 ARG 42 27.469 1.744 -14.258 582 HG3 ARG 42 HG3 ARG 42 29.207 1.775 -13.961 583 HD2 ARG 42 HD2 ARG 42 28.896 1.253 -16.255 584 HD3 ARG 42 HD3 ARG 42 29.407 -0.234 -15.462 585 HE ARG 42 HE ARG 42 26.575 -0.091 -15.584 586 HH11 ARG 42 HH11 ARG 42 29.340 -0.653 -17.660 587 HH12 ARG 42 HH12 ARG 42 28.439 -1.587 -18.805 588 HH21 ARG 42 HH21 ARG 42 25.406 -1.261 -17.154 589 HH22 ARG 42 HH22 ARG 42 26.235 -1.928 -18.520 590 H LEU 43 H LEU 43 26.392 0.923 -9.927 591 HA LEU 43 HA LEU 43 27.305 -1.427 -8.423 592 HB2 LEU 43 HB2 LEU 43 25.333 0.732 -7.681 593 HB3 LEU 43 HB3 LEU 43 25.773 -0.615 -6.640 594 HG LEU 43 HG LEU 43 27.627 1.574 -7.604 595 HD11 LEU 43 HD11 LEU 43 25.965 2.222 -5.878 596 HD12 LEU 43 HD12 LEU 43 27.627 2.278 -5.285 597 HD13 LEU 43 HD13 LEU 43 26.579 0.929 -4.847 598 HD21 LEU 43 HD21 LEU 43 29.189 0.534 -5.889 599 HD22 LEU 43 HD22 LEU 43 28.978 -0.381 -7.388 600 HD23 LEU 43 HD23 LEU 43 28.133 -0.879 -5.919 601 H ILE 44 H ILE 44 26.178 -3.185 -8.093 602 HA ILE 44 HA ILE 44 23.523 -3.462 -9.369 603 HB ILE 44 HB ILE 44 25.834 -5.407 -9.337 604 HG12 ILE 44 HG12 ILE 44 25.293 -5.479 -11.824 605 HG13 ILE 44 HG13 ILE 44 24.298 -4.057 -11.546 606 HG21 ILE 44 HG21 ILE 44 23.589 -6.534 -8.870 607 HG22 ILE 44 HG22 ILE 44 24.531 -7.155 -10.224 608 HG23 ILE 44 HG23 ILE 44 23.155 -6.091 -10.519 609 HD11 ILE 44 HD11 ILE 44 26.477 -3.440 -12.431 610 HD12 ILE 44 HD12 ILE 44 27.275 -4.260 -11.089 611 HD13 ILE 44 HD13 ILE 44 26.287 -2.833 -10.787 612 H PHE 45 H PHE 45 21.990 -4.363 -8.233 613 HA PHE 45 HA PHE 45 22.508 -6.244 -6.093 614 HB2 PHE 45 HB2 PHE 45 22.515 -4.074 -4.879 615 HB3 PHE 45 HB3 PHE 45 20.910 -3.722 -5.542 616 HD1 PHE 45 HD1 PHE 45 22.751 -6.201 -3.454 617 HD2 PHE 45 HD2 PHE 45 18.979 -4.472 -4.481 618 HE1 PHE 45 HE1 PHE 45 21.677 -7.457 -1.617 619 HE2 PHE 45 HE2 PHE 45 17.901 -5.717 -2.630 620 HZ PHE 45 HZ PHE 45 19.255 -7.214 -1.207 621 H ALA 46 H ALA 46 21.119 -7.815 -6.260 622 HA ALA 46 HA ALA 46 19.365 -9.126 -6.837 623 HB1 ALA 46 HB1 ALA 46 18.162 -7.753 -5.257 624 HB2 ALA 46 HB2 ALA 46 17.098 -8.161 -6.602 625 HB3 ALA 46 HB3 ALA 46 17.819 -6.556 -6.508 626 H GLY 47 H GLY 47 20.930 -8.235 -8.901 627 HA2 GLY 47 HA2 GLY 47 21.109 -8.370 -11.189 628 HA3 GLY 47 HA3 GLY 47 19.465 -8.980 -11.209 629 H LYS 48 H LYS 48 20.336 -5.858 -9.937 630 HA LYS 48 HA LYS 48 19.157 -4.450 -12.254 631 HB2 LYS 48 HB2 LYS 48 18.547 -4.176 -9.315 632 HB3 LYS 48 HB3 LYS 48 18.306 -2.816 -10.411 633 HG2 LYS 48 HG2 LYS 48 16.793 -4.206 -11.780 634 HG3 LYS 48 HG3 LYS 48 17.004 -5.529 -10.633 635 HD2 LYS 48 HD2 LYS 48 15.719 -2.848 -10.127 636 HD3 LYS 48 HD3 LYS 48 14.947 -4.427 -10.113 637 HE2 LYS 48 HE2 LYS 48 16.981 -3.403 -8.122 638 HE3 LYS 48 HE3 LYS 48 15.255 -3.651 -7.842 639 HZ1 LYS 48 HZ1 LYS 48 17.331 -5.687 -8.300 640 HZ2 LYS 48 HZ2 LYS 48 15.682 -6.031 -8.437 641 HZ3 LYS 48 HZ3 LYS 48 16.315 -5.505 -6.960 642 H GLN 49 H GLN 49 20.250 -2.687 -12.897 643 HA GLN 49 HA GLN 49 22.688 -1.861 -11.542 644 HB2 GLN 49 HB2 GLN 49 21.305 -0.591 -13.926 645 HB3 GLN 49 HB3 GLN 49 22.946 -0.259 -13.373 646 HG2 GLN 49 HG2 GLN 49 23.390 -2.754 -13.740 647 HG3 GLN 49 HG3 GLN 49 21.883 -2.759 -14.660 648 HE21 GLN 49 HE21 GLN 49 22.675 -3.069 -16.649 649 HE22 GLN 49 HE22 GLN 49 23.734 -1.984 -17.475 650 H LEU 50 H LEU 50 22.898 -0.193 -10.213 651 HA LEU 50 HA LEU 50 20.461 0.967 -9.184 652 HB2 LEU 50 HB2 LEU 50 23.293 1.367 -8.222 653 HB3 LEU 50 HB3 LEU 50 21.817 1.741 -7.338 654 HG LEU 50 HG LEU 50 22.824 -0.994 -8.119 655 HD11 LEU 50 HD11 LEU 50 23.859 0.205 -6.170 656 HD12 LEU 50 HD12 LEU 50 23.152 -1.371 -5.814 657 HD13 LEU 50 HD13 LEU 50 22.285 0.102 -5.381 658 HD21 LEU 50 HD21 LEU 50 20.531 -1.347 -8.303 659 HD22 LEU 50 HD22 LEU 50 20.154 -0.185 -7.031 660 HD23 LEU 50 HD23 LEU 50 20.858 -1.750 -6.614 661 H GLU 51 H GLU 51 19.825 2.990 -9.193 662 HA GLU 51 HA GLU 51 20.944 4.717 -11.273 663 HB2 GLU 51 HB2 GLU 51 18.260 4.763 -9.894 664 HB3 GLU 51 HB3 GLU 51 18.708 5.763 -11.267 665 HG2 GLU 51 HG2 GLU 51 18.449 2.751 -11.253 666 HG3 GLU 51 HG3 GLU 51 17.288 3.888 -11.934 667 H ASP 52 H ASP 52 21.729 6.689 -10.821 668 HA ASP 52 HA ASP 52 22.787 7.214 -8.322 669 HB2 ASP 52 HB2 ASP 52 22.338 9.001 -10.685 670 HB3 ASP 52 HB3 ASP 52 23.130 9.599 -9.226 671 H GLY 53 H GLY 53 19.901 8.692 -9.729 672 HA2 GLY 53 HA2 GLY 53 19.357 10.382 -7.463 673 HA3 GLY 53 HA3 GLY 53 18.358 10.189 -8.888 674 H ARG 54 H ARG 54 18.992 7.160 -7.570 675 HA ARG 54 HA ARG 54 16.445 7.143 -6.084 676 HB2 ARG 54 HB2 ARG 54 18.062 4.813 -7.135 677 HB3 ARG 54 HB3 ARG 54 16.510 4.687 -6.326 678 HG2 ARG 54 HG2 ARG 54 17.019 5.993 -9.002 679 HG3 ARG 54 HG3 ARG 54 16.329 4.399 -8.759 680 HD2 ARG 54 HD2 ARG 54 15.060 6.943 -7.747 681 HD3 ARG 54 HD3 ARG 54 14.692 6.229 -9.319 682 HE ARG 54 HE ARG 54 14.356 4.589 -6.933 683 HH11 ARG 54 HH11 ARG 54 12.766 6.388 -9.512 684 HH12 ARG 54 HH12 ARG 54 11.209 5.726 -9.136 685 HH21 ARG 54 HH21 ARG 54 12.295 3.933 -6.364 686 HH22 ARG 54 HH22 ARG 54 10.941 4.353 -7.360 687 H THR 55 H THR 55 16.554 5.401 -4.245 688 HA THR 55 HA THR 55 19.008 5.902 -2.680 689 HB THR 55 HB THR 55 17.568 5.825 -0.634 690 HG1 THR 55 HG1 THR 55 15.239 6.446 -1.856 691 HG21 THR 55 HG21 THR 55 18.237 8.000 -1.489 692 HG22 THR 55 HG22 THR 55 16.579 8.094 -0.901 693 HG23 THR 55 HG23 THR 55 16.896 8.004 -2.634 694 H LEU 56 H LEU 56 19.101 4.333 -0.734 695 HA LEU 56 HA LEU 56 19.368 1.696 -1.700 696 HB2 LEU 56 HB2 LEU 56 19.292 2.747 1.119 697 HB3 LEU 56 HB3 LEU 56 19.721 1.083 0.721 698 HG LEU 56 HG LEU 56 21.191 3.574 -0.189 699 HD11 LEU 56 HD11 LEU 56 21.383 3.001 2.226 700 HD12 LEU 56 HD12 LEU 56 22.913 2.874 1.352 701 HD13 LEU 56 HD13 LEU 56 22.003 1.419 1.756 702 HD21 LEU 56 HD21 LEU 56 21.524 1.908 -1.884 703 HD22 LEU 56 HD22 LEU 56 21.728 0.642 -0.663 704 HD23 LEU 56 HD23 LEU 56 22.961 1.894 -0.853 705 H SER 57 H SER 57 16.860 3.212 0.214 706 HA SER 57 HA SER 57 15.289 0.983 0.868 707 HB2 SER 57 HB2 SER 57 13.433 2.626 1.148 708 HB3 SER 57 HB3 SER 57 14.921 3.133 1.946 709 HG SER 57 HG SER 57 13.801 4.094 -0.463 710 H ASP 58 H ASP 58 15.627 2.714 -2.120 711 HA ASP 58 HA ASP 58 13.162 1.900 -3.322 712 HB2 ASP 58 HB2 ASP 58 15.681 3.151 -4.362 713 HB3 ASP 58 HB3 ASP 58 14.443 2.584 -5.475 714 H TYR 59 H TYR 59 15.733 0.063 -2.485 715 HA TYR 59 HA TYR 59 15.146 -1.953 -4.555 716 HB2 TYR 59 HB2 TYR 59 17.865 -1.265 -3.434 717 HB3 TYR 59 HB3 TYR 59 17.526 -2.583 -4.552 718 HD1 TYR 59 HD1 TYR 59 16.490 -1.949 -6.820 719 HD2 TYR 59 HD2 TYR 59 18.435 0.836 -4.247 720 HE1 TYR 59 HE1 TYR 59 16.975 -0.510 -8.758 721 HE2 TYR 59 HE2 TYR 59 18.932 2.280 -6.175 722 HH TYR 59 HH TYR 59 18.882 2.445 -8.390 723 H ASN 60 H ASN 60 15.185 -1.162 -1.347 724 HA ASN 60 HA ASN 60 14.872 -2.240 0.597 725 HB2 ASN 60 HB2 ASN 60 13.374 -3.622 -1.046 726 HB3 ASN 60 HB3 ASN 60 14.561 -4.887 -0.748 727 HD21 ASN 60 HD21 ASN 60 13.077 -6.172 0.304 728 HD22 ASN 60 HD22 ASN 60 12.495 -5.815 1.888 729 H ILE 61 H ILE 61 17.465 -1.888 -0.354 730 HA ILE 61 HA ILE 61 19.147 -4.110 0.363 731 HB ILE 61 HB ILE 61 19.779 -1.163 0.096 732 HG12 ILE 61 HG12 ILE 61 20.224 -3.454 -1.823 733 HG13 ILE 61 HG13 ILE 61 18.924 -2.276 -1.951 734 HG21 ILE 61 HG21 ILE 61 21.428 -2.309 1.511 735 HG22 ILE 61 HG22 ILE 61 22.149 -1.815 -0.026 736 HG23 ILE 61 HG23 ILE 61 21.690 -3.503 0.243 737 HD11 ILE 61 HD11 ILE 61 21.881 -1.697 -2.197 738 HD12 ILE 61 HD12 ILE 61 20.583 -0.505 -2.329 739 HD13 ILE 61 HD13 ILE 61 20.717 -1.800 -3.521 740 H GLN 62 H GLN 62 19.017 -4.865 2.346 741 HA GLN 62 HA GLN 62 18.703 -3.008 4.596 742 HB2 GLN 62 HB2 GLN 62 18.155 -5.975 4.422 743 HB3 GLN 62 HB3 GLN 62 17.884 -4.979 5.844 744 HG2 GLN 62 HG2 GLN 62 16.264 -3.630 4.485 745 HG3 GLN 62 HG3 GLN 62 16.444 -4.820 3.196 746 HE21 GLN 62 HE21 GLN 62 16.738 -6.949 5.336 747 HE22 GLN 62 HE22 GLN 62 15.117 -7.265 5.839 748 H LYS 63 H LYS 63 19.580 -4.477 6.694 749 HA LYS 63 HA LYS 63 22.395 -4.180 6.569 750 HB2 LYS 63 HB2 LYS 63 22.458 -5.092 8.804 751 HB3 LYS 63 HB3 LYS 63 21.061 -4.037 8.670 752 HG2 LYS 63 HG2 LYS 63 19.612 -6.014 8.387 753 HG3 LYS 63 HG3 LYS 63 21.026 -7.054 8.599 754 HD2 LYS 63 HD2 LYS 63 21.398 -6.055 10.827 755 HD3 LYS 63 HD3 LYS 63 19.939 -5.081 10.611 756 HE2 LYS 63 HE2 LYS 63 18.651 -7.212 10.325 757 HE3 LYS 63 HE3 LYS 63 20.118 -8.091 10.781 758 HZ1 LYS 63 HZ1 LYS 63 18.721 -6.064 12.422 759 HZ2 LYS 63 HZ2 LYS 63 20.144 -6.870 12.857 760 HZ3 LYS 63 HZ3 LYS 63 18.703 -7.737 12.678 761 H GLU 64 H GLU 64 24.013 -5.598 6.284 762 HA GLU 64 HA GLU 64 25.183 -7.510 5.849 763 HB2 GLU 64 HB2 GLU 64 22.828 -8.533 7.109 764 HB3 GLU 64 HB3 GLU 64 23.267 -9.597 5.781 765 HG2 GLU 64 HG2 GLU 64 24.254 -10.279 7.920 766 HG3 GLU 64 HG3 GLU 64 25.472 -9.910 6.701 767 H SER 65 H SER 65 23.005 -6.199 3.874 768 HA SER 65 HA SER 65 22.784 -8.129 1.760 769 HB2 SER 65 HB2 SER 65 22.625 -5.103 1.711 770 HB3 SER 65 HB3 SER 65 22.258 -6.131 0.324 771 HG SER 65 HG SER 65 20.900 -6.973 2.497 772 H THR 66 H THR 66 24.082 -8.451 0.005 773 HA THR 66 HA THR 66 26.507 -6.792 -0.123 774 HB THR 66 HB THR 66 27.954 -8.458 -0.408 775 HG1 THR 66 HG1 THR 66 27.693 -9.586 -2.128 776 HG21 THR 66 HG21 THR 66 26.065 -9.275 1.451 777 HG22 THR 66 HG22 THR 66 27.690 -9.935 1.254 778 HG23 THR 66 HG23 THR 66 26.321 -10.694 0.437 779 H LEU 67 H LEU 67 26.984 -5.852 -1.829 780 HA LEU 67 HA LEU 67 25.331 -6.074 -4.265 781 HB2 LEU 67 HB2 LEU 67 26.913 -3.835 -2.986 782 HB3 LEU 67 HB3 LEU 67 26.327 -3.722 -4.634 783 HG LEU 67 HG LEU 67 24.006 -3.813 -3.821 784 HD11 LEU 67 HD11 LEU 67 24.423 -5.108 -1.697 785 HD12 LEU 67 HD12 LEU 67 23.411 -3.677 -1.504 786 HD13 LEU 67 HD13 LEU 67 25.106 -3.632 -1.016 787 HD21 LEU 67 HD21 LEU 67 25.112 -1.678 -4.103 788 HD22 LEU 67 HD22 LEU 67 25.764 -1.777 -2.468 789 HD23 LEU 67 HD23 LEU 67 24.023 -1.613 -2.715 790 H HIS 68 H HIS 68 26.519 -5.588 -6.251 791 HA HIS 68 HA HIS 68 29.354 -6.405 -6.162 792 HB2 HIS 68 HB2 HIS 68 27.206 -7.023 -8.185 793 HB3 HIS 68 HB3 HIS 68 28.923 -7.131 -8.605 794 HD1 HIS 68 HD1 HIS 68 26.416 -8.800 -6.291 795 HD2 HIS 68 HD2 HIS 68 30.277 -9.163 -7.676 796 HE1 HIS 68 HE1 HIS 68 27.206 -11.093 -5.543 797 HE2 HIS 68 HE2 HIS 68 29.625 -11.195 -6.299 798 H LEU 69 H LEU 69 30.790 -5.424 -7.443 799 HA LEU 69 HA LEU 69 30.042 -2.784 -8.546 800 HB2 LEU 69 HB2 LEU 69 31.440 -2.587 -6.563 801 HB3 LEU 69 HB3 LEU 69 32.597 -3.734 -7.225 802 HG LEU 69 HG LEU 69 33.087 -2.126 -9.058 803 HD11 LEU 69 HD11 LEU 69 31.431 -0.185 -7.450 804 HD12 LEU 69 HD12 LEU 69 30.961 -0.868 -9.008 805 HD13 LEU 69 HD13 LEU 69 32.383 0.177 -8.892 806 HD21 LEU 69 HD21 LEU 69 34.620 -2.174 -7.262 807 HD22 LEU 69 HD22 LEU 69 33.523 -1.281 -6.209 808 HD23 LEU 69 HD23 LEU 69 34.286 -0.470 -7.577 809 H VAL 70 H VAL 70 30.361 -2.491 -10.627 810 HA VAL 70 HA VAL 70 32.285 -4.175 -12.095 811 HB VAL 70 HB VAL 70 29.743 -2.789 -13.060 812 HG11 VAL 70 HG11 VAL 70 31.345 -2.556 -14.823 813 HG12 VAL 70 HG12 VAL 70 30.210 -3.824 -15.284 814 HG13 VAL 70 HG13 VAL 70 31.813 -4.252 -14.690 815 HG21 VAL 70 HG21 VAL 70 29.582 -5.019 -11.807 816 HG22 VAL 70 HG22 VAL 70 30.299 -5.735 -13.249 817 HG23 VAL 70 HG23 VAL 70 28.750 -4.896 -13.356 818 H LEU 71 H LEU 71 33.852 -3.029 -13.223 819 HA LEU 71 HA LEU 71 34.104 -0.225 -12.475 820 HB2 LEU 71 HB2 LEU 71 35.902 -2.287 -12.438 821 HB3 LEU 71 HB3 LEU 71 36.299 -1.507 -13.961 822 HG LEU 71 HG LEU 71 36.208 0.653 -12.436 823 HD11 LEU 71 HD11 LEU 71 35.530 -0.699 -10.459 824 HD12 LEU 71 HD12 LEU 71 36.959 0.301 -10.205 825 HD13 LEU 71 HD13 LEU 71 37.134 -1.433 -10.475 826 HD21 LEU 71 HD21 LEU 71 38.561 -1.216 -12.874 827 HD22 LEU 71 HD22 LEU 71 38.749 0.347 -12.077 828 HD23 LEU 71 HD23 LEU 71 38.171 0.270 -13.742 Start of MODEL 2 1 H GLY 12 H GLY 12 6.690 -11.494 -1.565 2 HA2 GLY 12 HA2 GLY 12 8.678 -11.214 0.388 3 HA3 GLY 12 HA3 GLY 12 9.319 -12.253 -0.877 4 HA PRO 13 HA PRO 13 10.316 -8.708 -3.298 5 HB2 PRO 13 HB2 PRO 13 9.496 -9.282 -5.843 6 HB3 PRO 13 HB3 PRO 13 10.926 -9.998 -5.092 7 HG2 PRO 13 HG2 PRO 13 8.203 -11.156 -5.481 8 HG3 PRO 13 HG3 PRO 13 9.783 -11.952 -5.569 9 HD2 PRO 13 HD2 PRO 13 8.095 -12.138 -3.402 10 HD3 PRO 13 HD3 PRO 13 9.856 -12.326 -3.296 11 H MET 14 H MET 14 8.669 -7.502 -2.040 12 HA MET 14 HA MET 14 6.097 -6.990 -3.167 13 HB2 MET 14 HB2 MET 14 7.716 -5.741 -0.952 14 HB3 MET 14 HB3 MET 14 6.207 -4.995 -1.493 15 HG2 MET 14 HG2 MET 14 6.379 -7.909 -0.740 16 HG3 MET 14 HG3 MET 14 5.990 -6.645 0.443 17 HE1 MET 14 HE1 MET 14 2.441 -7.509 0.302 18 HE2 MET 14 HE2 MET 14 3.465 -6.252 0.998 19 HE3 MET 14 HE3 MET 14 4.004 -7.930 1.002 20 H LEU 15 H LEU 15 6.648 -6.471 -5.353 21 HA LEU 15 HA LEU 15 8.262 -4.187 -5.983 22 HB2 LEU 15 HB2 LEU 15 7.122 -6.375 -7.396 23 HB3 LEU 15 HB3 LEU 15 6.473 -4.906 -8.130 24 HG LEU 15 HG LEU 15 8.801 -4.025 -8.365 25 HD11 LEU 15 HD11 LEU 15 10.540 -5.023 -7.352 26 HD12 LEU 15 HD12 LEU 15 10.143 -6.566 -8.110 27 HD13 LEU 15 HD13 LEU 15 9.397 -6.117 -6.574 28 HD21 LEU 15 HD21 LEU 15 7.739 -5.164 -10.239 29 HD22 LEU 15 HD22 LEU 15 8.253 -6.728 -9.606 30 HD23 LEU 15 HD23 LEU 15 9.453 -5.575 -10.186 31 H CYS 16 H CYS 16 7.599 -2.141 -6.661 32 HA CYS 16 HA CYS 16 5.617 -0.828 -5.348 33 HB2 CYS 16 HB2 CYS 16 7.489 0.128 -6.821 34 HB3 CYS 16 HB3 CYS 16 6.335 -0.016 -8.158 35 H SER 17 H SER 17 3.506 -0.503 -5.439 36 HA SER 17 HA SER 17 1.825 -2.150 -7.003 37 HB2 SER 17 HB2 SER 17 1.128 0.342 -5.424 38 HB3 SER 17 HB3 SER 17 -0.022 -0.876 -5.989 39 HG SER 17 HG SER 17 1.738 -2.270 -4.751 40 H THR 18 H THR 18 2.961 1.162 -7.418 41 HA THR 18 HA THR 18 1.082 1.849 -9.458 42 HB THR 18 HB THR 18 2.561 3.791 -9.857 43 HG1 THR 18 HG1 THR 18 4.533 2.622 -9.354 44 HG21 THR 18 HG21 THR 18 2.057 3.178 -6.936 45 HG22 THR 18 HG22 THR 18 0.860 3.822 -8.061 46 HG23 THR 18 HG23 THR 18 2.277 4.783 -7.632 47 H GLY 19 H GLY 19 3.882 -0.138 -9.524 48 HA2 GLY 19 HA2 GLY 19 4.781 -1.338 -11.297 49 HA3 GLY 19 HA3 GLY 19 3.617 -0.558 -12.359 50 H CYS 20 H CYS 20 6.121 0.910 -10.281 51 HA CYS 20 HA CYS 20 6.991 2.513 -12.523 52 HB2 CYS 20 HB2 CYS 20 8.317 3.754 -10.923 53 HB3 CYS 20 HB3 CYS 20 6.729 3.459 -10.215 54 H GLY 21 H GLY 21 7.948 -0.502 -11.185 55 HA2 GLY 21 HA2 GLY 21 9.510 -1.926 -12.277 56 HA3 GLY 21 HA3 GLY 21 10.312 -0.509 -12.931 57 H PHE 22 H PHE 22 9.749 0.034 -9.663 58 HA PHE 22 HA PHE 22 12.438 -0.955 -8.959 59 HB2 PHE 22 HB2 PHE 22 11.016 1.587 -8.190 60 HB3 PHE 22 HB3 PHE 22 12.446 1.000 -7.325 61 HD1 PHE 22 HD1 PHE 22 14.598 0.784 -8.468 62 HD2 PHE 22 HD2 PHE 22 11.209 2.518 -10.408 63 HE1 PHE 22 HE1 PHE 22 16.080 1.705 -10.214 64 HE2 PHE 22 HE2 PHE 22 12.684 3.455 -12.155 65 HZ PHE 22 HZ PHE 22 15.121 3.046 -12.060 66 H TYR 23 H TYR 23 12.561 -0.749 -6.334 67 HA TYR 23 HA TYR 23 10.477 -2.598 -5.425 68 HB2 TYR 23 HB2 TYR 23 13.329 -2.155 -4.715 69 HB3 TYR 23 HB3 TYR 23 12.249 -2.715 -3.433 70 HD1 TYR 23 HD1 TYR 23 11.108 -4.907 -3.638 71 HD2 TYR 23 HD2 TYR 23 13.909 -3.538 -6.551 72 HE1 TYR 23 HE1 TYR 23 11.276 -7.200 -4.544 73 HE2 TYR 23 HE2 TYR 23 14.091 -5.817 -7.470 74 HH TYR 23 HH TYR 23 13.717 -8.155 -6.725 75 H GLY 24 H GLY 24 9.251 -2.241 -3.593 76 HA2 GLY 24 HA2 GLY 24 9.335 0.511 -2.512 77 HA3 GLY 24 HA3 GLY 24 7.886 -0.484 -2.615 78 H ASN 25 H ASN 25 8.715 0.763 -0.228 79 HA ASN 25 HA ASN 25 9.999 -1.272 1.405 80 HB2 ASN 25 HB2 ASN 25 8.931 1.494 2.020 81 HB3 ASN 25 HB3 ASN 25 9.578 0.405 3.250 82 HD21 ASN 25 HD21 ASN 25 11.310 1.867 3.709 83 HD22 ASN 25 HD22 ASN 25 12.642 2.031 2.623 84 HA PRO 26 HA PRO 26 5.950 -3.002 2.455 85 HB2 PRO 26 HB2 PRO 26 6.719 -4.649 4.464 86 HB3 PRO 26 HB3 PRO 26 6.941 -5.041 2.752 87 HG2 PRO 26 HG2 PRO 26 8.902 -3.935 4.724 88 HG3 PRO 26 HG3 PRO 26 9.140 -5.207 3.511 89 HD2 PRO 26 HD2 PRO 26 9.988 -2.660 3.115 90 HD3 PRO 26 HD3 PRO 26 9.411 -3.672 1.778 91 H ARG 27 H ARG 27 8.050 -1.276 4.639 92 HA ARG 27 HA ARG 27 6.183 -1.118 6.823 93 HB2 ARG 27 HB2 ARG 27 8.682 0.433 6.103 94 HB3 ARG 27 HB3 ARG 27 7.712 0.817 7.527 95 HG2 ARG 27 HG2 ARG 27 7.960 -1.568 8.258 96 HG3 ARG 27 HG3 ARG 27 9.080 -1.806 6.921 97 HD2 ARG 27 HD2 ARG 27 10.568 -1.283 8.627 98 HD3 ARG 27 HD3 ARG 27 10.299 0.302 7.890 99 HE ARG 27 HE ARG 27 8.660 -0.468 9.341 100 HH11 ARG 27 HH11 ARG 27 11.851 0.437 9.577 101 HH12 ARG 27 HH12 ARG 27 11.995 1.254 11.097 102 HH21 ARG 27 HH21 ARG 27 8.641 0.982 11.898 103 HH22 ARG 27 HH22 ARG 27 10.198 1.557 12.396 104 H THR 28 H THR 28 6.894 0.739 3.922 105 HA THR 28 HA THR 28 5.185 2.955 4.622 106 HB THR 28 HB THR 28 5.675 3.759 2.352 107 HG1 THR 28 HG1 THR 28 6.066 1.134 1.919 108 HG21 THR 28 HG21 THR 28 8.255 3.570 2.470 109 HG22 THR 28 HG22 THR 28 7.981 2.646 3.944 110 HG23 THR 28 HG23 THR 28 7.417 4.316 3.832 111 H ASN 29 H ASN 29 3.881 3.100 1.926 112 HA ASN 29 HA ASN 29 1.648 1.324 2.518 113 HB2 ASN 29 HB2 ASN 29 2.068 3.744 0.789 114 HB3 ASN 29 HB3 ASN 29 0.667 2.699 0.504 115 HD21 ASN 29 HD21 ASN 29 -1.072 3.667 1.491 116 HD22 ASN 29 HD22 ASN 29 -1.052 4.339 3.082 117 H GLY 30 H GLY 30 4.201 0.242 1.316 118 HA2 GLY 30 HA2 GLY 30 4.548 -1.588 -0.104 119 HA3 GLY 30 HA3 GLY 30 2.959 -1.309 -0.812 120 H MET 31 H MET 31 4.790 1.569 -0.637 121 HA MET 31 HA MET 31 5.605 1.282 -3.461 122 HB2 MET 31 HB2 MET 31 4.167 3.464 -2.000 123 HB3 MET 31 HB3 MET 31 5.230 3.906 -3.350 124 HG2 MET 31 HG2 MET 31 3.098 3.604 -4.317 125 HG3 MET 31 HG3 MET 31 3.979 2.116 -4.696 126 HE1 MET 31 HE1 MET 31 -0.070 2.070 -3.471 127 HE2 MET 31 HE2 MET 31 0.897 2.538 -4.869 128 HE3 MET 31 HE3 MET 31 0.801 3.605 -3.467 129 H CYS 32 H CYS 32 7.361 2.727 -4.122 130 HA CYS 32 HA CYS 32 9.542 2.626 -2.291 131 HB2 CYS 32 HB2 CYS 32 10.811 3.699 -4.172 132 HB3 CYS 32 HB3 CYS 32 9.910 2.269 -4.675 133 H SER 33 H SER 33 10.967 4.964 -2.529 134 HA SER 33 HA SER 33 9.531 6.666 -0.720 135 HB2 SER 33 HB2 SER 33 11.640 8.059 -0.823 136 HB3 SER 33 HB3 SER 33 11.892 6.379 -0.343 137 HG SER 33 HG SER 33 13.206 6.288 -1.965 138 H VAL 34 H VAL 34 9.737 6.583 -4.099 139 HA VAL 34 HA VAL 34 9.475 9.432 -4.515 140 HB VAL 34 HB VAL 34 9.188 7.209 -6.539 141 HG11 VAL 34 HG11 VAL 34 9.731 8.982 -8.162 142 HG12 VAL 34 HG12 VAL 34 9.784 10.154 -6.844 143 HG13 VAL 34 HG13 VAL 34 8.263 9.367 -7.259 144 HG21 VAL 34 HG21 VAL 34 11.536 7.587 -7.081 145 HG22 VAL 34 HG22 VAL 34 11.388 7.143 -5.379 146 HG23 VAL 34 HG23 VAL 34 11.642 8.828 -5.834 147 H CYS 35 H CYS 35 7.371 6.587 -4.803 148 HA CYS 35 HA CYS 35 5.102 8.166 -5.641 149 HB2 CYS 35 HB2 CYS 35 5.365 5.242 -4.926 150 HB3 CYS 35 HB3 CYS 35 3.909 5.987 -5.601 151 H TYR 36 H TYR 36 6.351 6.948 -2.642 152 HA TYR 36 HA TYR 36 4.013 6.830 -1.111 153 HB2 TYR 36 HB2 TYR 36 6.138 5.897 -0.329 154 HB3 TYR 36 HB3 TYR 36 6.835 7.515 -0.230 155 HD1 TYR 36 HD1 TYR 36 3.420 6.407 0.868 156 HD2 TYR 36 HD2 TYR 36 7.325 7.765 2.025 157 HE1 TYR 36 HE1 TYR 36 2.651 6.614 3.219 158 HE2 TYR 36 HE2 TYR 36 6.560 7.978 4.375 159 HH TYR 36 HH TYR 36 3.626 6.643 5.502 160 H LYS 37 H LYS 37 6.241 9.605 -1.558 161 HA LYS 37 HA LYS 37 4.661 11.321 0.095 162 HB2 LYS 37 HB2 LYS 37 6.106 13.147 -0.737 163 HB3 LYS 37 HB3 LYS 37 7.058 11.764 -0.203 164 HG2 LYS 37 HG2 LYS 37 7.275 11.019 -2.546 165 HG3 LYS 37 HG3 LYS 37 6.356 12.440 -3.063 166 HD2 LYS 37 HD2 LYS 37 8.099 13.853 -1.890 167 HD3 LYS 37 HD3 LYS 37 9.064 12.376 -1.731 168 HE2 LYS 37 HE2 LYS 37 8.799 12.091 -4.248 169 HE3 LYS 37 HE3 LYS 37 8.177 13.752 -4.264 170 HZ1 LYS 37 HZ1 LYS 37 10.227 14.505 -3.240 171 HZ2 LYS 37 HZ2 LYS 37 10.557 13.705 -4.694 172 HZ3 LYS 37 HZ3 LYS 37 10.831 12.926 -3.218 173 H GLU 38 H GLU 38 5.003 10.849 -3.391 174 HA GLU 38 HA GLU 38 3.417 12.925 -4.325 175 HB2 GLU 38 HB2 GLU 38 4.058 10.186 -5.391 176 HB3 GLU 38 HB3 GLU 38 2.935 11.244 -6.260 177 HG2 GLU 38 HG2 GLU 38 5.632 12.243 -5.368 178 HG3 GLU 38 HG3 GLU 38 5.422 11.385 -6.904 179 H HIS 39 H HIS 39 2.399 9.701 -3.173 180 HA HIS 39 HA HIS 39 -0.356 10.325 -3.833 181 HB2 HIS 39 HB2 HIS 39 -0.916 8.082 -3.354 182 HB3 HIS 39 HB3 HIS 39 0.681 7.998 -4.084 183 HD1 HIS 39 HD1 HIS 39 1.917 6.168 -2.995 184 HD2 HIS 39 HD2 HIS 39 -0.340 8.313 -0.217 185 HE1 HIS 39 HE1 HIS 39 2.285 5.052 -0.757 186 HE2 HIS 39 HE2 HIS 39 1.223 6.590 0.957 187 H LEU 40 H LEU 40 1.657 10.246 -0.977 188 HA LEU 40 HA LEU 40 -0.357 10.339 0.998 189 HB2 LEU 40 HB2 LEU 40 2.144 9.945 1.328 190 HB3 LEU 40 HB3 LEU 40 2.337 11.696 1.203 191 HG LEU 40 HG LEU 40 0.573 11.882 3.053 192 HD11 LEU 40 HD11 LEU 40 -0.205 9.503 2.792 193 HD12 LEU 40 HD12 LEU 40 0.244 9.932 4.445 194 HD13 LEU 40 HD13 LEU 40 1.350 8.985 3.453 195 HD21 LEU 40 HD21 LEU 40 2.282 11.293 4.826 196 HD22 LEU 40 HD22 LEU 40 2.879 12.357 3.551 197 HD23 LEU 40 HD23 LEU 40 3.289 10.643 3.535 198 H GLN 41 H GLN 41 1.006 12.832 -1.056 199 HA GLN 41 HA GLN 41 0.136 15.095 0.406 200 HB2 GLN 41 HB2 GLN 41 1.094 14.558 -2.369 201 HB3 GLN 41 HB3 GLN 41 0.250 16.085 -2.079 202 HG2 GLN 41 HG2 GLN 41 1.800 16.657 -0.297 203 HG3 GLN 41 HG3 GLN 41 2.616 15.096 -0.471 204 HE21 GLN 41 HE21 GLN 41 2.222 18.269 -1.880 205 HE22 GLN 41 HE22 GLN 41 3.467 18.087 -3.064 206 H ARG 42 H ARG 42 -1.404 13.156 -2.136 207 HA ARG 42 HA ARG 42 -3.712 14.877 -2.314 208 HB2 ARG 42 HB2 ARG 42 -3.063 12.151 -3.439 209 HB3 ARG 42 HB3 ARG 42 -4.621 12.945 -3.707 210 HG2 ARG 42 HG2 ARG 42 -3.611 14.767 -4.851 211 HG3 ARG 42 HG3 ARG 42 -1.993 14.285 -4.316 212 HD2 ARG 42 HD2 ARG 42 -2.305 12.145 -5.591 213 HD3 ARG 42 HD3 ARG 42 -3.776 12.842 -6.281 214 HE ARG 42 HE ARG 42 -1.032 13.195 -6.698 215 HH11 ARG 42 HH11 ARG 42 -4.300 14.841 -6.758 216 HH12 ARG 42 HH12 ARG 42 -3.994 16.072 -7.938 217 HH21 ARG 42 HH21 ARG 42 -0.750 15.063 -8.580 218 HH22 ARG 42 HH22 ARG 42 -2.006 16.194 -8.957 219 H GLN 43 H GLN 43 -2.830 11.972 -0.563 220 HA GLN 43 HA GLN 43 -5.494 11.322 0.277 221 HB2 GLN 43 HB2 GLN 43 -3.364 9.805 0.131 222 HB3 GLN 43 HB3 GLN 43 -3.024 10.439 1.746 223 HG2 GLN 43 HG2 GLN 43 -4.266 8.573 2.281 224 HG3 GLN 43 HG3 GLN 43 -5.543 9.793 2.184 225 HE21 GLN 43 HE21 GLN 43 -7.137 8.219 1.573 226 HE22 GLN 43 HE22 GLN 43 -7.126 7.492 0.006 227 H GLN 44 H GLN 44 -2.762 13.120 1.607 228 HA GLN 44 HA GLN 44 -3.925 13.544 4.186 229 HB2 GLN 44 HB2 GLN 44 -1.431 13.662 3.509 230 HB3 GLN 44 HB3 GLN 44 -1.803 15.308 2.977 231 HG2 GLN 44 HG2 GLN 44 -2.509 15.954 5.166 232 HG3 GLN 44 HG3 GLN 44 -2.469 14.278 5.733 233 HE21 GLN 44 HE21 GLN 44 -0.196 16.535 4.118 234 HE22 GLN 44 HE22 GLN 44 1.140 16.112 5.128 235 H ASN 45 H ASN 45 -3.723 15.435 1.191 236 HA ASN 45 HA ASN 45 -4.868 17.815 2.226 237 HB2 ASN 45 HB2 ASN 45 -4.446 16.697 -0.532 238 HB3 ASN 45 HB3 ASN 45 -5.434 18.147 -0.319 239 HD21 ASN 45 HD21 ASN 45 -2.664 17.769 -1.504 240 HD22 ASN 45 HD22 ASN 45 -1.687 18.905 -0.644 241 H SER 46 H SER 46 -6.258 14.987 0.590 242 HA SER 46 HA SER 46 -8.924 16.038 0.547 243 HB2 SER 46 HB2 SER 46 -7.858 14.184 -0.951 244 HB3 SER 46 HB3 SER 46 -8.298 13.102 0.377 245 HG SER 46 HG SER 46 -10.010 14.747 -1.176 246 H1 MET 1 H1 MET 1 22.531 -0.361 10.102 247 H2 MET 1 H2 MET 1 23.229 0.290 8.705 248 H3 MET 1 H3 MET 1 24.183 0.003 10.072 249 HA MET 1 HA MET 1 23.849 -2.352 9.869 250 HB2 MET 1 HB2 MET 1 22.645 -3.285 7.991 251 HB3 MET 1 HB3 MET 1 21.586 -2.157 8.824 252 HG2 MET 1 HG2 MET 1 22.054 -0.461 7.119 253 HG3 MET 1 HG3 MET 1 23.118 -1.589 6.288 254 HE1 MET 1 HE1 MET 1 20.399 -1.633 3.654 255 HE2 MET 1 HE2 MET 1 22.123 -1.599 4.029 256 HE3 MET 1 HE3 MET 1 21.090 -0.251 4.507 257 H GLN 2 H GLN 2 25.457 -3.526 8.818 258 HA GLN 2 HA GLN 2 27.143 -1.934 7.019 259 HB2 GLN 2 HB2 GLN 2 28.928 -3.354 7.539 260 HB3 GLN 2 HB3 GLN 2 28.062 -3.179 9.058 261 HG2 GLN 2 HG2 GLN 2 27.018 -5.357 8.741 262 HG3 GLN 2 HG3 GLN 2 27.812 -5.526 7.179 263 HE21 GLN 2 HE21 GLN 2 30.240 -4.199 8.427 264 HE22 GLN 2 HE22 GLN 2 31.012 -5.480 9.295 265 H ILE 3 H ILE 3 27.662 -2.507 5.013 266 HA ILE 3 HA ILE 3 26.720 -5.072 3.966 267 HB ILE 3 HB ILE 3 25.803 -4.298 2.024 268 HG12 ILE 3 HG12 ILE 3 27.382 -2.625 1.331 269 HG13 ILE 3 HG13 ILE 3 25.733 -2.070 1.118 270 HG21 ILE 3 HG21 ILE 3 24.286 -4.082 3.873 271 HG22 ILE 3 HG22 ILE 3 23.916 -2.925 2.596 272 HG23 ILE 3 HG23 ILE 3 24.736 -2.387 4.063 273 HD11 ILE 3 HD11 ILE 3 27.743 -0.607 2.165 274 HD12 ILE 3 HD12 ILE 3 27.014 -1.246 3.636 275 HD13 ILE 3 HD13 ILE 3 26.028 -0.320 2.499 276 H PHE 4 H PHE 4 27.888 -5.664 1.978 277 HA PHE 4 HA PHE 4 30.686 -4.719 2.181 278 HB2 PHE 4 HB2 PHE 4 29.717 -7.437 1.244 279 HB3 PHE 4 HB3 PHE 4 31.389 -6.969 1.612 280 HD1 PHE 4 HD1 PHE 4 31.934 -6.293 4.036 281 HD2 PHE 4 HD2 PHE 4 28.311 -8.266 2.905 282 HE1 PHE 4 HE1 PHE 4 31.531 -6.915 6.393 283 HE2 PHE 4 HE2 PHE 4 27.920 -8.908 5.261 284 HZ PHE 4 HZ PHE 4 29.531 -8.222 7.005 285 H VAL 5 H VAL 5 31.749 -4.144 0.403 286 HA VAL 5 HA VAL 5 30.423 -4.375 -2.231 287 HB VAL 5 HB VAL 5 32.141 -2.077 -1.244 288 HG11 VAL 5 HG11 VAL 5 32.567 -2.322 -3.579 289 HG12 VAL 5 HG12 VAL 5 31.406 -1.006 -3.419 290 HG13 VAL 5 HG13 VAL 5 30.863 -2.606 -3.929 291 HG21 VAL 5 HG21 VAL 5 29.269 -1.892 -2.120 292 HG22 VAL 5 HG22 VAL 5 30.219 -0.730 -1.182 293 HG23 VAL 5 HG23 VAL 5 29.696 -2.246 -0.447 294 H LYS 6 H LYS 6 31.430 -6.072 -3.003 295 HA LYS 6 HA LYS 6 34.250 -6.600 -2.709 296 HB2 LYS 6 HB2 LYS 6 32.103 -7.759 -4.498 297 HB3 LYS 6 HB3 LYS 6 33.749 -8.374 -4.408 298 HG2 LYS 6 HG2 LYS 6 33.449 -8.979 -2.084 299 HG3 LYS 6 HG3 LYS 6 31.829 -8.270 -2.082 300 HD2 LYS 6 HD2 LYS 6 31.728 -10.713 -2.359 301 HD3 LYS 6 HD3 LYS 6 31.114 -9.877 -3.786 302 HE2 LYS 6 HE2 LYS 6 33.427 -10.156 -4.791 303 HE3 LYS 6 HE3 LYS 6 33.784 -11.248 -3.449 304 HZ1 LYS 6 HZ1 LYS 6 31.625 -11.568 -5.439 305 HZ2 LYS 6 HZ2 LYS 6 31.920 -12.608 -4.139 306 HZ3 LYS 6 HZ3 LYS 6 33.065 -12.454 -5.375 307 H THR 7 H THR 7 35.843 -5.961 -3.961 308 HA THR 7 HA THR 7 35.246 -4.703 -6.566 309 HB THR 7 HB THR 7 37.449 -3.720 -6.501 310 HG1 THR 7 HG1 THR 7 37.807 -5.611 -4.485 311 HG21 THR 7 HG21 THR 7 36.517 -3.391 -3.663 312 HG22 THR 7 HG22 THR 7 35.591 -2.714 -5.008 313 HG23 THR 7 HG23 THR 7 37.253 -2.188 -4.722 314 H LEU 8 H LEU 8 36.949 -5.224 -8.260 315 HA LEU 8 HA LEU 8 36.814 -8.068 -8.598 316 HB2 LEU 8 HB2 LEU 8 37.841 -5.984 -10.507 317 HB3 LEU 8 HB3 LEU 8 37.456 -7.658 -10.903 318 HG LEU 8 HG LEU 8 35.526 -5.555 -9.923 319 HD11 LEU 8 HD11 LEU 8 36.303 -5.393 -12.289 320 HD12 LEU 8 HD12 LEU 8 34.562 -5.607 -12.092 321 HD13 LEU 8 HD13 LEU 8 35.570 -6.972 -12.567 322 HD21 LEU 8 HD21 LEU 8 35.120 -8.495 -10.357 323 HD22 LEU 8 HD22 LEU 8 33.794 -7.350 -10.556 324 HD23 LEU 8 HD23 LEU 8 34.611 -7.493 -8.999 325 H THR 9 H THR 9 39.274 -5.942 -7.635 326 HA THR 9 HA THR 9 41.564 -7.548 -8.009 327 HB THR 9 HB THR 9 42.417 -6.436 -5.919 328 HG1 THR 9 HG1 THR 9 39.945 -5.041 -6.051 329 HG21 THR 9 HG21 THR 9 41.334 -4.751 -8.167 330 HG22 THR 9 HG22 THR 9 42.953 -5.434 -8.017 331 HG23 THR 9 HG23 THR 9 42.437 -4.137 -6.938 332 H GLY 10 H GLY 10 38.945 -7.686 -5.710 333 HA2 GLY 10 HA2 GLY 10 38.370 -9.969 -4.876 334 HA3 GLY 10 HA3 GLY 10 40.071 -10.128 -4.457 335 H LYS 11 H LYS 11 40.115 -7.250 -3.606 336 HA LYS 11 HA LYS 11 39.637 -7.521 -0.844 337 HB2 LYS 11 HB2 LYS 11 41.094 -5.784 -2.095 338 HB3 LYS 11 HB3 LYS 11 39.597 -4.861 -2.267 339 HG2 LYS 11 HG2 LYS 11 39.595 -5.566 0.401 340 HG3 LYS 11 HG3 LYS 11 41.292 -5.227 0.079 341 HD2 LYS 11 HD2 LYS 11 39.028 -3.356 -0.604 342 HD3 LYS 11 HD3 LYS 11 39.954 -3.271 0.888 343 HE2 LYS 11 HE2 LYS 11 41.196 -3.046 -1.849 344 HE3 LYS 11 HE3 LYS 11 40.640 -1.656 -0.919 345 HZ1 LYS 11 HZ1 LYS 11 42.722 -3.592 -0.108 346 HZ2 LYS 11 HZ2 LYS 11 42.162 -2.309 0.843 347 HZ3 LYS 11 HZ3 LYS 11 42.974 -1.995 -0.606 348 H THR 12 H THR 12 38.042 -6.729 0.472 349 HA THR 12 HA THR 12 35.441 -6.029 -0.777 350 HB THR 12 HB THR 12 35.984 -7.689 1.700 351 HG1 THR 12 HG1 THR 12 36.124 -9.102 0.108 352 HG21 THR 12 HG21 THR 12 33.323 -6.905 0.497 353 HG22 THR 12 HG22 THR 12 33.948 -6.360 2.054 354 HG23 THR 12 HG23 THR 12 33.545 -8.061 1.808 355 H ILE 13 H ILE 13 34.647 -4.184 -0.200 356 HA ILE 13 HA ILE 13 35.795 -2.615 2.013 357 HB ILE 13 HB ILE 13 33.521 -1.660 0.333 358 HG12 ILE 13 HG12 ILE 13 34.900 -2.463 -1.438 359 HG13 ILE 13 HG13 ILE 13 35.043 -0.716 -1.385 360 HG21 ILE 13 HG21 ILE 13 34.329 -0.318 2.188 361 HG22 ILE 13 HG22 ILE 13 34.512 0.523 0.651 362 HG23 ILE 13 HG23 ILE 13 35.919 -0.206 1.430 363 HD11 ILE 13 HD11 ILE 13 37.186 -1.844 -1.861 364 HD12 ILE 13 HD12 ILE 13 37.072 -2.667 -0.308 365 HD13 ILE 13 HD13 ILE 13 37.245 -0.911 -0.359 366 H THR 14 H THR 14 34.758 -2.498 3.918 367 HA THR 14 HA THR 14 31.931 -3.354 4.099 368 HB THR 14 HB THR 14 33.960 -2.872 6.299 369 HG1 THR 14 HG1 THR 14 34.409 -4.766 5.166 370 HG21 THR 14 HG21 THR 14 31.628 -2.441 7.031 371 HG22 THR 14 HG22 THR 14 32.331 -3.854 7.821 372 HG23 THR 14 HG23 THR 14 31.189 -4.061 6.494 373 H LEU 15 H LEU 15 30.411 -1.909 4.386 374 HA LEU 15 HA LEU 15 31.134 0.843 5.191 375 HB2 LEU 15 HB2 LEU 15 29.039 -0.018 3.199 376 HB3 LEU 15 HB3 LEU 15 29.304 1.643 3.715 377 HG LEU 15 HG LEU 15 31.372 -0.054 2.298 378 HD11 LEU 15 HD11 LEU 15 29.661 2.165 1.181 379 HD12 LEU 15 HD12 LEU 15 29.331 0.449 0.930 380 HD13 LEU 15 HD13 LEU 15 30.823 1.172 0.301 381 HD21 LEU 15 HD21 LEU 15 31.328 2.716 3.387 382 HD22 LEU 15 HD22 LEU 15 32.144 2.457 1.842 383 HD23 LEU 15 HD23 LEU 15 32.664 1.564 3.273 384 H GLU 16 H GLU 16 29.897 1.848 6.621 385 HA GLU 16 HA GLU 16 27.583 0.484 7.836 386 HB2 GLU 16 HB2 GLU 16 29.327 1.302 9.374 387 HB3 GLU 16 HB3 GLU 16 29.175 2.920 8.704 388 HG2 GLU 16 HG2 GLU 16 28.012 2.757 10.841 389 HG3 GLU 16 HG3 GLU 16 26.883 3.066 9.525 390 H VAL 17 H VAL 17 25.746 0.930 6.895 391 HA VAL 17 HA VAL 17 25.208 3.650 5.902 392 HB VAL 17 HB VAL 17 24.135 2.757 3.927 393 HG11 VAL 17 HG11 VAL 17 26.596 3.320 3.945 394 HG12 VAL 17 HG12 VAL 17 26.046 2.266 2.635 395 HG13 VAL 17 HG13 VAL 17 26.887 1.576 4.025 396 HG21 VAL 17 HG21 VAL 17 25.106 0.033 4.755 397 HG22 VAL 17 HG22 VAL 17 24.234 0.432 3.272 398 HG23 VAL 17 HG23 VAL 17 23.436 0.595 4.838 399 H GLU 18 H GLU 18 22.894 3.865 5.268 400 HA GLU 18 HA GLU 18 20.978 2.349 6.934 401 HB2 GLU 18 HB2 GLU 18 20.877 5.243 6.012 402 HB3 GLU 18 HB3 GLU 18 19.577 4.419 6.864 403 HG2 GLU 18 HG2 GLU 18 22.341 4.974 7.931 404 HG3 GLU 18 HG3 GLU 18 20.862 5.801 8.397 405 H SER 19 H SER 19 18.986 1.833 5.880 406 HA SER 19 HA SER 19 19.069 1.208 3.134 407 HB2 SER 19 HB2 SER 19 16.589 1.561 4.839 408 HB3 SER 19 HB3 SER 19 16.694 0.685 3.309 409 HG SER 19 HG SER 19 18.502 -0.478 4.587 410 H SER 20 H SER 20 18.012 4.039 4.797 411 HA SER 20 HA SER 20 16.617 5.314 2.682 412 HB2 SER 20 HB2 SER 20 16.857 7.368 4.122 413 HB3 SER 20 HB3 SER 20 16.075 5.983 4.887 414 HG SER 20 HG SER 20 18.670 7.021 5.308 415 H ASP 21 H ASP 21 19.953 4.881 3.081 416 HA ASP 21 HA ASP 21 20.934 7.317 2.019 417 HB2 ASP 21 HB2 ASP 21 22.100 4.537 2.000 418 HB3 ASP 21 HB3 ASP 21 22.962 5.937 1.369 419 H THR 22 H THR 22 20.976 8.133 0.111 420 HA THR 22 HA THR 22 19.826 6.887 -2.198 421 HB THR 22 HB THR 22 20.577 8.828 -3.441 422 HG1 THR 22 HG1 THR 22 22.035 10.279 -2.624 423 HG21 THR 22 HG21 THR 22 19.587 9.614 -0.701 424 HG22 THR 22 HG22 THR 22 18.593 9.185 -2.093 425 HG23 THR 22 HG23 THR 22 19.563 10.658 -2.121 426 H ILE 23 H ILE 23 20.938 6.236 -4.111 427 HA ILE 23 HA ILE 23 23.252 4.674 -3.770 428 HB ILE 23 HB ILE 23 22.010 5.790 -6.266 429 HG12 ILE 23 HG12 ILE 23 20.488 4.398 -5.079 430 HG13 ILE 23 HG13 ILE 23 21.041 3.523 -6.501 431 HG21 ILE 23 HG21 ILE 23 23.168 4.017 -7.536 432 HG22 ILE 23 HG22 ILE 23 24.112 3.637 -6.089 433 HG23 ILE 23 HG23 ILE 23 24.254 5.225 -6.848 434 HD11 ILE 23 HD11 ILE 23 20.946 1.951 -4.741 435 HD12 ILE 23 HD12 ILE 23 21.749 3.045 -3.614 436 HD13 ILE 23 HD13 ILE 23 22.662 2.320 -4.939 437 H ASP 24 H ASP 24 22.851 7.935 -5.009 438 HA ASP 24 HA ASP 24 25.485 8.524 -5.755 439 HB2 ASP 24 HB2 ASP 24 23.581 9.979 -6.288 440 HB3 ASP 24 HB3 ASP 24 23.383 10.353 -4.572 441 H ASN 25 H ASN 25 23.897 8.747 -2.621 442 HA ASN 25 HA ASN 25 26.003 9.870 -1.121 443 HB2 ASN 25 HB2 ASN 25 23.714 9.860 -0.327 444 HB3 ASN 25 HB3 ASN 25 23.694 8.100 -0.315 445 HD21 ASN 25 HD21 ASN 25 23.687 7.393 1.609 446 HD22 ASN 25 HD22 ASN 25 24.607 7.973 2.951 447 H VAL 26 H VAL 26 25.152 6.505 -1.805 448 HA VAL 26 HA VAL 26 27.129 5.241 -0.226 449 HB VAL 26 HB VAL 26 25.676 4.324 -2.709 450 HG11 VAL 26 HG11 VAL 26 26.366 2.012 -2.066 451 HG12 VAL 26 HG12 VAL 26 27.491 2.712 -0.900 452 HG13 VAL 26 HG13 VAL 26 27.711 3.005 -2.626 453 HG21 VAL 26 HG21 VAL 26 25.291 3.096 -0.038 454 HG22 VAL 26 HG22 VAL 26 24.119 3.417 -1.322 455 HG23 VAL 26 HG23 VAL 26 24.663 4.729 -0.272 456 H LYS 27 H LYS 27 27.141 6.173 -3.660 457 HA LYS 27 HA LYS 27 29.703 5.268 -4.325 458 HB2 LYS 27 HB2 LYS 27 28.075 7.544 -5.470 459 HB3 LYS 27 HB3 LYS 27 29.577 6.952 -6.186 460 HG2 LYS 27 HG2 LYS 27 28.600 4.724 -6.427 461 HG3 LYS 27 HG3 LYS 27 27.087 5.306 -5.721 462 HD2 LYS 27 HD2 LYS 27 26.800 6.866 -7.558 463 HD3 LYS 27 HD3 LYS 27 28.348 6.366 -8.261 464 HE2 LYS 27 HE2 LYS 27 27.499 4.112 -8.574 465 HE3 LYS 27 HE3 LYS 27 25.957 4.545 -7.818 466 HZ1 LYS 27 HZ1 LYS 27 27.084 5.701 -10.304 467 HZ2 LYS 27 HZ2 LYS 27 25.603 6.125 -9.605 468 HZ3 LYS 27 HZ3 LYS 27 25.833 4.566 -10.222 469 H SER 28 H SER 28 28.661 8.333 -2.965 470 HA SER 28 HA SER 28 31.150 9.659 -2.850 471 HB2 SER 28 HB2 SER 28 28.973 10.789 -2.482 472 HB3 SER 28 HB3 SER 28 28.816 9.934 -0.941 473 HG SER 28 HG SER 28 29.898 11.597 -0.198 474 H LYS 29 H LYS 29 29.572 7.454 -0.581 475 HA LYS 29 HA LYS 29 31.526 7.472 1.460 476 HB2 LYS 29 HB2 LYS 29 29.597 5.297 0.642 477 HB3 LYS 29 HB3 LYS 29 30.609 5.223 2.079 478 HG2 LYS 29 HG2 LYS 29 29.508 7.220 2.971 479 HG3 LYS 29 HG3 LYS 29 28.496 7.307 1.520 480 HD2 LYS 29 HD2 LYS 29 27.626 5.047 2.024 481 HD3 LYS 29 HD3 LYS 29 28.588 5.031 3.500 482 HE2 LYS 29 HE2 LYS 29 26.468 7.086 2.918 483 HE3 LYS 29 HE3 LYS 29 26.158 5.600 3.813 484 HZ1 LYS 29 HZ1 LYS 29 26.550 7.445 5.282 485 HZ2 LYS 29 HZ2 LYS 29 28.054 7.742 4.569 486 HZ3 LYS 29 HZ3 LYS 29 27.796 6.311 5.434 487 H ILE 30 H ILE 30 31.290 5.641 -1.527 488 HA ILE 30 HA ILE 30 33.512 3.909 -1.113 489 HB ILE 30 HB ILE 30 32.091 4.801 -3.603 490 HG12 ILE 30 HG12 ILE 30 32.159 2.156 -2.153 491 HG13 ILE 30 HG13 ILE 30 30.893 3.362 -1.996 492 HG21 ILE 30 HG21 ILE 30 34.543 4.214 -4.019 493 HG22 ILE 30 HG22 ILE 30 33.341 3.349 -4.974 494 HG23 ILE 30 HG23 ILE 30 34.102 2.561 -3.591 495 HD11 ILE 30 HD11 ILE 30 30.104 1.642 -3.454 496 HD12 ILE 30 HD12 ILE 30 31.564 1.729 -4.438 497 HD13 ILE 30 HD13 ILE 30 30.417 3.072 -4.441 498 H GLN 31 H GLN 31 33.156 7.032 -2.742 499 HA GLN 31 HA GLN 31 35.815 7.452 -3.525 500 HB2 GLN 31 HB2 GLN 31 33.885 8.838 -4.223 501 HB3 GLN 31 HB3 GLN 31 33.787 9.495 -2.589 502 HG2 GLN 31 HG2 GLN 31 36.048 10.417 -2.818 503 HG3 GLN 31 HG3 GLN 31 36.139 9.776 -4.460 504 HE21 GLN 31 HE21 GLN 31 36.385 11.741 -5.388 505 HE22 GLN 31 HE22 GLN 31 35.123 12.916 -5.494 506 H ASP 32 H ASP 32 34.194 7.986 -0.460 507 HA ASP 32 HA ASP 32 36.321 9.271 0.875 508 HB2 ASP 32 HB2 ASP 32 33.827 7.927 1.846 509 HB3 ASP 32 HB3 ASP 32 35.024 8.574 2.970 510 H LYS 33 H LYS 33 35.773 5.896 0.299 511 HA LYS 33 HA LYS 33 37.905 5.229 2.199 512 HB2 LYS 33 HB2 LYS 33 35.861 3.508 0.839 513 HB3 LYS 33 HB3 LYS 33 37.277 2.821 1.638 514 HG2 LYS 33 HG2 LYS 33 36.521 4.256 3.668 515 HG3 LYS 33 HG3 LYS 33 34.962 4.297 2.840 516 HD2 LYS 33 HD2 LYS 33 34.927 2.450 4.388 517 HD3 LYS 33 HD3 LYS 33 35.028 1.794 2.752 518 HE2 LYS 33 HE2 LYS 33 37.442 1.477 3.010 519 HE3 LYS 33 HE3 LYS 33 37.367 2.166 4.631 520 HZ1 LYS 33 HZ1 LYS 33 35.969 0.345 5.305 521 HZ2 LYS 33 HZ2 LYS 33 37.434 -0.225 4.680 522 HZ3 LYS 33 HZ3 LYS 33 36.026 -0.311 3.746 523 H GLU 34 H GLU 34 37.187 5.030 -1.228 524 HA GLU 34 HA GLU 34 39.738 3.651 -1.694 525 HB2 GLU 34 HB2 GLU 34 37.237 3.812 -3.362 526 HB3 GLU 34 HB3 GLU 34 38.749 3.121 -3.942 527 HG2 GLU 34 HG2 GLU 34 37.232 2.182 -1.509 528 HG3 GLU 34 HG3 GLU 34 37.229 1.393 -3.084 529 H GLY 35 H GLY 35 38.039 6.563 -2.498 530 HA2 GLY 35 HA2 GLY 35 39.024 8.580 -3.257 531 HA3 GLY 35 HA3 GLY 35 40.407 7.666 -3.839 532 H ILE 36 H ILE 36 37.716 6.035 -4.781 533 HA ILE 36 HA ILE 36 37.987 6.683 -7.550 534 HB ILE 36 HB ILE 36 35.826 5.030 -6.225 535 HG12 ILE 36 HG12 ILE 36 38.381 4.100 -7.560 536 HG13 ILE 36 HG13 ILE 36 38.184 4.252 -5.815 537 HG21 ILE 36 HG21 ILE 36 35.498 4.050 -8.452 538 HG22 ILE 36 HG22 ILE 36 36.752 5.104 -9.109 539 HG23 ILE 36 HG23 ILE 36 35.250 5.798 -8.499 540 HD11 ILE 36 HD11 ILE 36 36.848 2.300 -7.678 541 HD12 ILE 36 HD12 ILE 36 36.239 2.617 -6.050 542 HD13 ILE 36 HD13 ILE 36 37.864 1.974 -6.272 543 HA PRO 37 HA PRO 37 35.196 10.204 -7.685 544 HB2 PRO 37 HB2 PRO 37 35.377 9.409 -10.570 545 HB3 PRO 37 HB3 PRO 37 35.478 11.027 -9.850 546 HG2 PRO 37 HG2 PRO 37 37.742 9.839 -10.612 547 HG3 PRO 37 HG3 PRO 37 37.688 10.634 -9.019 548 HD2 PRO 37 HD2 PRO 37 37.435 7.698 -9.666 549 HD3 PRO 37 HD3 PRO 37 38.361 8.474 -8.370 550 HA PRO 38 HA PRO 38 31.409 7.817 -7.525 551 HB2 PRO 38 HB2 PRO 38 30.298 10.574 -7.823 552 HB3 PRO 38 HB3 PRO 38 29.820 9.293 -6.691 553 HG2 PRO 38 HG2 PRO 38 31.361 11.273 -5.786 554 HG3 PRO 38 HG3 PRO 38 31.792 9.597 -5.364 555 HD2 PRO 38 HD2 PRO 38 32.984 11.362 -7.503 556 HD3 PRO 38 HD3 PRO 38 33.808 10.297 -6.352 557 H ASP 39 H ASP 39 31.822 10.378 -9.902 558 HA ASP 39 HA ASP 39 29.765 9.458 -11.667 559 HB2 ASP 39 HB2 ASP 39 30.586 11.260 -13.151 560 HB3 ASP 39 HB3 ASP 39 30.219 11.804 -11.526 561 H GLN 40 H GLN 40 32.322 7.817 -11.039 562 HA GLN 40 HA GLN 40 32.605 6.792 -13.773 563 HB2 GLN 40 HB2 GLN 40 34.637 8.041 -12.901 564 HB3 GLN 40 HB3 GLN 40 34.789 6.747 -11.712 565 HG2 GLN 40 HG2 GLN 40 34.762 5.146 -13.709 566 HG3 GLN 40 HG3 GLN 40 35.081 6.568 -14.701 567 HE21 GLN 40 HE21 GLN 40 36.346 6.174 -11.463 568 HE22 GLN 40 HE22 GLN 40 37.998 5.976 -11.928 569 H GLN 41 H GLN 41 31.283 6.168 -10.951 570 HA GLN 41 HA GLN 41 31.929 3.340 -10.720 571 HB2 GLN 41 HB2 GLN 41 30.211 5.167 -9.020 572 HB3 GLN 41 HB3 GLN 41 30.637 3.507 -8.612 573 HG2 GLN 41 HG2 GLN 41 33.002 4.161 -8.456 574 HG3 GLN 41 HG3 GLN 41 32.554 5.826 -8.863 575 HE21 GLN 41 HE21 GLN 41 33.078 6.801 -6.986 576 HE22 GLN 41 HE22 GLN 41 32.326 6.471 -5.465 577 H ARG 42 H ARG 42 30.596 1.846 -11.426 578 HA ARG 42 HA ARG 42 27.721 2.428 -11.814 579 HB2 ARG 42 HB2 ARG 42 29.520 0.577 -13.403 580 HB3 ARG 42 HB3 ARG 42 27.762 0.591 -13.556 581 HG2 ARG 42 HG2 ARG 42 27.799 2.860 -14.361 582 HG3 ARG 42 HG3 ARG 42 29.525 2.995 -14.026 583 HD2 ARG 42 HD2 ARG 42 29.288 2.665 -16.365 584 HD3 ARG 42 HD3 ARG 42 29.900 1.153 -15.699 585 HE ARG 42 HE ARG 42 27.069 1.095 -15.867 586 HH11 ARG 42 HH11 ARG 42 29.897 0.938 -17.927 587 HH12 ARG 42 HH12 ARG 42 29.087 0.047 -19.171 588 HH21 ARG 42 HH21 ARG 42 26.015 -0.009 -17.562 589 HH22 ARG 42 HH22 ARG 42 26.911 -0.484 -18.966 590 H LEU 43 H LEU 43 26.725 1.562 -10.146 591 HA LEU 43 HA LEU 43 27.796 -0.840 -8.845 592 HB2 LEU 43 HB2 LEU 43 25.653 1.085 -7.950 593 HB3 LEU 43 HB3 LEU 43 26.180 -0.315 -7.028 594 HG LEU 43 HG LEU 43 27.874 2.088 -7.749 595 HD11 LEU 43 HD11 LEU 43 26.143 2.445 -6.006 596 HD12 LEU 43 HD12 LEU 43 27.788 2.571 -5.376 597 HD13 LEU 43 HD13 LEU 43 26.839 1.111 -5.085 598 HD21 LEU 43 HD21 LEU 43 29.485 1.013 -6.103 599 HD22 LEU 43 HD22 LEU 43 29.366 0.228 -7.684 600 HD23 LEU 43 HD23 LEU 43 28.542 -0.466 -6.285 601 H ILE 44 H ILE 44 26.802 -2.702 -8.700 602 HA ILE 44 HA ILE 44 24.196 -3.058 -10.052 603 HB ILE 44 HB ILE 44 26.647 -4.819 -10.149 604 HG12 ILE 44 HG12 ILE 44 26.150 -4.700 -12.642 605 HG13 ILE 44 HG13 ILE 44 25.046 -3.390 -12.256 606 HG21 ILE 44 HG21 ILE 44 24.489 -6.149 -9.834 607 HG22 ILE 44 HG22 ILE 44 25.497 -6.569 -11.220 608 HG23 ILE 44 HG23 ILE 44 24.047 -5.589 -11.447 609 HD11 ILE 44 HD11 ILE 44 27.182 -2.530 -13.036 610 HD12 ILE 44 HD12 ILE 44 28.022 -3.409 -11.758 611 HD13 ILE 44 HD13 ILE 44 26.923 -2.094 -11.348 612 H PHE 45 H PHE 45 22.719 -4.173 -9.038 613 HA PHE 45 HA PHE 45 23.350 -6.200 -7.068 614 HB2 PHE 45 HB2 PHE 45 23.173 -4.157 -5.660 615 HB3 PHE 45 HB3 PHE 45 21.555 -3.867 -6.323 616 HD1 PHE 45 HD1 PHE 45 23.551 -6.383 -4.432 617 HD2 PHE 45 HD2 PHE 45 19.672 -4.857 -5.375 618 HE1 PHE 45 HE1 PHE 45 22.550 -7.882 -2.737 619 HE2 PHE 45 HE2 PHE 45 18.668 -6.344 -3.670 620 HZ PHE 45 HZ PHE 45 20.110 -7.860 -2.360 621 H ALA 46 H ALA 46 22.088 -7.850 -7.407 622 HA ALA 46 HA ALA 46 20.483 -9.231 -8.213 623 HB1 ALA 46 HB1 ALA 46 19.211 -8.230 -6.413 624 HB2 ALA 46 HB2 ALA 46 18.148 -8.566 -7.780 625 HB3 ALA 46 HB3 ALA 46 18.694 -6.918 -7.474 626 H GLY 47 H GLY 47 21.884 -7.976 -10.155 627 HA2 GLY 47 HA2 GLY 47 21.994 -7.763 -12.440 628 HA3 GLY 47 HA3 GLY 47 20.382 -8.451 -12.510 629 H LYS 48 H LYS 48 21.139 -5.509 -10.811 630 HA LYS 48 HA LYS 48 19.812 -3.843 -12.864 631 HB2 LYS 48 HB2 LYS 48 19.358 -3.910 -9.870 632 HB3 LYS 48 HB3 LYS 48 18.864 -2.548 -10.874 633 HG2 LYS 48 HG2 LYS 48 17.411 -4.013 -12.181 634 HG3 LYS 48 HG3 LYS 48 17.929 -5.396 -11.217 635 HD2 LYS 48 HD2 LYS 48 16.693 -2.992 -9.916 636 HD3 LYS 48 HD3 LYS 48 15.688 -4.238 -10.644 637 HE2 LYS 48 HE2 LYS 48 17.760 -4.780 -8.509 638 HE3 LYS 48 HE3 LYS 48 16.047 -4.500 -8.183 639 HZ1 LYS 48 HZ1 LYS 48 17.092 -6.645 -9.925 640 HZ2 LYS 48 HZ2 LYS 48 15.481 -6.403 -9.469 641 HZ3 LYS 48 HZ3 LYS 48 16.629 -6.853 -8.311 642 H GLN 49 H GLN 49 20.894 -2.049 -13.359 643 HA GLN 49 HA GLN 49 23.274 -1.243 -11.895 644 HB2 GLN 49 HB2 GLN 49 21.878 0.164 -14.192 645 HB3 GLN 49 HB3 GLN 49 23.494 0.515 -13.582 646 HG2 GLN 49 HG2 GLN 49 24.048 -1.920 -14.145 647 HG3 GLN 49 HG3 GLN 49 22.557 -1.909 -15.091 648 HE21 GLN 49 HE21 GLN 49 23.392 -2.023 -17.083 649 HE22 GLN 49 HE22 GLN 49 24.417 -0.831 -17.797 650 H LEU 50 H LEU 50 23.395 0.319 -10.429 651 HA LEU 50 HA LEU 50 20.895 1.289 -9.356 652 HB2 LEU 50 HB2 LEU 50 23.694 1.721 -8.311 653 HB3 LEU 50 HB3 LEU 50 22.190 1.963 -7.428 654 HG LEU 50 HG LEU 50 23.320 -0.655 -8.410 655 HD11 LEU 50 HD11 LEU 50 24.274 0.419 -6.351 656 HD12 LEU 50 HD12 LEU 50 23.628 -1.209 -6.139 657 HD13 LEU 50 HD13 LEU 50 22.695 0.186 -5.602 658 HD21 LEU 50 HD21 LEU 50 21.049 -1.083 -8.666 659 HD22 LEU 50 HD22 LEU 50 20.604 -0.047 -7.310 660 HD23 LEU 50 HD23 LEU 50 21.366 -1.612 -7.009 661 H GLU 51 H GLU 51 20.177 3.280 -9.211 662 HA GLU 51 HA GLU 51 21.322 5.250 -11.056 663 HB2 GLU 51 HB2 GLU 51 18.532 4.714 -10.065 664 HB3 GLU 51 HB3 GLU 51 18.930 6.179 -10.950 665 HG2 GLU 51 HG2 GLU 51 19.235 3.353 -11.978 666 HG3 GLU 51 HG3 GLU 51 17.918 4.452 -12.379 667 H ASP 52 H ASP 52 21.715 7.312 -10.397 668 HA ASP 52 HA ASP 52 22.623 7.687 -7.813 669 HB2 ASP 52 HB2 ASP 52 21.966 9.655 -9.975 670 HB3 ASP 52 HB3 ASP 52 22.622 10.187 -8.426 671 H GLY 53 H GLY 53 19.580 8.881 -9.161 672 HA2 GLY 53 HA2 GLY 53 18.737 10.193 -6.742 673 HA3 GLY 53 HA3 GLY 53 17.811 10.027 -8.218 674 H ARG 54 H ARG 54 18.863 6.989 -7.229 675 HA ARG 54 HA ARG 54 16.326 6.434 -5.827 676 HB2 ARG 54 HB2 ARG 54 18.233 4.486 -7.135 677 HB3 ARG 54 HB3 ARG 54 16.694 4.069 -6.402 678 HG2 ARG 54 HG2 ARG 54 17.183 5.627 -8.935 679 HG3 ARG 54 HG3 ARG 54 16.425 4.055 -8.778 680 HD2 ARG 54 HD2 ARG 54 15.289 6.685 -7.820 681 HD3 ARG 54 HD3 ARG 54 14.784 5.798 -9.261 682 HE ARG 54 HE ARG 54 14.580 4.468 -6.677 683 HH11 ARG 54 HH11 ARG 54 12.848 6.037 -9.314 684 HH12 ARG 54 HH12 ARG 54 11.305 5.493 -8.743 685 HH21 ARG 54 HH21 ARG 54 12.551 3.978 -5.874 686 HH22 ARG 54 HH22 ARG 54 11.135 4.342 -6.803 687 H THR 55 H THR 55 16.549 4.686 -4.122 688 HA THR 55 HA THR 55 19.001 5.153 -2.543 689 HB THR 55 HB THR 55 17.649 4.921 -0.501 690 HG1 THR 55 HG1 THR 55 15.192 5.251 -1.374 691 HG21 THR 55 HG21 THR 55 17.987 7.184 -1.397 692 HG22 THR 55 HG22 THR 55 16.415 7.050 -0.614 693 HG23 THR 55 HG23 THR 55 16.527 7.029 -2.374 694 H LEU 56 H LEU 56 19.190 3.430 -0.741 695 HA LEU 56 HA LEU 56 19.584 0.904 -1.931 696 HB2 LEU 56 HB2 LEU 56 19.478 1.702 0.969 697 HB3 LEU 56 HB3 LEU 56 19.986 0.102 0.426 698 HG LEU 56 HG LEU 56 21.321 2.733 -0.271 699 HD11 LEU 56 HD11 LEU 56 21.561 1.966 2.085 700 HD12 LEU 56 HD12 LEU 56 23.089 1.994 1.197 701 HD13 LEU 56 HD13 LEU 56 22.258 0.465 1.478 702 HD21 LEU 56 HD21 LEU 56 21.724 1.240 -2.106 703 HD22 LEU 56 HD22 LEU 56 22.003 -0.115 -1.000 704 HD23 LEU 56 HD23 LEU 56 23.169 1.211 -1.085 705 H SER 57 H SER 57 17.017 2.116 0.115 706 HA SER 57 HA SER 57 15.568 -0.325 0.402 707 HB2 SER 57 HB2 SER 57 13.771 1.077 1.312 708 HB3 SER 57 HB3 SER 57 15.325 1.546 1.998 709 HG SER 57 HG SER 57 14.706 2.909 -0.288 710 H ASP 58 H ASP 58 15.950 1.793 -2.203 711 HA ASP 58 HA ASP 58 13.330 1.290 -3.388 712 HB2 ASP 58 HB2 ASP 58 15.648 3.040 -4.149 713 HB3 ASP 58 HB3 ASP 58 14.351 2.708 -5.290 714 H TYR 59 H TYR 59 16.314 -0.225 -3.357 715 HA TYR 59 HA TYR 59 15.783 -1.606 -5.916 716 HB2 TYR 59 HB2 TYR 59 18.290 -0.688 -4.599 717 HB3 TYR 59 HB3 TYR 59 18.349 -2.175 -5.541 718 HD1 TYR 59 HD1 TYR 59 17.271 -2.008 -7.935 719 HD2 TYR 59 HD2 TYR 59 18.684 1.315 -5.670 720 HE1 TYR 59 HE1 TYR 59 17.652 -0.757 -10.021 721 HE2 TYR 59 HE2 TYR 59 19.076 2.574 -7.747 722 HH TYR 59 HH TYR 59 19.114 2.462 -9.966 723 H ASN 60 H ASN 60 15.433 -1.970 -2.723 724 HA ASN 60 HA ASN 60 14.973 -3.699 -1.359 725 HB2 ASN 60 HB2 ASN 60 14.233 -4.734 -3.628 726 HB3 ASN 60 HB3 ASN 60 15.671 -5.731 -3.438 727 HD21 ASN 60 HD21 ASN 60 14.517 -7.605 -3.187 728 HD22 ASN 60 HD22 ASN 60 13.599 -7.959 -1.769 729 H ILE 61 H ILE 61 17.750 -2.703 -2.128 730 HA ILE 61 HA ILE 61 19.595 -4.696 -1.177 731 HB ILE 61 HB ILE 61 19.892 -1.696 -1.455 732 HG12 ILE 61 HG12 ILE 61 20.833 -3.950 -3.235 733 HG13 ILE 61 HG13 ILE 61 19.429 -2.938 -3.551 734 HG21 ILE 61 HG21 ILE 61 21.500 -2.540 0.165 735 HG22 ILE 61 HG22 ILE 61 22.341 -2.090 -1.325 736 HG23 ILE 61 HG23 ILE 61 22.016 -3.792 -0.961 737 HD11 ILE 61 HD11 ILE 61 22.284 -1.952 -3.417 738 HD12 ILE 61 HD12 ILE 61 20.860 -1.003 -3.858 739 HD13 ILE 61 HD13 ILE 61 21.394 -2.326 -4.898 740 H GLN 62 H GLN 62 19.338 -5.440 0.797 741 HA GLN 62 HA GLN 62 18.556 -3.611 2.953 742 HB2 GLN 62 HB2 GLN 62 18.388 -6.624 2.791 743 HB3 GLN 62 HB3 GLN 62 17.844 -5.653 4.151 744 HG2 GLN 62 HG2 GLN 62 16.236 -4.525 2.593 745 HG3 GLN 62 HG3 GLN 62 16.698 -5.698 1.360 746 HE21 GLN 62 HE21 GLN 62 17.005 -7.754 3.569 747 HE22 GLN 62 HE22 GLN 62 15.388 -8.258 3.900 748 H LYS 63 H LYS 63 19.363 -4.940 5.169 749 HA LYS 63 HA LYS 63 22.120 -4.305 5.345 750 HB2 LYS 63 HB2 LYS 63 22.041 -5.179 7.594 751 HB3 LYS 63 HB3 LYS 63 20.552 -4.304 7.282 752 HG2 LYS 63 HG2 LYS 63 19.392 -6.444 6.894 753 HG3 LYS 63 HG3 LYS 63 20.887 -7.303 7.283 754 HD2 LYS 63 HD2 LYS 63 20.886 -6.242 9.512 755 HD3 LYS 63 HD3 LYS 63 19.355 -5.454 9.116 756 HE2 LYS 63 HE2 LYS 63 18.371 -7.730 8.743 757 HE3 LYS 63 HE3 LYS 63 19.872 -8.420 9.376 758 HZ1 LYS 63 HZ1 LYS 63 18.070 -6.561 10.805 759 HZ2 LYS 63 HZ2 LYS 63 19.522 -7.183 11.412 760 HZ3 LYS 63 HZ3 LYS 63 18.223 -8.219 11.098 761 H GLU 64 H GLU 64 23.916 -5.520 5.271 762 HA GLU 64 HA GLU 64 25.348 -7.281 5.013 763 HB2 GLU 64 HB2 GLU 64 23.005 -8.569 6.032 764 HB3 GLU 64 HB3 GLU 64 23.714 -9.586 4.787 765 HG2 GLU 64 HG2 GLU 64 24.531 -10.119 7.035 766 HG3 GLU 64 HG3 GLU 64 25.825 -9.619 5.948 767 H SER 65 H SER 65 23.261 -6.264 2.782 768 HA SER 65 HA SER 65 23.510 -8.228 0.703 769 HB2 SER 65 HB2 SER 65 22.994 -5.245 0.564 770 HB3 SER 65 HB3 SER 65 22.911 -6.324 -0.829 771 HG SER 65 HG SER 65 21.430 -7.303 1.203 772 H THR 66 H THR 66 25.022 -8.410 -0.892 773 HA THR 66 HA THR 66 27.231 -6.470 -0.796 774 HB THR 66 HB THR 66 28.889 -7.952 -0.880 775 HG1 THR 66 HG1 THR 66 28.958 -9.121 -2.592 776 HG21 THR 66 HG21 THR 66 26.916 -8.971 0.781 777 HG22 THR 66 HG22 THR 66 28.621 -9.431 0.777 778 HG23 THR 66 HG23 THR 66 27.451 -10.358 -0.164 779 H LEU 67 H LEU 67 27.779 -5.496 -2.461 780 HA LEU 67 HA LEU 67 26.446 -5.945 -5.056 781 HB2 LEU 67 HB2 LEU 67 27.597 -3.515 -3.668 782 HB3 LEU 67 HB3 LEU 67 27.188 -3.491 -5.371 783 HG LEU 67 HG LEU 67 24.818 -3.855 -4.813 784 HD11 LEU 67 HD11 LEU 67 25.150 -5.068 -2.626 785 HD12 LEU 67 HD12 LEU 67 23.959 -3.768 -2.580 786 HD13 LEU 67 HD13 LEU 67 25.572 -3.513 -1.910 787 HD21 LEU 67 HD21 LEU 67 25.687 -1.607 -5.025 788 HD22 LEU 67 HD22 LEU 67 26.161 -1.608 -3.326 789 HD23 LEU 67 HD23 LEU 67 24.449 -1.660 -3.766 790 H HIS 68 H HIS 68 27.781 -5.338 -6.913 791 HA HIS 68 HA HIS 68 30.664 -5.806 -6.496 792 HB2 HIS 68 HB2 HIS 68 28.843 -6.701 -8.725 793 HB3 HIS 68 HB3 HIS 68 30.597 -6.603 -8.952 794 HD1 HIS 68 HD1 HIS 68 28.066 -8.541 -6.887 795 HD2 HIS 68 HD2 HIS 68 32.073 -8.446 -7.833 796 HE1 HIS 68 HE1 HIS 68 29.035 -10.711 -6.004 797 HE2 HIS 68 HE2 HIS 68 31.518 -10.528 -6.486 798 H LEU 69 H LEU 69 32.108 -4.669 -7.637 799 HA LEU 69 HA LEU 69 31.175 -2.151 -8.877 800 HB2 LEU 69 HB2 LEU 69 32.313 -1.766 -6.759 801 HB3 LEU 69 HB3 LEU 69 33.664 -2.771 -7.264 802 HG LEU 69 HG LEU 69 34.159 -1.134 -9.068 803 HD11 LEU 69 HD11 LEU 69 32.113 0.607 -7.697 804 HD12 LEU 69 HD12 LEU 69 31.905 -0.145 -9.280 805 HD13 LEU 69 HD13 LEU 69 33.171 1.067 -9.035 806 HD21 LEU 69 HD21 LEU 69 35.477 -0.978 -7.116 807 HD22 LEU 69 HD22 LEU 69 34.171 -0.214 -6.210 808 HD23 LEU 69 HD23 LEU 69 34.979 0.670 -7.505 809 H VAL 70 H VAL 70 31.687 -1.843 -10.916 810 HA VAL 70 HA VAL 70 33.949 -3.298 -12.125 811 HB VAL 70 HB VAL 70 31.382 -2.241 -13.393 812 HG11 VAL 70 HG11 VAL 70 33.131 -1.835 -14.976 813 HG12 VAL 70 HG12 VAL 70 32.213 -3.235 -15.528 814 HG13 VAL 70 HG13 VAL 70 33.780 -3.460 -14.753 815 HG21 VAL 70 HG21 VAL 70 31.352 -4.461 -12.114 816 HG22 VAL 70 HG22 VAL 70 32.304 -5.098 -13.452 817 HG23 VAL 70 HG23 VAL 70 30.688 -4.455 -13.747 818 H LEU 71 H LEU 71 35.483 -1.984 -13.102 819 HA LEU 71 HA LEU 71 35.314 0.838 -12.399 820 HB2 LEU 71 HB2 LEU 71 37.330 -0.990 -12.117 821 HB3 LEU 71 HB3 LEU 71 37.799 -0.184 -13.605 822 HG LEU 71 HG LEU 71 37.280 1.966 -12.152 823 HD11 LEU 71 HD11 LEU 71 36.553 0.563 -10.228 824 HD12 LEU 71 HD12 LEU 71 37.816 1.733 -9.845 825 HD13 LEU 71 HD13 LEU 71 38.226 0.029 -10.052 826 HD21 LEU 71 HD21 LEU 71 39.874 0.391 -12.287 827 HD22 LEU 71 HD22 LEU 71 39.785 1.974 -11.511 828 HD23 LEU 71 HD23 LEU 71 39.408 1.811 -13.227 Start of MODEL 3 1 H GLY 12 H GLY 12 7.027 -11.590 -2.559 2 HA2 GLY 12 HA2 GLY 12 8.862 -11.110 -0.480 3 HA3 GLY 12 HA3 GLY 12 9.650 -12.100 -1.700 4 HA PRO 13 HA PRO 13 10.393 -8.550 -4.209 5 HB2 PRO 13 HB2 PRO 13 9.422 -9.080 -6.711 6 HB3 PRO 13 HB3 PRO 13 10.900 -9.799 -6.063 7 HG2 PRO 13 HG2 PRO 13 8.166 -10.972 -6.309 8 HG3 PRO 13 HG3 PRO 13 9.743 -11.753 -6.510 9 HD2 PRO 13 HD2 PRO 13 8.191 -11.995 -4.248 10 HD3 PRO 13 HD3 PRO 13 9.957 -12.172 -4.252 11 H MET 14 H MET 14 8.817 -7.381 -2.829 12 HA MET 14 HA MET 14 6.178 -6.869 -3.786 13 HB2 MET 14 HB2 MET 14 7.921 -5.651 -1.648 14 HB3 MET 14 HB3 MET 14 6.377 -4.906 -2.082 15 HG2 MET 14 HG2 MET 14 6.614 -7.834 -1.400 16 HG3 MET 14 HG3 MET 14 6.289 -6.597 -0.171 17 HE1 MET 14 HE1 MET 14 2.743 -7.484 -0.111 18 HE2 MET 14 HE2 MET 14 3.800 -6.233 0.546 19 HE3 MET 14 HE3 MET 14 4.349 -7.908 0.483 20 H LEU 15 H LEU 15 6.591 -6.303 -5.990 21 HA LEU 15 HA LEU 15 8.148 -3.993 -6.672 22 HB2 LEU 15 HB2 LEU 15 6.938 -6.162 -8.056 23 HB3 LEU 15 HB3 LEU 15 6.236 -4.685 -8.719 24 HG LEU 15 HG LEU 15 8.540 -3.779 -9.078 25 HD11 LEU 15 HD11 LEU 15 10.343 -4.784 -8.194 26 HD12 LEU 15 HD12 LEU 15 9.911 -6.315 -8.957 27 HD13 LEU 15 HD13 LEU 15 9.258 -5.904 -7.368 28 HD21 LEU 15 HD21 LEU 15 7.373 -4.890 -10.906 29 HD22 LEU 15 HD22 LEU 15 7.934 -6.463 -10.339 30 HD23 LEU 15 HD23 LEU 15 9.089 -5.288 -10.967 31 H CYS 16 H CYS 16 7.432 -1.940 -7.266 32 HA CYS 16 HA CYS 16 5.525 -0.668 -5.809 33 HB2 CYS 16 HB2 CYS 16 7.296 0.332 -7.372 34 HB3 CYS 16 HB3 CYS 16 6.064 0.205 -8.641 35 H SER 17 H SER 17 3.409 -0.359 -5.764 36 HA SER 17 HA SER 17 1.647 -1.987 -7.255 37 HB2 SER 17 HB2 SER 17 1.032 0.468 -5.586 38 HB3 SER 17 HB3 SER 17 -0.143 -0.748 -6.104 39 HG SER 17 HG SER 17 1.699 -2.153 -5.005 40 H THR 18 H THR 18 2.734 1.341 -7.671 41 HA THR 18 HA THR 18 0.729 2.054 -9.579 42 HB THR 18 HB THR 18 2.168 4.015 -10.029 43 HG1 THR 18 HG1 THR 18 4.174 2.852 -9.669 44 HG21 THR 18 HG21 THR 18 1.847 3.341 -7.095 45 HG22 THR 18 HG22 THR 18 0.580 3.996 -8.132 46 HG23 THR 18 HG23 THR 18 2.013 4.960 -7.771 47 H GLY 19 H GLY 19 3.533 0.090 -9.855 48 HA2 GLY 19 HA2 GLY 19 4.331 -1.068 -11.704 49 HA3 GLY 19 HA3 GLY 19 3.098 -0.276 -12.678 50 H CYS 20 H CYS 20 5.714 1.170 -10.726 51 HA CYS 20 HA CYS 20 6.431 2.831 -12.977 52 HB2 CYS 20 HB2 CYS 20 7.867 4.029 -11.435 53 HB3 CYS 20 HB3 CYS 20 6.323 3.721 -10.641 54 H GLY 21 H GLY 21 7.465 -0.224 -11.828 55 HA2 GLY 21 HA2 GLY 21 8.957 -1.599 -13.071 56 HA3 GLY 21 HA3 GLY 21 9.727 -0.154 -13.703 57 H PHE 22 H PHE 22 9.350 0.240 -10.387 58 HA PHE 22 HA PHE 22 12.095 -0.721 -9.900 59 HB2 PHE 22 HB2 PHE 22 10.603 1.674 -8.849 60 HB3 PHE 22 HB3 PHE 22 12.085 1.080 -8.084 61 HD1 PHE 22 HD1 PHE 22 14.213 1.214 -9.188 62 HD2 PHE 22 HD2 PHE 22 10.670 2.641 -11.104 63 HE1 PHE 22 HE1 PHE 22 15.598 2.343 -10.889 64 HE2 PHE 22 HE2 PHE 22 12.047 3.785 -12.805 65 HZ PHE 22 HZ PHE 22 14.514 3.635 -12.701 66 H TYR 23 H TYR 23 12.469 -0.969 -7.401 67 HA TYR 23 HA TYR 23 10.523 -2.948 -6.535 68 HB2 TYR 23 HB2 TYR 23 13.358 -2.349 -5.940 69 HB3 TYR 23 HB3 TYR 23 12.409 -3.005 -4.602 70 HD1 TYR 23 HD1 TYR 23 13.380 -3.591 -8.121 71 HD2 TYR 23 HD2 TYR 23 11.886 -5.317 -4.516 72 HE1 TYR 23 HE1 TYR 23 13.613 -5.833 -9.116 73 HE2 TYR 23 HE2 TYR 23 12.112 -7.574 -5.495 74 HH TYR 23 HH TYR 23 13.858 -8.185 -8.359 75 H GLY 24 H GLY 24 9.349 -2.873 -4.635 76 HA2 GLY 24 HA2 GLY 24 9.244 -0.234 -3.298 77 HA3 GLY 24 HA3 GLY 24 7.867 -1.317 -3.477 78 H ASN 25 H ASN 25 8.227 -0.484 -0.996 79 HA ASN 25 HA ASN 25 9.643 -2.681 0.375 80 HB2 ASN 25 HB2 ASN 25 9.599 0.209 0.849 81 HB3 ASN 25 HB3 ASN 25 9.190 -0.733 2.286 82 HD21 ASN 25 HD21 ASN 25 11.122 -0.362 3.400 83 HD22 ASN 25 HD22 ASN 25 12.637 -0.988 2.860 84 HA PRO 26 HA PRO 26 5.443 -3.752 1.677 85 HB2 PRO 26 HB2 PRO 26 6.053 -5.651 3.511 86 HB3 PRO 26 HB3 PRO 26 6.070 -5.947 1.765 87 HG2 PRO 26 HG2 PRO 26 8.344 -5.348 3.618 88 HG3 PRO 26 HG3 PRO 26 8.256 -6.550 2.317 89 HD2 PRO 26 HD2 PRO 26 9.516 -4.169 1.997 90 HD3 PRO 26 HD3 PRO 26 8.665 -4.964 0.660 91 H ARG 27 H ARG 27 7.979 -2.583 3.766 92 HA ARG 27 HA ARG 27 6.422 -2.302 6.143 93 HB2 ARG 27 HB2 ARG 27 8.864 -0.745 5.232 94 HB3 ARG 27 HB3 ARG 27 8.217 -0.769 6.874 95 HG2 ARG 27 HG2 ARG 27 8.560 -3.238 6.927 96 HG3 ARG 27 HG3 ARG 27 9.327 -3.129 5.346 97 HD2 ARG 27 HD2 ARG 27 11.097 -3.103 6.977 98 HD3 ARG 27 HD3 ARG 27 10.960 -1.475 6.302 99 HE ARG 27 HE ARG 27 9.415 -1.844 7.897 100 HH11 ARG 27 HH11 ARG 27 12.743 -2.135 7.941 101 HH12 ARG 27 HH12 ARG 27 13.243 -1.551 9.493 102 HH21 ARG 27 HH21 ARG 27 10.053 -0.714 10.535 103 HH22 ARG 27 HH22 ARG 27 11.736 -0.757 10.944 104 H THR 28 H THR 28 7.105 -0.242 3.342 105 HA THR 28 HA THR 28 5.606 2.004 4.359 106 HB THR 28 HB THR 28 6.065 3.015 2.168 107 HG1 THR 28 HG1 THR 28 6.076 0.519 1.360 108 HG21 THR 28 HG21 THR 28 8.589 2.751 2.151 109 HG22 THR 28 HG22 THR 28 8.393 1.521 3.396 110 HG23 THR 28 HG23 THR 28 7.888 3.184 3.711 111 H ASN 29 H ASN 29 4.208 2.539 1.762 112 HA ASN 29 HA ASN 29 1.869 0.878 2.271 113 HB2 ASN 29 HB2 ASN 29 2.405 3.437 0.792 114 HB3 ASN 29 HB3 ASN 29 0.917 2.537 0.467 115 HD21 ASN 29 HD21 ASN 29 -0.698 3.515 1.637 116 HD22 ASN 29 HD22 ASN 29 -0.561 4.003 3.287 117 H GLY 30 H GLY 30 4.277 -0.249 0.834 118 HA2 GLY 30 HA2 GLY 30 4.419 -1.931 -0.789 119 HA3 GLY 30 HA3 GLY 30 2.830 -1.459 -1.384 120 H MET 31 H MET 31 4.887 1.239 -0.992 121 HA MET 31 HA MET 31 5.559 1.207 -3.867 122 HB2 MET 31 HB2 MET 31 4.360 3.314 -2.112 123 HB3 MET 31 HB3 MET 31 5.396 3.824 -3.456 124 HG2 MET 31 HG2 MET 31 3.209 3.789 -4.345 125 HG3 MET 31 HG3 MET 31 3.953 2.290 -4.924 126 HE1 MET 31 HE1 MET 31 -0.030 2.407 -3.511 127 HE2 MET 31 HE2 MET 31 0.911 2.955 -4.897 128 HE3 MET 31 HE3 MET 31 0.956 3.864 -3.385 129 H CYS 32 H CYS 32 7.395 2.583 -4.457 130 HA CYS 32 HA CYS 32 9.624 2.141 -2.723 131 HB2 CYS 32 HB2 CYS 32 10.923 3.231 -4.568 132 HB3 CYS 32 HB3 CYS 32 9.879 1.931 -5.143 133 H SER 33 H SER 33 11.217 4.408 -2.925 134 HA SER 33 HA SER 33 10.023 6.056 -0.901 135 HB2 SER 33 HB2 SER 33 12.162 7.160 -0.775 136 HB3 SER 33 HB3 SER 33 12.470 5.434 -0.985 137 HG SER 33 HG SER 33 13.577 6.017 -2.659 138 H VAL 34 H VAL 34 10.081 6.231 -4.302 139 HA VAL 34 HA VAL 34 9.880 9.122 -4.434 140 HB VAL 34 HB VAL 34 9.643 7.069 -6.639 141 HG11 VAL 34 HG11 VAL 34 10.012 8.973 -8.145 142 HG12 VAL 34 HG12 VAL 34 10.049 10.061 -6.757 143 HG13 VAL 34 HG13 VAL 34 8.559 9.218 -7.173 144 HG21 VAL 34 HG21 VAL 34 11.949 7.651 -7.183 145 HG22 VAL 34 HG22 VAL 34 11.861 7.076 -5.517 146 HG23 VAL 34 HG23 VAL 34 11.991 8.802 -5.850 147 H CYS 35 H CYS 35 7.763 6.343 -5.109 148 HA CYS 35 HA CYS 35 5.508 8.003 -5.762 149 HB2 CYS 35 HB2 CYS 35 5.735 5.027 -5.294 150 HB3 CYS 35 HB3 CYS 35 4.295 5.843 -5.920 151 H TYR 36 H TYR 36 6.721 6.499 -2.874 152 HA TYR 36 HA TYR 36 4.369 6.290 -1.374 153 HB2 TYR 36 HB2 TYR 36 6.471 5.247 -0.667 154 HB3 TYR 36 HB3 TYR 36 7.199 6.835 -0.419 155 HD1 TYR 36 HD1 TYR 36 3.755 5.701 0.556 156 HD2 TYR 36 HD2 TYR 36 7.676 6.869 1.853 157 HE1 TYR 36 HE1 TYR 36 2.971 5.708 2.912 158 HE2 TYR 36 HE2 TYR 36 6.898 6.882 4.208 159 HH TYR 36 HH TYR 36 3.931 5.511 5.194 160 H LYS 37 H LYS 37 6.655 9.049 -1.553 161 HA LYS 37 HA LYS 37 5.096 10.639 0.240 162 HB2 LYS 37 HB2 LYS 37 6.584 12.504 -0.414 163 HB3 LYS 37 HB3 LYS 37 7.505 11.058 -0.003 164 HG2 LYS 37 HG2 LYS 37 7.724 10.524 -2.403 165 HG3 LYS 37 HG3 LYS 37 6.836 12.005 -2.794 166 HD2 LYS 37 HD2 LYS 37 8.598 13.270 -1.487 167 HD3 LYS 37 HD3 LYS 37 9.533 11.766 -1.459 168 HE2 LYS 37 HE2 LYS 37 9.280 11.716 -3.992 169 HE3 LYS 37 HE3 LYS 37 8.691 13.384 -3.861 170 HZ1 LYS 37 HZ1 LYS 37 10.749 13.999 -2.761 171 HZ2 LYS 37 HZ2 LYS 37 11.073 13.328 -4.280 172 HZ3 LYS 37 HZ3 LYS 37 11.321 12.413 -2.880 173 H GLU 38 H GLU 38 5.455 10.479 -3.273 174 HA GLU 38 HA GLU 38 3.916 12.662 -4.022 175 HB2 GLU 38 HB2 GLU 38 4.511 10.019 -5.330 176 HB3 GLU 38 HB3 GLU 38 3.416 11.174 -6.104 177 HG2 GLU 38 HG2 GLU 38 6.126 12.033 -5.112 178 HG3 GLU 38 HG3 GLU 38 5.911 11.323 -6.720 179 H HIS 39 H HIS 39 2.827 9.369 -3.174 180 HA HIS 39 HA HIS 39 0.091 10.105 -3.789 181 HB2 HIS 39 HB2 HIS 39 -0.517 7.839 -3.520 182 HB3 HIS 39 HB3 HIS 39 1.083 7.790 -4.247 183 HD1 HIS 39 HD1 HIS 39 2.274 5.844 -3.321 184 HD2 HIS 39 HD2 HIS 39 0.040 7.773 -0.372 185 HE1 HIS 39 HE1 HIS 39 2.604 4.523 -1.193 186 HE2 HIS 39 HE2 HIS 39 1.560 5.919 0.649 187 H LEU 40 H LEU 40 2.080 9.727 -0.942 188 HA LEU 40 HA LEU 40 0.055 9.681 1.021 189 HB2 LEU 40 HB2 LEU 40 2.544 9.207 1.329 190 HB3 LEU 40 HB3 LEU 40 2.773 10.958 1.365 191 HG LEU 40 HG LEU 40 1.000 11.011 3.214 192 HD11 LEU 40 HD11 LEU 40 0.176 8.681 2.734 193 HD12 LEU 40 HD12 LEU 40 0.622 8.949 4.421 194 HD13 LEU 40 HD13 LEU 40 1.715 8.073 3.353 195 HD21 LEU 40 HD21 LEU 40 2.683 10.229 4.936 196 HD22 LEU 40 HD22 LEU 40 3.311 11.391 3.766 197 HD23 LEU 40 HD23 LEU 40 3.687 9.678 3.596 198 H GLN 41 H GLN 41 1.481 12.321 -0.789 199 HA GLN 41 HA GLN 41 0.645 14.458 0.869 200 HB2 GLN 41 HB2 GLN 41 1.613 14.157 -1.938 201 HB3 GLN 41 HB3 GLN 41 0.797 15.668 -1.516 202 HG2 GLN 41 HG2 GLN 41 2.344 16.045 0.320 203 HG3 GLN 41 HG3 GLN 41 3.130 14.490 0.009 204 HE21 GLN 41 HE21 GLN 41 2.810 17.785 -1.108 205 HE22 GLN 41 HE22 GLN 41 4.058 17.686 -2.297 206 H ARG 42 H ARG 42 -0.915 12.791 -1.848 207 HA ARG 42 HA ARG 42 -3.188 14.567 -1.881 208 HB2 ARG 42 HB2 ARG 42 -2.583 11.942 -3.245 209 HB3 ARG 42 HB3 ARG 42 -4.124 12.788 -3.449 210 HG2 ARG 42 HG2 ARG 42 -3.069 14.686 -4.417 211 HG3 ARG 42 HG3 ARG 42 -1.466 14.125 -3.919 212 HD2 ARG 42 HD2 ARG 42 -1.810 12.116 -5.386 213 HD3 ARG 42 HD3 ARG 42 -3.261 12.903 -6.017 214 HE ARG 42 HE ARG 42 -0.523 13.242 -6.395 215 HH11 ARG 42 HH11 ARG 42 -3.744 14.947 -6.313 216 HH12 ARG 42 HH12 ARG 42 -3.405 16.273 -7.375 217 HH21 ARG 42 HH21 ARG 42 -0.177 15.262 -8.087 218 HH22 ARG 42 HH22 ARG 42 -1.408 16.446 -8.368 219 H GLN 43 H GLN 43 -2.374 11.498 -0.397 220 HA GLN 43 HA GLN 43 -5.057 10.828 0.365 221 HB2 GLN 43 HB2 GLN 43 -2.955 9.287 0.093 222 HB3 GLN 43 HB3 GLN 43 -2.614 9.765 1.761 223 HG2 GLN 43 HG2 GLN 43 -3.897 7.883 2.119 224 HG3 GLN 43 HG3 GLN 43 -5.150 9.133 2.126 225 HE21 GLN 43 HE21 GLN 43 -6.770 7.654 1.365 226 HE22 GLN 43 HE22 GLN 43 -6.761 7.071 -0.261 227 H GLN 44 H GLN 44 -2.300 12.442 1.869 228 HA GLN 44 HA GLN 44 -3.473 12.652 4.469 229 HB2 GLN 44 HB2 GLN 44 -0.972 12.782 3.819 230 HB3 GLN 44 HB3 GLN 44 -1.308 14.476 3.436 231 HG2 GLN 44 HG2 GLN 44 -2.016 14.934 5.672 232 HG3 GLN 44 HG3 GLN 44 -2.014 13.213 6.085 233 HE21 GLN 44 HE21 GLN 44 0.313 15.563 4.695 234 HE22 GLN 44 HE22 GLN 44 1.634 15.023 5.669 235 H ASN 45 H ASN 45 -3.213 14.804 1.660 236 HA ASN 45 HA ASN 45 -4.318 17.102 2.902 237 HB2 ASN 45 HB2 ASN 45 -3.898 16.232 0.055 238 HB3 ASN 45 HB3 ASN 45 -4.859 17.675 0.394 239 HD21 ASN 45 HD21 ASN 45 -2.088 17.351 -0.806 240 HD22 ASN 45 HD22 ASN 45 -1.096 18.385 0.160 241 H SER 46 H SER 46 -5.751 14.463 1.006 242 HA SER 46 HA SER 46 -8.395 15.568 1.044 243 HB2 SER 46 HB2 SER 46 -7.355 13.836 -0.610 244 HB3 SER 46 HB3 SER 46 -7.827 12.647 0.611 245 HG SER 46 HG SER 46 -9.493 14.460 -0.794 246 H1 MET 1 H1 MET 1 22.576 -0.050 10.037 247 H2 MET 1 H2 MET 1 23.318 0.584 8.656 248 H3 MET 1 H3 MET 1 24.238 0.264 10.038 249 HA MET 1 HA MET 1 23.835 -2.081 9.822 250 HB2 MET 1 HB2 MET 1 22.641 -2.971 7.919 251 HB3 MET 1 HB3 MET 1 21.600 -1.814 8.735 252 HG2 MET 1 HG2 MET 1 22.151 -0.127 7.045 253 HG3 MET 1 HG3 MET 1 23.195 -1.284 6.230 254 HE1 MET 1 HE1 MET 1 20.525 -1.238 3.546 255 HE2 MET 1 HE2 MET 1 22.242 -1.258 3.952 256 HE3 MET 1 HE3 MET 1 21.241 0.118 4.416 257 H GLN 2 H GLN 2 25.426 -3.298 8.797 258 HA GLN 2 HA GLN 2 27.193 -1.754 7.035 259 HB2 GLN 2 HB2 GLN 2 28.925 -3.228 7.584 260 HB3 GLN 2 HB3 GLN 2 28.036 -3.032 9.086 261 HG2 GLN 2 HG2 GLN 2 26.933 -5.175 8.742 262 HG3 GLN 2 HG3 GLN 2 27.751 -5.365 7.194 263 HE21 GLN 2 HE21 GLN 2 30.196 -4.114 8.492 264 HE22 GLN 2 HE22 GLN 2 30.912 -5.420 9.369 265 H ILE 3 H ILE 3 27.732 -2.336 5.037 266 HA ILE 3 HA ILE 3 26.735 -4.868 3.964 267 HB ILE 3 HB ILE 3 25.877 -4.062 2.007 268 HG12 ILE 3 HG12 ILE 3 27.519 -2.434 1.350 269 HG13 ILE 3 HG13 ILE 3 25.891 -1.829 1.107 270 HG21 ILE 3 HG21 ILE 3 24.334 -3.805 3.829 271 HG22 ILE 3 HG22 ILE 3 24.024 -2.632 2.549 272 HG23 ILE 3 HG23 ILE 3 24.831 -2.125 4.033 273 HD11 ILE 3 HD11 ILE 3 27.923 -0.429 2.197 274 HD12 ILE 3 HD12 ILE 3 27.147 -1.051 3.653 275 HD13 ILE 3 HD13 ILE 3 26.213 -0.091 2.501 276 H PHE 4 H PHE 4 27.922 -5.489 1.996 277 HA PHE 4 HA PHE 4 30.742 -4.628 2.254 278 HB2 PHE 4 HB2 PHE 4 29.709 -7.313 1.291 279 HB3 PHE 4 HB3 PHE 4 31.386 -6.898 1.691 280 HD1 PHE 4 HD1 PHE 4 31.907 -6.246 4.126 281 HD2 PHE 4 HD2 PHE 4 28.249 -8.104 2.920 282 HE1 PHE 4 HE1 PHE 4 31.442 -6.861 6.474 283 HE2 PHE 4 HE2 PHE 4 27.794 -8.742 5.268 284 HZ PHE 4 HZ PHE 4 29.391 -8.110 7.043 285 H VAL 5 H VAL 5 31.854 -4.081 0.500 286 HA VAL 5 HA VAL 5 30.572 -4.264 -2.161 287 HB VAL 5 HB VAL 5 32.339 -2.021 -1.134 288 HG11 VAL 5 HG11 VAL 5 32.803 -2.273 -3.460 289 HG12 VAL 5 HG12 VAL 5 31.678 -0.923 -3.319 290 HG13 VAL 5 HG13 VAL 5 31.097 -2.505 -3.843 291 HG21 VAL 5 HG21 VAL 5 29.492 -1.747 -2.062 292 HG22 VAL 5 HG22 VAL 5 30.457 -0.618 -1.103 293 HG23 VAL 5 HG23 VAL 5 29.876 -2.120 -0.382 294 H LYS 6 H LYS 6 31.542 -5.989 -2.920 295 HA LYS 6 HA LYS 6 34.340 -6.601 -2.575 296 HB2 LYS 6 HB2 LYS 6 32.193 -7.689 -4.408 297 HB3 LYS 6 HB3 LYS 6 33.819 -8.353 -4.291 298 HG2 LYS 6 HG2 LYS 6 33.455 -8.958 -1.973 299 HG3 LYS 6 HG3 LYS 6 31.858 -8.201 -1.998 300 HD2 LYS 6 HD2 LYS 6 31.688 -10.640 -2.287 301 HD3 LYS 6 HD3 LYS 6 31.127 -9.781 -3.722 302 HE2 LYS 6 HE2 LYS 6 33.449 -10.125 -4.683 303 HE3 LYS 6 HE3 LYS 6 33.748 -11.231 -3.340 304 HZ1 LYS 6 HZ1 LYS 6 31.618 -11.480 -5.372 305 HZ2 LYS 6 HZ2 LYS 6 31.857 -12.533 -4.070 306 HZ3 LYS 6 HZ3 LYS 6 33.028 -12.410 -5.284 307 H THR 7 H THR 7 35.972 -6.008 -3.794 308 HA THR 7 HA THR 7 35.465 -4.724 -6.405 309 HB THR 7 HB THR 7 37.694 -3.810 -6.297 310 HG1 THR 7 HG1 THR 7 37.958 -5.715 -4.281 311 HG21 THR 7 HG21 THR 7 36.719 -3.460 -3.476 312 HG22 THR 7 HG22 THR 7 35.841 -2.750 -4.834 313 HG23 THR 7 HG23 THR 7 37.512 -2.277 -4.516 314 H LEU 8 H LEU 8 37.181 -5.292 -8.070 315 HA LEU 8 HA LEU 8 36.967 -8.129 -8.421 316 HB2 LEU 8 HB2 LEU 8 38.093 -6.072 -10.303 317 HB3 LEU 8 HB3 LEU 8 37.665 -7.733 -10.712 318 HG LEU 8 HG LEU 8 35.781 -5.574 -9.760 319 HD11 LEU 8 HD11 LEU 8 36.605 -5.430 -12.111 320 HD12 LEU 8 HD12 LEU 8 34.856 -5.592 -11.947 321 HD13 LEU 8 HD13 LEU 8 35.832 -6.985 -12.410 322 HD21 LEU 8 HD21 LEU 8 35.296 -8.500 -10.212 323 HD22 LEU 8 HD22 LEU 8 34.008 -7.315 -10.433 324 HD23 LEU 8 HD23 LEU 8 34.791 -7.487 -8.860 325 H THR 9 H THR 9 39.473 -6.081 -7.404 326 HA THR 9 HA THR 9 41.719 -7.754 -7.740 327 HB THR 9 HB THR 9 42.566 -6.675 -5.631 328 HG1 THR 9 HG1 THR 9 40.140 -5.205 -5.805 329 HG21 THR 9 HG21 THR 9 41.576 -4.950 -7.893 330 HG22 THR 9 HG22 THR 9 43.172 -5.682 -7.716 331 HG23 THR 9 HG23 THR 9 42.675 -4.374 -6.643 332 H GLY 10 H GLY 10 39.056 -7.821 -5.493 333 HA2 GLY 10 HA2 GLY 10 38.397 -10.087 -4.678 334 HA3 GLY 10 HA3 GLY 10 40.084 -10.298 -4.226 335 H LYS 11 H LYS 11 40.198 -7.425 -3.365 336 HA LYS 11 HA LYS 11 39.660 -7.690 -0.614 337 HB2 LYS 11 HB2 LYS 11 41.192 -5.995 -1.831 338 HB3 LYS 11 HB3 LYS 11 39.727 -5.028 -2.028 339 HG2 LYS 11 HG2 LYS 11 39.653 -5.738 0.638 340 HG3 LYS 11 HG3 LYS 11 41.365 -5.448 0.349 341 HD2 LYS 11 HD2 LYS 11 39.171 -3.510 -0.370 342 HD3 LYS 11 HD3 LYS 11 40.071 -3.458 1.140 343 HE2 LYS 11 HE2 LYS 11 41.371 -3.260 -1.573 344 HE3 LYS 11 HE3 LYS 11 40.840 -1.856 -0.650 345 HZ1 LYS 11 HZ1 LYS 11 42.847 -3.858 0.195 346 HZ2 LYS 11 HZ2 LYS 11 42.308 -2.563 1.140 347 HZ3 LYS 11 HZ3 LYS 11 43.156 -2.268 -0.293 348 H THR 12 H THR 12 38.065 -6.854 0.676 349 HA THR 12 HA THR 12 35.511 -6.073 -0.618 350 HB THR 12 HB THR 12 35.957 -7.756 1.862 351 HG1 THR 12 HG1 THR 12 36.085 -9.167 0.268 352 HG21 THR 12 HG21 THR 12 33.343 -6.888 0.612 353 HG22 THR 12 HG22 THR 12 33.954 -6.367 2.182 354 HG23 THR 12 HG23 THR 12 33.505 -8.054 1.922 355 H ILE 13 H ILE 13 34.761 -4.207 -0.050 356 HA ILE 13 HA ILE 13 35.914 -2.679 2.188 357 HB ILE 13 HB ILE 13 33.701 -1.650 0.471 358 HG12 ILE 13 HG12 ILE 13 35.089 -2.490 -1.278 359 HG13 ILE 13 HG13 ILE 13 35.284 -0.748 -1.216 360 HG21 ILE 13 HG21 ILE 13 34.516 -0.339 2.345 361 HG22 ILE 13 HG22 ILE 13 34.753 0.501 0.814 362 HG23 ILE 13 HG23 ILE 13 36.122 -0.273 1.617 363 HD11 ILE 13 HD11 ILE 13 37.401 -1.938 -1.655 364 HD12 ILE 13 HD12 ILE 13 37.231 -2.761 -0.108 365 HD13 ILE 13 HD13 ILE 13 37.460 -1.013 -0.149 366 H THR 14 H THR 14 34.845 -2.538 4.076 367 HA THR 14 HA THR 14 31.990 -3.308 4.199 368 HB THR 14 HB THR 14 33.992 -2.893 6.438 369 HG1 THR 14 HG1 THR 14 34.405 -4.797 5.307 370 HG21 THR 14 HG21 THR 14 31.661 -2.395 7.127 371 HG22 THR 14 HG22 THR 14 32.306 -3.830 7.926 372 HG23 THR 14 HG23 THR 14 31.182 -3.999 6.577 373 H LEU 15 H LEU 15 30.511 -1.819 4.462 374 HA LEU 15 HA LEU 15 31.301 0.909 5.291 375 HB2 LEU 15 HB2 LEU 15 29.218 0.117 3.258 376 HB3 LEU 15 HB3 LEU 15 29.524 1.767 3.784 377 HG LEU 15 HG LEU 15 31.566 0.013 2.400 378 HD11 LEU 15 HD11 LEU 15 29.944 2.285 1.260 379 HD12 LEU 15 HD12 LEU 15 29.568 0.581 0.996 380 HD13 LEU 15 HD13 LEU 15 31.090 1.261 0.398 381 HD21 LEU 15 HD21 LEU 15 31.586 2.779 3.499 382 HD22 LEU 15 HD22 LEU 15 32.422 2.500 1.969 383 HD23 LEU 15 HD23 LEU 15 32.887 1.589 3.406 384 H GLU 16 H GLU 16 30.067 1.944 6.701 385 HA GLU 16 HA GLU 16 27.690 0.650 7.868 386 HB2 GLU 16 HB2 GLU 16 29.429 1.407 9.443 387 HB3 GLU 16 HB3 GLU 16 29.339 3.034 8.774 388 HG2 GLU 16 HG2 GLU 16 28.131 2.900 10.888 389 HG3 GLU 16 HG3 GLU 16 27.037 3.246 9.554 390 H VAL 17 H VAL 17 25.886 1.152 6.895 391 HA VAL 17 HA VAL 17 25.449 3.890 5.902 392 HB VAL 17 HB VAL 17 24.386 3.037 3.902 393 HG11 VAL 17 HG11 VAL 17 26.863 3.523 3.970 394 HG12 VAL 17 HG12 VAL 17 26.307 2.491 2.646 395 HG13 VAL 17 HG13 VAL 17 27.100 1.773 4.050 396 HG21 VAL 17 HG21 VAL 17 25.260 0.280 4.740 397 HG22 VAL 17 HG22 VAL 17 24.429 0.710 3.242 398 HG23 VAL 17 HG23 VAL 17 23.606 0.892 4.795 399 H GLU 18 H GLU 18 23.156 4.176 5.225 400 HA GLU 18 HA GLU 18 21.163 2.714 6.849 401 HB2 GLU 18 HB2 GLU 18 21.167 5.612 5.935 402 HB3 GLU 18 HB3 GLU 18 19.826 4.825 6.760 403 HG2 GLU 18 HG2 GLU 18 22.585 5.294 7.882 404 HG3 GLU 18 HG3 GLU 18 21.123 6.165 8.322 405 H SER 19 H SER 19 19.177 2.262 5.758 406 HA SER 19 HA SER 19 19.299 1.659 3.003 407 HB2 SER 19 HB2 SER 19 16.844 1.984 4.749 408 HB3 SER 19 HB3 SER 19 16.866 1.246 3.145 409 HG SER 19 HG SER 19 17.042 -0.340 4.783 410 H SER 20 H SER 20 18.283 4.489 4.686 411 HA SER 20 HA SER 20 16.920 5.812 2.579 412 HB2 SER 20 HB2 SER 20 17.197 7.846 4.043 413 HB3 SER 20 HB3 SER 20 16.384 6.470 4.790 414 HG SER 20 HG SER 20 18.998 7.448 5.231 415 H ASP 21 H ASP 21 20.247 5.308 2.986 416 HA ASP 21 HA ASP 21 21.280 7.734 1.951 417 HB2 ASP 21 HB2 ASP 21 22.390 4.932 1.907 418 HB3 ASP 21 HB3 ASP 21 23.282 6.321 1.294 419 H THR 22 H THR 22 21.344 8.571 0.053 420 HA THR 22 HA THR 22 20.177 7.372 -2.272 421 HB THR 22 HB THR 22 20.973 9.309 -3.492 422 HG1 THR 22 HG1 THR 22 22.455 10.723 -2.655 423 HG21 THR 22 HG21 THR 22 19.988 10.088 -0.747 424 HG22 THR 22 HG22 THR 22 18.990 9.692 -2.147 425 HG23 THR 22 HG23 THR 22 19.989 11.145 -2.156 426 H ILE 23 H ILE 23 21.283 6.718 -4.189 427 HA ILE 23 HA ILE 23 23.564 5.108 -3.858 428 HB ILE 23 HB ILE 23 22.354 6.274 -6.344 429 HG12 ILE 23 HG12 ILE 23 20.798 4.900 -5.177 430 HG13 ILE 23 HG13 ILE 23 21.339 4.029 -6.606 431 HG21 ILE 23 HG21 ILE 23 23.480 4.490 -7.630 432 HG22 ILE 23 HG22 ILE 23 24.410 4.077 -6.184 433 HG23 ILE 23 HG23 ILE 23 24.587 5.669 -6.925 434 HD11 ILE 23 HD11 ILE 23 21.206 2.440 -4.863 435 HD12 ILE 23 HD12 ILE 23 22.028 3.507 -3.723 436 HD13 ILE 23 HD13 ILE 23 22.929 2.777 -5.052 437 H ASP 24 H ASP 24 23.233 8.388 -5.063 438 HA ASP 24 HA ASP 24 25.881 8.930 -5.793 439 HB2 ASP 24 HB2 ASP 24 24.008 10.430 -6.318 440 HB3 ASP 24 HB3 ASP 24 23.811 10.790 -4.600 441 H ASN 25 H ASN 25 24.286 9.152 -2.664 442 HA ASN 25 HA ASN 25 26.410 10.217 -1.144 443 HB2 ASN 25 HB2 ASN 25 24.119 10.246 -0.357 444 HB3 ASN 25 HB3 ASN 25 24.062 8.486 -0.364 445 HD21 ASN 25 HD21 ASN 25 24.035 7.759 1.551 446 HD22 ASN 25 HD22 ASN 25 24.961 8.306 2.902 447 H VAL 26 H VAL 26 25.493 6.878 -1.866 448 HA VAL 26 HA VAL 26 27.438 5.558 -0.294 449 HB VAL 26 HB VAL 26 25.977 4.698 -2.791 450 HG11 VAL 26 HG11 VAL 26 26.617 2.364 -2.169 451 HG12 VAL 26 HG12 VAL 26 27.752 3.029 -0.993 452 HG13 VAL 26 HG13 VAL 26 27.984 3.336 -2.715 453 HG21 VAL 26 HG21 VAL 26 25.557 3.448 -0.135 454 HG22 VAL 26 HG22 VAL 26 24.396 3.806 -1.418 455 HG23 VAL 26 HG23 VAL 26 24.964 5.096 -0.355 456 H LYS 27 H LYS 27 27.481 6.525 -3.716 457 HA LYS 27 HA LYS 27 30.028 5.576 -4.385 458 HB2 LYS 27 HB2 LYS 27 28.448 7.896 -5.511 459 HB3 LYS 27 HB3 LYS 27 29.942 7.281 -6.227 460 HG2 LYS 27 HG2 LYS 27 28.921 5.075 -6.495 461 HG3 LYS 27 HG3 LYS 27 27.418 5.680 -5.788 462 HD2 LYS 27 HD2 LYS 27 27.168 7.267 -7.610 463 HD3 LYS 27 HD3 LYS 27 28.707 6.743 -8.313 464 HE2 LYS 27 HE2 LYS 27 27.814 4.510 -8.652 465 HE3 LYS 27 HE3 LYS 27 26.280 4.965 -7.897 466 HZ1 LYS 27 HZ1 LYS 27 27.439 6.123 -10.366 467 HZ2 LYS 27 HZ2 LYS 27 25.963 6.569 -9.669 468 HZ3 LYS 27 HZ3 LYS 27 26.164 5.013 -10.300 469 H SER 28 H SER 28 29.043 8.647 -2.996 470 HA SER 28 HA SER 28 31.557 9.921 -2.858 471 HB2 SER 28 HB2 SER 28 29.402 11.091 -2.486 472 HB3 SER 28 HB3 SER 28 29.222 10.223 -0.954 473 HG SER 28 HG SER 28 30.335 11.858 -0.190 474 H LYS 29 H LYS 29 29.928 7.726 -0.618 475 HA LYS 29 HA LYS 29 31.874 7.683 1.430 476 HB2 LYS 29 HB2 LYS 29 29.904 5.555 0.582 477 HB3 LYS 29 HB3 LYS 29 30.910 5.446 2.022 478 HG2 LYS 29 HG2 LYS 29 29.845 7.455 2.931 479 HG3 LYS 29 HG3 LYS 29 28.841 7.578 1.477 480 HD2 LYS 29 HD2 LYS 29 27.923 5.331 1.956 481 HD3 LYS 29 HD3 LYS 29 28.880 5.278 3.434 482 HE2 LYS 29 HE2 LYS 29 26.803 7.383 2.868 483 HE3 LYS 29 HE3 LYS 29 26.461 5.893 3.746 484 HZ1 LYS 29 HZ1 LYS 29 26.885 7.715 5.235 485 HZ2 LYS 29 HZ2 LYS 29 28.398 7.988 4.530 486 HZ3 LYS 29 HZ3 LYS 29 28.108 6.555 5.380 487 H ILE 30 H ILE 30 31.612 5.887 -1.578 488 HA ILE 30 HA ILE 30 33.796 4.107 -1.173 489 HB ILE 30 HB ILE 30 32.403 5.054 -3.660 490 HG12 ILE 30 HG12 ILE 30 32.412 2.392 -2.236 491 HG13 ILE 30 HG13 ILE 30 31.170 3.621 -2.072 492 HG21 ILE 30 HG21 ILE 30 34.844 4.422 -4.073 493 HG22 ILE 30 HG22 ILE 30 33.629 3.592 -5.042 494 HG23 ILE 30 HG23 ILE 30 34.369 2.774 -3.665 495 HD11 ILE 30 HD11 ILE 30 30.352 1.933 -3.551 496 HD12 ILE 30 HD12 ILE 30 31.818 2.002 -4.529 497 HD13 ILE 30 HD13 ILE 30 30.698 3.367 -4.521 498 H GLN 31 H GLN 31 33.511 7.254 -2.772 499 HA GLN 31 HA GLN 31 36.179 7.629 -3.541 500 HB2 GLN 31 HB2 GLN 31 34.281 9.058 -4.231 501 HB3 GLN 31 HB3 GLN 31 34.189 9.702 -2.590 502 HG2 GLN 31 HG2 GLN 31 36.469 10.580 -2.802 503 HG3 GLN 31 HG3 GLN 31 36.552 9.955 -4.451 504 HE21 GLN 31 HE21 GLN 31 36.841 11.922 -5.358 505 HE22 GLN 31 HE22 GLN 31 35.604 13.125 -5.457 506 H ASP 32 H ASP 32 34.558 8.162 -0.477 507 HA ASP 32 HA ASP 32 36.707 9.391 0.879 508 HB2 ASP 32 HB2 ASP 32 34.184 8.087 1.829 509 HB3 ASP 32 HB3 ASP 32 35.389 8.698 2.962 510 H LYS 33 H LYS 33 36.091 6.033 0.265 511 HA LYS 33 HA LYS 33 38.204 5.305 2.165 512 HB2 LYS 33 HB2 LYS 33 36.132 3.639 0.780 513 HB3 LYS 33 HB3 LYS 33 37.529 2.916 1.577 514 HG2 LYS 33 HG2 LYS 33 36.796 4.344 3.620 515 HG3 LYS 33 HG3 LYS 33 35.240 4.424 2.787 516 HD2 LYS 33 HD2 LYS 33 35.164 2.563 4.315 517 HD3 LYS 33 HD3 LYS 33 35.258 1.922 2.673 518 HE2 LYS 33 HE2 LYS 33 37.663 1.553 2.935 519 HE3 LYS 33 HE3 LYS 33 37.597 2.227 4.564 520 HZ1 LYS 33 HZ1 LYS 33 36.160 0.427 5.213 521 HZ2 LYS 33 HZ2 LYS 33 37.615 -0.165 4.587 522 HZ3 LYS 33 HZ3 LYS 33 36.208 -0.213 3.648 523 H GLU 34 H GLU 34 37.494 5.155 -1.268 524 HA GLU 34 HA GLU 34 40.018 3.730 -1.736 525 HB2 GLU 34 HB2 GLU 34 37.527 3.958 -3.412 526 HB3 GLU 34 HB3 GLU 34 39.027 3.243 -3.994 527 HG2 GLU 34 HG2 GLU 34 37.485 2.309 -1.577 528 HG3 GLU 34 HG3 GLU 34 37.470 1.538 -3.160 529 H GLY 35 H GLY 35 38.382 6.683 -2.517 530 HA2 GLY 35 HA2 GLY 35 39.409 8.688 -3.251 531 HA3 GLY 35 HA3 GLY 35 40.776 7.752 -3.838 532 H ILE 36 H ILE 36 38.055 6.186 -4.806 533 HA ILE 36 HA ILE 36 38.348 6.857 -7.567 534 HB ILE 36 HB ILE 36 36.151 5.234 -6.267 535 HG12 ILE 36 HG12 ILE 36 38.691 4.268 -7.603 536 HG13 ILE 36 HG13 ILE 36 38.490 4.405 -5.858 537 HG21 ILE 36 HG21 ILE 36 35.811 4.286 -8.504 538 HG22 ILE 36 HG22 ILE 36 37.088 5.320 -9.148 539 HG23 ILE 36 HG23 ILE 36 35.598 6.038 -8.535 540 HD11 ILE 36 HD11 ILE 36 37.122 2.499 -7.745 541 HD12 ILE 36 HD12 ILE 36 36.515 2.811 -6.116 542 HD13 ILE 36 HD13 ILE 36 38.127 2.139 -6.339 543 HA PRO 37 HA PRO 37 35.632 10.435 -7.674 544 HB2 PRO 37 HB2 PRO 37 35.804 9.667 -10.567 545 HB3 PRO 37 HB3 PRO 37 35.934 11.275 -9.830 546 HG2 PRO 37 HG2 PRO 37 38.179 10.051 -10.597 547 HG3 PRO 37 HG3 PRO 37 38.136 10.830 -8.996 548 HD2 PRO 37 HD2 PRO 37 37.824 7.905 -9.675 549 HD3 PRO 37 HD3 PRO 37 38.762 8.649 -8.368 550 HA PRO 38 HA PRO 38 31.794 8.121 -7.551 551 HB2 PRO 38 HB2 PRO 38 30.740 10.904 -7.825 552 HB3 PRO 38 HB3 PRO 38 30.232 9.622 -6.709 553 HG2 PRO 38 HG2 PRO 38 31.810 11.562 -5.776 554 HG3 PRO 38 HG3 PRO 38 32.206 9.873 -5.371 555 HD2 PRO 38 HD2 PRO 38 33.441 11.636 -7.488 556 HD3 PRO 38 HD3 PRO 38 34.241 10.543 -6.344 557 H ASP 39 H ASP 39 32.267 10.700 -9.900 558 HA ASP 39 HA ASP 39 30.198 9.840 -11.682 559 HB2 ASP 39 HB2 ASP 39 31.061 11.640 -13.145 560 HB3 ASP 39 HB3 ASP 39 30.699 12.175 -11.514 561 H GLN 40 H GLN 40 32.721 8.142 -11.062 562 HA GLN 40 HA GLN 40 32.987 7.132 -13.794 563 HB2 GLN 40 HB2 GLN 40 35.045 8.338 -12.915 564 HB3 GLN 40 HB3 GLN 40 35.167 7.028 -11.740 565 HG2 GLN 40 HG2 GLN 40 35.116 5.450 -13.754 566 HG3 GLN 40 HG3 GLN 40 35.465 6.876 -14.728 567 HE21 GLN 40 HE21 GLN 40 36.712 6.423 -11.491 568 HE22 GLN 40 HE22 GLN 40 38.361 6.196 -11.952 569 H GLN 41 H GLN 41 31.647 6.512 -10.994 570 HA GLN 41 HA GLN 41 32.236 3.671 -10.792 571 HB2 GLN 41 HB2 GLN 41 30.548 5.514 -9.078 572 HB3 GLN 41 HB3 GLN 41 30.939 3.841 -8.686 573 HG2 GLN 41 HG2 GLN 41 33.317 4.447 -8.516 574 HG3 GLN 41 HG3 GLN 41 32.905 6.124 -8.907 575 HE21 GLN 41 HE21 GLN 41 33.440 7.067 -7.018 576 HE22 GLN 41 HE22 GLN 41 32.678 6.736 -5.503 577 H ARG 42 H ARG 42 30.876 2.209 -11.518 578 HA ARG 42 HA ARG 42 28.013 2.855 -11.908 579 HB2 ARG 42 HB2 ARG 42 29.781 0.985 -13.510 580 HB3 ARG 42 HB3 ARG 42 28.024 1.036 -13.670 581 HG2 ARG 42 HG2 ARG 42 28.110 3.312 -14.450 582 HG3 ARG 42 HG3 ARG 42 29.837 3.408 -14.110 583 HD2 ARG 42 HD2 ARG 42 29.601 3.108 -16.452 584 HD3 ARG 42 HD3 ARG 42 30.181 1.576 -15.801 585 HE ARG 42 HE ARG 42 27.349 1.577 -15.977 586 HH11 ARG 42 HH11 ARG 42 30.181 1.384 -18.031 587 HH12 ARG 42 HH12 ARG 42 29.357 0.523 -19.287 588 HH21 ARG 42 HH21 ARG 42 26.280 0.512 -17.689 589 HH22 ARG 42 HH22 ARG 42 27.171 0.035 -19.095 590 H LEU 43 H LEU 43 26.997 1.991 -10.253 591 HA LEU 43 HA LEU 43 28.013 -0.444 -8.974 592 HB2 LEU 43 HB2 LEU 43 25.906 1.514 -8.066 593 HB3 LEU 43 HB3 LEU 43 26.402 0.094 -7.157 594 HG LEU 43 HG LEU 43 28.146 2.468 -7.848 595 HD11 LEU 43 HD11 LEU 43 26.417 2.844 -6.107 596 HD12 LEU 43 HD12 LEU 43 28.062 2.930 -5.470 597 HD13 LEU 43 HD13 LEU 43 27.084 1.487 -5.198 598 HD21 LEU 43 HD21 LEU 43 29.730 1.345 -6.207 599 HD22 LEU 43 HD22 LEU 43 29.601 0.580 -7.796 600 HD23 LEU 43 HD23 LEU 43 28.758 -0.113 -6.408 601 H ILE 44 H ILE 44 26.982 -2.287 -8.853 602 HA ILE 44 HA ILE 44 24.373 -2.577 -10.216 603 HB ILE 44 HB ILE 44 26.790 -4.385 -10.324 604 HG12 ILE 44 HG12 ILE 44 26.303 -4.231 -12.818 605 HG13 ILE 44 HG13 ILE 44 25.223 -2.903 -12.422 606 HG21 ILE 44 HG21 ILE 44 24.604 -5.676 -10.031 607 HG22 ILE 44 HG22 ILE 44 25.607 -6.101 -11.417 608 HG23 ILE 44 HG23 ILE 44 24.178 -5.090 -11.638 609 HD11 ILE 44 HD11 ILE 44 27.380 -2.078 -13.185 610 HD12 ILE 44 HD12 ILE 44 28.198 -2.987 -11.913 611 HD13 ILE 44 HD13 ILE 44 27.124 -1.654 -11.493 612 H PHE 45 H PHE 45 22.872 -3.674 -9.218 613 HA PHE 45 HA PHE 45 23.454 -5.732 -7.267 614 HB2 PHE 45 HB2 PHE 45 23.314 -3.702 -5.840 615 HB3 PHE 45 HB3 PHE 45 21.705 -3.372 -6.505 616 HD1 PHE 45 HD1 PHE 45 23.642 -5.947 -4.633 617 HD2 PHE 45 HD2 PHE 45 19.799 -4.332 -5.574 618 HE1 PHE 45 HE1 PHE 45 22.607 -7.443 -2.959 619 HE2 PHE 45 HE2 PHE 45 18.758 -5.818 -3.887 620 HZ PHE 45 HZ PHE 45 20.166 -7.377 -2.588 621 H ALA 46 H ALA 46 22.161 -7.353 -7.628 622 HA ALA 46 HA ALA 46 20.554 -8.691 -8.507 623 HB1 ALA 46 HB1 ALA 46 19.342 -7.741 -6.616 624 HB2 ALA 46 HB2 ALA 46 18.245 -8.084 -7.953 625 HB3 ALA 46 HB3 ALA 46 18.758 -6.426 -7.637 626 H GLY 47 H GLY 47 21.905 -7.369 -10.421 627 HA2 GLY 47 HA2 GLY 47 21.954 -7.046 -12.695 628 HA3 GLY 47 HA3 GLY 47 20.329 -7.703 -12.752 629 H LYS 48 H LYS 48 21.187 -4.859 -10.934 630 HA LYS 48 HA LYS 48 19.804 -3.082 -12.855 631 HB2 LYS 48 HB2 LYS 48 19.457 -3.375 -9.873 632 HB3 LYS 48 HB3 LYS 48 19.087 -1.849 -10.676 633 HG2 LYS 48 HG2 LYS 48 17.506 -3.059 -12.162 634 HG3 LYS 48 HG3 LYS 48 17.819 -4.528 -11.238 635 HD2 LYS 48 HD2 LYS 48 16.802 -1.987 -9.976 636 HD3 LYS 48 HD3 LYS 48 15.734 -3.231 -10.612 637 HE2 LYS 48 HE2 LYS 48 17.819 -3.745 -8.484 638 HE3 LYS 48 HE3 LYS 48 16.133 -3.345 -8.139 639 HZ1 LYS 48 HZ1 LYS 48 17.116 -5.695 -9.635 640 HZ2 LYS 48 HZ2 LYS 48 15.485 -5.285 -9.450 641 HZ3 LYS 48 HZ3 LYS 48 16.414 -5.693 -8.096 642 H GLN 49 H GLN 49 20.942 -1.338 -13.376 643 HA GLN 49 HA GLN 49 23.385 -0.608 -11.980 644 HB2 GLN 49 HB2 GLN 49 21.955 0.859 -14.215 645 HB3 GLN 49 HB3 GLN 49 23.598 1.163 -13.653 646 HG2 GLN 49 HG2 GLN 49 24.071 -1.280 -14.259 647 HG3 GLN 49 HG3 GLN 49 22.553 -1.220 -15.159 648 HE21 GLN 49 HE21 GLN 49 23.322 -1.330 -17.177 649 HE22 GLN 49 HE22 GLN 49 24.357 -0.158 -17.909 650 H LEU 50 H LEU 50 23.591 0.931 -10.501 651 HA LEU 50 HA LEU 50 21.152 1.953 -9.339 652 HB2 LEU 50 HB2 LEU 50 23.992 2.301 -8.378 653 HB3 LEU 50 HB3 LEU 50 22.523 2.569 -7.445 654 HG LEU 50 HG LEU 50 23.556 -0.063 -8.492 655 HD11 LEU 50 HD11 LEU 50 24.599 0.963 -6.451 656 HD12 LEU 50 HD12 LEU 50 23.918 -0.652 -6.237 657 HD13 LEU 50 HD13 LEU 50 23.038 0.762 -5.656 658 HD21 LEU 50 HD21 LEU 50 21.265 -0.432 -8.681 659 HD22 LEU 50 HD22 LEU 50 20.889 0.599 -7.301 660 HD23 LEU 50 HD23 LEU 50 21.620 -0.988 -7.042 661 H GLU 51 H GLU 51 20.489 3.959 -9.150 662 HA GLU 51 HA GLU 51 21.680 5.946 -10.957 663 HB2 GLU 51 HB2 GLU 51 18.832 5.659 -10.000 664 HB3 GLU 51 HB3 GLU 51 19.391 6.831 -11.184 665 HG2 GLU 51 HG2 GLU 51 19.541 3.839 -11.568 666 HG3 GLU 51 HG3 GLU 51 18.190 4.829 -12.113 667 H ASP 52 H ASP 52 22.059 7.987 -10.232 668 HA ASP 52 HA ASP 52 22.852 8.300 -7.602 669 HB2 ASP 52 HB2 ASP 52 22.301 10.320 -9.746 670 HB3 ASP 52 HB3 ASP 52 22.891 10.813 -8.158 671 H GLY 53 H GLY 53 19.878 9.541 -9.057 672 HA2 GLY 53 HA2 GLY 53 18.934 10.805 -6.649 673 HA3 GLY 53 HA3 GLY 53 18.074 10.677 -8.169 674 H ARG 54 H ARG 54 19.065 7.612 -7.201 675 HA ARG 54 HA ARG 54 16.481 7.058 -5.879 676 HB2 ARG 54 HB2 ARG 54 18.340 5.113 -7.259 677 HB3 ARG 54 HB3 ARG 54 16.775 4.718 -6.569 678 HG2 ARG 54 HG2 ARG 54 17.277 6.507 -8.951 679 HG3 ARG 54 HG3 ARG 54 16.701 4.853 -9.015 680 HD2 ARG 54 HD2 ARG 54 15.219 7.137 -7.711 681 HD3 ARG 54 HD3 ARG 54 14.927 6.565 -9.356 682 HE ARG 54 HE ARG 54 14.654 4.727 -7.094 683 HH11 ARG 54 HH11 ARG 54 13.084 6.426 -9.753 684 HH12 ARG 54 HH12 ARG 54 11.593 5.571 -9.536 685 HH21 ARG 54 HH21 ARG 54 12.645 3.813 -6.729 686 HH22 ARG 54 HH22 ARG 54 11.342 4.109 -7.830 687 H THR 55 H THR 55 16.642 5.223 -4.261 688 HA THR 55 HA THR 55 19.090 5.554 -2.640 689 HB THR 55 HB THR 55 17.621 5.110 -0.641 690 HG1 THR 55 HG1 THR 55 15.400 5.846 -2.194 691 HG21 THR 55 HG21 THR 55 18.287 7.385 -1.043 692 HG22 THR 55 HG22 THR 55 16.580 7.402 -0.606 693 HG23 THR 55 HG23 THR 55 17.059 7.587 -2.293 694 H LEU 56 H LEU 56 19.229 3.735 -0.929 695 HA LEU 56 HA LEU 56 19.592 1.269 -2.247 696 HB2 LEU 56 HB2 LEU 56 19.467 1.915 0.690 697 HB3 LEU 56 HB3 LEU 56 19.953 0.338 0.068 698 HG LEU 56 HG LEU 56 21.341 2.978 -0.476 699 HD11 LEU 56 HD11 LEU 56 21.543 2.083 1.839 700 HD12 LEU 56 HD12 LEU 56 23.080 2.131 0.970 701 HD13 LEU 56 HD13 LEU 56 22.220 0.604 1.161 702 HD21 LEU 56 HD21 LEU 56 21.741 1.576 -2.381 703 HD22 LEU 56 HD22 LEU 56 21.983 0.161 -1.347 704 HD23 LEU 56 HD23 LEU 56 23.172 1.468 -1.348 705 H SER 57 H SER 57 17.023 2.418 -0.166 706 HA SER 57 HA SER 57 15.530 0.051 0.126 707 HB2 SER 57 HB2 SER 57 13.643 1.547 0.721 708 HB3 SER 57 HB3 SER 57 15.132 2.009 1.543 709 HG SER 57 HG SER 57 14.326 3.195 -0.893 710 H ASP 58 H ASP 58 15.858 2.213 -2.548 711 HA ASP 58 HA ASP 58 13.390 1.560 -3.863 712 HB2 ASP 58 HB2 ASP 58 15.865 3.042 -4.692 713 HB3 ASP 58 HB3 ASP 58 14.609 2.657 -5.862 714 H TYR 59 H TYR 59 16.425 0.018 -3.649 715 HA TYR 59 HA TYR 59 15.818 -1.712 -5.963 716 HB2 TYR 59 HB2 TYR 59 18.445 -1.086 -4.614 717 HB3 TYR 59 HB3 TYR 59 18.245 -2.261 -5.910 718 HD1 TYR 59 HD1 TYR 59 17.813 -1.561 -8.185 719 HD2 TYR 59 HD2 TYR 59 18.350 1.294 -5.066 720 HE1 TYR 59 HE1 TYR 59 18.293 0.173 -9.866 721 HE2 TYR 59 HE2 TYR 59 18.837 3.035 -6.734 722 HH TYR 59 HH TYR 59 19.211 3.443 -8.886 723 H ASN 60 H ASN 60 15.274 -1.687 -2.837 724 HA ASN 60 HA ASN 60 14.864 -3.169 -1.202 725 HB2 ASN 60 HB2 ASN 60 13.855 -4.391 -3.191 726 HB3 ASN 60 HB3 ASN 60 15.297 -5.402 -3.170 727 HD21 ASN 60 HD21 ASN 60 14.251 -7.258 -2.627 728 HD22 ASN 60 HD22 ASN 60 13.521 -7.525 -1.087 729 H ILE 61 H ILE 61 17.613 -2.368 -1.943 730 HA ILE 61 HA ILE 61 19.406 -4.404 -0.983 731 HB ILE 61 HB ILE 61 19.776 -1.413 -1.265 732 HG12 ILE 61 HG12 ILE 61 20.669 -3.689 -3.041 733 HG13 ILE 61 HG13 ILE 61 19.287 -2.649 -3.361 734 HG21 ILE 61 HG21 ILE 61 21.360 -2.293 0.359 735 HG22 ILE 61 HG22 ILE 61 22.214 -1.867 -1.129 736 HG23 ILE 61 HG23 ILE 61 21.848 -3.559 -0.764 737 HD11 ILE 61 HD11 ILE 61 22.165 -1.729 -3.229 738 HD12 ILE 61 HD12 ILE 61 20.764 -0.742 -3.660 739 HD13 ILE 61 HD13 ILE 61 21.261 -2.073 -4.708 740 H GLN 62 H GLN 62 19.125 -5.137 0.991 741 HA GLN 62 HA GLN 62 18.380 -3.285 3.141 742 HB2 GLN 62 HB2 GLN 62 18.142 -6.293 2.986 743 HB3 GLN 62 HB3 GLN 62 17.616 -5.307 4.342 744 HG2 GLN 62 HG2 GLN 62 16.040 -4.144 2.776 745 HG3 GLN 62 HG3 GLN 62 16.479 -5.331 1.547 746 HE21 GLN 62 HE21 GLN 62 16.729 -7.388 3.761 747 HE22 GLN 62 HE22 GLN 62 15.099 -7.853 4.088 748 H LYS 63 H LYS 63 19.149 -4.627 5.364 749 HA LYS 63 HA LYS 63 21.918 -4.060 5.546 750 HB2 LYS 63 HB2 LYS 63 21.811 -4.926 7.797 751 HB3 LYS 63 HB3 LYS 63 20.345 -4.015 7.479 752 HG2 LYS 63 HG2 LYS 63 19.133 -6.128 7.091 753 HG3 LYS 63 HG3 LYS 63 20.607 -7.022 7.487 754 HD2 LYS 63 HD2 LYS 63 20.626 -5.955 9.714 755 HD3 LYS 63 HD3 LYS 63 19.115 -5.132 9.311 756 HE2 LYS 63 HE2 LYS 63 18.078 -7.383 8.939 757 HE3 LYS 63 HE3 LYS 63 19.560 -8.108 9.579 758 HZ1 LYS 63 HZ1 LYS 63 17.798 -6.204 10.998 759 HZ2 LYS 63 HZ2 LYS 63 19.232 -6.859 11.611 760 HZ3 LYS 63 HZ3 LYS 63 17.910 -7.866 11.295 761 H GLU 64 H GLU 64 23.686 -5.315 5.481 762 HA GLU 64 HA GLU 64 25.076 -7.110 5.232 763 HB2 GLU 64 HB2 GLU 64 22.701 -8.341 6.247 764 HB3 GLU 64 HB3 GLU 64 23.389 -9.376 5.005 765 HG2 GLU 64 HG2 GLU 64 24.186 -9.925 7.257 766 HG3 GLU 64 HG3 GLU 64 25.495 -9.457 6.173 767 H SER 65 H SER 65 23.022 -6.051 2.993 768 HA SER 65 HA SER 65 23.229 -8.024 0.916 769 HB2 SER 65 HB2 SER 65 22.787 -5.030 0.771 770 HB3 SER 65 HB3 SER 65 22.681 -6.110 -0.621 771 HG SER 65 HG SER 65 21.170 -7.049 1.408 772 H THR 66 H THR 66 24.743 -8.245 -0.672 773 HA THR 66 HA THR 66 26.997 -6.359 -0.572 774 HB THR 66 HB THR 66 28.620 -7.881 -0.649 775 HG1 THR 66 HG1 THR 66 28.665 -9.055 -2.357 776 HG21 THR 66 HG21 THR 66 26.617 -8.848 1.009 777 HG22 THR 66 HG22 THR 66 28.310 -9.349 1.012 778 HG23 THR 66 HG23 THR 66 27.122 -10.250 0.068 779 H LEU 67 H LEU 67 27.574 -5.402 -2.238 780 HA LEU 67 HA LEU 67 26.238 -5.825 -4.836 781 HB2 LEU 67 HB2 LEU 67 27.442 -3.420 -3.450 782 HB3 LEU 67 HB3 LEU 67 27.041 -3.391 -5.154 783 HG LEU 67 HG LEU 67 24.661 -3.697 -4.604 784 HD11 LEU 67 HD11 LEU 67 24.956 -4.913 -2.414 785 HD12 LEU 67 HD12 LEU 67 23.796 -3.583 -2.373 786 HD13 LEU 67 HD13 LEU 67 25.412 -3.366 -1.699 787 HD21 LEU 67 HD21 LEU 67 25.583 -1.469 -4.817 788 HD22 LEU 67 HD22 LEU 67 26.051 -1.478 -3.116 789 HD23 LEU 67 HD23 LEU 67 24.342 -1.489 -3.561 790 H HIS 68 H HIS 68 27.593 -5.254 -6.690 791 HA HIS 68 HA HIS 68 30.465 -5.789 -6.262 792 HB2 HIS 68 HB2 HIS 68 28.629 -6.645 -8.496 793 HB3 HIS 68 HB3 HIS 68 30.384 -6.591 -8.717 794 HD1 HIS 68 HD1 HIS 68 27.803 -8.462 -6.656 795 HD2 HIS 68 HD2 HIS 68 31.812 -8.466 -7.588 796 HE1 HIS 68 HE1 HIS 68 28.716 -10.655 -5.764 797 HE2 HIS 68 HE2 HIS 68 31.205 -10.530 -6.240 798 H LEU 69 H LEU 69 31.937 -4.690 -7.401 799 HA LEU 69 HA LEU 69 31.070 -2.155 -8.649 800 HB2 LEU 69 HB2 LEU 69 32.209 -1.791 -6.529 801 HB3 LEU 69 HB3 LEU 69 33.537 -2.830 -7.026 802 HG LEU 69 HG LEU 69 34.078 -1.210 -8.834 803 HD11 LEU 69 HD11 LEU 69 32.070 0.584 -7.473 804 HD12 LEU 69 HD12 LEU 69 31.848 -0.166 -9.056 805 HD13 LEU 69 HD13 LEU 69 33.141 1.014 -8.807 806 HD21 LEU 69 HD21 LEU 69 35.392 -1.080 -6.876 807 HD22 LEU 69 HD22 LEU 69 34.102 -0.282 -5.977 808 HD23 LEU 69 HD23 LEU 69 34.935 0.578 -7.271 809 H VAL 70 H VAL 70 31.595 -1.863 -10.688 810 HA VAL 70 HA VAL 70 33.826 -3.374 -11.887 811 HB VAL 70 HB VAL 70 31.289 -2.259 -13.165 812 HG11 VAL 70 HG11 VAL 70 33.053 -1.897 -14.743 813 HG12 VAL 70 HG12 VAL 70 32.104 -3.277 -15.295 814 HG13 VAL 70 HG13 VAL 70 33.662 -3.537 -14.514 815 HG21 VAL 70 HG21 VAL 70 31.201 -4.474 -11.880 816 HG22 VAL 70 HG22 VAL 70 32.144 -5.138 -13.213 817 HG23 VAL 70 HG23 VAL 70 30.544 -4.456 -13.515 818 H LEU 71 H LEU 71 35.395 -2.098 -12.860 819 HA LEU 71 HA LEU 71 35.290 0.728 -12.166 820 HB2 LEU 71 HB2 LEU 71 37.262 -1.146 -11.871 821 HB3 LEU 71 HB3 LEU 71 37.753 -0.356 -13.360 822 HG LEU 71 HG LEU 71 37.282 1.809 -11.915 823 HD11 LEU 71 HD11 LEU 71 36.516 0.428 -9.990 824 HD12 LEU 71 HD12 LEU 71 37.805 1.567 -9.604 825 HD13 LEU 71 HD13 LEU 71 38.174 -0.146 -9.807 826 HD21 LEU 71 HD21 LEU 71 39.838 0.172 -12.036 827 HD22 LEU 71 HD22 LEU 71 39.785 1.758 -11.265 828 HD23 LEU 71 HD23 LEU 71 39.411 1.600 -12.981 Start of MODEL 4 1 H GLY 12 H GLY 12 6.466 -11.218 -0.561 2 HA2 GLY 12 HA2 GLY 12 8.928 -11.023 0.915 3 HA3 GLY 12 HA3 GLY 12 9.044 -12.105 -0.465 4 HA PRO 13 HA PRO 13 9.884 -8.586 -2.992 5 HB2 PRO 13 HB2 PRO 13 8.777 -9.268 -5.398 6 HB3 PRO 13 HB3 PRO 13 10.292 -9.944 -4.793 7 HG2 PRO 13 HG2 PRO 13 7.555 -11.133 -4.812 8 HG3 PRO 13 HG3 PRO 13 9.123 -11.924 -5.053 9 HD2 PRO 13 HD2 PRO 13 7.702 -12.031 -2.696 10 HD3 PRO 13 HD3 PRO 13 9.465 -12.203 -2.791 11 H MET 14 H MET 14 8.382 -7.338 -1.598 12 HA MET 14 HA MET 14 5.691 -6.887 -2.434 13 HB2 MET 14 HB2 MET 14 7.545 -5.541 -0.476 14 HB3 MET 14 HB3 MET 14 5.976 -4.825 -0.866 15 HG2 MET 14 HG2 MET 14 6.267 -7.705 -0.022 16 HG3 MET 14 HG3 MET 14 6.004 -6.397 1.146 17 HE1 MET 14 HE1 MET 14 2.473 -7.286 1.460 18 HE2 MET 14 HE2 MET 14 3.558 -5.995 1.979 19 HE3 MET 14 HE3 MET 14 4.112 -7.669 1.986 20 H LEU 15 H LEU 15 5.976 -6.456 -4.689 21 HA LEU 15 HA LEU 15 7.481 -4.190 -5.596 22 HB2 LEU 15 HB2 LEU 15 6.207 -6.441 -6.775 23 HB3 LEU 15 HB3 LEU 15 5.460 -5.008 -7.485 24 HG LEU 15 HG LEU 15 7.735 -4.123 -8.029 25 HD11 LEU 15 HD11 LEU 15 9.591 -5.070 -7.188 26 HD12 LEU 15 HD12 LEU 15 9.124 -6.644 -7.832 27 HD13 LEU 15 HD13 LEU 15 8.559 -6.138 -6.237 28 HD21 LEU 15 HD21 LEU 15 6.472 -5.343 -9.718 29 HD22 LEU 15 HD22 LEU 15 7.074 -6.879 -9.088 30 HD23 LEU 15 HD23 LEU 15 8.185 -5.744 -9.850 31 H CYS 16 H CYS 16 6.722 -2.179 -6.272 32 HA CYS 16 HA CYS 16 4.893 -0.823 -4.789 33 HB2 CYS 16 HB2 CYS 16 6.569 0.083 -6.508 34 HB3 CYS 16 HB3 CYS 16 5.269 -0.124 -7.694 35 H SER 17 H SER 17 2.783 -0.515 -4.644 36 HA SER 17 HA SER 17 0.948 -2.234 -5.931 37 HB2 SER 17 HB2 SER 17 0.416 0.317 -4.383 38 HB3 SER 17 HB3 SER 17 -0.781 -0.930 -4.760 39 HG SER 17 HG SER 17 1.127 -2.263 -3.682 40 H THR 18 H THR 18 1.992 1.064 -6.610 41 HA THR 18 HA THR 18 -0.120 1.656 -8.440 42 HB THR 18 HB THR 18 1.281 3.589 -9.089 43 HG1 THR 18 HG1 THR 18 3.310 2.453 -8.773 44 HG21 THR 18 HG21 THR 18 1.129 3.094 -6.107 45 HG22 THR 18 HG22 THR 18 -0.198 3.682 -7.107 46 HG23 THR 18 HG23 THR 18 1.249 4.669 -6.887 47 H GLY 19 H GLY 19 2.673 -0.316 -8.755 48 HA2 GLY 19 HA2 GLY 19 3.372 -1.583 -10.572 49 HA3 GLY 19 HA3 GLY 19 2.082 -0.855 -11.521 50 H CYS 20 H CYS 20 4.797 0.713 -9.812 51 HA CYS 20 HA CYS 20 5.364 2.272 -12.165 52 HB2 CYS 20 HB2 CYS 20 6.934 3.492 -10.786 53 HB3 CYS 20 HB3 CYS 20 5.470 3.213 -9.844 54 H GLY 21 H GLY 21 6.431 -0.779 -11.060 55 HA2 GLY 21 HA2 GLY 21 7.795 -2.198 -12.397 56 HA3 GLY 21 HA3 GLY 21 8.543 -0.775 -13.104 57 H PHE 22 H PHE 22 8.431 -0.342 -9.773 58 HA PHE 22 HA PHE 22 11.129 -1.488 -9.437 59 HB2 PHE 22 HB2 PHE 22 10.037 1.170 -8.524 60 HB3 PHE 22 HB3 PHE 22 11.534 0.478 -7.881 61 HD1 PHE 22 HD1 PHE 22 13.419 -0.031 -9.417 62 HD2 PHE 22 HD2 PHE 22 9.992 2.188 -10.684 63 HE1 PHE 22 HE1 PHE 22 14.671 0.761 -11.391 64 HE2 PHE 22 HE2 PHE 22 11.241 2.995 -12.657 65 HZ PHE 22 HZ PHE 22 13.583 2.279 -13.013 66 H TYR 23 H TYR 23 11.669 -1.407 -6.919 67 HA TYR 23 HA TYR 23 9.652 -3.104 -5.703 68 HB2 TYR 23 HB2 TYR 23 12.503 -2.432 -4.999 69 HB3 TYR 23 HB3 TYR 23 11.456 -3.339 -3.903 70 HD1 TYR 23 HD1 TYR 23 12.465 -3.325 -7.488 71 HD2 TYR 23 HD2 TYR 23 11.514 -5.661 -4.046 72 HE1 TYR 23 HE1 TYR 23 12.971 -5.374 -8.758 73 HE2 TYR 23 HE2 TYR 23 12.016 -7.728 -5.301 74 HH TYR 23 HH TYR 23 13.629 -7.725 -8.305 75 H GLY 24 H GLY 24 8.713 -2.749 -3.662 76 HA2 GLY 24 HA2 GLY 24 8.752 0.074 -2.765 77 HA3 GLY 24 HA3 GLY 24 7.336 -0.970 -2.679 78 H ASN 25 H ASN 25 9.045 0.521 -0.612 79 HA ASN 25 HA ASN 25 10.268 -1.477 1.015 80 HB2 ASN 25 HB2 ASN 25 10.586 1.134 1.005 81 HB3 ASN 25 HB3 ASN 25 9.221 1.105 2.124 82 HD21 ASN 25 HD21 ASN 25 10.619 1.892 3.818 83 HD22 ASN 25 HD22 ASN 25 11.722 0.821 4.601 84 HA PRO 26 HA PRO 26 6.322 -2.977 2.685 85 HB2 PRO 26 HB2 PRO 26 7.316 -4.688 4.536 86 HB3 PRO 26 HB3 PRO 26 7.213 -5.078 2.812 87 HG2 PRO 26 HG2 PRO 26 9.555 -4.119 4.410 88 HG3 PRO 26 HG3 PRO 26 9.494 -5.394 3.179 89 HD2 PRO 26 HD2 PRO 26 10.426 -2.905 2.633 90 HD3 PRO 26 HD3 PRO 26 9.561 -3.866 1.420 91 H ARG 27 H ARG 27 8.877 -1.409 4.467 92 HA ARG 27 HA ARG 27 7.431 -1.149 6.940 93 HB2 ARG 27 HB2 ARG 27 9.862 0.242 5.794 94 HB3 ARG 27 HB3 ARG 27 9.181 0.677 7.363 95 HG2 ARG 27 HG2 ARG 27 9.395 -1.727 8.048 96 HG3 ARG 27 HG3 ARG 27 10.251 -2.025 6.537 97 HD2 ARG 27 HD2 ARG 27 12.040 -1.613 7.958 98 HD3 ARG 27 HD3 ARG 27 11.752 -0.009 7.274 99 HE ARG 27 HE ARG 27 10.343 -0.682 8.989 100 HH11 ARG 27 HH11 ARG 27 13.580 0.008 8.666 101 HH12 ARG 27 HH12 ARG 27 14.038 0.801 10.136 102 HH21 ARG 27 HH21 ARG 27 10.863 0.743 11.506 103 HH22 ARG 27 HH22 ARG 27 12.516 1.210 11.725 104 H THR 28 H THR 28 7.747 0.683 3.955 105 HA THR 28 HA THR 28 6.336 3.000 4.934 106 HB THR 28 HB THR 28 6.473 3.783 2.607 107 HG1 THR 28 HG1 THR 28 6.381 1.272 2.018 108 HG21 THR 28 HG21 THR 28 8.980 3.577 2.293 109 HG22 THR 28 HG22 THR 28 8.987 2.474 3.667 110 HG23 THR 28 HG23 THR 28 8.468 4.149 3.882 111 H ASN 29 H ASN 29 4.597 3.251 2.505 112 HA ASN 29 HA ASN 29 2.390 1.619 3.480 113 HB2 ASN 29 HB2 ASN 29 2.662 4.022 1.697 114 HB3 ASN 29 HB3 ASN 29 1.167 3.073 1.662 115 HD21 ASN 29 HD21 ASN 29 -0.308 4.143 2.933 116 HD22 ASN 29 HD22 ASN 29 0.031 4.799 4.495 117 H GLY 30 H GLY 30 4.619 0.384 1.857 118 HA2 GLY 30 HA2 GLY 30 4.592 -1.452 0.404 119 HA3 GLY 30 HA3 GLY 30 2.928 -1.065 -0.020 120 H MET 31 H MET 31 4.947 1.687 -0.173 121 HA MET 31 HA MET 31 5.239 1.371 -3.094 122 HB2 MET 31 HB2 MET 31 4.223 3.629 -1.413 123 HB3 MET 31 HB3 MET 31 5.062 4.013 -2.927 124 HG2 MET 31 HG2 MET 31 2.779 3.859 -3.509 125 HG3 MET 31 HG3 MET 31 3.483 2.319 -4.031 126 HE1 MET 31 HE1 MET 31 -0.286 2.527 -2.123 127 HE2 MET 31 HE2 MET 31 0.452 2.943 -3.668 128 HE3 MET 31 HE3 MET 31 0.670 4.003 -2.273 129 H CYS 32 H CYS 32 6.946 2.703 -4.054 130 HA CYS 32 HA CYS 32 9.391 2.478 -2.584 131 HB2 CYS 32 HB2 CYS 32 10.437 3.295 -4.678 132 HB3 CYS 32 HB3 CYS 32 9.277 2.006 -5.002 133 H SER 33 H SER 33 10.919 4.677 -3.127 134 HA SER 33 HA SER 33 9.912 6.555 -1.220 135 HB2 SER 33 HB2 SER 33 12.038 7.748 -1.593 136 HB3 SER 33 HB3 SER 33 12.316 6.020 -1.362 137 HG SER 33 HG SER 33 13.063 5.915 -3.322 138 H VAL 34 H VAL 34 9.790 6.399 -4.660 139 HA VAL 34 HA VAL 34 9.477 9.233 -5.071 140 HB VAL 34 HB VAL 34 8.913 7.021 -7.045 141 HG11 VAL 34 HG11 VAL 34 9.372 8.754 -8.713 142 HG12 VAL 34 HG12 VAL 34 9.684 9.916 -7.424 143 HG13 VAL 34 HG13 VAL 34 8.062 9.261 -7.643 144 HG21 VAL 34 HG21 VAL 34 11.230 7.319 -7.816 145 HG22 VAL 34 HG22 VAL 34 11.193 6.775 -6.138 146 HG23 VAL 34 HG23 VAL 34 11.514 8.468 -6.511 147 H CYS 35 H CYS 35 7.318 6.411 -5.146 148 HA CYS 35 HA CYS 35 4.996 8.013 -5.746 149 HB2 CYS 35 HB2 CYS 35 5.276 5.094 -5.018 150 HB3 CYS 35 HB3 CYS 35 3.784 5.859 -5.582 151 H TYR 36 H TYR 36 6.502 6.736 -2.877 152 HA TYR 36 HA TYR 36 4.319 6.715 -1.128 153 HB2 TYR 36 HB2 TYR 36 6.464 5.678 -0.558 154 HB3 TYR 36 HB3 TYR 36 7.242 7.261 -0.523 155 HD1 TYR 36 HD1 TYR 36 3.902 6.304 0.898 156 HD2 TYR 36 HD2 TYR 36 7.959 7.471 1.676 157 HE1 TYR 36 HE1 TYR 36 3.373 6.528 3.314 158 HE2 TYR 36 HE2 TYR 36 7.436 7.701 4.089 159 HH TYR 36 HH TYR 36 4.565 6.496 5.491 160 H LYS 37 H LYS 37 6.622 9.386 -1.779 161 HA LYS 37 HA LYS 37 5.291 11.161 0.023 162 HB2 LYS 37 HB2 LYS 37 6.734 12.925 -0.939 163 HB3 LYS 37 HB3 LYS 37 7.667 11.494 -0.503 164 HG2 LYS 37 HG2 LYS 37 7.620 10.758 -2.859 165 HG3 LYS 37 HG3 LYS 37 6.723 12.225 -3.280 166 HD2 LYS 37 HD2 LYS 37 8.637 13.546 -2.276 167 HD3 LYS 37 HD3 LYS 37 9.542 12.025 -2.217 168 HE2 LYS 37 HE2 LYS 37 9.021 11.771 -4.697 169 HE3 LYS 37 HE3 LYS 37 8.480 13.459 -4.647 170 HZ1 LYS 37 HZ1 LYS 37 10.652 14.108 -3.825 171 HZ2 LYS 37 HZ2 LYS 37 10.803 13.305 -5.307 172 HZ3 LYS 37 HZ3 LYS 37 11.181 12.502 -3.867 173 H GLU 38 H GLU 38 5.272 10.702 -3.481 174 HA GLU 38 HA GLU 38 3.703 12.855 -4.250 175 HB2 GLU 38 HB2 GLU 38 4.107 10.098 -5.382 176 HB3 GLU 38 HB3 GLU 38 2.958 11.214 -6.133 177 HG2 GLU 38 HG2 GLU 38 5.773 12.079 -5.505 178 HG3 GLU 38 HG3 GLU 38 5.375 11.244 -7.015 179 H HIS 39 H HIS 39 2.650 9.675 -3.013 180 HA HIS 39 HA HIS 39 -0.122 10.431 -3.401 181 HB2 HIS 39 HB2 HIS 39 -0.739 8.212 -2.879 182 HB3 HIS 39 HB3 HIS 39 0.774 8.060 -3.760 183 HD1 HIS 39 HD1 HIS 39 2.021 6.166 -2.802 184 HD2 HIS 39 HD2 HIS 39 0.148 8.392 0.189 185 HE1 HIS 39 HE1 HIS 39 2.552 5.018 -0.614 186 HE2 HIS 39 HE2 HIS 39 1.734 6.589 1.201 187 H LEU 40 H LEU 40 2.151 10.237 -0.754 188 HA LEU 40 HA LEU 40 0.344 10.408 1.405 189 HB2 LEU 40 HB2 LEU 40 2.844 9.895 1.491 190 HB3 LEU 40 HB3 LEU 40 3.106 11.636 1.354 191 HG LEU 40 HG LEU 40 1.542 11.889 3.367 192 HD11 LEU 40 HD11 LEU 40 0.629 9.552 3.174 193 HD12 LEU 40 HD12 LEU 40 1.256 9.946 4.778 194 HD13 LEU 40 HD13 LEU 40 2.213 8.956 3.680 195 HD21 LEU 40 HD21 LEU 40 3.383 11.207 4.964 196 HD22 LEU 40 HD22 LEU 40 3.904 12.252 3.639 197 HD23 LEU 40 HD23 LEU 40 4.229 10.522 3.579 198 H GLN 41 H GLN 41 1.618 12.850 -0.762 199 HA GLN 41 HA GLN 41 1.001 15.139 0.785 200 HB2 GLN 41 HB2 GLN 41 1.660 14.580 -2.071 201 HB3 GLN 41 HB3 GLN 41 0.921 16.142 -1.696 202 HG2 GLN 41 HG2 GLN 41 2.661 16.628 -0.071 203 HG3 GLN 41 HG3 GLN 41 3.381 15.033 -0.328 204 HE21 GLN 41 HE21 GLN 41 3.004 18.230 -1.683 205 HE22 GLN 41 HE22 GLN 41 4.117 18.000 -2.983 206 H ARG 42 H ARG 42 -0.868 13.294 -1.602 207 HA ARG 42 HA ARG 42 -3.098 15.122 -1.549 208 HB2 ARG 42 HB2 ARG 42 -2.690 12.378 -2.741 209 HB3 ARG 42 HB3 ARG 42 -4.229 13.246 -2.854 210 HG2 ARG 42 HG2 ARG 42 -3.249 15.028 -4.085 211 HG3 ARG 42 HG3 ARG 42 -1.611 14.467 -3.711 212 HD2 ARG 42 HD2 ARG 42 -2.145 12.353 -4.956 213 HD3 ARG 42 HD3 ARG 42 -3.641 13.123 -5.498 214 HE ARG 42 HE ARG 42 -0.937 13.351 -6.180 215 HH11 ARG 42 HH11 ARG 42 -4.114 15.149 -5.916 216 HH12 ARG 42 HH12 ARG 42 -3.867 16.372 -7.116 217 HH21 ARG 42 HH21 ARG 42 -0.751 15.219 -8.072 218 HH22 ARG 42 HH22 ARG 42 -1.983 16.410 -8.323 219 H GLN 43 H GLN 43 -2.189 12.166 0.097 220 HA GLN 43 HA GLN 43 -4.787 11.634 1.191 221 HB2 GLN 43 HB2 GLN 43 -2.755 10.020 0.834 222 HB3 GLN 43 HB3 GLN 43 -2.231 10.625 2.409 223 HG2 GLN 43 HG2 GLN 43 -3.501 8.815 3.058 224 HG3 GLN 43 HG3 GLN 43 -4.724 10.095 3.089 225 HE21 GLN 43 HE21 GLN 43 -6.441 8.602 2.630 226 HE22 GLN 43 HE22 GLN 43 -6.616 7.887 1.067 227 H GLN 44 H GLN 44 -1.857 13.293 2.255 228 HA GLN 44 HA GLN 44 -2.743 13.750 4.936 229 HB2 GLN 44 HB2 GLN 44 -0.324 13.757 4.020 230 HB3 GLN 44 HB3 GLN 44 -0.669 15.423 3.531 231 HG2 GLN 44 HG2 GLN 44 -1.127 16.083 5.782 232 HG3 GLN 44 HG3 GLN 44 -1.112 14.403 6.336 233 HE21 GLN 44 HE21 GLN 44 1.097 16.566 4.517 234 HE22 GLN 44 HE22 GLN 44 2.504 16.074 5.391 235 H ASN 45 H ASN 45 -2.745 15.654 1.942 236 HA ASN 45 HA ASN 45 -3.670 18.076 3.091 237 HB2 ASN 45 HB2 ASN 45 -3.569 16.961 0.301 238 HB3 ASN 45 HB3 ASN 45 -4.463 18.453 0.613 239 HD21 ASN 45 HD21 ASN 45 -1.842 17.956 -0.836 240 HD22 ASN 45 HD22 ASN 45 -0.735 19.039 -0.072 241 H SER 46 H SER 46 -5.343 15.329 1.587 242 HA SER 46 HA SER 46 -7.949 16.503 1.806 243 HB2 SER 46 HB2 SER 46 -7.121 14.612 0.207 244 HB3 SER 46 HB3 SER 46 -7.481 13.542 1.568 245 HG SER 46 HG SER 46 -9.255 15.277 0.194 246 H1 MET 1 H1 MET 1 22.656 0.670 9.796 247 H2 MET 1 H2 MET 1 23.264 1.203 8.310 248 H3 MET 1 H3 MET 1 24.305 1.010 9.629 249 HA MET 1 HA MET 1 23.940 -1.351 9.634 250 HB2 MET 1 HB2 MET 1 22.608 -2.412 7.916 251 HB3 MET 1 HB3 MET 1 21.616 -1.209 8.727 252 HG2 MET 1 HG2 MET 1 21.981 0.345 6.869 253 HG3 MET 1 HG3 MET 1 22.978 -0.857 6.060 254 HE1 MET 1 HE1 MET 1 20.090 -1.072 3.623 255 HE2 MET 1 HE2 MET 1 21.835 -1.031 3.879 256 HE3 MET 1 HE3 MET 1 20.846 0.362 4.317 257 H GLN 2 H GLN 2 25.465 -2.621 8.575 258 HA GLN 2 HA GLN 2 27.040 -1.196 6.550 259 HB2 GLN 2 HB2 GLN 2 28.846 -2.594 7.062 260 HB3 GLN 2 HB3 GLN 2 28.085 -2.290 8.616 261 HG2 GLN 2 HG2 GLN 2 27.005 -4.471 8.540 262 HG3 GLN 2 HG3 GLN 2 27.693 -4.771 6.946 263 HE21 GLN 2 HE21 GLN 2 30.208 -3.383 7.926 264 HE22 GLN 2 HE22 GLN 2 31.026 -4.602 8.837 265 H ILE 3 H ILE 3 27.422 -1.929 4.566 266 HA ILE 3 HA ILE 3 26.393 -4.555 3.785 267 HB ILE 3 HB ILE 3 25.356 -3.924 1.855 268 HG12 ILE 3 HG12 ILE 3 26.896 -2.328 0.930 269 HG13 ILE 3 HG13 ILE 3 25.241 -1.771 0.783 270 HG21 ILE 3 HG21 ILE 3 23.966 -3.546 3.777 271 HG22 ILE 3 HG22 ILE 3 23.521 -2.486 2.440 272 HG23 ILE 3 HG23 ILE 3 24.440 -1.847 3.803 273 HD11 ILE 3 HD11 ILE 3 27.326 -0.256 1.578 274 HD12 ILE 3 HD12 ILE 3 26.691 -0.770 3.140 275 HD13 ILE 3 HD13 ILE 3 25.640 0.077 2.001 276 H PHE 4 H PHE 4 27.422 -5.315 1.779 277 HA PHE 4 HA PHE 4 30.235 -4.391 1.722 278 HB2 PHE 4 HB2 PHE 4 29.185 -7.161 1.066 279 HB3 PHE 4 HB3 PHE 4 30.882 -6.687 1.287 280 HD1 PHE 4 HD1 PHE 4 31.591 -5.834 3.610 281 HD2 PHE 4 HD2 PHE 4 27.888 -7.841 2.875 282 HE1 PHE 4 HE1 PHE 4 31.341 -6.264 6.030 283 HE2 PHE 4 HE2 PHE 4 27.649 -8.293 5.297 284 HZ PHE 4 HZ PHE 4 29.377 -7.496 6.872 285 H VAL 5 H VAL 5 31.180 -3.969 -0.160 286 HA VAL 5 HA VAL 5 29.682 -4.387 -2.677 287 HB VAL 5 HB VAL 5 31.478 -2.041 -1.987 288 HG11 VAL 5 HG11 VAL 5 31.747 -2.471 -4.318 289 HG12 VAL 5 HG12 VAL 5 30.607 -1.132 -4.186 290 HG13 VAL 5 HG13 VAL 5 30.021 -2.760 -4.532 291 HG21 VAL 5 HG21 VAL 5 28.555 -1.888 -2.684 292 HG22 VAL 5 HG22 VAL 5 29.573 -0.671 -1.904 293 HG23 VAL 5 HG23 VAL 5 29.090 -2.118 -1.019 294 H LYS 6 H LYS 6 30.623 -6.151 -3.378 295 HA LYS 6 HA LYS 6 33.454 -6.689 -3.228 296 HB2 LYS 6 HB2 LYS 6 31.183 -7.957 -4.777 297 HB3 LYS 6 HB3 LYS 6 32.827 -8.584 -4.748 298 HG2 LYS 6 HG2 LYS 6 32.676 -9.004 -2.368 299 HG3 LYS 6 HG3 LYS 6 31.065 -8.277 -2.315 300 HD2 LYS 6 HD2 LYS 6 30.929 -10.732 -2.394 301 HD3 LYS 6 HD3 LYS 6 30.228 -10.002 -3.838 302 HE2 LYS 6 HE2 LYS 6 32.467 -10.386 -4.967 303 HE3 LYS 6 HE3 LYS 6 32.904 -11.375 -3.571 304 HZ1 LYS 6 HZ1 LYS 6 30.616 -11.822 -5.384 305 HZ2 LYS 6 HZ2 LYS 6 30.989 -12.762 -4.028 306 HZ3 LYS 6 HZ3 LYS 6 32.051 -12.718 -5.344 307 H THR 7 H THR 7 34.963 -6.170 -4.628 308 HA THR 7 HA THR 7 34.205 -5.110 -7.279 309 HB THR 7 HB THR 7 36.414 -4.153 -7.435 310 HG1 THR 7 HG1 THR 7 36.890 -5.885 -5.306 311 HG21 THR 7 HG21 THR 7 35.674 -3.593 -4.579 312 HG22 THR 7 HG22 THR 7 34.668 -3.011 -5.909 313 HG23 THR 7 HG23 THR 7 36.348 -2.486 -5.774 314 H LEU 8 H LEU 8 35.786 -5.783 -9.034 315 HA LEU 8 HA LEU 8 35.608 -8.642 -9.141 316 HB2 LEU 8 HB2 LEU 8 36.523 -6.726 -11.271 317 HB3 LEU 8 HB3 LEU 8 36.100 -8.421 -11.509 318 HG LEU 8 HG LEU 8 34.254 -6.224 -10.571 319 HD11 LEU 8 HD11 LEU 8 34.873 -6.255 -12.987 320 HD12 LEU 8 HD12 LEU 8 33.148 -6.432 -12.661 321 HD13 LEU 8 HD13 LEU 8 34.112 -7.842 -13.094 322 HD21 LEU 8 HD21 LEU 8 33.801 -9.183 -10.745 323 HD22 LEU 8 HD22 LEU 8 32.471 -8.042 -10.946 324 HD23 LEU 8 HD23 LEU 8 33.388 -8.073 -9.440 325 H THR 9 H THR 9 38.144 -6.478 -8.510 326 HA THR 9 HA THR 9 40.391 -8.138 -8.906 327 HB THR 9 HB THR 9 41.389 -6.878 -6.970 328 HG1 THR 9 HG1 THR 9 38.923 -5.465 -7.051 329 HG21 THR 9 HG21 THR 9 40.172 -5.358 -9.268 330 HG22 THR 9 HG22 THR 9 41.792 -6.048 -9.171 331 HG23 THR 9 HG23 THR 9 41.359 -4.664 -8.166 332 H GLY 10 H GLY 10 37.931 -8.064 -6.438 333 HA2 GLY 10 HA2 GLY 10 37.395 -10.269 -5.391 334 HA3 GLY 10 HA3 GLY 10 39.120 -10.415 -5.073 335 H LYS 11 H LYS 11 39.240 -7.480 -4.455 336 HA LYS 11 HA LYS 11 38.944 -7.529 -1.655 337 HB2 LYS 11 HB2 LYS 11 40.329 -5.915 -3.131 338 HB3 LYS 11 HB3 LYS 11 38.831 -4.990 -3.276 339 HG2 LYS 11 HG2 LYS 11 38.998 -5.484 -0.566 340 HG3 LYS 11 HG3 LYS 11 40.673 -5.191 -1.024 341 HD2 LYS 11 HD2 LYS 11 38.382 -3.352 -1.702 342 HD3 LYS 11 HD3 LYS 11 39.407 -3.164 -0.285 343 HE2 LYS 11 HE2 LYS 11 40.466 -3.165 -3.107 344 HE3 LYS 11 HE3 LYS 11 39.983 -1.700 -2.254 345 HZ1 LYS 11 HZ1 LYS 11 42.100 -3.594 -1.432 346 HZ2 LYS 11 HZ2 LYS 11 41.614 -2.236 -0.549 347 HZ3 LYS 11 HZ3 LYS 11 42.331 -2.044 -2.069 348 H THR 12 H THR 12 37.446 -6.619 -0.302 349 HA THR 12 HA THR 12 34.774 -5.986 -1.428 350 HB THR 12 HB THR 12 35.467 -7.456 1.129 351 HG1 THR 12 HG1 THR 12 35.492 -8.987 -0.354 352 HG21 THR 12 HG21 THR 12 32.738 -6.735 0.046 353 HG22 THR 12 HG22 THR 12 33.467 -6.078 1.511 354 HG23 THR 12 HG23 THR 12 33.037 -7.787 1.425 355 H ILE 13 H ILE 13 34.032 -4.092 -0.947 356 HA ILE 13 HA ILE 13 35.337 -2.370 1.054 357 HB ILE 13 HB ILE 13 32.962 -1.521 -0.541 358 HG12 ILE 13 HG12 ILE 13 34.216 -2.474 -2.331 359 HG13 ILE 13 HG13 ILE 13 34.375 -0.730 -2.424 360 HG21 ILE 13 HG21 ILE 13 33.902 -0.048 1.146 361 HG22 ILE 13 HG22 ILE 13 33.989 0.668 -0.460 362 HG23 ILE 13 HG23 ILE 13 35.439 -0.015 0.280 363 HD11 ILE 13 HD11 ILE 13 36.475 -1.920 -2.949 364 HD12 ILE 13 HD12 ILE 13 36.456 -2.617 -1.333 365 HD13 ILE 13 HD13 ILE 13 36.640 -0.874 -1.532 366 H THR 14 H THR 14 34.428 -2.093 3.011 367 HA THR 14 HA THR 14 31.613 -2.898 3.442 368 HB THR 14 HB THR 14 33.789 -2.270 5.459 369 HG1 THR 14 HG1 THR 14 34.147 -4.253 4.451 370 HG21 THR 14 HG21 THR 14 31.513 -1.756 6.307 371 HG22 THR 14 HG22 THR 14 32.255 -3.111 7.157 372 HG23 THR 14 HG23 THR 14 31.026 -3.407 5.928 373 H LEU 15 H LEU 15 30.126 -1.416 3.714 374 HA LEU 15 HA LEU 15 30.922 1.382 4.252 375 HB2 LEU 15 HB2 LEU 15 28.693 0.395 2.476 376 HB3 LEU 15 HB3 LEU 15 29.004 2.087 2.841 377 HG LEU 15 HG LEU 15 30.961 0.260 1.429 378 HD11 LEU 15 HD11 LEU 15 29.196 2.407 0.257 379 HD12 LEU 15 HD12 LEU 15 28.838 0.681 0.163 380 HD13 LEU 15 HD13 LEU 15 30.289 1.334 -0.617 381 HD21 LEU 15 HD21 LEU 15 31.010 3.106 2.300 382 HD22 LEU 15 HD22 LEU 15 31.720 2.717 0.729 383 HD23 LEU 15 HD23 LEU 15 32.327 1.933 2.189 384 H GLU 16 H GLU 16 29.790 2.510 5.677 385 HA GLU 16 HA GLU 16 27.552 1.273 7.144 386 HB2 GLU 16 HB2 GLU 16 29.399 2.186 8.498 387 HB3 GLU 16 HB3 GLU 16 29.216 3.750 7.714 388 HG2 GLU 16 HG2 GLU 16 28.195 3.767 9.927 389 HG3 GLU 16 HG3 GLU 16 26.984 3.987 8.669 390 H VAL 17 H VAL 17 25.658 1.669 6.294 391 HA VAL 17 HA VAL 17 25.077 4.309 5.128 392 HB VAL 17 HB VAL 17 23.868 3.278 3.304 393 HG11 VAL 17 HG11 VAL 17 26.329 3.811 3.116 394 HG12 VAL 17 HG12 VAL 17 25.686 2.665 1.933 395 HG13 VAL 17 HG13 VAL 17 26.613 2.074 3.314 396 HG21 VAL 17 HG21 VAL 17 24.874 0.614 4.278 397 HG22 VAL 17 HG22 VAL 17 23.907 0.909 2.828 398 HG23 VAL 17 HG23 VAL 17 23.216 1.201 4.427 399 H GLU 18 H GLU 18 22.727 4.503 4.634 400 HA GLU 18 HA GLU 18 20.916 3.146 6.534 401 HB2 GLU 18 HB2 GLU 18 20.775 5.959 5.397 402 HB3 GLU 18 HB3 GLU 18 19.528 5.219 6.394 403 HG2 GLU 18 HG2 GLU 18 22.359 5.822 7.232 404 HG3 GLU 18 HG3 GLU 18 20.920 6.702 7.728 405 H SER 19 H SER 19 18.854 2.572 5.658 406 HA SER 19 HA SER 19 18.731 1.689 3.002 407 HB2 SER 19 HB2 SER 19 16.323 2.393 4.699 408 HB3 SER 19 HB3 SER 19 16.390 1.247 3.355 409 HG SER 19 HG SER 19 16.649 0.542 5.752 410 H SER 20 H SER 20 17.798 4.718 4.409 411 HA SER 20 HA SER 20 16.425 5.821 2.185 412 HB2 SER 20 HB2 SER 20 16.718 7.994 3.426 413 HB3 SER 20 HB3 SER 20 15.905 6.706 4.319 414 HG SER 20 HG SER 20 18.526 7.717 4.638 415 H ASP 21 H ASP 21 19.752 5.349 2.620 416 HA ASP 21 HA ASP 21 20.787 7.652 1.334 417 HB2 ASP 21 HB2 ASP 21 21.887 4.857 1.573 418 HB3 ASP 21 HB3 ASP 21 22.780 6.171 0.813 419 H THR 22 H THR 22 20.840 8.285 -0.642 420 HA THR 22 HA THR 22 19.656 6.857 -2.824 421 HB THR 22 HB THR 22 20.447 8.654 -4.244 422 HG1 THR 22 HG1 THR 22 21.940 10.141 -3.567 423 HG21 THR 22 HG21 THR 22 19.484 9.717 -1.588 424 HG22 THR 22 HG22 THR 22 18.476 9.182 -2.933 425 HG23 THR 22 HG23 THR 22 19.479 10.622 -3.100 426 H ILE 23 H ILE 23 20.747 6.003 -4.669 427 HA ILE 23 HA ILE 23 23.025 4.428 -4.186 428 HB ILE 23 HB ILE 23 21.802 5.334 -6.773 429 HG12 ILE 23 HG12 ILE 23 20.251 4.093 -5.460 430 HG13 ILE 23 HG13 ILE 23 20.779 3.076 -6.794 431 HG21 ILE 23 HG21 ILE 23 22.913 3.422 -7.873 432 HG22 ILE 23 HG22 ILE 23 23.854 3.158 -6.398 433 HG23 ILE 23 HG23 ILE 23 24.029 4.664 -7.302 434 HD11 ILE 23 HD11 ILE 23 20.654 1.679 -4.894 435 HD12 ILE 23 HD12 ILE 23 21.486 2.856 -3.876 436 HD13 ILE 23 HD13 ILE 23 22.376 1.988 -5.128 437 H ASP 24 H ASP 24 22.695 7.568 -5.723 438 HA ASP 24 HA ASP 24 25.339 8.021 -6.523 439 HB2 ASP 24 HB2 ASP 24 23.467 9.464 -7.189 440 HB3 ASP 24 HB3 ASP 24 23.282 10.002 -5.515 441 H ASN 25 H ASN 25 23.767 8.573 -3.422 442 HA ASN 25 HA ASN 25 25.902 9.783 -2.037 443 HB2 ASN 25 HB2 ASN 25 23.616 9.900 -1.242 444 HB3 ASN 25 HB3 ASN 25 23.556 8.150 -1.065 445 HD21 ASN 25 HD21 ASN 25 23.539 7.627 0.915 446 HD22 ASN 25 HD22 ASN 25 24.477 8.307 2.196 447 H VAL 26 H VAL 26 24.972 6.391 -2.403 448 HA VAL 26 HA VAL 26 26.924 5.233 -0.712 449 HB VAL 26 HB VAL 26 25.442 4.123 -3.097 450 HG11 VAL 26 HG11 VAL 26 26.082 1.863 -2.241 451 HG12 VAL 26 HG12 VAL 26 27.225 2.644 -1.147 452 HG13 VAL 26 HG13 VAL 26 27.448 2.769 -2.895 453 HG21 VAL 26 HG21 VAL 26 25.039 3.157 -0.325 454 HG22 VAL 26 HG22 VAL 26 23.869 3.384 -1.631 455 HG23 VAL 26 HG23 VAL 26 24.447 4.775 -0.710 456 H LYS 27 H LYS 27 26.946 5.839 -4.218 457 HA LYS 27 HA LYS 27 29.486 4.817 -4.799 458 HB2 LYS 27 HB2 LYS 27 27.907 7.013 -6.151 459 HB3 LYS 27 HB3 LYS 27 29.392 6.322 -6.809 460 HG2 LYS 27 HG2 LYS 27 28.364 4.105 -6.839 461 HG3 LYS 27 HG3 LYS 27 26.868 4.785 -6.190 462 HD2 LYS 27 HD2 LYS 27 26.610 6.172 -8.164 463 HD3 LYS 27 HD3 LYS 27 28.142 5.573 -8.820 464 HE2 LYS 27 HE2 LYS 27 27.243 3.321 -8.919 465 HE3 LYS 27 HE3 LYS 27 25.714 3.858 -8.205 466 HZ1 LYS 27 HZ1 LYS 27 26.859 4.750 -10.788 467 HZ2 LYS 27 HZ2 LYS 27 25.389 5.270 -10.132 468 HZ3 LYS 27 HZ3 LYS 27 25.582 3.656 -10.600 469 H SER 28 H SER 28 28.519 8.018 -3.732 470 HA SER 28 HA SER 28 31.037 9.292 -3.742 471 HB2 SER 28 HB2 SER 28 28.890 10.501 -3.480 472 HB3 SER 28 HB3 SER 28 28.716 9.798 -1.866 473 HG SER 28 HG SER 28 29.838 11.499 -1.282 474 H LYS 29 H LYS 29 29.417 7.346 -1.277 475 HA LYS 29 HA LYS 29 31.377 7.510 0.755 476 HB2 LYS 29 HB2 LYS 29 29.395 5.313 0.144 477 HB3 LYS 29 HB3 LYS 29 30.409 5.350 1.581 478 HG2 LYS 29 HG2 LYS 29 29.359 7.448 2.282 479 HG3 LYS 29 HG3 LYS 29 28.344 7.422 0.831 480 HD2 LYS 29 HD2 LYS 29 27.423 5.240 1.545 481 HD3 LYS 29 HD3 LYS 29 28.389 5.338 3.015 482 HE2 LYS 29 HE2 LYS 29 26.315 7.379 2.245 483 HE3 LYS 29 HE3 LYS 29 25.974 5.989 3.276 484 HZ1 LYS 29 HZ1 LYS 29 26.412 7.955 4.566 485 HZ2 LYS 29 HZ2 LYS 29 27.920 8.149 3.827 486 HZ3 LYS 29 HZ3 LYS 29 27.633 6.812 4.823 487 H ILE 30 H ILE 30 31.089 5.413 -2.051 488 HA ILE 30 HA ILE 30 33.272 3.677 -1.476 489 HB ILE 30 HB ILE 30 31.866 4.365 -4.039 490 HG12 ILE 30 HG12 ILE 30 31.876 1.864 -2.347 491 HG13 ILE 30 HG13 ILE 30 30.639 3.109 -2.303 492 HG21 ILE 30 HG21 ILE 30 34.302 3.686 -4.400 493 HG22 ILE 30 HG22 ILE 30 33.077 2.763 -5.269 494 HG23 ILE 30 HG23 ILE 30 33.825 2.090 -3.819 495 HD11 ILE 30 HD11 ILE 30 29.806 1.281 -3.594 496 HD12 ILE 30 HD12 ILE 30 31.265 1.241 -4.583 497 HD13 ILE 30 HD13 ILE 30 30.150 2.604 -4.709 498 H GLN 31 H GLN 31 32.983 6.641 -3.392 499 HA GLN 31 HA GLN 31 35.649 6.925 -4.212 500 HB2 GLN 31 HB2 GLN 31 33.749 8.283 -5.035 501 HB3 GLN 31 HB3 GLN 31 33.670 9.093 -3.469 502 HG2 GLN 31 HG2 GLN 31 35.951 9.937 -3.786 503 HG3 GLN 31 HG3 GLN 31 36.022 9.143 -5.361 504 HE21 GLN 31 HE21 GLN 31 36.311 11.006 -6.469 505 HE22 GLN 31 HE22 GLN 31 35.077 12.196 -6.684 506 H ASP 32 H ASP 32 34.050 7.781 -1.209 507 HA ASP 32 HA ASP 32 36.210 9.135 -0.002 508 HB2 ASP 32 HB2 ASP 32 33.688 7.946 1.093 509 HB3 ASP 32 HB3 ASP 32 34.903 8.668 2.150 510 H LYS 33 H LYS 33 35.582 5.736 -0.259 511 HA LYS 33 HA LYS 33 37.705 5.200 1.692 512 HB2 LYS 33 HB2 LYS 33 35.619 3.406 0.502 513 HB3 LYS 33 HB3 LYS 33 37.021 2.765 1.360 514 HG2 LYS 33 HG2 LYS 33 36.304 4.399 3.248 515 HG3 LYS 33 HG3 LYS 33 34.744 4.398 2.420 516 HD2 LYS 33 HD2 LYS 33 34.672 2.707 4.133 517 HD3 LYS 33 HD3 LYS 33 34.752 1.898 2.567 518 HE2 LYS 33 HE2 LYS 33 37.159 1.550 2.851 519 HE3 LYS 33 HE3 LYS 33 37.105 2.390 4.400 520 HZ1 LYS 33 HZ1 LYS 33 35.667 0.673 5.243 521 HZ2 LYS 33 HZ2 LYS 33 37.116 0.012 4.672 522 HZ3 LYS 33 HZ3 LYS 33 35.703 -0.127 3.753 523 H GLU 34 H GLU 34 36.972 4.696 -1.702 524 HA GLU 34 HA GLU 34 39.489 3.222 -2.036 525 HB2 GLU 34 HB2 GLU 34 36.987 3.283 -3.711 526 HB3 GLU 34 HB3 GLU 34 38.482 2.507 -4.225 527 HG2 GLU 34 HG2 GLU 34 36.952 1.834 -1.715 528 HG3 GLU 34 HG3 GLU 34 36.926 0.903 -3.209 529 H GLY 35 H GLY 35 37.856 6.084 -3.109 530 HA2 GLY 35 HA2 GLY 35 38.883 7.999 -4.054 531 HA3 GLY 35 HA3 GLY 35 40.243 7.003 -4.549 532 H ILE 36 H ILE 36 37.513 5.353 -5.332 533 HA ILE 36 HA ILE 36 37.790 5.732 -8.150 534 HB ILE 36 HB ILE 36 35.597 4.261 -6.674 535 HG12 ILE 36 HG12 ILE 36 38.125 3.152 -7.918 536 HG13 ILE 36 HG13 ILE 36 37.937 3.470 -6.195 537 HG21 ILE 36 HG21 ILE 36 35.238 3.087 -8.798 538 HG22 ILE 36 HG22 ILE 36 36.514 4.044 -9.553 539 HG23 ILE 36 HG23 ILE 36 35.030 4.827 -9.010 540 HD11 ILE 36 HD11 ILE 36 36.550 1.385 -7.867 541 HD12 ILE 36 HD12 ILE 36 35.954 1.866 -6.275 542 HD13 ILE 36 HD13 ILE 36 37.563 1.168 -6.437 543 HA PRO 37 HA PRO 37 35.082 9.289 -8.612 544 HB2 PRO 37 HB2 PRO 37 35.232 8.224 -11.409 545 HB3 PRO 37 HB3 PRO 37 35.373 9.899 -10.844 546 HG2 PRO 37 HG2 PRO 37 37.607 8.594 -11.494 547 HG3 PRO 37 HG3 PRO 37 37.578 9.535 -9.982 548 HD2 PRO 37 HD2 PRO 37 37.254 6.557 -10.352 549 HD3 PRO 37 HD3 PRO 37 38.202 7.431 -9.135 550 HA PRO 38 HA PRO 38 31.238 7.015 -8.224 551 HB2 PRO 38 HB2 PRO 38 30.192 9.758 -8.779 552 HB3 PRO 38 HB3 PRO 38 29.688 8.599 -7.533 553 HG2 PRO 38 HG2 PRO 38 31.277 10.619 -6.818 554 HG3 PRO 38 HG3 PRO 38 31.670 8.980 -6.240 555 HD2 PRO 38 HD2 PRO 38 32.896 10.510 -8.537 556 HD3 PRO 38 HD3 PRO 38 33.700 9.538 -7.291 557 H ASP 39 H ASP 39 31.704 9.333 -10.832 558 HA ASP 39 HA ASP 39 29.621 8.300 -12.502 559 HB2 ASP 39 HB2 ASP 39 30.478 9.934 -14.148 560 HB3 ASP 39 HB3 ASP 39 30.128 10.637 -12.580 561 H GLN 40 H GLN 40 32.142 6.667 -11.724 562 HA GLN 40 HA GLN 40 32.393 5.383 -14.351 563 HB2 GLN 40 HB2 GLN 40 34.455 6.661 -13.602 564 HB3 GLN 40 HB3 GLN 40 34.582 5.480 -12.297 565 HG2 GLN 40 HG2 GLN 40 34.511 3.702 -14.136 566 HG3 GLN 40 HG3 GLN 40 34.859 5.018 -15.257 567 HE21 GLN 40 HE21 GLN 40 36.125 4.898 -11.997 568 HE22 GLN 40 HE22 GLN 40 37.772 4.619 -12.443 569 H GLN 41 H GLN 41 31.065 5.060 -11.481 570 HA GLN 41 HA GLN 41 31.648 2.249 -10.988 571 HB2 GLN 41 HB2 GLN 41 29.976 4.266 -9.464 572 HB3 GLN 41 HB3 GLN 41 30.365 2.641 -8.903 573 HG2 GLN 41 HG2 GLN 41 32.746 3.254 -8.812 574 HG3 GLN 41 HG3 GLN 41 32.335 4.882 -9.372 575 HE21 GLN 41 HE21 GLN 41 32.887 6.015 -7.594 576 HE22 GLN 41 HE22 GLN 41 32.133 5.846 -6.050 577 H ARG 42 H ARG 42 30.279 0.726 -11.549 578 HA ARG 42 HA ARG 42 27.415 1.335 -11.988 579 HB2 ARG 42 HB2 ARG 42 29.168 -0.697 -13.398 580 HB3 ARG 42 HB3 ARG 42 27.410 -0.656 -13.551 581 HG2 ARG 42 HG2 ARG 42 27.497 1.526 -14.563 582 HG3 ARG 42 HG3 ARG 42 29.226 1.652 -14.244 583 HD2 ARG 42 HD2 ARG 42 28.974 1.111 -16.541 584 HD3 ARG 42 HD3 ARG 42 29.554 -0.347 -15.738 585 HE ARG 42 HE ARG 42 26.721 -0.355 -15.897 586 HH11 ARG 42 HH11 ARG 42 29.540 -0.770 -17.937 587 HH12 ARG 42 HH12 ARG 42 28.704 -1.754 -19.092 588 HH21 ARG 42 HH21 ARG 42 25.638 -1.588 -17.483 589 HH22 ARG 42 HH22 ARG 42 26.519 -2.212 -18.836 590 H LEU 43 H LEU 43 26.407 0.653 -10.245 591 HA LEU 43 HA LEU 43 27.424 -1.640 -8.725 592 HB2 LEU 43 HB2 LEU 43 25.329 0.410 -8.014 593 HB3 LEU 43 HB3 LEU 43 25.827 -0.911 -6.966 594 HG LEU 43 HG LEU 43 27.574 1.374 -7.909 595 HD11 LEU 43 HD11 LEU 43 25.857 1.932 -6.206 596 HD12 LEU 43 HD12 LEU 43 27.507 2.079 -5.592 597 HD13 LEU 43 HD13 LEU 43 26.527 0.675 -5.165 598 HD21 LEU 43 HD21 LEU 43 29.165 0.421 -6.171 599 HD22 LEU 43 HD22 LEU 43 29.024 -0.506 -7.672 600 HD23 LEU 43 HD23 LEU 43 28.188 -1.046 -6.213 601 H ILE 44 H ILE 44 26.389 -3.460 -8.406 602 HA ILE 44 HA ILE 44 23.770 -3.879 -9.716 603 HB ILE 44 HB ILE 44 26.182 -5.696 -9.651 604 HG12 ILE 44 HG12 ILE 44 25.679 -5.800 -12.145 605 HG13 ILE 44 HG13 ILE 44 24.606 -4.434 -11.882 606 HG21 ILE 44 HG21 ILE 44 23.994 -6.941 -9.211 607 HG22 ILE 44 HG22 ILE 44 24.988 -7.511 -10.552 608 HG23 ILE 44 HG23 ILE 44 23.559 -6.525 -10.868 609 HD11 ILE 44 HD11 ILE 44 26.760 -3.699 -12.740 610 HD12 ILE 44 HD12 ILE 44 27.582 -4.475 -11.385 611 HD13 ILE 44 HD13 ILE 44 26.516 -3.102 -11.101 612 H PHE 45 H PHE 45 22.273 -4.859 -8.601 613 HA PHE 45 HA PHE 45 22.863 -6.707 -6.451 614 HB2 PHE 45 HB2 PHE 45 22.738 -4.538 -5.240 615 HB3 PHE 45 HB3 PHE 45 21.125 -4.274 -5.925 616 HD1 PHE 45 HD1 PHE 45 23.067 -6.647 -3.809 617 HD2 PHE 45 HD2 PHE 45 19.223 -5.126 -4.888 618 HE1 PHE 45 HE1 PHE 45 22.038 -7.959 -1.982 619 HE2 PHE 45 HE2 PHE 45 18.189 -6.424 -3.050 620 HZ PHE 45 HZ PHE 45 19.602 -7.844 -1.605 621 H ALA 46 H ALA 46 21.562 -8.352 -6.632 622 HA ALA 46 HA ALA 46 19.902 -9.759 -7.257 623 HB1 ALA 46 HB1 ALA 46 18.631 -8.473 -5.644 624 HB2 ALA 46 HB2 ALA 46 17.588 -8.960 -6.979 625 HB3 ALA 46 HB3 ALA 46 18.186 -7.304 -6.889 626 H GLY 47 H GLY 47 21.404 -8.754 -9.304 627 HA2 GLY 47 HA2 GLY 47 21.581 -8.836 -11.594 628 HA3 GLY 47 HA3 GLY 47 19.969 -9.526 -11.624 629 H LYS 48 H LYS 48 20.689 -6.391 -10.292 630 HA LYS 48 HA LYS 48 19.441 -4.997 -12.582 631 HB2 LYS 48 HB2 LYS 48 18.869 -4.687 -9.624 632 HB3 LYS 48 HB3 LYS 48 18.411 -3.470 -10.815 633 HG2 LYS 48 HG2 LYS 48 17.043 -5.148 -11.991 634 HG3 LYS 48 HG3 LYS 48 17.482 -6.340 -10.768 635 HD2 LYS 48 HD2 LYS 48 16.145 -3.741 -10.056 636 HD3 LYS 48 HD3 LYS 48 15.226 -5.168 -10.512 637 HE2 LYS 48 HE2 LYS 48 17.216 -5.120 -8.238 638 HE3 LYS 48 HE3 LYS 48 15.487 -4.818 -8.040 639 HZ1 LYS 48 HZ1 LYS 48 16.668 -7.285 -9.159 640 HZ2 LYS 48 HZ2 LYS 48 15.022 -6.989 -8.907 641 HZ3 LYS 48 HZ3 LYS 48 16.070 -7.110 -7.586 642 H GLN 49 H GLN 49 20.502 -3.227 -13.223 643 HA GLN 49 HA GLN 49 22.852 -2.269 -11.804 644 HB2 GLN 49 HB2 GLN 49 21.493 -1.101 -14.251 645 HB3 GLN 49 HB3 GLN 49 23.097 -0.683 -13.650 646 HG2 GLN 49 HG2 GLN 49 23.669 -3.158 -13.961 647 HG3 GLN 49 HG3 GLN 49 22.195 -3.248 -14.932 648 HE21 GLN 49 HE21 GLN 49 23.067 -3.550 -16.887 649 HE22 GLN 49 HE22 GLN 49 24.102 -2.429 -17.696 650 H LEU 50 H LEU 50 22.939 -0.572 -10.495 651 HA LEU 50 HA LEU 50 20.417 0.485 -9.565 652 HB2 LEU 50 HB2 LEU 50 23.195 1.032 -8.518 653 HB3 LEU 50 HB3 LEU 50 21.673 1.350 -7.689 654 HG LEU 50 HG LEU 50 22.832 -1.345 -8.393 655 HD11 LEU 50 HD11 LEU 50 23.744 -0.069 -6.430 656 HD12 LEU 50 HD12 LEU 50 23.100 -1.672 -6.072 657 HD13 LEU 50 HD13 LEU 50 22.151 -0.236 -5.691 658 HD21 LEU 50 HD21 LEU 50 20.566 -1.810 -8.646 659 HD22 LEU 50 HD22 LEU 50 20.094 -0.648 -7.406 660 HD23 LEU 50 HD23 LEU 50 20.856 -2.173 -6.940 661 H GLU 51 H GLU 51 19.688 2.477 -9.629 662 HA GLU 51 HA GLU 51 20.811 4.232 -11.685 663 HB2 GLU 51 HB2 GLU 51 18.057 4.111 -10.454 664 HB3 GLU 51 HB3 GLU 51 18.514 5.163 -11.786 665 HG2 GLU 51 HG2 GLU 51 18.488 2.140 -11.844 666 HG3 GLU 51 HG3 GLU 51 17.249 3.190 -12.527 667 H ASP 52 H ASP 52 21.424 6.269 -11.234 668 HA ASP 52 HA ASP 52 22.346 6.884 -8.701 669 HB2 ASP 52 HB2 ASP 52 21.862 8.620 -11.095 670 HB3 ASP 52 HB3 ASP 52 22.554 9.282 -9.613 671 H GLY 53 H GLY 53 19.419 8.145 -10.228 672 HA2 GLY 53 HA2 GLY 53 18.673 9.808 -7.999 673 HA3 GLY 53 HA3 GLY 53 17.745 9.537 -9.458 674 H ARG 54 H ARG 54 18.539 6.568 -8.090 675 HA ARG 54 HA ARG 54 15.954 6.391 -6.679 676 HB2 ARG 54 HB2 ARG 54 17.726 4.180 -7.735 677 HB3 ARG 54 HB3 ARG 54 16.194 3.933 -6.917 678 HG2 ARG 54 HG2 ARG 54 16.616 5.255 -9.599 679 HG3 ARG 54 HG3 ARG 54 15.968 3.650 -9.327 680 HD2 ARG 54 HD2 ARG 54 14.665 6.229 -8.445 681 HD3 ARG 54 HD3 ARG 54 14.233 5.318 -9.894 682 HE ARG 54 HE ARG 54 14.084 3.964 -7.320 683 HH11 ARG 54 HH11 ARG 54 12.285 5.444 -9.964 684 HH12 ARG 54 HH12 ARG 54 10.772 4.802 -9.412 685 HH21 ARG 54 HH21 ARG 54 12.080 3.345 -6.541 686 HH22 ARG 54 HH22 ARG 54 10.654 3.630 -7.482 687 H THR 55 H THR 55 16.074 4.740 -4.807 688 HA THR 55 HA THR 55 18.481 5.333 -3.202 689 HB THR 55 HB THR 55 16.963 5.142 -1.192 690 HG1 THR 55 HG1 THR 55 14.930 5.348 -3.183 691 HG21 THR 55 HG21 THR 55 17.628 7.347 -1.824 692 HG22 THR 55 HG22 THR 55 15.893 7.419 -1.526 693 HG23 THR 55 HG23 THR 55 16.502 7.377 -3.181 694 H LEU 56 H LEU 56 18.639 3.777 -1.269 695 HA LEU 56 HA LEU 56 19.028 1.149 -2.218 696 HB2 LEU 56 HB2 LEU 56 18.895 2.211 0.594 697 HB3 LEU 56 HB3 LEU 56 19.398 0.566 0.207 698 HG LEU 56 HG LEU 56 20.759 3.114 -0.712 699 HD11 LEU 56 HD11 LEU 56 20.967 2.564 1.707 700 HD12 LEU 56 HD12 LEU 56 22.504 2.502 0.839 701 HD13 LEU 56 HD13 LEU 56 21.660 1.009 1.248 702 HD21 LEU 56 HD21 LEU 56 21.172 1.456 -2.397 703 HD22 LEU 56 HD22 LEU 56 21.429 0.206 -1.168 704 HD23 LEU 56 HD23 LEU 56 22.605 1.513 -1.360 705 H SER 57 H SER 57 16.447 2.562 -0.321 706 HA SER 57 HA SER 57 14.975 0.257 0.324 707 HB2 SER 57 HB2 SER 57 13.071 1.799 0.676 708 HB3 SER 57 HB3 SER 57 14.553 2.418 1.404 709 HG SER 57 HG SER 57 14.400 3.299 -1.106 710 H ASP 58 H ASP 58 15.139 2.128 -2.618 711 HA ASP 58 HA ASP 58 12.735 1.202 -3.825 712 HB2 ASP 58 HB2 ASP 58 15.231 2.391 -5.038 713 HB3 ASP 58 HB3 ASP 58 13.762 2.055 -5.946 714 H TYR 59 H TYR 59 15.719 -0.332 -3.319 715 HA TYR 59 HA TYR 59 15.095 -2.408 -5.327 716 HB2 TYR 59 HB2 TYR 59 17.742 -1.488 -4.211 717 HB3 TYR 59 HB3 TYR 59 17.549 -2.933 -5.200 718 HD1 TYR 59 HD1 TYR 59 16.585 -2.656 -7.538 719 HD2 TYR 59 HD2 TYR 59 18.037 0.604 -5.208 720 HE1 TYR 59 HE1 TYR 59 16.969 -1.364 -9.599 721 HE2 TYR 59 HE2 TYR 59 18.432 1.903 -7.259 722 HH TYR 59 HH TYR 59 18.460 1.839 -9.480 723 H ASN 60 H ASN 60 14.785 -1.799 -2.182 724 HA ASN 60 HA ASN 60 14.510 -2.956 -0.278 725 HB2 ASN 60 HB2 ASN 60 13.391 -4.486 -2.157 726 HB3 ASN 60 HB3 ASN 60 14.616 -5.612 -1.585 727 HD21 ASN 60 HD21 ASN 60 13.041 -6.972 -0.749 728 HD22 ASN 60 HD22 ASN 60 12.186 -6.602 0.703 729 H ILE 61 H ILE 61 17.142 -2.347 -1.164 730 HA ILE 61 HA ILE 61 18.975 -4.380 -0.277 731 HB ILE 61 HB ILE 61 19.359 -1.402 -0.650 732 HG12 ILE 61 HG12 ILE 61 20.094 -3.728 -2.433 733 HG13 ILE 61 HG13 ILE 61 18.714 -2.668 -2.682 734 HG21 ILE 61 HG21 ILE 61 21.034 -2.298 0.888 735 HG22 ILE 61 HG22 ILE 61 21.789 -1.866 -0.653 736 HG23 ILE 61 HG23 ILE 61 21.446 -3.560 -0.271 737 HD11 ILE 61 HD11 ILE 61 21.613 -1.812 -2.771 738 HD12 ILE 61 HD12 ILE 61 20.208 -0.793 -3.107 739 HD13 ILE 61 HD13 ILE 61 20.589 -2.149 -4.172 740 H GLN 62 H GLN 62 18.816 -5.066 1.729 741 HA GLN 62 HA GLN 62 18.236 -3.157 3.880 742 HB2 GLN 62 HB2 GLN 62 17.956 -6.164 3.811 743 HB3 GLN 62 HB3 GLN 62 17.532 -5.140 5.175 744 HG2 GLN 62 HG2 GLN 62 15.868 -3.995 3.689 745 HG3 GLN 62 HG3 GLN 62 16.212 -5.215 2.462 746 HE21 GLN 62 HE21 GLN 62 16.587 -7.223 4.704 747 HE22 GLN 62 HE22 GLN 62 14.977 -7.661 5.147 748 H LYS 63 H LYS 63 19.136 -4.457 6.076 749 HA LYS 63 HA LYS 63 21.917 -3.918 6.063 750 HB2 LYS 63 HB2 LYS 63 21.951 -4.732 8.336 751 HB3 LYS 63 HB3 LYS 63 20.477 -3.811 8.094 752 HG2 LYS 63 HG2 LYS 63 19.220 -5.917 7.836 753 HG3 LYS 63 HG3 LYS 63 20.708 -6.820 8.155 754 HD2 LYS 63 HD2 LYS 63 20.885 -5.703 10.349 755 HD3 LYS 63 HD3 LYS 63 19.359 -4.871 10.028 756 HE2 LYS 63 HE2 LYS 63 18.276 -7.119 9.779 757 HE3 LYS 63 HE3 LYS 63 19.789 -7.847 10.336 758 HZ1 LYS 63 HZ1 LYS 63 18.147 -5.888 11.824 759 HZ2 LYS 63 HZ2 LYS 63 19.611 -6.546 12.356 760 HZ3 LYS 63 HZ3 LYS 63 18.260 -7.543 12.152 761 H GLU 64 H GLU 64 23.664 -5.199 5.910 762 HA GLU 64 HA GLU 64 25.014 -7.015 5.612 763 HB2 GLU 64 HB2 GLU 64 22.699 -8.191 6.809 764 HB3 GLU 64 HB3 GLU 64 23.293 -9.263 5.549 765 HG2 GLU 64 HG2 GLU 64 24.230 -9.771 7.757 766 HG3 GLU 64 HG3 GLU 64 25.469 -9.344 6.579 767 H SER 65 H SER 65 22.828 -5.981 3.488 768 HA SER 65 HA SER 65 22.876 -8.004 1.451 769 HB2 SER 65 HB2 SER 65 22.458 -5.008 1.265 770 HB3 SER 65 HB3 SER 65 22.248 -6.118 -0.091 771 HG SER 65 HG SER 65 20.866 -6.992 2.055 772 H THR 66 H THR 66 24.279 -8.280 -0.229 773 HA THR 66 HA THR 66 26.554 -6.418 -0.322 774 HB THR 66 HB THR 66 28.153 -7.961 -0.471 775 HG1 THR 66 HG1 THR 66 28.071 -9.175 -2.150 776 HG21 THR 66 HG21 THR 66 26.255 -8.866 1.338 777 HG22 THR 66 HG22 THR 66 27.937 -9.387 1.242 778 HG23 THR 66 HG23 THR 66 26.680 -10.295 0.398 779 H LEU 67 H LEU 67 27.028 -5.507 -2.045 780 HA LEU 67 HA LEU 67 25.519 -5.971 -4.540 781 HB2 LEU 67 HB2 LEU 67 26.840 -3.552 -3.291 782 HB3 LEU 67 HB3 LEU 67 26.325 -3.557 -4.967 783 HG LEU 67 HG LEU 67 23.983 -3.821 -4.253 784 HD11 LEU 67 HD11 LEU 67 24.411 -4.989 -2.057 785 HD12 LEU 67 HD12 LEU 67 23.270 -3.646 -1.972 786 HD13 LEU 67 HD13 LEU 67 24.931 -3.433 -1.412 787 HD21 LEU 67 HD21 LEU 67 24.914 -1.610 -4.579 788 HD22 LEU 67 HD22 LEU 67 25.494 -1.586 -2.913 789 HD23 LEU 67 HD23 LEU 67 23.758 -1.587 -3.244 790 H HIS 68 H HIS 68 26.754 -5.460 -6.490 791 HA HIS 68 HA HIS 68 29.641 -6.020 -6.242 792 HB2 HIS 68 HB2 HIS 68 27.653 -6.905 -8.328 793 HB3 HIS 68 HB3 HIS 68 29.391 -6.878 -8.666 794 HD1 HIS 68 HD1 HIS 68 26.931 -8.670 -6.395 795 HD2 HIS 68 HD2 HIS 68 30.870 -8.743 -7.592 796 HE1 HIS 68 HE1 HIS 68 27.880 -10.852 -5.515 797 HE2 HIS 68 HE2 HIS 68 30.332 -10.770 -6.157 798 H LEU 69 H LEU 69 31.047 -4.967 -7.501 799 HA LEU 69 HA LEU 69 30.126 -2.449 -8.749 800 HB2 LEU 69 HB2 LEU 69 31.406 -2.053 -6.717 801 HB3 LEU 69 HB3 LEU 69 32.688 -3.117 -7.277 802 HG LEU 69 HG LEU 69 33.123 -1.545 -9.153 803 HD11 LEU 69 HD11 LEU 69 31.231 0.303 -7.707 804 HD12 LEU 69 HD12 LEU 69 30.897 -0.481 -9.252 805 HD13 LEU 69 HD13 LEU 69 32.217 0.690 -9.118 806 HD21 LEU 69 HD21 LEU 69 34.568 -1.388 -7.292 807 HD22 LEU 69 HD22 LEU 69 33.349 -0.554 -6.328 808 HD23 LEU 69 HD23 LEU 69 34.103 0.267 -7.695 809 H VAL 70 H VAL 70 30.518 -2.211 -10.823 810 HA VAL 70 HA VAL 70 32.647 -3.776 -12.131 811 HB VAL 70 HB VAL 70 30.043 -2.660 -13.265 812 HG11 VAL 70 HG11 VAL 70 31.702 -2.356 -14.965 813 HG12 VAL 70 HG12 VAL 70 30.704 -3.736 -15.420 814 HG13 VAL 70 HG13 VAL 70 32.308 -3.997 -14.738 815 HG21 VAL 70 HG21 VAL 70 30.019 -4.844 -11.926 816 HG22 VAL 70 HG22 VAL 70 30.863 -5.548 -13.303 817 HG23 VAL 70 HG23 VAL 70 29.253 -4.855 -13.514 818 H LEU 71 H LEU 71 34.162 -2.543 -13.236 819 HA LEU 71 HA LEU 71 34.134 0.302 -12.602 820 HB2 LEU 71 HB2 LEU 71 36.101 -1.590 -12.397 821 HB3 LEU 71 HB3 LEU 71 36.500 -0.839 -13.933 822 HG LEU 71 HG LEU 71 36.149 1.363 -12.509 823 HD11 LEU 71 HD11 LEU 71 35.497 0.035 -10.507 824 HD12 LEU 71 HD12 LEU 71 36.822 1.167 -10.234 825 HD13 LEU 71 HD13 LEU 71 37.159 -0.555 -10.421 826 HD21 LEU 71 HD21 LEU 71 38.674 -0.307 -12.761 827 HD22 LEU 71 HD22 LEU 71 38.689 1.297 -12.025 828 HD23 LEU 71 HD23 LEU 71 38.199 1.104 -13.709 Start of MODEL 5 1 H GLY 12 H GLY 12 7.184 -11.837 -1.015 2 HA2 GLY 12 HA2 GLY 12 9.257 -11.428 0.881 3 HA3 GLY 12 HA3 GLY 12 9.841 -12.425 -0.445 4 HA PRO 13 HA PRO 13 10.520 -8.811 -2.874 5 HB2 PRO 13 HB2 PRO 13 9.549 -9.390 -5.364 6 HB3 PRO 13 HB3 PRO 13 11.057 -10.052 -4.725 7 HG2 PRO 13 HG2 PRO 13 8.364 -11.323 -4.941 8 HG3 PRO 13 HG3 PRO 13 9.968 -12.049 -5.150 9 HD2 PRO 13 HD2 PRO 13 8.444 -12.333 -2.873 10 HD3 PRO 13 HD3 PRO 13 10.215 -12.445 -2.892 11 H MET 14 H MET 14 8.915 -7.691 -1.488 12 HA MET 14 HA MET 14 6.251 -7.278 -2.426 13 HB2 MET 14 HB2 MET 14 7.966 -5.987 -0.310 14 HB3 MET 14 HB3 MET 14 6.394 -5.299 -0.734 15 HG2 MET 14 HG2 MET 14 6.741 -8.213 -0.038 16 HG3 MET 14 HG3 MET 14 6.382 -6.981 1.188 17 HE1 MET 14 HE1 MET 14 2.871 -7.994 1.282 18 HE2 MET 14 HE2 MET 14 3.887 -6.702 1.924 19 HE3 MET 14 HE3 MET 14 4.496 -8.357 1.865 20 H LEU 15 H LEU 15 6.626 -6.711 -4.637 21 HA LEU 15 HA LEU 15 8.093 -4.352 -5.344 22 HB2 LEU 15 HB2 LEU 15 6.952 -6.570 -6.706 23 HB3 LEU 15 HB3 LEU 15 6.190 -5.124 -7.371 24 HG LEU 15 HG LEU 15 8.457 -4.139 -7.755 25 HD11 LEU 15 HD11 LEU 15 10.303 -5.073 -6.880 26 HD12 LEU 15 HD12 LEU 15 9.919 -6.622 -7.631 27 HD13 LEU 15 HD13 LEU 15 9.264 -6.226 -6.039 28 HD21 LEU 15 HD21 LEU 15 7.316 -5.302 -9.566 29 HD22 LEU 15 HD22 LEU 15 7.939 -6.850 -8.994 30 HD23 LEU 15 HD23 LEU 15 9.045 -5.639 -9.639 31 H CYS 16 H CYS 16 7.299 -2.330 -5.945 32 HA CYS 16 HA CYS 16 5.359 -1.118 -4.479 33 HB2 CYS 16 HB2 CYS 16 7.081 -0.064 -6.063 34 HB3 CYS 16 HB3 CYS 16 5.844 -0.244 -7.320 35 H SER 17 H SER 17 3.234 -0.884 -4.418 36 HA SER 17 HA SER 17 1.520 -2.583 -5.884 37 HB2 SER 17 HB2 SER 17 0.832 -0.143 -4.226 38 HB3 SER 17 HB3 SER 17 -0.304 -1.403 -4.726 39 HG SER 17 HG SER 17 1.596 -2.734 -3.635 40 H THR 18 H THR 18 2.483 0.778 -6.330 41 HA THR 18 HA THR 18 0.439 1.408 -8.225 42 HB THR 18 HB THR 18 1.803 3.416 -8.697 43 HG1 THR 18 HG1 THR 18 3.852 2.328 -8.348 44 HG21 THR 18 HG21 THR 18 1.530 2.748 -5.757 45 HG22 THR 18 HG22 THR 18 0.231 3.351 -6.788 46 HG23 THR 18 HG23 THR 18 1.633 4.368 -6.444 47 H GLY 19 H GLY 19 3.309 -0.457 -8.513 48 HA2 GLY 19 HA2 GLY 19 4.132 -1.596 -10.361 49 HA3 GLY 19 HA3 GLY 19 2.865 -0.855 -11.329 50 H CYS 20 H CYS 20 5.443 0.696 -9.408 51 HA CYS 20 HA CYS 20 6.039 2.463 -11.578 52 HB2 CYS 20 HB2 CYS 20 7.625 3.511 -10.079 53 HB3 CYS 20 HB3 CYS 20 6.164 3.132 -9.169 54 H GLY 21 H GLY 21 7.135 -0.689 -10.815 55 HA2 GLY 21 HA2 GLY 21 8.486 -1.952 -12.314 56 HA3 GLY 21 HA3 GLY 21 9.213 -0.458 -12.883 57 H PHE 22 H PHE 22 9.154 -0.370 -9.524 58 HA PHE 22 HA PHE 22 11.848 -1.557 -9.339 59 HB2 PHE 22 HB2 PHE 22 10.830 1.056 -8.240 60 HB3 PHE 22 HB3 PHE 22 12.307 0.288 -7.640 61 HD1 PHE 22 HD1 PHE 22 14.183 -0.168 -9.199 62 HD2 PHE 22 HD2 PHE 22 10.814 2.203 -10.335 63 HE1 PHE 22 HE1 PHE 22 15.461 0.713 -11.118 64 HE2 PHE 22 HE2 PHE 22 12.089 3.099 -12.254 65 HZ PHE 22 HZ PHE 22 14.413 2.352 -12.647 66 H TYR 23 H TYR 23 12.309 -1.311 -6.665 67 HA TYR 23 HA TYR 23 10.483 -3.306 -5.608 68 HB2 TYR 23 HB2 TYR 23 13.249 -2.545 -5.158 69 HB3 TYR 23 HB3 TYR 23 12.368 -2.749 -3.640 70 HD1 TYR 23 HD1 TYR 23 11.386 -4.939 -3.053 71 HD2 TYR 23 HD2 TYR 23 13.650 -4.374 -6.625 72 HE1 TYR 23 HE1 TYR 23 11.583 -7.388 -3.305 73 HE2 TYR 23 HE2 TYR 23 13.861 -6.815 -6.896 74 HH TYR 23 HH TYR 23 13.756 -8.855 -5.486 75 H GLY 24 H GLY 24 9.581 -3.145 -3.444 76 HA2 GLY 24 HA2 GLY 24 8.793 -0.373 -2.793 77 HA3 GLY 24 HA3 GLY 24 7.855 -1.815 -2.410 78 H ASN 25 H ASN 25 7.929 -0.553 -0.261 79 HA ASN 25 HA ASN 25 10.134 -1.670 1.329 80 HB2 ASN 25 HB2 ASN 25 10.288 0.903 0.768 81 HB3 ASN 25 HB3 ASN 25 9.042 1.035 2.012 82 HD21 ASN 25 HD21 ASN 25 10.583 2.219 3.328 83 HD22 ASN 25 HD22 ASN 25 11.807 1.363 4.193 84 HA PRO 26 HA PRO 26 6.366 -2.929 3.556 85 HB2 PRO 26 HB2 PRO 26 7.569 -4.365 5.514 86 HB3 PRO 26 HB3 PRO 26 7.282 -4.996 3.884 87 HG2 PRO 26 HG2 PRO 26 9.775 -3.836 5.068 88 HG3 PRO 26 HG3 PRO 26 9.593 -5.274 4.045 89 HD2 PRO 26 HD2 PRO 26 10.442 -2.895 3.052 90 HD3 PRO 26 HD3 PRO 26 9.458 -4.014 2.089 91 H ARG 27 H ARG 27 9.086 -1.142 4.810 92 HA ARG 27 HA ARG 27 7.972 -0.536 7.377 93 HB2 ARG 27 HB2 ARG 27 10.044 0.956 5.734 94 HB3 ARG 27 HB3 ARG 27 9.689 1.255 7.436 95 HG2 ARG 27 HG2 ARG 27 10.251 -1.154 7.895 96 HG3 ARG 27 HG3 ARG 27 10.801 -1.279 6.227 97 HD2 ARG 27 HD2 ARG 27 12.759 -0.799 7.510 98 HD3 ARG 27 HD3 ARG 27 12.331 0.690 6.661 99 HE ARG 27 HE ARG 27 11.093 0.664 8.367 100 HH11 ARG 27 HH11 ARG 27 14.282 -0.271 8.466 101 HH12 ARG 27 HH12 ARG 27 14.907 0.355 9.955 102 HH21 ARG 27 HH21 ARG 27 11.963 1.921 10.876 103 HH22 ARG 27 HH22 ARG 27 13.608 1.581 11.304 104 H THR 28 H THR 28 8.002 1.068 4.204 105 HA THR 28 HA THR 28 6.410 3.300 5.101 106 HB THR 28 HB THR 28 6.450 3.986 2.741 107 HG1 THR 28 HG1 THR 28 6.537 1.463 2.251 108 HG21 THR 28 HG21 THR 28 8.961 3.973 2.390 109 HG22 THR 28 HG22 THR 28 9.079 2.937 3.810 110 HG23 THR 28 HG23 THR 28 8.426 4.571 3.961 111 H ASN 29 H ASN 29 4.624 3.289 2.695 112 HA ASN 29 HA ASN 29 2.577 1.523 3.780 113 HB2 ASN 29 HB2 ASN 29 2.618 3.853 1.886 114 HB3 ASN 29 HB3 ASN 29 1.210 2.780 1.920 115 HD21 ASN 29 HD21 ASN 29 -0.333 3.779 3.166 116 HD22 ASN 29 HD22 ASN 29 -0.031 4.533 4.691 117 H GLY 30 H GLY 30 4.883 0.407 2.176 118 HA2 GLY 30 HA2 GLY 30 4.994 -1.491 0.808 119 HA3 GLY 30 HA3 GLY 30 3.297 -1.266 0.397 120 H MET 31 H MET 31 5.069 1.637 0.084 121 HA MET 31 HA MET 31 5.349 1.212 -2.824 122 HB2 MET 31 HB2 MET 31 4.165 3.451 -1.231 123 HB3 MET 31 HB3 MET 31 4.948 3.834 -2.774 124 HG2 MET 31 HG2 MET 31 2.679 3.459 -3.309 125 HG3 MET 31 HG3 MET 31 3.504 1.961 -3.773 126 HE1 MET 31 HE1 MET 31 -0.242 1.937 -1.810 127 HE2 MET 31 HE2 MET 31 0.437 2.342 -3.386 128 HE3 MET 31 HE3 MET 31 0.581 3.480 -2.044 129 H CYS 32 H CYS 32 6.922 2.639 -3.874 130 HA CYS 32 HA CYS 32 9.415 2.634 -2.512 131 HB2 CYS 32 HB2 CYS 32 10.325 3.498 -4.600 132 HB3 CYS 32 HB3 CYS 32 9.107 2.280 -4.982 133 H SER 33 H SER 33 10.821 4.779 -2.584 134 HA SER 33 HA SER 33 9.594 6.581 -0.773 135 HB2 SER 33 HB2 SER 33 11.702 7.870 -0.962 136 HB3 SER 33 HB3 SER 33 12.009 6.149 -0.720 137 HG SER 33 HG SER 33 12.722 5.988 -2.736 138 H VAL 34 H VAL 34 9.694 6.552 -4.207 139 HA VAL 34 HA VAL 34 9.364 9.389 -4.557 140 HB VAL 34 HB VAL 34 8.933 7.208 -6.600 141 HG11 VAL 34 HG11 VAL 34 9.408 8.992 -8.217 142 HG12 VAL 34 HG12 VAL 34 9.606 10.138 -6.891 143 HG13 VAL 34 HG13 VAL 34 8.027 9.420 -7.205 144 HG21 VAL 34 HG21 VAL 34 11.252 7.520 -7.254 145 HG22 VAL 34 HG22 VAL 34 11.190 7.080 -5.545 146 HG23 VAL 34 HG23 VAL 34 11.461 8.757 -6.017 147 H CYS 35 H CYS 35 7.233 6.557 -4.831 148 HA CYS 35 HA CYS 35 4.930 8.132 -5.523 149 HB2 CYS 35 HB2 CYS 35 5.260 5.225 -4.780 150 HB3 CYS 35 HB3 CYS 35 3.730 5.942 -5.307 151 H TYR 36 H TYR 36 6.319 6.953 -2.563 152 HA TYR 36 HA TYR 36 4.059 6.917 -0.913 153 HB2 TYR 36 HB2 TYR 36 6.201 5.950 -0.222 154 HB3 TYR 36 HB3 TYR 36 6.937 7.554 -0.192 155 HD1 TYR 36 HD1 TYR 36 3.560 6.544 1.100 156 HD2 TYR 36 HD2 TYR 36 7.547 7.836 2.031 157 HE1 TYR 36 HE1 TYR 36 2.916 6.814 3.483 158 HE2 TYR 36 HE2 TYR 36 6.908 8.110 4.412 159 HH TYR 36 HH TYR 36 4.007 6.864 5.713 160 H LYS 37 H LYS 37 6.323 9.632 -1.528 161 HA LYS 37 HA LYS 37 4.866 11.414 0.166 162 HB2 LYS 37 HB2 LYS 37 6.307 13.191 -0.774 163 HB3 LYS 37 HB3 LYS 37 7.255 11.796 -0.260 164 HG2 LYS 37 HG2 LYS 37 7.335 11.001 -2.596 165 HG3 LYS 37 HG3 LYS 37 6.421 12.434 -3.094 166 HD2 LYS 37 HD2 LYS 37 8.253 13.828 -2.040 167 HD3 LYS 37 HD3 LYS 37 9.192 12.333 -1.901 168 HE2 LYS 37 HE2 LYS 37 8.793 12.007 -4.394 169 HE3 LYS 37 HE3 LYS 37 8.208 13.680 -4.412 170 HZ1 LYS 37 HZ1 LYS 37 10.323 14.405 -3.508 171 HZ2 LYS 37 HZ2 LYS 37 10.561 13.571 -4.961 172 HZ3 LYS 37 HZ3 LYS 37 10.893 12.814 -3.486 173 H GLU 38 H GLU 38 5.020 10.869 -3.322 174 HA GLU 38 HA GLU 38 3.434 12.961 -4.216 175 HB2 GLU 38 HB2 GLU 38 3.959 10.189 -5.258 176 HB3 GLU 38 HB3 GLU 38 2.818 11.256 -6.090 177 HG2 GLU 38 HG2 GLU 38 5.578 12.209 -5.356 178 HG3 GLU 38 HG3 GLU 38 5.271 11.328 -6.861 179 H HIS 39 H HIS 39 2.406 9.786 -2.949 180 HA HIS 39 HA HIS 39 -0.365 10.458 -3.481 181 HB2 HIS 39 HB2 HIS 39 -0.949 8.239 -2.930 182 HB3 HIS 39 HB3 HIS 39 0.607 8.105 -3.737 183 HD1 HIS 39 HD1 HIS 39 1.856 6.267 -2.676 184 HD2 HIS 39 HD2 HIS 39 -0.208 8.516 0.169 185 HE1 HIS 39 HE1 HIS 39 2.313 5.187 -0.437 186 HE2 HIS 39 HE2 HIS 39 1.374 6.780 1.297 187 H LEU 40 H LEU 40 1.789 10.388 -0.730 188 HA LEU 40 HA LEU 40 -0.118 10.565 1.342 189 HB2 LEU 40 HB2 LEU 40 2.386 10.119 1.554 190 HB3 LEU 40 HB3 LEU 40 2.611 11.863 1.384 191 HG LEU 40 HG LEU 40 0.949 12.124 3.317 192 HD11 LEU 40 HD11 LEU 40 0.106 9.759 3.143 193 HD12 LEU 40 HD12 LEU 40 0.648 10.209 4.763 194 HD13 LEU 40 HD13 LEU 40 1.681 9.218 3.734 195 HD21 LEU 40 HD21 LEU 40 2.732 11.530 5.012 196 HD22 LEU 40 HD22 LEU 40 3.286 12.556 3.687 197 HD23 LEU 40 HD23 LEU 40 3.658 10.833 3.684 198 H GLN 41 H GLN 41 1.192 12.987 -0.827 199 HA GLN 41 HA GLN 41 0.447 15.295 0.631 200 HB2 GLN 41 HB2 GLN 41 1.251 14.684 -2.177 201 HB3 GLN 41 HB3 GLN 41 0.457 16.235 -1.876 202 HG2 GLN 41 HG2 GLN 41 2.107 16.806 -0.186 203 HG3 GLN 41 HG3 GLN 41 2.878 15.224 -0.370 204 HE21 GLN 41 HE21 GLN 41 2.483 18.378 -1.821 205 HE22 GLN 41 HE22 GLN 41 3.661 18.145 -3.063 206 H ARG 42 H ARG 42 -1.264 13.345 -1.790 207 HA ARG 42 HA ARG 42 -3.539 15.115 -1.886 208 HB2 ARG 42 HB2 ARG 42 -3.007 12.353 -2.987 209 HB3 ARG 42 HB3 ARG 42 -4.561 13.178 -3.191 210 HG2 ARG 42 HG2 ARG 42 -3.569 14.955 -4.422 211 HG3 ARG 42 HG3 ARG 42 -1.938 14.446 -3.959 212 HD2 ARG 42 HD2 ARG 42 -2.361 12.289 -5.174 213 HD3 ARG 42 HD3 ARG 42 -3.850 13.007 -5.802 214 HE ARG 42 HE ARG 42 -1.123 13.288 -6.367 215 HH11 ARG 42 HH11 ARG 42 -4.354 15.008 -6.292 216 HH12 ARG 42 HH12 ARG 42 -4.082 16.209 -7.511 217 HH21 ARG 42 HH21 ARG 42 -0.897 15.114 -8.295 218 HH22 ARG 42 HH22 ARG 42 -2.147 16.265 -8.632 219 H GLN 43 H GLN 43 -2.631 12.223 -0.124 220 HA GLN 43 HA GLN 43 -5.263 11.651 0.863 221 HB2 GLN 43 HB2 GLN 43 -3.176 10.082 0.639 222 HB3 GLN 43 HB3 GLN 43 -2.741 10.739 2.222 223 HG2 GLN 43 HG2 GLN 43 -3.994 8.912 2.858 224 HG3 GLN 43 HG3 GLN 43 -5.249 10.159 2.802 225 HE21 GLN 43 HE21 GLN 43 -6.905 8.612 2.304 226 HE22 GLN 43 HE22 GLN 43 -6.989 7.854 0.753 227 H GLN 44 H GLN 44 -2.427 13.410 2.016 228 HA GLN 44 HA GLN 44 -3.448 13.910 4.643 229 HB2 GLN 44 HB2 GLN 44 -0.989 13.957 3.837 230 HB3 GLN 44 HB3 GLN 44 -1.353 15.601 3.291 231 HG2 GLN 44 HG2 GLN 44 -1.930 16.304 5.500 232 HG3 GLN 44 HG3 GLN 44 -1.898 14.638 6.098 233 HE21 GLN 44 HE21 GLN 44 0.336 16.814 4.326 234 HE22 GLN 44 HE22 GLN 44 1.713 16.380 5.275 235 H ASN 45 H ASN 45 -3.359 15.739 1.604 236 HA ASN 45 HA ASN 45 -4.396 18.163 2.648 237 HB2 ASN 45 HB2 ASN 45 -4.141 16.984 -0.106 238 HB3 ASN 45 HB3 ASN 45 -5.084 18.459 0.127 239 HD21 ASN 45 HD21 ASN 45 -2.387 17.995 -1.188 240 HD22 ASN 45 HD22 ASN 45 -1.343 19.126 -0.401 241 H SER 46 H SER 46 -5.930 15.337 1.141 242 HA SER 46 HA SER 46 -8.570 16.449 1.211 243 HB2 SER 46 HB2 SER 46 -7.623 14.542 -0.300 244 HB3 SER 46 HB3 SER 46 -8.019 13.495 1.069 245 HG SER 46 HG SER 46 -9.771 15.149 -0.427 246 H1 MET 1 H1 MET 1 21.706 1.860 9.766 247 H2 MET 1 H2 MET 1 22.456 2.235 8.297 248 H3 MET 1 H3 MET 1 23.377 2.120 9.711 249 HA MET 1 HA MET 1 22.905 -0.216 9.885 250 HB2 MET 1 HB2 MET 1 21.670 -1.371 8.158 251 HB3 MET 1 HB3 MET 1 20.671 -0.065 8.777 252 HG2 MET 1 HG2 MET 1 21.256 1.304 6.830 253 HG3 MET 1 HG3 MET 1 22.259 -0.003 6.214 254 HE1 MET 1 HE1 MET 1 19.571 -0.321 3.567 255 HE2 MET 1 HE2 MET 1 21.290 -0.325 3.966 256 HE3 MET 1 HE3 MET 1 20.334 1.138 4.199 257 H GLN 2 H GLN 2 24.452 -1.632 9.071 258 HA GLN 2 HA GLN 2 26.249 -0.453 7.073 259 HB2 GLN 2 HB2 GLN 2 27.941 -1.868 7.852 260 HB3 GLN 2 HB3 GLN 2 27.070 -1.400 9.304 261 HG2 GLN 2 HG2 GLN 2 25.903 -3.538 9.324 262 HG3 GLN 2 HG3 GLN 2 26.703 -4.004 7.825 263 HE21 GLN 2 HE21 GLN 2 29.193 -2.630 8.891 264 HE22 GLN 2 HE22 GLN 2 29.878 -3.794 9.969 265 H ILE 3 H ILE 3 26.756 -1.373 5.196 266 HA ILE 3 HA ILE 3 25.675 -4.016 4.560 267 HB ILE 3 HB ILE 3 24.828 -3.519 2.501 268 HG12 ILE 3 HG12 ILE 3 26.509 -2.072 1.578 269 HG13 ILE 3 HG13 ILE 3 24.897 -1.466 1.245 270 HG21 ILE 3 HG21 ILE 3 23.305 -2.919 4.259 271 HG22 ILE 3 HG22 ILE 3 23.019 -1.965 2.804 272 HG23 ILE 3 HG23 ILE 3 23.853 -1.244 4.181 273 HD11 ILE 3 HD11 ILE 3 26.979 0.032 2.081 274 HD12 ILE 3 HD12 ILE 3 26.198 -0.318 3.623 275 HD13 ILE 3 HD13 ILE 3 25.281 0.466 2.331 276 H PHE 4 H PHE 4 26.828 -4.990 2.719 277 HA PHE 4 HA PHE 4 29.674 -4.183 2.823 278 HB2 PHE 4 HB2 PHE 4 28.556 -6.958 2.318 279 HB3 PHE 4 HB3 PHE 4 30.249 -6.532 2.639 280 HD1 PHE 4 HD1 PHE 4 30.807 -5.505 4.932 281 HD2 PHE 4 HD2 PHE 4 27.088 -7.424 4.060 282 HE1 PHE 4 HE1 PHE 4 30.343 -5.709 7.350 283 HE2 PHE 4 HE2 PHE 4 26.632 -7.652 6.482 284 HZ PHE 4 HZ PHE 4 28.262 -6.785 8.125 285 H VAL 5 H VAL 5 30.788 -3.966 0.996 286 HA VAL 5 HA VAL 5 29.480 -4.547 -1.593 287 HB VAL 5 HB VAL 5 31.320 -2.219 -0.955 288 HG11 VAL 5 HG11 VAL 5 31.757 -2.865 -3.209 289 HG12 VAL 5 HG12 VAL 5 30.672 -1.477 -3.289 290 HG13 VAL 5 HG13 VAL 5 30.042 -3.106 -3.543 291 HG21 VAL 5 HG21 VAL 5 28.474 -2.018 -1.907 292 HG22 VAL 5 HG22 VAL 5 29.480 -0.775 -1.150 293 HG23 VAL 5 HG23 VAL 5 28.861 -2.119 -0.189 294 H LYS 6 H LYS 6 30.393 -6.402 -2.059 295 HA LYS 6 HA LYS 6 33.175 -7.034 -1.625 296 HB2 LYS 6 HB2 LYS 6 30.982 -8.344 -3.248 297 HB3 LYS 6 HB3 LYS 6 32.588 -9.029 -3.026 298 HG2 LYS 6 HG2 LYS 6 32.226 -9.230 -0.641 299 HG3 LYS 6 HG3 LYS 6 30.651 -8.441 -0.786 300 HD2 LYS 6 HD2 LYS 6 30.409 -10.887 -0.667 301 HD3 LYS 6 HD3 LYS 6 29.862 -10.260 -2.222 302 HE2 LYS 6 HE2 LYS 6 32.164 -10.827 -3.121 303 HE3 LYS 6 HE3 LYS 6 32.443 -11.704 -1.614 304 HZ1 LYS 6 HZ1 LYS 6 30.290 -12.222 -3.570 305 HZ2 LYS 6 HZ2 LYS 6 30.509 -13.052 -2.112 306 HZ3 LYS 6 HZ3 LYS 6 31.673 -13.166 -3.333 307 H THR 7 H THR 7 34.815 -6.698 -2.932 308 HA THR 7 HA THR 7 34.322 -5.847 -5.718 309 HB THR 7 HB THR 7 36.579 -4.994 -5.768 310 HG1 THR 7 HG1 THR 7 36.802 -6.548 -3.466 311 HG21 THR 7 HG21 THR 7 35.636 -4.156 -3.040 312 HG22 THR 7 HG22 THR 7 34.768 -3.655 -4.496 313 HG23 THR 7 HG23 THR 7 36.454 -3.185 -4.264 314 H LEU 8 H LEU 8 36.009 -6.734 -7.271 315 HA LEU 8 HA LEU 8 35.709 -9.583 -7.146 316 HB2 LEU 8 HB2 LEU 8 36.880 -7.899 -9.346 317 HB3 LEU 8 HB3 LEU 8 36.400 -9.590 -9.475 318 HG LEU 8 HG LEU 8 34.588 -7.249 -8.887 319 HD11 LEU 8 HD11 LEU 8 35.397 -7.519 -11.231 320 HD12 LEU 8 HD12 LEU 8 33.644 -7.599 -11.038 321 HD13 LEU 8 HD13 LEU 8 34.576 -9.078 -11.266 322 HD21 LEU 8 HD21 LEU 8 34.015 -10.193 -8.847 323 HD22 LEU 8 HD22 LEU 8 32.760 -9.023 -9.257 324 HD23 LEU 8 HD23 LEU 8 33.550 -8.957 -7.680 325 H THR 9 H THR 9 38.281 -7.470 -6.490 326 HA THR 9 HA THR 9 40.476 -9.243 -6.552 327 HB THR 9 HB THR 9 41.371 -7.856 -4.654 328 HG1 THR 9 HG1 THR 9 38.985 -6.362 -5.062 329 HG21 THR 9 HG21 THR 9 40.413 -6.499 -7.167 330 HG22 THR 9 HG22 THR 9 41.987 -7.239 -6.875 331 HG23 THR 9 HG23 THR 9 41.537 -5.758 -6.030 332 H GLY 10 H GLY 10 37.828 -8.857 -4.316 333 HA2 GLY 10 HA2 GLY 10 37.112 -10.937 -3.136 334 HA3 GLY 10 HA3 GLY 10 38.796 -11.122 -2.662 335 H LYS 11 H LYS 11 38.998 -8.150 -2.287 336 HA LYS 11 HA LYS 11 38.475 -7.941 0.472 337 HB2 LYS 11 HB2 LYS 11 40.048 -6.516 -1.014 338 HB3 LYS 11 HB3 LYS 11 38.610 -5.551 -1.364 339 HG2 LYS 11 HG2 LYS 11 38.535 -5.810 1.384 340 HG3 LYS 11 HG3 LYS 11 40.254 -5.623 1.046 341 HD2 LYS 11 HD2 LYS 11 38.111 -3.765 0.023 342 HD3 LYS 11 HD3 LYS 11 39.025 -3.492 1.501 343 HE2 LYS 11 HE2 LYS 11 40.308 -3.784 -1.211 344 HE3 LYS 11 HE3 LYS 11 39.825 -2.232 -0.530 345 HZ1 LYS 11 HZ1 LYS 11 41.780 -4.125 0.626 346 HZ2 LYS 11 HZ2 LYS 11 41.287 -2.677 1.346 347 HZ3 LYS 11 HZ3 LYS 11 42.131 -2.648 -0.119 348 H THR 12 H THR 12 36.917 -6.857 1.611 349 HA THR 12 HA THR 12 34.377 -6.224 0.213 350 HB THR 12 HB THR 12 34.792 -7.488 2.936 351 HG1 THR 12 HG1 THR 12 34.867 -9.145 1.596 352 HG21 THR 12 HG21 THR 12 32.195 -6.760 1.568 353 HG22 THR 12 HG22 THR 12 32.834 -6.005 3.029 354 HG23 THR 12 HG23 THR 12 32.333 -7.697 3.052 355 H ILE 13 H ILE 13 33.684 -4.269 0.467 356 HA ILE 13 HA ILE 13 34.900 -2.426 2.418 357 HB ILE 13 HB ILE 13 32.705 -1.631 0.561 358 HG12 ILE 13 HG12 ILE 13 34.054 -2.788 -1.028 359 HG13 ILE 13 HG13 ILE 13 34.300 -1.067 -1.254 360 HG21 ILE 13 HG21 ILE 13 33.571 -0.052 2.191 361 HG22 ILE 13 HG22 ILE 13 33.820 0.517 0.542 362 HG23 ILE 13 HG23 ILE 13 35.173 -0.155 1.457 363 HD11 ILE 13 HD11 ILE 13 36.377 -2.377 -1.498 364 HD12 ILE 13 HD12 ILE 13 36.197 -2.927 0.165 365 HD13 ILE 13 HD13 ILE 13 36.474 -1.216 -0.165 366 H THR 14 H THR 14 33.851 -1.944 4.261 367 HA THR 14 HA THR 14 30.976 -2.597 4.520 368 HB THR 14 HB THR 14 33.007 -1.879 6.652 369 HG1 THR 14 HG1 THR 14 33.354 -3.956 5.850 370 HG21 THR 14 HG21 THR 14 30.697 -1.203 7.257 371 HG22 THR 14 HG22 THR 14 31.305 -2.507 8.279 372 HG23 THR 14 HG23 THR 14 30.168 -2.862 6.981 373 H LEU 15 H LEU 15 29.542 -1.042 4.537 374 HA LEU 15 HA LEU 15 30.417 1.760 4.901 375 HB2 LEU 15 HB2 LEU 15 28.296 0.707 3.033 376 HB3 LEU 15 HB3 LEU 15 28.654 2.412 3.278 377 HG LEU 15 HG LEU 15 30.634 0.391 2.197 378 HD11 LEU 15 HD11 LEU 15 29.069 2.493 0.702 379 HD12 LEU 15 HD12 LEU 15 28.641 0.779 0.724 380 HD13 LEU 15 HD13 LEU 15 30.179 1.306 0.017 381 HD21 LEU 15 HD21 LEU 15 30.741 3.300 2.823 382 HD22 LEU 15 HD22 LEU 15 31.557 2.747 1.358 383 HD23 LEU 15 HD23 LEU 15 32.007 2.072 2.924 384 H GLU 16 H GLU 16 29.226 3.052 6.124 385 HA GLU 16 HA GLU 16 26.823 2.037 7.496 386 HB2 GLU 16 HB2 GLU 16 28.595 2.994 8.919 387 HB3 GLU 16 HB3 GLU 16 28.547 4.488 7.992 388 HG2 GLU 16 HG2 GLU 16 27.352 4.741 10.101 389 HG3 GLU 16 HG3 GLU 16 26.257 4.895 8.731 390 H VAL 17 H VAL 17 25.025 2.428 6.460 391 HA VAL 17 HA VAL 17 24.660 4.975 5.029 392 HB VAL 17 HB VAL 17 23.558 3.835 3.202 393 HG11 VAL 17 HG11 VAL 17 26.047 4.253 3.179 394 HG12 VAL 17 HG12 VAL 17 25.451 3.034 2.046 395 HG13 VAL 17 HG13 VAL 17 26.234 2.531 3.546 396 HG21 VAL 17 HG21 VAL 17 24.358 1.231 4.479 397 HG22 VAL 17 HG22 VAL 17 23.526 1.432 2.934 398 HG23 VAL 17 HG23 VAL 17 22.722 1.892 4.438 399 H GLU 18 H GLU 18 22.370 5.215 4.321 400 HA GLU 18 HA GLU 18 20.350 4.102 6.171 401 HB2 GLU 18 HB2 GLU 18 20.431 6.807 4.791 402 HB3 GLU 18 HB3 GLU 18 19.075 6.207 5.739 403 HG2 GLU 18 HG2 GLU 18 21.854 6.771 6.758 404 HG3 GLU 18 HG3 GLU 18 20.422 7.746 7.053 405 H SER 19 H SER 19 18.342 3.533 5.175 406 HA SER 19 HA SER 19 18.411 2.449 2.581 407 HB2 SER 19 HB2 SER 19 15.932 3.280 4.117 408 HB3 SER 19 HB3 SER 19 16.006 2.128 2.779 409 HG SER 19 HG SER 19 16.029 1.093 4.848 410 H SER 20 H SER 20 17.513 5.593 3.704 411 HA SER 20 HA SER 20 16.271 6.572 1.349 412 HB2 SER 20 HB2 SER 20 16.607 8.823 2.433 413 HB3 SER 20 HB3 SER 20 15.710 7.640 3.387 414 HG SER 20 HG SER 20 18.356 8.570 3.734 415 H ASP 21 H ASP 21 19.557 6.007 1.953 416 HA ASP 21 HA ASP 21 20.733 8.161 0.536 417 HB2 ASP 21 HB2 ASP 21 21.708 5.353 1.032 418 HB3 ASP 21 HB3 ASP 21 22.682 6.569 0.212 419 H THR 22 H THR 22 20.886 8.636 -1.478 420 HA THR 22 HA THR 22 19.724 7.090 -3.590 421 HB THR 22 HB THR 22 20.642 8.738 -5.109 422 HG1 THR 22 HG1 THR 22 22.169 10.216 -4.490 423 HG21 THR 22 HG21 THR 22 19.626 10.042 -2.584 424 HG22 THR 22 HG22 THR 22 18.647 9.443 -3.923 425 HG23 THR 22 HG23 THR 22 19.713 10.827 -4.160 426 H ILE 23 H ILE 23 20.845 6.055 -5.319 427 HA ILE 23 HA ILE 23 23.036 4.433 -4.627 428 HB ILE 23 HB ILE 23 21.949 5.182 -7.322 429 HG12 ILE 23 HG12 ILE 23 20.300 4.108 -5.982 430 HG13 ILE 23 HG13 ILE 23 20.835 2.972 -7.213 431 HG21 ILE 23 HG21 ILE 23 23.020 3.150 -8.228 432 HG22 ILE 23 HG22 ILE 23 23.894 2.965 -6.701 433 HG23 ILE 23 HG23 ILE 23 24.164 4.388 -7.709 434 HD11 ILE 23 HD11 ILE 23 20.582 1.732 -5.219 435 HD12 ILE 23 HD12 ILE 23 21.424 2.950 -4.261 436 HD13 ILE 23 HD13 ILE 23 22.324 1.955 -5.407 437 H ASP 24 H ASP 24 22.895 7.454 -6.412 438 HA ASP 24 HA ASP 24 25.583 7.742 -7.138 439 HB2 ASP 24 HB2 ASP 24 23.799 9.201 -7.984 440 HB3 ASP 24 HB3 ASP 24 23.576 9.873 -6.366 441 H ASN 25 H ASN 25 23.922 8.593 -4.154 442 HA ASN 25 HA ASN 25 26.053 9.825 -2.779 443 HB2 ASN 25 HB2 ASN 25 23.748 10.091 -2.088 444 HB3 ASN 25 HB3 ASN 25 23.607 8.363 -1.782 445 HD21 ASN 25 HD21 ASN 25 23.493 7.998 0.232 446 HD22 ASN 25 HD22 ASN 25 24.411 8.738 1.493 447 H VAL 26 H VAL 26 24.997 6.452 -2.922 448 HA VAL 26 HA VAL 26 26.835 5.355 -1.073 449 HB VAL 26 HB VAL 26 25.399 4.120 -3.423 450 HG11 VAL 26 HG11 VAL 26 25.911 1.913 -2.373 451 HG12 VAL 26 HG12 VAL 26 27.045 2.731 -1.296 452 HG13 VAL 26 HG13 VAL 26 27.337 2.711 -3.037 453 HG21 VAL 26 HG21 VAL 26 24.853 3.391 -0.603 454 HG22 VAL 26 HG22 VAL 26 23.743 3.560 -1.968 455 HG23 VAL 26 HG23 VAL 26 24.344 4.996 -1.134 456 H LYS 27 H LYS 27 27.013 5.685 -4.610 457 HA LYS 27 HA LYS 27 29.528 4.524 -5.010 458 HB2 LYS 27 HB2 LYS 27 28.092 6.667 -6.588 459 HB3 LYS 27 HB3 LYS 27 29.571 5.871 -7.131 460 HG2 LYS 27 HG2 LYS 27 28.453 3.698 -7.032 461 HG3 LYS 27 HG3 LYS 27 26.963 4.484 -6.497 462 HD2 LYS 27 HD2 LYS 27 26.836 5.725 -8.580 463 HD3 LYS 27 HD3 LYS 27 28.367 5.018 -9.126 464 HE2 LYS 27 HE2 LYS 27 27.378 2.800 -9.091 465 HE3 LYS 27 HE3 LYS 27 25.846 3.450 -8.482 466 HZ1 LYS 27 HZ1 LYS 27 27.123 4.093 -11.077 467 HZ2 LYS 27 HZ2 LYS 27 25.652 4.719 -10.521 468 HZ3 LYS 27 HZ3 LYS 27 25.796 3.068 -10.858 469 H SER 28 H SER 28 28.656 7.833 -4.228 470 HA SER 28 HA SER 28 31.224 9.004 -4.235 471 HB2 SER 28 HB2 SER 28 29.120 10.313 -4.152 472 HB3 SER 28 HB3 SER 28 28.858 9.744 -2.497 473 HG SER 28 HG SER 28 30.028 11.440 -2.000 474 H LYS 29 H LYS 29 29.434 7.319 -1.695 475 HA LYS 29 HA LYS 29 31.323 7.564 0.392 476 HB2 LYS 29 HB2 LYS 29 29.274 5.406 -0.127 477 HB3 LYS 29 HB3 LYS 29 30.236 5.516 1.343 478 HG2 LYS 29 HG2 LYS 29 29.248 7.699 1.840 479 HG3 LYS 29 HG3 LYS 29 28.288 7.599 0.355 480 HD2 LYS 29 HD2 LYS 29 27.251 5.517 1.196 481 HD3 LYS 29 HD3 LYS 29 28.166 5.693 2.692 482 HE2 LYS 29 HE2 LYS 29 26.208 7.747 1.687 483 HE3 LYS 29 HE3 LYS 29 25.772 6.457 2.806 484 HZ1 LYS 29 HZ1 LYS 29 26.244 8.496 3.960 485 HZ2 LYS 29 HZ2 LYS 29 27.786 8.574 3.268 486 HZ3 LYS 29 HZ3 LYS 29 27.406 7.331 4.351 487 H ILE 30 H ILE 30 31.051 5.270 -2.253 488 HA ILE 30 HA ILE 30 33.138 3.499 -1.461 489 HB ILE 30 HB ILE 30 31.857 4.040 -4.123 490 HG12 ILE 30 HG12 ILE 30 31.701 1.681 -2.247 491 HG13 ILE 30 HG13 ILE 30 30.515 2.972 -2.348 492 HG21 ILE 30 HG21 ILE 30 34.274 3.241 -4.332 493 HG22 ILE 30 HG22 ILE 30 33.044 2.302 -5.177 494 HG23 ILE 30 HG23 ILE 30 33.710 1.717 -3.651 495 HD11 ILE 30 HD11 ILE 30 29.655 1.081 -3.526 496 HD12 ILE 30 HD12 ILE 30 31.148 0.909 -4.450 497 HD13 ILE 30 HD13 ILE 30 30.094 2.300 -4.724 498 H GLN 31 H GLN 31 33.044 6.315 -3.606 499 HA GLN 31 HA GLN 31 35.747 6.431 -4.339 500 HB2 GLN 31 HB2 GLN 31 33.937 7.793 -5.339 501 HB3 GLN 31 HB3 GLN 31 33.835 8.725 -3.844 502 HG2 GLN 31 HG2 GLN 31 36.159 9.453 -4.130 503 HG3 GLN 31 HG3 GLN 31 36.255 8.537 -5.638 504 HE21 GLN 31 HE21 GLN 31 36.660 10.295 -6.872 505 HE22 GLN 31 HE22 GLN 31 35.486 11.511 -7.226 506 H ASP 32 H ASP 32 34.075 7.579 -1.475 507 HA ASP 32 HA ASP 32 36.243 8.938 -0.291 508 HB2 ASP 32 HB2 ASP 32 33.636 7.935 0.791 509 HB3 ASP 32 HB3 ASP 32 34.840 8.689 1.837 510 H LYS 33 H LYS 33 35.485 5.555 -0.313 511 HA LYS 33 HA LYS 33 37.510 5.092 1.758 512 HB2 LYS 33 HB2 LYS 33 35.396 3.294 0.624 513 HB3 LYS 33 HB3 LYS 33 36.737 2.667 1.584 514 HG2 LYS 33 HG2 LYS 33 36.021 4.470 3.312 515 HG3 LYS 33 HG3 LYS 33 34.493 4.465 2.425 516 HD2 LYS 33 HD2 LYS 33 34.286 2.915 4.258 517 HD3 LYS 33 HD3 LYS 33 34.391 1.985 2.761 518 HE2 LYS 33 HE2 LYS 33 36.769 1.568 3.168 519 HE3 LYS 33 HE3 LYS 33 36.693 2.526 4.647 520 HZ1 LYS 33 HZ1 LYS 33 35.157 0.936 5.558 521 HZ2 LYS 33 HZ2 LYS 33 36.597 0.179 5.099 522 HZ3 LYS 33 HZ3 LYS 33 35.213 0.023 4.136 523 H GLU 34 H GLU 34 36.882 4.354 -1.615 524 HA GLU 34 HA GLU 34 39.346 2.763 -1.735 525 HB2 GLU 34 HB2 GLU 34 36.914 2.790 -3.509 526 HB3 GLU 34 HB3 GLU 34 38.392 1.919 -3.901 527 HG2 GLU 34 HG2 GLU 34 36.743 1.503 -1.410 528 HG3 GLU 34 HG3 GLU 34 36.733 0.460 -2.829 529 H GLY 35 H GLY 35 37.874 5.593 -3.087 530 HA2 GLY 35 HA2 GLY 35 39.015 7.386 -4.134 531 HA3 GLY 35 HA3 GLY 35 40.350 6.304 -4.496 532 H ILE 36 H ILE 36 37.584 4.706 -5.260 533 HA ILE 36 HA ILE 36 37.980 4.853 -8.086 534 HB ILE 36 HB ILE 36 35.674 3.587 -6.591 535 HG12 ILE 36 HG12 ILE 36 38.198 2.287 -7.645 536 HG13 ILE 36 HG13 ILE 36 37.960 2.746 -5.960 537 HG21 ILE 36 HG21 ILE 36 35.346 2.267 -8.633 538 HG22 ILE 36 HG22 ILE 36 36.688 3.113 -9.406 539 HG23 ILE 36 HG23 ILE 36 35.219 3.992 -8.983 540 HD11 ILE 36 HD11 ILE 36 36.550 0.593 -7.521 541 HD12 ILE 36 HD12 ILE 36 35.917 1.220 -5.995 542 HD13 ILE 36 HD13 ILE 36 37.500 0.450 -6.040 543 HA PRO 37 HA PRO 37 35.440 8.467 -8.924 544 HB2 PRO 37 HB2 PRO 37 35.653 7.181 -11.625 545 HB3 PRO 37 HB3 PRO 37 35.841 8.888 -11.184 546 HG2 PRO 37 HG2 PRO 37 38.041 7.453 -11.642 547 HG3 PRO 37 HG3 PRO 37 37.994 8.508 -10.209 548 HD2 PRO 37 HD2 PRO 37 37.562 5.525 -10.363 549 HD3 PRO 37 HD3 PRO 37 38.500 6.453 -9.179 550 HA PRO 38 HA PRO 38 31.496 6.380 -8.519 551 HB2 PRO 38 HB2 PRO 38 30.584 9.108 -9.324 552 HB3 PRO 38 HB3 PRO 38 29.987 8.071 -8.013 553 HG2 PRO 38 HG2 PRO 38 31.632 10.078 -7.390 554 HG3 PRO 38 HG3 PRO 38 31.935 8.475 -6.674 555 HD2 PRO 38 HD2 PRO 38 33.307 9.772 -9.031 556 HD3 PRO 38 HD3 PRO 38 34.023 8.869 -7.684 557 H ASP 39 H ASP 39 32.152 8.468 -11.275 558 HA ASP 39 HA ASP 39 30.091 7.389 -12.943 559 HB2 ASP 39 HB2 ASP 39 31.076 8.857 -14.674 560 HB3 ASP 39 HB3 ASP 39 30.698 9.692 -13.179 561 H GLN 40 H GLN 40 32.512 5.725 -11.943 562 HA GLN 40 HA GLN 40 32.806 4.234 -14.452 563 HB2 GLN 40 HB2 GLN 40 34.891 5.484 -13.722 564 HB3 GLN 40 HB3 GLN 40 34.921 4.405 -12.327 565 HG2 GLN 40 HG2 GLN 40 34.844 2.493 -14.026 566 HG3 GLN 40 HG3 GLN 40 35.287 3.703 -15.228 567 HE21 GLN 40 HE21 GLN 40 36.426 3.789 -11.922 568 HE22 GLN 40 HE22 GLN 40 38.074 3.412 -12.278 569 H GLN 41 H GLN 41 31.360 4.183 -11.622 570 HA GLN 41 HA GLN 41 31.806 1.401 -10.893 571 HB2 GLN 41 HB2 GLN 41 30.166 3.593 -9.596 572 HB3 GLN 41 HB3 GLN 41 30.466 2.003 -8.898 573 HG2 GLN 41 HG2 GLN 41 32.866 2.529 -8.757 574 HG3 GLN 41 HG3 GLN 41 32.545 4.123 -9.456 575 HE21 GLN 41 HE21 GLN 41 33.076 5.369 -7.751 576 HE22 GLN 41 HE22 GLN 41 32.259 5.350 -6.229 577 H ARG 42 H ARG 42 30.398 -0.107 -11.391 578 HA ARG 42 HA ARG 42 27.580 0.577 -11.989 579 HB2 ARG 42 HB2 ARG 42 29.297 -1.625 -13.168 580 HB3 ARG 42 HB3 ARG 42 27.549 -1.528 -13.395 581 HG2 ARG 42 HG2 ARG 42 27.764 0.564 -14.567 582 HG3 ARG 42 HG3 ARG 42 29.484 0.646 -14.190 583 HD2 ARG 42 HD2 ARG 42 29.296 -0.061 -16.446 584 HD3 ARG 42 HD3 ARG 42 29.784 -1.473 -15.511 585 HE ARG 42 HE ARG 42 26.961 -1.384 -15.783 586 HH11 ARG 42 HH11 ARG 42 29.832 -2.066 -17.670 587 HH12 ARG 42 HH12 ARG 42 29.001 -3.103 -18.780 588 HH21 ARG 42 HH21 ARG 42 25.885 -2.696 -17.311 589 HH22 ARG 42 HH22 ARG 42 26.790 -3.455 -18.577 590 H LEU 43 H LEU 43 26.480 0.071 -10.241 591 HA LEU 43 HA LEU 43 27.345 -2.136 -8.511 592 HB2 LEU 43 HB2 LEU 43 25.312 0.043 -8.044 593 HB3 LEU 43 HB3 LEU 43 25.716 -1.209 -6.878 594 HG LEU 43 HG LEU 43 27.590 0.926 -7.922 595 HD11 LEU 43 HD11 LEU 43 25.835 1.681 -6.336 596 HD12 LEU 43 HD12 LEU 43 27.465 1.811 -5.668 597 HD13 LEU 43 HD13 LEU 43 26.413 0.484 -5.176 598 HD21 LEU 43 HD21 LEU 43 29.075 0.050 -6.055 599 HD22 LEU 43 HD22 LEU 43 28.952 -0.985 -7.484 600 HD23 LEU 43 HD23 LEU 43 28.039 -1.378 -6.023 601 H ILE 44 H ILE 44 26.224 -3.880 -8.097 602 HA ILE 44 HA ILE 44 23.641 -4.300 -9.475 603 HB ILE 44 HB ILE 44 25.970 -6.200 -9.175 604 HG12 ILE 44 HG12 ILE 44 25.556 -6.477 -11.671 605 HG13 ILE 44 HG13 ILE 44 24.532 -5.054 -11.557 606 HG21 ILE 44 HG21 ILE 44 23.718 -7.322 -8.730 607 HG22 ILE 44 HG22 ILE 44 24.735 -8.033 -9.982 608 HG23 ILE 44 HG23 ILE 44 23.362 -7.019 -10.430 609 HD11 ILE 44 HD11 ILE 44 26.743 -4.474 -12.381 610 HD12 ILE 44 HD12 ILE 44 27.483 -5.173 -10.940 611 HD13 ILE 44 HD13 ILE 44 26.464 -3.741 -10.803 612 H PHE 45 H PHE 45 22.063 -5.134 -8.349 613 HA PHE 45 HA PHE 45 22.495 -6.829 -6.042 614 HB2 PHE 45 HB2 PHE 45 22.416 -4.571 -5.006 615 HB3 PHE 45 HB3 PHE 45 20.841 -4.297 -5.773 616 HD1 PHE 45 HD1 PHE 45 22.605 -6.573 -3.406 617 HD2 PHE 45 HD2 PHE 45 18.869 -4.993 -4.752 618 HE1 PHE 45 HE1 PHE 45 21.457 -7.696 -1.529 619 HE2 PHE 45 HE2 PHE 45 17.716 -6.102 -2.862 620 HZ PHE 45 HZ PHE 45 19.013 -7.460 -1.258 621 H ALA 46 H ALA 46 21.135 -8.431 -6.150 622 HA ALA 46 HA ALA 46 19.465 -9.828 -6.778 623 HB1 ALA 46 HB1 ALA 46 18.213 -8.453 -5.227 624 HB2 ALA 46 HB2 ALA 46 17.170 -8.959 -6.555 625 HB3 ALA 46 HB3 ALA 46 17.812 -7.318 -6.518 626 H GLY 47 H GLY 47 21.011 -8.946 -8.844 627 HA2 GLY 47 HA2 GLY 47 21.209 -9.118 -11.128 628 HA3 GLY 47 HA3 GLY 47 19.578 -9.761 -11.148 629 H LYS 48 H LYS 48 20.378 -6.600 -9.926 630 HA LYS 48 HA LYS 48 19.181 -5.261 -12.277 631 HB2 LYS 48 HB2 LYS 48 18.598 -4.878 -9.335 632 HB3 LYS 48 HB3 LYS 48 18.259 -3.612 -10.516 633 HG2 LYS 48 HG2 LYS 48 16.834 -5.239 -11.762 634 HG3 LYS 48 HG3 LYS 48 17.083 -6.386 -10.446 635 HD2 LYS 48 HD2 LYS 48 15.836 -3.651 -10.155 636 HD3 LYS 48 HD3 LYS 48 14.945 -5.163 -10.260 637 HE2 LYS 48 HE2 LYS 48 16.913 -4.440 -8.076 638 HE3 LYS 48 HE3 LYS 48 15.153 -4.370 -7.941 639 HZ1 LYS 48 HZ1 LYS 48 16.783 -6.787 -8.417 640 HZ2 LYS 48 HZ2 LYS 48 15.093 -6.746 -8.413 641 HZ3 LYS 48 HZ3 LYS 48 15.950 -6.391 -7.000 642 H GLN 49 H GLN 49 20.295 -3.552 -12.991 643 HA GLN 49 HA GLN 49 22.685 -2.620 -11.621 644 HB2 GLN 49 HB2 GLN 49 21.350 -1.502 -14.105 645 HB3 GLN 49 HB3 GLN 49 22.970 -1.116 -13.528 646 HG2 GLN 49 HG2 GLN 49 23.458 -3.620 -13.746 647 HG3 GLN 49 HG3 GLN 49 21.976 -3.696 -14.705 648 HE21 GLN 49 HE21 GLN 49 22.827 -4.106 -16.650 649 HE22 GLN 49 HE22 GLN 49 23.892 -3.050 -17.507 650 H LEU 50 H LEU 50 22.838 -0.877 -10.379 651 HA LEU 50 HA LEU 50 20.358 0.301 -9.480 652 HB2 LEU 50 HB2 LEU 50 23.159 0.793 -8.468 653 HB3 LEU 50 HB3 LEU 50 21.654 1.194 -7.645 654 HG LEU 50 HG LEU 50 22.716 -1.563 -8.248 655 HD11 LEU 50 HD11 LEU 50 23.684 -0.246 -6.341 656 HD12 LEU 50 HD12 LEU 50 22.987 -1.811 -5.918 657 HD13 LEU 50 HD13 LEU 50 22.090 -0.329 -5.589 658 HD21 LEU 50 HD21 LEU 50 20.435 -1.960 -8.471 659 HD22 LEU 50 HD22 LEU 50 20.009 -0.736 -7.276 660 HD23 LEU 50 HD23 LEU 50 20.722 -2.266 -6.754 661 H GLU 51 H GLU 51 19.697 2.312 -9.618 662 HA GLU 51 HA GLU 51 20.893 3.965 -11.720 663 HB2 GLU 51 HB2 GLU 51 18.102 3.826 -10.586 664 HB3 GLU 51 HB3 GLU 51 18.587 4.966 -11.833 665 HG2 GLU 51 HG2 GLU 51 18.509 1.952 -12.045 666 HG3 GLU 51 HG3 GLU 51 17.415 3.095 -12.821 667 H ASP 52 H ASP 52 21.511 6.013 -11.323 668 HA ASP 52 HA ASP 52 22.381 6.698 -8.789 669 HB2 ASP 52 HB2 ASP 52 21.973 8.363 -11.248 670 HB3 ASP 52 HB3 ASP 52 22.637 9.065 -9.771 671 H GLY 53 H GLY 53 19.504 7.941 -10.426 672 HA2 GLY 53 HA2 GLY 53 18.724 9.681 -8.269 673 HA3 GLY 53 HA3 GLY 53 17.827 9.373 -9.741 674 H ARG 54 H ARG 54 18.557 6.441 -8.262 675 HA ARG 54 HA ARG 54 15.964 6.366 -6.847 676 HB2 ARG 54 HB2 ARG 54 17.598 4.070 -7.944 677 HB3 ARG 54 HB3 ARG 54 16.059 3.907 -7.117 678 HG2 ARG 54 HG2 ARG 54 16.594 5.099 -9.832 679 HG3 ARG 54 HG3 ARG 54 15.679 3.652 -9.463 680 HD2 ARG 54 HD2 ARG 54 14.865 6.462 -8.716 681 HD3 ARG 54 HD3 ARG 54 14.257 5.568 -10.111 682 HE ARG 54 HE ARG 54 13.898 4.524 -7.396 683 HH11 ARG 54 HH11 ARG 54 12.405 5.670 -10.375 684 HH12 ARG 54 HH12 ARG 54 10.812 5.243 -9.846 685 HH21 ARG 54 HH21 ARG 54 11.804 4.196 -6.684 686 HH22 ARG 54 HH22 ARG 54 10.471 4.424 -7.766 687 H THR 55 H THR 55 15.896 5.411 -4.779 688 HA THR 55 HA THR 55 18.416 5.668 -3.310 689 HB THR 55 HB THR 55 17.004 5.643 -1.274 690 HG1 THR 55 HG1 THR 55 15.278 4.438 -2.677 691 HG21 THR 55 HG21 THR 55 17.504 7.794 -2.413 692 HG22 THR 55 HG22 THR 55 15.966 7.828 -1.555 693 HG23 THR 55 HG23 THR 55 15.992 7.650 -3.310 694 H LEU 56 H LEU 56 18.603 4.143 -1.364 695 HA LEU 56 HA LEU 56 18.909 1.491 -2.275 696 HB2 LEU 56 HB2 LEU 56 18.882 2.607 0.520 697 HB3 LEU 56 HB3 LEU 56 19.339 0.945 0.150 698 HG LEU 56 HG LEU 56 20.725 3.446 -0.859 699 HD11 LEU 56 HD11 LEU 56 20.993 2.937 1.564 700 HD12 LEU 56 HD12 LEU 56 22.502 2.826 0.652 701 HD13 LEU 56 HD13 LEU 56 21.640 1.360 1.115 702 HD21 LEU 56 HD21 LEU 56 21.052 1.748 -2.523 703 HD22 LEU 56 HD22 LEU 56 21.320 0.516 -1.278 704 HD23 LEU 56 HD23 LEU 56 22.516 1.794 -1.529 705 H SER 57 H SER 57 16.415 2.992 -0.329 706 HA SER 57 HA SER 57 14.917 0.726 0.398 707 HB2 SER 57 HB2 SER 57 13.074 2.300 0.825 708 HB3 SER 57 HB3 SER 57 14.597 2.937 1.444 709 HG SER 57 HG SER 57 14.048 3.653 -1.150 710 H ASP 58 H ASP 58 15.231 2.333 -2.627 711 HA ASP 58 HA ASP 58 12.720 1.349 -3.719 712 HB2 ASP 58 HB2 ASP 58 14.975 2.878 -5.027 713 HB3 ASP 58 HB3 ASP 58 13.449 2.473 -5.803 714 H TYR 59 H TYR 59 15.464 -0.187 -3.058 715 HA TYR 59 HA TYR 59 15.179 -2.054 -5.320 716 HB2 TYR 59 HB2 TYR 59 17.667 -0.793 -4.227 717 HB3 TYR 59 HB3 TYR 59 17.737 -2.382 -4.983 718 HD1 TYR 59 HD1 TYR 59 16.444 -2.478 -7.327 719 HD2 TYR 59 HD2 TYR 59 18.116 1.021 -5.559 720 HE1 TYR 59 HE1 TYR 59 16.723 -1.490 -9.565 721 HE2 TYR 59 HE2 TYR 59 18.406 2.018 -7.790 722 HH TYR 59 HH TYR 59 18.289 1.652 -9.978 723 H ASN 60 H ASN 60 14.802 -1.658 -2.149 724 HA ASN 60 HA ASN 60 14.621 -2.940 -0.316 725 HB2 ASN 60 HB2 ASN 60 13.427 -4.373 -2.049 726 HB3 ASN 60 HB3 ASN 60 14.872 -5.377 -2.057 727 HD21 ASN 60 HD21 ASN 60 13.646 -7.112 -1.288 728 HD22 ASN 60 HD22 ASN 60 13.173 -7.221 0.368 729 H ILE 61 H ILE 61 17.235 -2.147 -1.293 730 HA ILE 61 HA ILE 61 19.179 -4.078 -0.415 731 HB ILE 61 HB ILE 61 19.375 -1.098 -0.893 732 HG12 ILE 61 HG12 ILE 61 20.366 -3.441 -2.524 733 HG13 ILE 61 HG13 ILE 61 18.883 -2.554 -2.854 734 HG21 ILE 61 HG21 ILE 61 21.065 -1.900 0.756 735 HG22 ILE 61 HG22 ILE 61 21.790 -1.274 -0.731 736 HG23 ILE 61 HG23 ILE 61 21.670 -3.020 -0.462 737 HD11 ILE 61 HD11 ILE 61 21.690 -1.436 -2.985 738 HD12 ILE 61 HD12 ILE 61 20.205 -0.540 -3.326 739 HD13 ILE 61 HD13 ILE 61 20.675 -1.894 -4.358 740 H GLN 62 H GLN 62 19.092 -4.742 1.604 741 HA GLN 62 HA GLN 62 18.643 -2.776 3.744 742 HB2 GLN 62 HB2 GLN 62 17.910 -5.705 3.629 743 HB3 GLN 62 HB3 GLN 62 17.731 -4.697 5.058 744 HG2 GLN 62 HG2 GLN 62 16.132 -3.281 3.871 745 HG3 GLN 62 HG3 GLN 62 16.330 -4.258 2.416 746 HE21 GLN 62 HE21 GLN 62 16.470 -6.760 3.977 747 HE22 GLN 62 HE22 GLN 62 14.848 -7.091 4.469 748 H LYS 63 H LYS 63 19.373 -4.197 5.937 749 HA LYS 63 HA LYS 63 22.201 -4.040 5.900 750 HB2 LYS 63 HB2 LYS 63 22.144 -4.860 8.169 751 HB3 LYS 63 HB3 LYS 63 20.806 -3.747 7.944 752 HG2 LYS 63 HG2 LYS 63 19.273 -5.663 7.690 753 HG3 LYS 63 HG3 LYS 63 20.626 -6.759 7.994 754 HD2 LYS 63 HD2 LYS 63 20.972 -5.686 10.191 755 HD3 LYS 63 HD3 LYS 63 19.571 -4.654 9.886 756 HE2 LYS 63 HE2 LYS 63 18.190 -6.732 9.639 757 HE3 LYS 63 HE3 LYS 63 19.595 -7.659 10.182 758 HZ1 LYS 63 HZ1 LYS 63 18.245 -5.504 11.689 759 HZ2 LYS 63 HZ2 LYS 63 19.612 -6.356 12.206 760 HZ3 LYS 63 HZ3 LYS 63 18.136 -7.161 12.012 761 H GLU 64 H GLU 64 23.757 -5.544 5.730 762 HA GLU 64 HA GLU 64 24.847 -7.527 5.415 763 HB2 GLU 64 HB2 GLU 64 22.403 -8.384 6.630 764 HB3 GLU 64 HB3 GLU 64 22.835 -9.521 5.362 765 HG2 GLU 64 HG2 GLU 64 23.715 -10.159 7.559 766 HG3 GLU 64 HG3 GLU 64 24.990 -9.899 6.371 767 H SER 65 H SER 65 22.802 -6.198 3.313 768 HA SER 65 HA SER 65 22.559 -8.201 1.271 769 HB2 SER 65 HB2 SER 65 22.548 -5.176 1.093 770 HB3 SER 65 HB3 SER 65 22.179 -6.243 -0.263 771 HG SER 65 HG SER 65 20.709 -6.928 1.893 772 H THR 66 H THR 66 23.898 -8.658 -0.424 773 HA THR 66 HA THR 66 26.403 -7.122 -0.532 774 HB THR 66 HB THR 66 27.776 -8.866 -0.697 775 HG1 THR 66 HG1 THR 66 27.518 -10.051 -2.380 776 HG21 THR 66 HG21 THR 66 25.788 -9.512 1.126 777 HG22 THR 66 HG22 THR 66 27.384 -10.256 1.012 778 HG23 THR 66 HG23 THR 66 26.008 -10.982 0.179 779 H LEU 67 H LEU 67 26.983 -6.277 -2.255 780 HA LEU 67 HA LEU 67 25.404 -6.523 -4.739 781 HB2 LEU 67 HB2 LEU 67 27.049 -4.310 -3.495 782 HB3 LEU 67 HB3 LEU 67 26.525 -4.239 -5.166 783 HG LEU 67 HG LEU 67 24.176 -4.185 -4.433 784 HD11 LEU 67 HD11 LEU 67 24.459 -5.408 -2.244 785 HD12 LEU 67 HD12 LEU 67 23.511 -3.924 -2.146 786 HD13 LEU 67 HD13 LEU 67 25.190 -3.939 -1.599 787 HD21 LEU 67 HD21 LEU 67 25.394 -2.120 -4.762 788 HD22 LEU 67 HD22 LEU 67 25.985 -2.180 -3.101 789 HD23 LEU 67 HD23 LEU 67 24.262 -1.945 -3.416 790 H HIS 68 H HIS 68 26.680 -6.177 -6.700 791 HA HIS 68 HA HIS 68 29.467 -7.123 -6.477 792 HB2 HIS 68 HB2 HIS 68 27.360 -7.723 -8.548 793 HB3 HIS 68 HB3 HIS 68 29.083 -7.929 -8.901 794 HD1 HIS 68 HD1 HIS 68 26.422 -9.381 -6.614 795 HD2 HIS 68 HD2 HIS 68 30.304 -9.983 -7.844 796 HE1 HIS 68 HE1 HIS 68 27.071 -11.673 -5.747 797 HE2 HIS 68 HE2 HIS 68 29.509 -11.923 -6.410 798 H LEU 69 H LEU 69 30.991 -6.264 -7.744 799 HA LEU 69 HA LEU 69 30.410 -3.640 -8.979 800 HB2 LEU 69 HB2 LEU 69 31.750 -3.429 -6.956 801 HB3 LEU 69 HB3 LEU 69 32.870 -4.655 -7.529 802 HG LEU 69 HG LEU 69 33.499 -3.151 -9.406 803 HD11 LEU 69 HD11 LEU 69 31.886 -1.068 -7.939 804 HD12 LEU 69 HD12 LEU 69 31.435 -1.794 -9.483 805 HD13 LEU 69 HD13 LEU 69 32.904 -0.813 -9.359 806 HD21 LEU 69 HD21 LEU 69 34.967 -3.197 -7.558 807 HD22 LEU 69 HD22 LEU 69 33.880 -2.209 -6.581 808 HD23 LEU 69 HD23 LEU 69 34.727 -1.493 -7.952 809 H VAL 70 H VAL 70 30.813 -3.451 -11.055 810 HA VAL 70 HA VAL 70 32.702 -5.283 -12.386 811 HB VAL 70 HB VAL 70 30.263 -3.821 -13.495 812 HG11 VAL 70 HG11 VAL 70 31.933 -3.737 -15.208 813 HG12 VAL 70 HG12 VAL 70 30.754 -4.969 -15.658 814 HG13 VAL 70 HG13 VAL 70 32.313 -5.446 -14.991 815 HG21 VAL 70 HG21 VAL 70 29.953 -5.987 -12.160 816 HG22 VAL 70 HG22 VAL 70 30.682 -6.795 -13.547 817 HG23 VAL 70 HG23 VAL 70 29.180 -5.889 -13.742 818 H LEU 71 H LEU 71 34.360 -4.264 -13.502 819 HA LEU 71 HA LEU 71 34.722 -1.445 -12.859 820 HB2 LEU 71 HB2 LEU 71 36.416 -3.585 -12.676 821 HB3 LEU 71 HB3 LEU 71 36.901 -2.890 -14.213 822 HG LEU 71 HG LEU 71 36.862 -0.667 -12.782 823 HD11 LEU 71 HD11 LEU 71 36.053 -1.900 -10.777 824 HD12 LEU 71 HD12 LEU 71 37.521 -0.959 -10.513 825 HD13 LEU 71 HD13 LEU 71 37.620 -2.709 -10.707 826 HD21 LEU 71 HD21 LEU 71 39.136 -2.661 -13.060 827 HD22 LEU 71 HD22 LEU 71 39.373 -1.077 -12.320 828 HD23 LEU 71 HD23 LEU 71 38.848 -1.196 -14.000 Start of MODEL 6 1 H GLY 12 H GLY 12 7.953 -10.576 -0.165 2 HA2 GLY 12 HA2 GLY 12 10.750 -11.108 0.264 3 HA3 GLY 12 HA3 GLY 12 10.071 -12.047 -1.057 4 HA PRO 13 HA PRO 13 11.184 -8.463 -3.470 5 HB2 PRO 13 HB2 PRO 13 10.053 -9.210 -5.846 6 HB3 PRO 13 HB3 PRO 13 11.602 -9.828 -5.263 7 HG2 PRO 13 HG2 PRO 13 8.908 -11.109 -5.216 8 HG3 PRO 13 HG3 PRO 13 10.496 -11.849 -5.479 9 HD2 PRO 13 HD2 PRO 13 9.126 -11.976 -3.095 10 HD3 PRO 13 HD3 PRO 13 10.892 -12.090 -3.221 11 H MET 14 H MET 14 9.667 -7.251 -2.061 12 HA MET 14 HA MET 14 6.947 -6.902 -2.849 13 HB2 MET 14 HB2 MET 14 8.792 -5.469 -0.943 14 HB3 MET 14 HB3 MET 14 7.193 -4.812 -1.309 15 HG2 MET 14 HG2 MET 14 7.597 -7.671 -0.440 16 HG3 MET 14 HG3 MET 14 7.313 -6.358 0.720 17 HE1 MET 14 HE1 MET 14 3.820 -7.362 1.112 18 HE2 MET 14 HE2 MET 14 4.871 -6.030 1.597 19 HE3 MET 14 HE3 MET 14 5.482 -7.684 1.611 20 H LEU 15 H LEU 15 7.173 -6.487 -5.113 21 HA LEU 15 HA LEU 15 8.582 -4.182 -6.074 22 HB2 LEU 15 HB2 LEU 15 7.362 -6.487 -7.204 23 HB3 LEU 15 HB3 LEU 15 6.554 -5.090 -7.914 24 HG LEU 15 HG LEU 15 8.788 -4.135 -8.512 25 HD11 LEU 15 HD11 LEU 15 10.690 -5.007 -7.698 26 HD12 LEU 15 HD12 LEU 15 10.264 -6.604 -8.316 27 HD13 LEU 15 HD13 LEU 15 9.713 -6.099 -6.715 28 HD21 LEU 15 HD21 LEU 15 7.534 -5.417 -10.162 29 HD22 LEU 15 HD22 LEU 15 8.199 -6.923 -9.528 30 HD23 LEU 15 HD23 LEU 15 9.256 -5.760 -10.325 31 H CYS 16 H CYS 16 7.742 -2.205 -6.757 32 HA CYS 16 HA CYS 16 5.899 -0.895 -5.253 33 HB2 CYS 16 HB2 CYS 16 7.509 0.046 -7.014 34 HB3 CYS 16 HB3 CYS 16 6.192 -0.217 -8.173 35 H SER 17 H SER 17 3.781 -0.657 -5.069 36 HA SER 17 HA SER 17 1.982 -2.451 -6.301 37 HB2 SER 17 HB2 SER 17 1.393 0.098 -4.771 38 HB3 SER 17 HB3 SER 17 0.232 -1.193 -5.110 39 HG SER 17 HG SER 17 2.205 -2.448 -4.056 40 H THR 18 H THR 18 2.900 0.872 -7.037 41 HA THR 18 HA THR 18 0.733 1.371 -8.831 42 HB THR 18 HB THR 18 2.056 3.343 -9.528 43 HG1 THR 18 HG1 THR 18 4.128 2.279 -9.241 44 HG21 THR 18 HG21 THR 18 1.978 2.877 -6.539 45 HG22 THR 18 HG22 THR 18 0.613 3.410 -7.519 46 HG23 THR 18 HG23 THR 18 2.030 4.447 -7.338 47 H GLY 19 H GLY 19 3.585 -0.509 -9.180 48 HA2 GLY 19 HA2 GLY 19 4.291 -1.772 -10.996 49 HA3 GLY 19 HA3 GLY 19 2.959 -1.099 -11.928 50 H CYS 20 H CYS 20 5.651 0.578 -10.290 51 HA CYS 20 HA CYS 20 6.143 2.071 -12.719 52 HB2 CYS 20 HB2 CYS 20 7.578 3.483 -11.386 53 HB3 CYS 20 HB3 CYS 20 6.121 3.152 -10.451 54 H GLY 21 H GLY 21 7.304 -0.865 -11.498 55 HA2 GLY 21 HA2 GLY 21 8.804 -2.240 -12.733 56 HA3 GLY 21 HA3 GLY 21 9.534 -0.796 -13.414 57 H PHE 22 H PHE 22 9.203 -0.329 -10.102 58 HA PHE 22 HA PHE 22 11.939 -1.320 -9.605 59 HB2 PHE 22 HB2 PHE 22 10.612 1.262 -8.833 60 HB3 PHE 22 HB3 PHE 22 12.014 0.654 -7.942 61 HD1 PHE 22 HD1 PHE 22 14.092 0.032 -9.283 62 HD2 PHE 22 HD2 PHE 22 10.923 2.432 -10.854 63 HE1 PHE 22 HE1 PHE 22 15.605 0.857 -11.050 64 HE2 PHE 22 HE2 PHE 22 12.433 3.273 -12.619 65 HZ PHE 22 HZ PHE 22 14.774 2.484 -12.720 66 H TYR 23 H TYR 23 12.146 -0.900 -6.924 67 HA TYR 23 HA TYR 23 10.292 -2.914 -5.898 68 HB2 TYR 23 HB2 TYR 23 13.035 -2.017 -5.173 69 HB3 TYR 23 HB3 TYR 23 12.015 -2.668 -3.885 70 HD1 TYR 23 HD1 TYR 23 13.027 -3.434 -7.385 71 HD2 TYR 23 HD2 TYR 23 12.051 -4.969 -3.525 72 HE1 TYR 23 HE1 TYR 23 13.546 -5.709 -8.176 73 HE2 TYR 23 HE2 TYR 23 12.565 -7.258 -4.297 74 HH TYR 23 HH TYR 23 14.202 -7.904 -7.218 75 H GLY 24 H GLY 24 10.078 -2.561 -3.308 76 HA2 GLY 24 HA2 GLY 24 9.157 0.214 -2.861 77 HA3 GLY 24 HA3 GLY 24 8.124 -1.158 -2.470 78 H ASN 25 H ASN 25 8.067 -0.440 -0.265 79 HA ASN 25 HA ASN 25 10.362 -1.410 1.264 80 HB2 ASN 25 HB2 ASN 25 10.354 1.203 0.882 81 HB3 ASN 25 HB3 ASN 25 9.101 1.167 2.126 82 HD21 ASN 25 HD21 ASN 25 10.514 2.315 3.578 83 HD22 ASN 25 HD22 ASN 25 11.810 1.491 4.366 84 HA PRO 26 HA PRO 26 6.721 -3.069 3.409 85 HB2 PRO 26 HB2 PRO 26 8.014 -4.375 5.402 86 HB3 PRO 26 HB3 PRO 26 7.860 -5.020 3.760 87 HG2 PRO 26 HG2 PRO 26 10.159 -3.590 5.039 88 HG3 PRO 26 HG3 PRO 26 10.181 -5.029 4.002 89 HD2 PRO 26 HD2 PRO 26 10.782 -2.558 3.055 90 HD3 PRO 26 HD3 PRO 26 9.969 -3.773 2.050 91 H ARG 27 H ARG 27 9.170 -0.991 4.772 92 HA ARG 27 HA ARG 27 7.818 -0.530 7.275 93 HB2 ARG 27 HB2 ARG 27 9.912 1.167 5.880 94 HB3 ARG 27 HB3 ARG 27 9.442 1.279 7.578 95 HG2 ARG 27 HG2 ARG 27 10.249 -0.975 7.997 96 HG3 ARG 27 HG3 ARG 27 10.622 -1.188 6.289 97 HD2 ARG 27 HD2 ARG 27 12.704 -0.619 7.267 98 HD3 ARG 27 HD3 ARG 27 12.137 0.860 6.485 99 HE ARG 27 HE ARG 27 11.133 0.703 8.395 100 HH11 ARG 27 HH11 ARG 27 14.379 0.219 7.861 101 HH12 ARG 27 HH12 ARG 27 15.189 0.946 9.210 102 HH21 ARG 27 HH21 ARG 27 12.292 2.102 10.706 103 HH22 ARG 27 HH22 ARG 27 14.018 1.998 10.801 104 H THR 28 H THR 28 8.075 1.133 4.141 105 HA THR 28 HA THR 28 6.281 3.259 4.904 106 HB THR 28 HB THR 28 6.524 3.995 2.573 107 HG1 THR 28 HG1 THR 28 7.059 1.386 2.203 108 HG21 THR 28 HG21 THR 28 9.112 3.983 2.474 109 HG22 THR 28 HG22 THR 28 9.026 3.105 4.000 110 HG23 THR 28 HG23 THR 28 8.340 4.728 3.875 111 H ASN 29 H ASN 29 4.750 3.201 2.328 112 HA ASN 29 HA ASN 29 2.704 1.308 3.176 113 HB2 ASN 29 HB2 ASN 29 2.808 3.675 1.329 114 HB3 ASN 29 HB3 ASN 29 1.465 2.530 1.204 115 HD21 ASN 29 HD21 ASN 29 -0.249 3.421 2.301 116 HD22 ASN 29 HD22 ASN 29 -0.143 4.159 3.859 117 H GLY 30 H GLY 30 5.217 0.348 1.796 118 HA2 GLY 30 HA2 GLY 30 5.569 -1.513 0.420 119 HA3 GLY 30 HA3 GLY 30 3.911 -1.370 -0.158 120 H MET 31 H MET 31 5.546 1.627 -0.246 121 HA MET 31 HA MET 31 6.139 1.277 -3.118 122 HB2 MET 31 HB2 MET 31 4.681 3.418 -1.620 123 HB3 MET 31 HB3 MET 31 5.593 3.871 -3.070 124 HG2 MET 31 HG2 MET 31 3.414 3.388 -3.839 125 HG3 MET 31 HG3 MET 31 4.362 1.947 -4.239 126 HE1 MET 31 HE1 MET 31 0.443 1.686 -2.667 127 HE2 MET 31 HE2 MET 31 1.255 2.158 -4.159 128 HE3 MET 31 HE3 MET 31 1.202 3.274 -2.793 129 H CYS 32 H CYS 32 7.729 2.804 -3.981 130 HA CYS 32 HA CYS 32 10.057 2.927 -2.340 131 HB2 CYS 32 HB2 CYS 32 11.074 4.024 -4.370 132 HB3 CYS 32 HB3 CYS 32 10.282 2.487 -4.716 133 H SER 33 H SER 33 11.307 5.316 -2.728 134 HA SER 33 HA SER 33 9.846 7.022 -0.931 135 HB2 SER 33 HB2 SER 33 11.886 8.483 -1.105 136 HB3 SER 33 HB3 SER 33 12.238 6.822 -0.621 137 HG SER 33 HG SER 33 12.560 6.512 -2.999 138 H VAL 34 H VAL 34 9.554 6.697 -4.173 139 HA VAL 34 HA VAL 34 9.344 9.540 -4.794 140 HB VAL 34 HB VAL 34 8.979 7.170 -6.633 141 HG11 VAL 34 HG11 VAL 34 9.283 8.822 -8.423 142 HG12 VAL 34 HG12 VAL 34 9.431 10.099 -7.216 143 HG13 VAL 34 HG13 VAL 34 7.901 9.248 -7.410 144 HG21 VAL 34 HG21 VAL 34 11.259 7.639 -7.404 145 HG22 VAL 34 HG22 VAL 34 11.260 7.255 -5.682 146 HG23 VAL 34 HG23 VAL 34 11.402 8.929 -6.214 147 H CYS 35 H CYS 35 7.279 6.637 -5.012 148 HA CYS 35 HA CYS 35 4.933 8.172 -5.645 149 HB2 CYS 35 HB2 CYS 35 5.252 5.258 -4.916 150 HB3 CYS 35 HB3 CYS 35 3.783 5.992 -5.575 151 H TYR 36 H TYR 36 6.387 6.972 -2.729 152 HA TYR 36 HA TYR 36 4.149 6.823 -1.056 153 HB2 TYR 36 HB2 TYR 36 6.331 5.916 -0.409 154 HB3 TYR 36 HB3 TYR 36 7.012 7.543 -0.351 155 HD1 TYR 36 HD1 TYR 36 3.686 6.389 0.955 156 HD2 TYR 36 HD2 TYR 36 7.638 7.797 1.870 157 HE1 TYR 36 HE1 TYR 36 3.061 6.584 3.350 158 HE2 TYR 36 HE2 TYR 36 7.018 7.997 4.263 159 HH TYR 36 HH TYR 36 4.176 6.625 5.568 160 H LYS 37 H LYS 37 6.310 9.627 -1.635 161 HA LYS 37 HA LYS 37 4.813 11.320 0.115 162 HB2 LYS 37 HB2 LYS 37 6.181 13.166 -0.802 163 HB3 LYS 37 HB3 LYS 37 7.182 11.794 -0.330 164 HG2 LYS 37 HG2 LYS 37 7.262 11.054 -2.683 165 HG3 LYS 37 HG3 LYS 37 6.293 12.464 -3.140 166 HD2 LYS 37 HD2 LYS 37 8.088 13.898 -2.075 167 HD3 LYS 37 HD3 LYS 37 9.081 12.433 -1.980 168 HE2 LYS 37 HE2 LYS 37 8.663 12.147 -4.475 169 HE3 LYS 37 HE3 LYS 37 8.020 13.800 -4.449 170 HZ1 LYS 37 HZ1 LYS 37 10.121 14.579 -3.554 171 HZ2 LYS 37 HZ2 LYS 37 10.369 13.785 -5.026 172 HZ3 LYS 37 HZ3 LYS 37 10.745 13.007 -3.572 173 H GLU 38 H GLU 38 4.944 10.857 -3.387 174 HA GLU 38 HA GLU 38 3.276 12.912 -4.216 175 HB2 GLU 38 HB2 GLU 38 3.885 10.183 -5.326 176 HB3 GLU 38 HB3 GLU 38 2.697 11.227 -6.120 177 HG2 GLU 38 HG2 GLU 38 5.431 12.260 -5.396 178 HG3 GLU 38 HG3 GLU 38 5.137 11.400 -6.917 179 H HIS 39 H HIS 39 2.373 9.674 -3.009 180 HA HIS 39 HA HIS 39 -0.424 10.263 -3.495 181 HB2 HIS 39 HB2 HIS 39 -0.925 8.012 -2.987 182 HB3 HIS 39 HB3 HIS 39 0.625 7.950 -3.814 183 HD1 HIS 39 HD1 HIS 39 1.949 6.135 -2.808 184 HD2 HIS 39 HD2 HIS 39 -0.158 8.248 0.109 185 HE1 HIS 39 HE1 HIS 39 2.470 5.022 -0.599 186 HE2 HIS 39 HE2 HIS 39 1.496 6.544 1.180 187 H LEU 40 H LEU 40 1.763 10.207 -0.770 188 HA LEU 40 HA LEU 40 -0.125 10.272 1.326 189 HB2 LEU 40 HB2 LEU 40 2.396 9.910 1.500 190 HB3 LEU 40 HB3 LEU 40 2.558 11.664 1.366 191 HG LEU 40 HG LEU 40 0.911 11.825 3.323 192 HD11 LEU 40 HD11 LEU 40 0.148 9.437 3.106 193 HD12 LEU 40 HD12 LEU 40 0.693 9.870 4.728 194 HD13 LEU 40 HD13 LEU 40 1.746 8.938 3.669 195 HD21 LEU 40 HD21 LEU 40 2.733 11.256 4.985 196 HD22 LEU 40 HD22 LEU 40 3.237 12.329 3.676 197 HD23 LEU 40 HD23 LEU 40 3.667 10.621 3.632 198 H GLN 41 H GLN 41 1.075 12.785 -0.803 199 HA GLN 41 HA GLN 41 0.268 15.034 0.714 200 HB2 GLN 41 HB2 GLN 41 1.060 14.512 -2.116 201 HB3 GLN 41 HB3 GLN 41 0.216 16.028 -1.773 202 HG2 GLN 41 HG2 GLN 41 1.865 16.619 -0.089 203 HG3 GLN 41 HG3 GLN 41 2.688 15.069 -0.316 204 HE21 GLN 41 HE21 GLN 41 2.168 18.238 -1.692 205 HE22 GLN 41 HE22 GLN 41 3.338 18.073 -2.952 206 H ARG 42 H ARG 42 -1.402 13.078 -1.731 207 HA ARG 42 HA ARG 42 -3.739 14.770 -1.762 208 HB2 ARG 42 HB2 ARG 42 -3.125 12.053 -2.930 209 HB3 ARG 42 HB3 ARG 42 -4.707 12.828 -3.101 210 HG2 ARG 42 HG2 ARG 42 -3.794 14.663 -4.301 211 HG3 ARG 42 HG3 ARG 42 -2.139 14.202 -3.869 212 HD2 ARG 42 HD2 ARG 42 -2.503 12.059 -5.125 213 HD3 ARG 42 HD3 ARG 42 -4.022 12.738 -5.721 214 HE ARG 42 HE ARG 42 -1.314 13.126 -6.310 215 HH11 ARG 42 HH11 ARG 42 -4.601 14.730 -6.161 216 HH12 ARG 42 HH12 ARG 42 -4.384 15.966 -7.356 217 HH21 ARG 42 HH21 ARG 42 -1.174 15.000 -8.199 218 HH22 ARG 42 HH22 ARG 42 -2.466 16.114 -8.497 219 H GLN 43 H GLN 43 -2.712 11.875 -0.075 220 HA GLN 43 HA GLN 43 -5.309 11.190 0.927 221 HB2 GLN 43 HB2 GLN 43 -3.173 9.699 0.646 222 HB3 GLN 43 HB3 GLN 43 -2.741 10.336 2.238 223 HG2 GLN 43 HG2 GLN 43 -3.924 8.455 2.847 224 HG3 GLN 43 HG3 GLN 43 -5.222 9.658 2.831 225 HE21 GLN 43 HE21 GLN 43 -6.829 8.066 2.318 226 HE22 GLN 43 HE22 GLN 43 -6.906 7.340 0.752 227 H GLN 44 H GLN 44 -2.523 13.020 2.088 228 HA GLN 44 HA GLN 44 -3.529 13.428 4.736 229 HB2 GLN 44 HB2 GLN 44 -1.085 13.579 3.905 230 HB3 GLN 44 HB3 GLN 44 -1.510 15.220 3.399 231 HG2 GLN 44 HG2 GLN 44 -2.086 15.854 5.629 232 HG3 GLN 44 HG3 GLN 44 -1.989 14.179 6.190 233 HE21 GLN 44 HE21 GLN 44 0.148 16.468 4.443 234 HE22 GLN 44 HE22 GLN 44 1.550 16.062 5.366 235 H ASN 45 H ASN 45 -3.539 15.324 1.737 236 HA ASN 45 HA ASN 45 -4.647 17.687 2.846 237 HB2 ASN 45 HB2 ASN 45 -4.383 16.578 0.064 238 HB3 ASN 45 HB3 ASN 45 -5.375 18.015 0.341 239 HD21 ASN 45 HD21 ASN 45 -2.679 17.673 -1.015 240 HD22 ASN 45 HD22 ASN 45 -1.666 18.822 -0.214 241 H SER 46 H SER 46 -6.100 14.843 1.293 242 HA SER 46 HA SER 46 -8.777 15.861 1.417 243 HB2 SER 46 HB2 SER 46 -7.782 14.020 -0.146 244 HB3 SER 46 HB3 SER 46 -8.124 12.932 1.204 245 HG SER 46 HG SER 46 -9.951 14.556 -0.236 246 H1 MET 1 H1 MET 1 22.458 1.011 9.977 247 H2 MET 1 H2 MET 1 23.102 1.488 8.487 248 H3 MET 1 H3 MET 1 24.121 1.279 9.820 249 HA MET 1 HA MET 1 23.659 -1.065 9.868 250 HB2 MET 1 HB2 MET 1 22.302 -2.103 8.156 251 HB3 MET 1 HB3 MET 1 21.351 -0.846 8.933 252 HG2 MET 1 HG2 MET 1 21.799 0.655 7.048 253 HG3 MET 1 HG3 MET 1 22.754 -0.603 6.273 254 HE1 MET 1 HE1 MET 1 19.885 -0.747 3.809 255 HE2 MET 1 HE2 MET 1 21.628 -0.772 4.085 256 HE3 MET 1 HE3 MET 1 20.693 0.668 4.484 257 H GLN 2 H GLN 2 25.141 -2.416 8.850 258 HA GLN 2 HA GLN 2 26.795 -1.098 6.816 259 HB2 GLN 2 HB2 GLN 2 28.536 -2.557 7.373 260 HB3 GLN 2 HB3 GLN 2 27.771 -2.193 8.913 261 HG2 GLN 2 HG2 GLN 2 26.604 -4.329 8.867 262 HG3 GLN 2 HG3 GLN 2 27.294 -4.690 7.287 263 HE21 GLN 2 HE21 GLN 2 29.855 -3.384 8.268 264 HE22 GLN 2 HE22 GLN 2 30.613 -4.617 9.211 265 H ILE 3 H ILE 3 27.166 -1.885 4.848 266 HA ILE 3 HA ILE 3 26.037 -4.482 4.109 267 HB ILE 3 HB ILE 3 25.047 -3.847 2.155 268 HG12 ILE 3 HG12 ILE 3 26.661 -2.334 1.217 269 HG13 ILE 3 HG13 ILE 3 25.032 -1.713 1.041 270 HG21 ILE 3 HG21 ILE 3 23.653 -3.375 4.054 271 HG22 ILE 3 HG22 ILE 3 23.266 -2.323 2.691 272 HG23 ILE 3 HG23 ILE 3 24.197 -1.696 4.052 273 HD11 ILE 3 HD11 ILE 3 27.169 -0.268 1.829 274 HD12 ILE 3 HD12 ILE 3 26.499 -0.726 3.394 275 HD13 ILE 3 HD13 ILE 3 25.494 0.142 2.228 276 H PHE 4 H PHE 4 27.055 -5.323 2.129 277 HA PHE 4 HA PHE 4 29.903 -4.516 2.085 278 HB2 PHE 4 HB2 PHE 4 28.747 -7.253 1.471 279 HB3 PHE 4 HB3 PHE 4 30.459 -6.845 1.701 280 HD1 PHE 4 HD1 PHE 4 31.180 -5.976 4.013 281 HD2 PHE 4 HD2 PHE 4 27.404 -7.842 3.277 282 HE1 PHE 4 HE1 PHE 4 30.888 -6.346 6.439 283 HE2 PHE 4 HE2 PHE 4 27.123 -8.238 5.706 284 HZ PHE 4 HZ PHE 4 28.865 -7.480 7.284 285 H VAL 5 H VAL 5 30.884 -4.171 0.204 286 HA VAL 5 HA VAL 5 29.395 -4.576 -2.319 287 HB VAL 5 HB VAL 5 31.279 -2.292 -1.655 288 HG11 VAL 5 HG11 VAL 5 31.554 -2.780 -3.974 289 HG12 VAL 5 HG12 VAL 5 30.470 -1.394 -3.881 290 HG13 VAL 5 HG13 VAL 5 29.819 -3.002 -4.201 291 HG21 VAL 5 HG21 VAL 5 28.373 -2.034 -2.387 292 HG22 VAL 5 HG22 VAL 5 29.433 -0.844 -1.619 293 HG23 VAL 5 HG23 VAL 5 28.880 -2.253 -0.713 294 H LYS 6 H LYS 6 30.270 -6.392 -2.975 295 HA LYS 6 HA LYS 6 33.074 -7.043 -2.784 296 HB2 LYS 6 HB2 LYS 6 30.770 -8.246 -4.334 297 HB3 LYS 6 HB3 LYS 6 32.386 -8.938 -4.275 298 HG2 LYS 6 HG2 LYS 6 32.195 -9.305 -1.888 299 HG3 LYS 6 HG3 LYS 6 30.614 -8.512 -1.866 300 HD2 LYS 6 HD2 LYS 6 30.377 -10.962 -1.898 301 HD3 LYS 6 HD3 LYS 6 29.721 -10.232 -3.365 302 HE2 LYS 6 HE2 LYS 6 31.953 -10.728 -4.462 303 HE3 LYS 6 HE3 LYS 6 32.336 -11.707 -3.043 304 HZ1 LYS 6 HZ1 LYS 6 30.050 -12.096 -4.870 305 HZ2 LYS 6 HZ2 LYS 6 30.370 -13.023 -3.493 306 HZ3 LYS 6 HZ3 LYS 6 31.445 -13.048 -4.799 307 H THR 7 H THR 7 34.617 -6.613 -4.177 308 HA THR 7 HA THR 7 33.931 -5.575 -6.856 309 HB THR 7 HB THR 7 36.180 -4.714 -7.008 310 HG1 THR 7 HG1 THR 7 36.562 -6.421 -4.840 311 HG21 THR 7 HG21 THR 7 35.435 -4.066 -4.169 312 HG22 THR 7 HG22 THR 7 34.466 -3.469 -5.521 313 HG23 THR 7 HG23 THR 7 36.164 -3.012 -5.378 314 H LEU 8 H LEU 8 35.502 -6.346 -8.581 315 HA LEU 8 HA LEU 8 35.206 -9.198 -8.634 316 HB2 LEU 8 HB2 LEU 8 36.221 -7.364 -10.790 317 HB3 LEU 8 HB3 LEU 8 35.731 -9.045 -10.999 318 HG LEU 8 HG LEU 8 33.969 -6.754 -10.125 319 HD11 LEU 8 HD11 LEU 8 34.609 -6.861 -12.534 320 HD12 LEU 8 HD12 LEU 8 32.874 -6.959 -12.222 321 HD13 LEU 8 HD13 LEU 8 33.785 -8.416 -12.618 322 HD21 LEU 8 HD21 LEU 8 33.395 -9.695 -10.248 323 HD22 LEU 8 HD22 LEU 8 32.116 -8.504 -10.486 324 HD23 LEU 8 HD23 LEU 8 33.016 -8.544 -8.968 325 H THR 9 H THR 9 37.823 -7.127 -8.017 326 HA THR 9 HA THR 9 40.004 -8.884 -8.357 327 HB THR 9 HB THR 9 41.033 -7.629 -6.435 328 HG1 THR 9 HG1 THR 9 38.628 -6.119 -6.568 329 HG21 THR 9 HG21 THR 9 39.902 -6.107 -8.775 330 HG22 THR 9 HG22 THR 9 41.492 -6.860 -8.647 331 HG23 THR 9 HG23 THR 9 41.105 -5.441 -7.673 332 H GLY 10 H GLY 10 37.523 -8.663 -5.917 333 HA2 GLY 10 HA2 GLY 10 36.887 -10.822 -4.835 334 HA3 GLY 10 HA3 GLY 10 38.599 -11.033 -4.494 335 H LYS 11 H LYS 11 38.836 -8.094 -3.932 336 HA LYS 11 HA LYS 11 38.510 -8.075 -1.135 337 HB2 LYS 11 HB2 LYS 11 39.974 -6.549 -2.628 338 HB3 LYS 11 HB3 LYS 11 38.516 -5.566 -2.807 339 HG2 LYS 11 HG2 LYS 11 38.637 -6.013 -0.086 340 HG3 LYS 11 HG3 LYS 11 40.326 -5.798 -0.531 341 HD2 LYS 11 HD2 LYS 11 38.120 -3.880 -1.270 342 HD3 LYS 11 HD3 LYS 11 39.137 -3.705 0.155 343 HE2 LYS 11 HE2 LYS 11 40.224 -3.807 -2.655 344 HE3 LYS 11 HE3 LYS 11 39.794 -2.307 -1.837 345 HZ1 LYS 11 HZ1 LYS 11 41.821 -4.270 -0.954 346 HZ2 LYS 11 HZ2 LYS 11 41.383 -2.874 -0.103 347 HZ3 LYS 11 HZ3 LYS 11 42.122 -2.744 -1.618 348 H THR 12 H THR 12 37.036 -7.078 0.183 349 HA THR 12 HA THR 12 34.404 -6.358 -0.986 350 HB THR 12 HB THR 12 35.010 -7.803 1.608 351 HG1 THR 12 HG1 THR 12 34.986 -9.366 0.157 352 HG21 THR 12 HG21 THR 12 32.324 -6.993 0.482 353 HG22 THR 12 HG22 THR 12 33.066 -6.338 1.941 354 HG23 THR 12 HG23 THR 12 32.567 -8.030 1.884 355 H ILE 13 H ILE 13 33.736 -4.426 -0.549 356 HA ILE 13 HA ILE 13 35.090 -2.721 1.434 357 HB ILE 13 HB ILE 13 32.769 -1.805 -0.204 358 HG12 ILE 13 HG12 ILE 13 34.001 -2.846 -1.961 359 HG13 ILE 13 HG13 ILE 13 34.232 -1.111 -2.085 360 HG21 ILE 13 HG21 ILE 13 33.751 -0.339 1.466 361 HG22 ILE 13 HG22 ILE 13 33.884 0.341 -0.154 362 HG23 ILE 13 HG23 ILE 13 35.297 -0.387 0.615 363 HD11 ILE 13 HD11 ILE 13 36.285 -2.395 -2.565 364 HD12 ILE 13 HD12 ILE 13 36.223 -3.059 -0.936 365 HD13 ILE 13 HD13 ILE 13 36.479 -1.329 -1.166 366 H THR 14 H THR 14 34.175 -2.367 3.375 367 HA THR 14 HA THR 14 31.325 -3.047 3.790 368 HB THR 14 HB THR 14 33.503 -2.470 5.819 369 HG1 THR 14 HG1 THR 14 33.789 -4.484 4.854 370 HG21 THR 14 HG21 THR 14 31.242 -1.845 6.631 371 HG22 THR 14 HG22 THR 14 31.919 -3.213 7.515 372 HG23 THR 14 HG23 THR 14 30.691 -3.482 6.280 373 H LEU 15 H LEU 15 29.898 -1.499 4.017 374 HA LEU 15 HA LEU 15 30.801 1.272 4.510 375 HB2 LEU 15 HB2 LEU 15 28.551 0.343 2.728 376 HB3 LEU 15 HB3 LEU 15 28.929 2.028 3.065 377 HG LEU 15 HG LEU 15 30.823 0.095 1.710 378 HD11 LEU 15 HD11 LEU 15 29.160 2.287 0.477 379 HD12 LEU 15 HD12 LEU 15 28.732 0.576 0.413 380 HD13 LEU 15 HD13 LEU 15 30.216 1.155 -0.364 381 HD21 LEU 15 HD21 LEU 15 30.981 2.953 2.526 382 HD22 LEU 15 HD22 LEU 15 31.690 2.504 0.971 383 HD23 LEU 15 HD23 LEU 15 32.248 1.724 2.451 384 H GLU 16 H GLU 16 29.702 2.473 5.901 385 HA GLU 16 HA GLU 16 27.402 1.360 7.366 386 HB2 GLU 16 HB2 GLU 16 29.271 2.222 8.722 387 HB3 GLU 16 HB3 GLU 16 29.160 3.778 7.906 388 HG2 GLU 16 HG2 GLU 16 28.119 3.880 10.107 389 HG3 GLU 16 HG3 GLU 16 26.929 4.125 8.833 390 H VAL 17 H VAL 17 25.535 1.814 6.489 391 HA VAL 17 HA VAL 17 25.073 4.454 5.266 392 HB VAL 17 HB VAL 17 23.842 3.438 3.447 393 HG11 VAL 17 HG11 VAL 17 26.326 3.865 3.278 394 HG12 VAL 17 HG12 VAL 17 25.647 2.724 2.109 395 HG13 VAL 17 HG13 VAL 17 26.534 2.123 3.512 396 HG21 VAL 17 HG21 VAL 17 24.727 0.754 4.484 397 HG22 VAL 17 HG22 VAL 17 23.788 1.059 3.020 398 HG23 VAL 17 HG23 VAL 17 23.094 1.412 4.605 399 H GLU 18 H GLU 18 22.739 4.734 4.741 400 HA GLU 18 HA GLU 18 20.854 3.490 6.648 401 HB2 GLU 18 HB2 GLU 18 20.841 6.283 5.455 402 HB3 GLU 18 HB3 GLU 18 19.555 5.616 6.452 403 HG2 GLU 18 HG2 GLU 18 22.399 6.118 7.310 404 HG3 GLU 18 HG3 GLU 18 20.994 7.066 7.772 405 H SER 19 H SER 19 18.780 2.985 5.761 406 HA SER 19 HA SER 19 18.654 2.066 3.112 407 HB2 SER 19 HB2 SER 19 16.322 2.823 4.895 408 HB3 SER 19 HB3 SER 19 16.235 1.816 3.447 409 HG SER 19 HG SER 19 16.594 0.893 5.786 410 H SER 20 H SER 20 17.842 5.144 4.475 411 HA SER 20 HA SER 20 16.491 6.268 2.247 412 HB2 SER 20 HB2 SER 20 16.886 8.446 3.451 413 HB3 SER 20 HB3 SER 20 16.032 7.207 4.372 414 HG SER 20 HG SER 20 18.693 8.113 4.649 415 H ASP 21 H ASP 21 19.801 5.666 2.656 416 HA ASP 21 HA ASP 21 20.914 7.904 1.321 417 HB2 ASP 21 HB2 ASP 21 21.902 5.070 1.594 418 HB3 ASP 21 HB3 ASP 21 22.840 6.335 0.805 419 H THR 22 H THR 22 20.972 8.504 -0.664 420 HA THR 22 HA THR 22 19.706 7.092 -2.810 421 HB THR 22 HB THR 22 20.555 8.832 -4.265 422 HG1 THR 22 HG1 THR 22 22.116 10.267 -3.629 423 HG21 THR 22 HG21 THR 22 19.664 9.975 -1.618 424 HG22 THR 22 HG22 THR 22 18.621 9.462 -2.944 425 HG23 THR 22 HG23 THR 22 19.681 10.857 -3.144 426 H ILE 23 H ILE 23 20.741 6.166 -4.651 427 HA ILE 23 HA ILE 23 22.956 4.505 -4.168 428 HB ILE 23 HB ILE 23 21.744 5.419 -6.754 429 HG12 ILE 23 HG12 ILE 23 20.159 4.267 -5.407 430 HG13 ILE 23 HG13 ILE 23 20.629 3.208 -6.731 431 HG21 ILE 23 HG21 ILE 23 22.765 3.448 -7.837 432 HG22 ILE 23 HG22 ILE 23 23.710 3.168 -6.368 433 HG23 ILE 23 HG23 ILE 23 23.936 4.651 -7.297 434 HD11 ILE 23 HD11 ILE 23 20.467 1.846 -4.807 435 HD12 ILE 23 HD12 ILE 23 21.358 3.003 -3.817 436 HD13 ILE 23 HD13 ILE 23 22.199 2.080 -5.064 437 H ASP 24 H ASP 24 22.740 7.631 -5.752 438 HA ASP 24 HA ASP 24 25.391 7.963 -6.586 439 HB2 ASP 24 HB2 ASP 24 23.573 9.472 -7.254 440 HB3 ASP 24 HB3 ASP 24 23.430 10.042 -5.588 441 H ASN 25 H ASN 25 23.877 8.627 -3.478 442 HA ASN 25 HA ASN 25 26.076 9.769 -2.134 443 HB2 ASN 25 HB2 ASN 25 23.807 9.993 -1.318 444 HB3 ASN 25 HB3 ASN 25 23.675 8.250 -1.113 445 HD21 ASN 25 HD21 ASN 25 23.659 7.757 0.875 446 HD22 ASN 25 HD22 ASN 25 24.636 8.419 2.136 447 H VAL 26 H VAL 26 25.003 6.412 -2.436 448 HA VAL 26 HA VAL 26 26.924 5.202 -0.748 449 HB VAL 26 HB VAL 26 25.372 4.116 -3.101 450 HG11 VAL 26 HG11 VAL 26 25.928 1.847 -2.214 451 HG12 VAL 26 HG12 VAL 26 27.114 2.598 -1.144 452 HG13 VAL 26 HG13 VAL 26 27.322 2.685 -2.895 453 HG21 VAL 26 HG21 VAL 26 24.959 3.212 -0.307 454 HG22 VAL 26 HG22 VAL 26 23.787 3.468 -1.605 455 HG23 VAL 26 HG23 VAL 26 24.431 4.848 -0.713 456 H LYS 27 H LYS 27 26.933 5.752 -4.264 457 HA LYS 27 HA LYS 27 29.422 4.618 -4.854 458 HB2 LYS 27 HB2 LYS 27 27.919 6.856 -6.225 459 HB3 LYS 27 HB3 LYS 27 29.368 6.094 -6.886 460 HG2 LYS 27 HG2 LYS 27 28.250 3.919 -6.871 461 HG3 LYS 27 HG3 LYS 27 26.789 4.670 -6.217 462 HD2 LYS 27 HD2 LYS 27 26.567 6.038 -8.210 463 HD3 LYS 27 HD3 LYS 27 28.068 5.366 -8.871 464 HE2 LYS 27 HE2 LYS 27 27.075 3.151 -8.926 465 HE3 LYS 27 HE3 LYS 27 25.577 3.762 -8.206 466 HZ1 LYS 27 HZ1 LYS 27 26.729 4.565 -10.814 467 HZ2 LYS 27 HZ2 LYS 27 25.288 5.157 -10.151 468 HZ3 LYS 27 HZ3 LYS 27 25.410 3.529 -10.595 469 H SER 28 H SER 28 28.600 7.873 -3.827 470 HA SER 28 HA SER 28 31.168 9.040 -3.884 471 HB2 SER 28 HB2 SER 28 29.073 10.342 -3.621 472 HB3 SER 28 HB3 SER 28 28.889 9.671 -1.993 473 HG SER 28 HG SER 28 30.087 11.333 -1.448 474 H LYS 29 H LYS 29 29.496 7.201 -1.371 475 HA LYS 29 HA LYS 29 31.483 7.316 0.635 476 HB2 LYS 29 HB2 LYS 29 29.407 5.193 0.081 477 HB3 LYS 29 HB3 LYS 29 30.437 5.211 1.506 478 HG2 LYS 29 HG2 LYS 29 29.481 7.360 2.186 479 HG3 LYS 29 HG3 LYS 29 28.450 7.353 0.745 480 HD2 LYS 29 HD2 LYS 29 27.449 5.223 1.504 481 HD3 LYS 29 HD3 LYS 29 28.434 5.304 2.962 482 HE2 LYS 29 HE2 LYS 29 26.436 7.416 2.181 483 HE3 LYS 29 HE3 LYS 29 26.050 6.059 3.237 484 HZ1 LYS 29 HZ1 LYS 29 26.582 8.025 4.491 485 HZ2 LYS 29 HZ2 LYS 29 28.091 8.145 3.732 486 HZ3 LYS 29 HZ3 LYS 29 27.758 6.836 4.753 487 H ILE 30 H ILE 30 31.078 5.188 -2.133 488 HA ILE 30 HA ILE 30 33.195 3.374 -1.552 489 HB ILE 30 HB ILE 30 31.790 4.080 -4.112 490 HG12 ILE 30 HG12 ILE 30 31.715 1.608 -2.381 491 HG13 ILE 30 HG13 ILE 30 30.531 2.902 -2.344 492 HG21 ILE 30 HG21 ILE 30 34.192 3.294 -4.487 493 HG22 ILE 30 HG22 ILE 30 32.921 2.410 -5.328 494 HG23 ILE 30 HG23 ILE 30 33.656 1.729 -3.876 495 HD11 ILE 30 HD11 ILE 30 29.610 1.090 -3.595 496 HD12 ILE 30 HD12 ILE 30 31.056 0.975 -4.599 497 HD13 ILE 30 HD13 ILE 30 29.995 2.380 -4.735 498 H GLN 31 H GLN 31 33.006 6.318 -3.512 499 HA GLN 31 HA GLN 31 35.672 6.478 -4.365 500 HB2 GLN 31 HB2 GLN 31 33.822 7.900 -5.190 501 HB3 GLN 31 HB3 GLN 31 33.793 8.736 -3.637 502 HG2 GLN 31 HG2 GLN 31 36.103 9.481 -3.989 503 HG3 GLN 31 HG3 GLN 31 36.124 8.661 -5.552 504 HE21 GLN 31 HE21 GLN 31 36.476 10.492 -6.693 505 HE22 GLN 31 HE22 GLN 31 35.290 11.728 -6.915 506 H ASP 32 H ASP 32 34.143 7.445 -1.360 507 HA ASP 32 HA ASP 32 36.369 8.727 -0.196 508 HB2 ASP 32 HB2 ASP 32 33.814 7.661 0.944 509 HB3 ASP 32 HB3 ASP 32 35.070 8.349 1.976 510 H LYS 33 H LYS 33 35.600 5.354 -0.394 511 HA LYS 33 HA LYS 33 37.721 4.761 1.545 512 HB2 LYS 33 HB2 LYS 33 35.549 3.037 0.405 513 HB3 LYS 33 HB3 LYS 33 36.933 2.351 1.259 514 HG2 LYS 33 HG2 LYS 33 36.305 4.044 3.128 515 HG3 LYS 33 HG3 LYS 33 34.737 4.094 2.317 516 HD2 LYS 33 HD2 LYS 33 34.614 2.434 4.058 517 HD3 LYS 33 HD3 LYS 33 34.644 1.598 2.502 518 HE2 LYS 33 HE2 LYS 33 37.038 1.156 2.768 519 HE3 LYS 33 HE3 LYS 33 37.035 2.021 4.304 520 HZ1 LYS 33 HZ1 LYS 33 35.538 0.378 5.189 521 HZ2 LYS 33 HZ2 LYS 33 36.952 -0.351 4.614 522 HZ3 LYS 33 HZ3 LYS 33 35.525 -0.446 3.711 523 H GLU 34 H GLU 34 36.929 4.235 -1.833 524 HA GLU 34 HA GLU 34 39.381 2.655 -2.169 525 HB2 GLU 34 HB2 GLU 34 36.867 2.792 -3.820 526 HB3 GLU 34 HB3 GLU 34 38.321 1.947 -4.336 527 HG2 GLU 34 HG2 GLU 34 36.792 1.377 -1.799 528 HG3 GLU 34 HG3 GLU 34 36.711 0.425 -3.278 529 H GLY 35 H GLY 35 37.854 5.563 -3.271 530 HA2 GLY 35 HA2 GLY 35 38.950 7.418 -4.257 531 HA3 GLY 35 HA3 GLY 35 40.263 6.359 -4.751 532 H ILE 36 H ILE 36 37.457 4.813 -5.479 533 HA ILE 36 HA ILE 36 37.718 5.137 -8.305 534 HB ILE 36 HB ILE 36 35.483 3.780 -6.783 535 HG12 ILE 36 HG12 ILE 36 37.949 2.549 -8.035 536 HG13 ILE 36 HG13 ILE 36 37.794 2.900 -6.316 537 HG21 ILE 36 HG21 ILE 36 35.053 2.588 -8.885 538 HG22 ILE 36 HG22 ILE 36 36.360 3.481 -9.668 539 HG23 ILE 36 HG23 ILE 36 34.915 4.332 -9.121 540 HD11 ILE 36 HD11 ILE 36 36.305 0.848 -7.939 541 HD12 ILE 36 HD12 ILE 36 35.747 1.379 -6.349 542 HD13 ILE 36 HD13 ILE 36 37.324 0.613 -6.516 543 HA PRO 37 HA PRO 37 35.153 8.795 -8.794 544 HB2 PRO 37 HB2 PRO 37 35.232 7.681 -11.577 545 HB3 PRO 37 HB3 PRO 37 35.446 9.356 -11.041 546 HG2 PRO 37 HG2 PRO 37 37.618 7.952 -11.691 547 HG3 PRO 37 HG3 PRO 37 37.642 8.915 -10.195 548 HD2 PRO 37 HD2 PRO 37 37.195 5.948 -10.514 549 HD3 PRO 37 HD3 PRO 37 38.192 6.801 -9.321 550 HA PRO 38 HA PRO 38 31.226 6.687 -8.333 551 HB2 PRO 38 HB2 PRO 38 30.286 9.461 -8.919 552 HB3 PRO 38 HB3 PRO 38 29.749 8.345 -7.649 553 HG2 PRO 38 HG2 PRO 38 31.428 10.309 -6.983 554 HG3 PRO 38 HG3 PRO 38 31.760 8.665 -6.383 555 HD2 PRO 38 HD2 PRO 38 33.022 10.105 -8.717 556 HD3 PRO 38 HD3 PRO 38 33.798 9.121 -7.465 557 H ASP 39 H ASP 39 31.757 8.944 -10.980 558 HA ASP 39 HA ASP 39 29.616 7.972 -12.612 559 HB2 ASP 39 HB2 ASP 39 30.521 9.544 -14.292 560 HB3 ASP 39 HB3 ASP 39 30.218 10.283 -12.733 561 H GLN 40 H GLN 40 32.074 6.248 -11.834 562 HA GLN 40 HA GLN 40 32.245 4.915 -14.443 563 HB2 GLN 40 HB2 GLN 40 34.365 6.118 -13.736 564 HB3 GLN 40 HB3 GLN 40 34.458 4.953 -12.413 565 HG2 GLN 40 HG2 GLN 40 34.295 3.151 -14.224 566 HG3 GLN 40 HG3 GLN 40 34.684 4.435 -15.368 567 HE21 GLN 40 HE21 GLN 40 35.980 4.313 -12.121 568 HE22 GLN 40 HE22 GLN 40 37.608 3.958 -12.578 569 H GLN 41 H GLN 41 30.935 4.689 -11.553 570 HA GLN 41 HA GLN 41 31.407 1.867 -11.024 571 HB2 GLN 41 HB2 GLN 41 29.836 3.974 -9.514 572 HB3 GLN 41 HB3 GLN 41 30.165 2.344 -8.932 573 HG2 GLN 41 HG2 GLN 41 32.570 2.859 -8.874 574 HG3 GLN 41 HG3 GLN 41 32.222 4.494 -9.456 575 HE21 GLN 41 HE21 GLN 41 32.839 5.631 -7.703 576 HE22 GLN 41 HE22 GLN 41 32.095 5.517 -6.148 577 H ARG 42 H ARG 42 29.971 0.392 -11.546 578 HA ARG 42 HA ARG 42 27.131 1.112 -11.964 579 HB2 ARG 42 HB2 ARG 42 28.783 -1.011 -13.360 580 HB3 ARG 42 HB3 ARG 42 27.026 -0.901 -13.496 581 HG2 ARG 42 HG2 ARG 42 27.191 1.260 -14.543 582 HG3 ARG 42 HG3 ARG 42 28.927 1.318 -14.244 583 HD2 ARG 42 HD2 ARG 42 28.630 0.754 -16.529 584 HD3 ARG 42 HD3 ARG 42 29.157 -0.714 -15.709 585 HE ARG 42 HE ARG 42 26.325 -0.609 -15.840 586 HH11 ARG 42 HH11 ARG 42 29.101 -1.170 -17.900 587 HH12 ARG 42 HH12 ARG 42 28.213 -2.136 -19.031 588 HH21 ARG 42 HH21 ARG 42 25.173 -1.819 -17.392 589 HH22 ARG 42 HH22 ARG 42 26.013 -2.500 -18.745 590 H LEU 43 H LEU 43 26.115 0.501 -10.200 591 HA LEU 43 HA LEU 43 27.054 -1.809 -8.656 592 HB2 LEU 43 HB2 LEU 43 25.053 0.334 -7.954 593 HB3 LEU 43 HB3 LEU 43 25.507 -0.988 -6.891 594 HG LEU 43 HG LEU 43 27.336 1.208 -7.888 595 HD11 LEU 43 HD11 LEU 43 25.661 1.864 -6.178 596 HD12 LEU 43 HD12 LEU 43 27.322 1.952 -5.582 597 HD13 LEU 43 HD13 LEU 43 26.290 0.596 -5.122 598 HD21 LEU 43 HD21 LEU 43 28.906 0.216 -6.152 599 HD22 LEU 43 HD22 LEU 43 28.710 -0.726 -7.635 600 HD23 LEU 43 HD23 LEU 43 27.868 -1.210 -6.159 601 H ILE 44 H ILE 44 25.948 -3.578 -8.297 602 HA ILE 44 HA ILE 44 23.300 -3.910 -9.573 603 HB ILE 44 HB ILE 44 25.635 -5.824 -9.503 604 HG12 ILE 44 HG12 ILE 44 25.101 -5.946 -11.989 605 HG13 ILE 44 HG13 ILE 44 24.088 -4.533 -11.738 606 HG21 ILE 44 HG21 ILE 44 23.402 -6.971 -9.022 607 HG22 ILE 44 HG22 ILE 44 24.357 -7.604 -10.362 608 HG23 ILE 44 HG23 ILE 44 22.968 -6.564 -10.680 609 HD11 ILE 44 HD11 ILE 44 26.261 -3.902 -12.628 610 HD12 ILE 44 HD12 ILE 44 27.066 -4.690 -11.271 611 HD13 ILE 44 HD13 ILE 44 26.059 -3.269 -10.996 612 H PHE 45 H PHE 45 21.776 -4.810 -8.427 613 HA PHE 45 HA PHE 45 22.313 -6.648 -6.253 614 HB2 PHE 45 HB2 PHE 45 22.290 -4.457 -5.075 615 HB3 PHE 45 HB3 PHE 45 20.682 -4.137 -5.749 616 HD1 PHE 45 HD1 PHE 45 22.549 -6.556 -3.614 617 HD2 PHE 45 HD2 PHE 45 18.758 -4.894 -4.678 618 HE1 PHE 45 HE1 PHE 45 21.487 -7.794 -1.757 619 HE2 PHE 45 HE2 PHE 45 17.693 -6.119 -2.809 620 HZ PHE 45 HZ PHE 45 19.061 -7.576 -1.357 621 H ALA 46 H ALA 46 20.943 -8.239 -6.394 622 HA ALA 46 HA ALA 46 19.222 -9.587 -6.982 623 HB1 ALA 46 HB1 ALA 46 17.954 -8.380 -5.390 624 HB2 ALA 46 HB2 ALA 46 16.913 -8.573 -6.799 625 HB3 ALA 46 HB3 ALA 46 17.711 -7.030 -6.499 626 H GLY 47 H GLY 47 20.736 -8.677 -9.061 627 HA2 GLY 47 HA2 GLY 47 20.881 -8.799 -11.351 628 HA3 GLY 47 HA3 GLY 47 19.241 -9.418 -11.351 629 H LYS 48 H LYS 48 20.112 -6.296 -10.073 630 HA LYS 48 HA LYS 48 18.880 -4.888 -12.363 631 HB2 LYS 48 HB2 LYS 48 18.269 -4.733 -9.432 632 HB3 LYS 48 HB3 LYS 48 18.156 -3.259 -10.391 633 HG2 LYS 48 HG2 LYS 48 16.557 -4.343 -11.895 634 HG3 LYS 48 HG3 LYS 48 16.682 -5.830 -10.956 635 HD2 LYS 48 HD2 LYS 48 15.509 -3.189 -10.106 636 HD3 LYS 48 HD3 LYS 48 14.700 -4.746 -10.238 637 HE2 LYS 48 HE2 LYS 48 16.820 -4.011 -8.205 638 HE3 LYS 48 HE3 LYS 48 15.087 -4.168 -7.901 639 HZ1 LYS 48 HZ1 LYS 48 16.913 -6.326 -8.760 640 HZ2 LYS 48 HZ2 LYS 48 15.241 -6.488 -8.566 641 HZ3 LYS 48 HZ3 LYS 48 16.218 -6.145 -7.229 642 H GLN 49 H GLN 49 19.986 -3.156 -13.052 643 HA GLN 49 HA GLN 49 22.432 -2.304 -11.730 644 HB2 GLN 49 HB2 GLN 49 21.032 -1.084 -14.130 645 HB3 GLN 49 HB3 GLN 49 22.676 -0.738 -13.594 646 HG2 GLN 49 HG2 GLN 49 23.120 -3.238 -13.913 647 HG3 GLN 49 HG3 GLN 49 21.607 -3.263 -14.824 648 HE21 GLN 49 HE21 GLN 49 22.388 -3.613 -16.811 649 HE22 GLN 49 HE22 GLN 49 23.440 -2.542 -17.665 650 H LEU 50 H LEU 50 22.648 -0.608 -10.435 651 HA LEU 50 HA LEU 50 20.216 0.570 -9.413 652 HB2 LEU 50 HB2 LEU 50 23.056 0.990 -8.479 653 HB3 LEU 50 HB3 LEU 50 21.584 1.382 -7.593 654 HG LEU 50 HG LEU 50 22.588 -1.367 -8.326 655 HD11 LEU 50 HD11 LEU 50 23.635 -0.128 -6.409 656 HD12 LEU 50 HD12 LEU 50 22.932 -1.699 -6.016 657 HD13 LEU 50 HD13 LEU 50 22.067 -0.218 -5.606 658 HD21 LEU 50 HD21 LEU 50 20.295 -1.727 -8.488 659 HD22 LEU 50 HD22 LEU 50 19.926 -0.540 -7.237 660 HD23 LEU 50 HD23 LEU 50 20.635 -2.096 -6.794 661 H GLU 51 H GLU 51 19.579 2.592 -9.460 662 HA GLU 51 HA GLU 51 20.693 4.282 -11.572 663 HB2 GLU 51 HB2 GLU 51 17.992 4.196 -10.232 664 HB3 GLU 51 HB3 GLU 51 18.419 5.365 -11.473 665 HG2 GLU 51 HG2 GLU 51 18.261 2.363 -11.794 666 HG3 GLU 51 HG3 GLU 51 17.103 3.544 -12.402 667 H ASP 52 H ASP 52 21.445 6.278 -11.158 668 HA ASP 52 HA ASP 52 22.498 6.858 -8.668 669 HB2 ASP 52 HB2 ASP 52 22.021 8.600 -11.059 670 HB3 ASP 52 HB3 ASP 52 22.806 9.233 -9.610 671 H GLY 53 H GLY 53 19.590 8.273 -10.094 672 HA2 GLY 53 HA2 GLY 53 19.027 9.991 -7.854 673 HA3 GLY 53 HA3 GLY 53 18.029 9.763 -9.274 674 H ARG 54 H ARG 54 18.706 6.763 -7.911 675 HA ARG 54 HA ARG 54 16.155 6.727 -6.433 676 HB2 ARG 54 HB2 ARG 54 17.822 4.371 -7.328 677 HB3 ARG 54 HB3 ARG 54 16.202 4.302 -6.657 678 HG2 ARG 54 HG2 ARG 54 16.967 5.496 -9.324 679 HG3 ARG 54 HG3 ARG 54 16.240 3.920 -9.087 680 HD2 ARG 54 HD2 ARG 54 14.919 6.515 -8.296 681 HD3 ARG 54 HD3 ARG 54 14.675 5.727 -9.857 682 HE ARG 54 HE ARG 54 14.145 4.131 -7.500 683 HH11 ARG 54 HH11 ARG 54 12.703 6.117 -10.029 684 HH12 ARG 54 HH12 ARG 54 11.105 5.537 -9.696 685 HH21 ARG 54 HH21 ARG 54 12.039 3.585 -6.977 686 HH22 ARG 54 HH22 ARG 54 10.729 4.122 -7.974 687 H THR 55 H THR 55 16.412 4.818 -4.646 688 HA THR 55 HA THR 55 18.800 5.465 -3.042 689 HB THR 55 HB THR 55 17.389 5.460 -1.001 690 HG1 THR 55 HG1 THR 55 15.230 5.247 -1.124 691 HG21 THR 55 HG21 THR 55 17.817 7.649 -1.623 692 HG22 THR 55 HG22 THR 55 16.055 7.640 -1.632 693 HG23 THR 55 HG23 THR 55 16.945 7.508 -3.150 694 H LEU 56 H LEU 56 18.917 3.931 -1.079 695 HA LEU 56 HA LEU 56 19.187 1.279 -1.996 696 HB2 LEU 56 HB2 LEU 56 19.130 2.383 0.802 697 HB3 LEU 56 HB3 LEU 56 19.561 0.712 0.432 698 HG LEU 56 HG LEU 56 21.015 3.190 -0.538 699 HD11 LEU 56 HD11 LEU 56 21.229 2.666 1.886 700 HD12 LEU 56 HD12 LEU 56 22.753 2.528 1.002 701 HD13 LEU 56 HD13 LEU 56 21.853 1.078 1.442 702 HD21 LEU 56 HD21 LEU 56 21.340 1.494 -2.204 703 HD22 LEU 56 HD22 LEU 56 21.560 0.252 -0.961 704 HD23 LEU 56 HD23 LEU 56 22.786 1.506 -1.183 705 H SER 57 H SER 57 16.688 2.820 -0.091 706 HA SER 57 HA SER 57 15.132 0.551 0.553 707 HB2 SER 57 HB2 SER 57 13.314 2.190 0.997 708 HB3 SER 57 HB3 SER 57 14.837 2.655 1.750 709 HG SER 57 HG SER 57 13.833 3.656 -0.710 710 H ASP 58 H ASP 58 15.362 2.478 -2.334 711 HA ASP 58 HA ASP 58 12.859 1.658 -3.488 712 HB2 ASP 58 HB2 ASP 58 15.269 3.041 -4.661 713 HB3 ASP 58 HB3 ASP 58 13.812 2.691 -5.582 714 H TYR 59 H TYR 59 15.630 -0.042 -2.979 715 HA TYR 59 HA TYR 59 15.090 -1.870 -5.234 716 HB2 TYR 59 HB2 TYR 59 17.701 -0.910 -4.104 717 HB3 TYR 59 HB3 TYR 59 17.592 -2.433 -4.984 718 HD1 TYR 59 HD1 TYR 59 16.493 -2.312 -7.337 719 HD2 TYR 59 HD2 TYR 59 18.096 1.051 -5.267 720 HE1 TYR 59 HE1 TYR 59 16.856 -1.172 -9.488 721 HE2 TYR 59 HE2 TYR 59 18.471 2.200 -7.410 722 HH TYR 59 HH TYR 59 18.437 1.987 -9.622 723 H ASN 60 H ASN 60 14.862 -1.498 -2.018 724 HA ASN 60 HA ASN 60 14.520 -2.823 -0.237 725 HB2 ASN 60 HB2 ASN 60 13.249 -4.149 -1.976 726 HB3 ASN 60 HB3 ASN 60 14.647 -5.217 -2.056 727 HD21 ASN 60 HD21 ASN 60 13.546 -6.974 -1.281 728 HD22 ASN 60 HD22 ASN 60 13.028 -7.111 0.359 729 H ILE 61 H ILE 61 17.201 -2.194 -1.239 730 HA ILE 61 HA ILE 61 19.007 -4.240 -0.330 731 HB ILE 61 HB ILE 61 19.445 -1.281 -0.796 732 HG12 ILE 61 HG12 ILE 61 20.093 -3.673 -2.523 733 HG13 ILE 61 HG13 ILE 61 18.734 -2.586 -2.778 734 HG21 ILE 61 HG21 ILE 61 21.133 -2.158 0.732 735 HG22 ILE 61 HG22 ILE 61 21.866 -1.801 -0.839 736 HG23 ILE 61 HG23 ILE 61 21.491 -3.471 -0.386 737 HD11 ILE 61 HD11 ILE 61 21.651 -1.806 -2.943 738 HD12 ILE 61 HD12 ILE 61 20.265 -0.765 -3.290 739 HD13 ILE 61 HD13 ILE 61 20.597 -2.163 -4.316 740 H GLN 62 H GLN 62 18.877 -4.862 1.699 741 HA GLN 62 HA GLN 62 18.378 -2.880 3.803 742 HB2 GLN 62 HB2 GLN 62 18.035 -5.882 3.827 743 HB3 GLN 62 HB3 GLN 62 17.660 -4.811 5.169 744 HG2 GLN 62 HG2 GLN 62 15.990 -3.674 3.683 745 HG3 GLN 62 HG3 GLN 62 16.283 -4.936 2.487 746 HE21 GLN 62 HE21 GLN 62 16.663 -6.886 4.778 747 HE22 GLN 62 HE22 GLN 62 15.053 -7.277 5.266 748 H LYS 63 H LYS 63 19.295 -4.136 6.020 749 HA LYS 63 HA LYS 63 22.085 -3.656 5.936 750 HB2 LYS 63 HB2 LYS 63 22.149 -4.405 8.230 751 HB3 LYS 63 HB3 LYS 63 20.689 -3.460 7.991 752 HG2 LYS 63 HG2 LYS 63 19.384 -5.546 7.819 753 HG3 LYS 63 HG3 LYS 63 20.859 -6.470 8.135 754 HD2 LYS 63 HD2 LYS 63 21.104 -5.296 10.291 755 HD3 LYS 63 HD3 LYS 63 19.589 -4.441 9.976 756 HE2 LYS 63 HE2 LYS 63 18.455 -6.671 9.814 757 HE3 LYS 63 HE3 LYS 63 19.964 -7.413 10.364 758 HZ1 LYS 63 HZ1 LYS 63 18.391 -5.379 11.824 759 HZ2 LYS 63 HZ2 LYS 63 19.852 -6.053 12.347 760 HZ3 LYS 63 HZ3 LYS 63 18.477 -7.027 12.199 761 H GLU 64 H GLU 64 23.803 -4.977 5.787 762 HA GLU 64 HA GLU 64 25.110 -6.829 5.516 763 HB2 GLU 64 HB2 GLU 64 22.795 -7.923 6.793 764 HB3 GLU 64 HB3 GLU 64 23.341 -9.043 5.554 765 HG2 GLU 64 HG2 GLU 64 24.312 -9.505 7.756 766 HG3 GLU 64 HG3 GLU 64 25.535 -9.138 6.540 767 H SER 65 H SER 65 22.901 -5.811 3.406 768 HA SER 65 HA SER 65 22.868 -7.892 1.428 769 HB2 SER 65 HB2 SER 65 22.507 -4.895 1.161 770 HB3 SER 65 HB3 SER 65 22.247 -6.040 -0.156 771 HG SER 65 HG SER 65 20.891 -6.821 2.041 772 H THR 66 H THR 66 24.230 -8.245 -0.269 773 HA THR 66 HA THR 66 26.541 -6.437 -0.462 774 HB THR 66 HB THR 66 28.103 -8.015 -0.596 775 HG1 THR 66 HG1 THR 66 27.966 -9.275 -2.238 776 HG21 THR 66 HG21 THR 66 26.225 -8.829 1.275 777 HG22 THR 66 HG22 THR 66 27.895 -9.388 1.160 778 HG23 THR 66 HG23 THR 66 26.602 -10.293 0.369 779 H LEU 67 H LEU 67 26.999 -5.586 -2.220 780 HA LEU 67 HA LEU 67 25.432 -6.090 -4.670 781 HB2 LEU 67 HB2 LEU 67 26.825 -3.663 -3.519 782 HB3 LEU 67 HB3 LEU 67 26.277 -3.705 -5.183 783 HG LEU 67 HG LEU 67 23.947 -3.899 -4.416 784 HD11 LEU 67 HD11 LEU 67 24.394 -5.014 -2.197 785 HD12 LEU 67 HD12 LEU 67 23.283 -3.644 -2.128 786 HD13 LEU 67 HD13 LEU 67 24.958 -3.450 -1.606 787 HD21 LEU 67 HD21 LEU 67 24.914 -1.720 -4.826 788 HD22 LEU 67 HD22 LEU 67 25.527 -1.660 -3.172 789 HD23 LEU 67 HD23 LEU 67 23.785 -1.634 -3.468 790 H HIS 68 H HIS 68 26.637 -5.661 -6.657 791 HA HIS 68 HA HIS 68 29.517 -6.274 -6.450 792 HB2 HIS 68 HB2 HIS 68 27.470 -7.177 -8.470 793 HB3 HIS 68 HB3 HIS 68 29.201 -7.196 -8.843 794 HD1 HIS 68 HD1 HIS 68 26.751 -8.868 -6.473 795 HD2 HIS 68 HD2 HIS 68 30.662 -9.060 -7.743 796 HE1 HIS 68 HE1 HIS 68 27.671 -11.045 -5.548 797 HE2 HIS 68 HE2 HIS 68 30.112 -11.032 -6.240 798 H LEU 69 H LEU 69 30.918 -5.286 -7.766 799 HA LEU 69 HA LEU 69 30.024 -2.787 -9.070 800 HB2 LEU 69 HB2 LEU 69 31.353 -2.359 -7.075 801 HB3 LEU 69 HB3 LEU 69 32.601 -3.467 -7.628 802 HG LEU 69 HG LEU 69 33.031 -1.960 -9.558 803 HD11 LEU 69 HD11 LEU 69 31.205 -0.031 -8.129 804 HD12 LEU 69 HD12 LEU 69 30.823 -0.852 -9.644 805 HD13 LEU 69 HD13 LEU 69 32.170 0.295 -9.571 806 HD21 LEU 69 HD21 LEU 69 34.514 -1.779 -7.730 807 HD22 LEU 69 HD22 LEU 69 33.333 -0.892 -6.767 808 HD23 LEU 69 HD23 LEU 69 34.076 -0.127 -8.172 809 H VAL 70 H VAL 70 30.379 -2.618 -11.156 810 HA VAL 70 HA VAL 70 32.450 -4.263 -12.459 811 HB VAL 70 HB VAL 70 29.847 -3.126 -13.575 812 HG11 VAL 70 HG11 VAL 70 31.477 -2.906 -15.314 813 HG12 VAL 70 HG12 VAL 70 30.442 -4.277 -15.710 814 HG13 VAL 70 HG13 VAL 70 32.053 -4.552 -15.052 815 HG21 VAL 70 HG21 VAL 70 29.804 -5.269 -12.171 816 HG22 VAL 70 HG22 VAL 70 30.605 -6.032 -13.544 817 HG23 VAL 70 HG23 VAL 70 29.007 -5.311 -13.743 818 H LEU 71 H LEU 71 33.966 -3.096 -13.630 819 HA LEU 71 HA LEU 71 34.011 -0.233 -13.079 820 HB2 LEU 71 HB2 LEU 71 35.941 -2.160 -12.856 821 HB3 LEU 71 HB3 LEU 71 36.325 -1.463 -14.421 822 HG LEU 71 HG LEU 71 36.048 0.787 -13.056 823 HD11 LEU 71 HD11 LEU 71 35.408 -0.469 -11.003 824 HD12 LEU 71 HD12 LEU 71 36.761 0.642 -10.788 825 HD13 LEU 71 HD13 LEU 71 37.059 -1.090 -10.932 826 HD21 LEU 71 HD21 LEU 71 38.532 -0.943 -13.309 827 HD22 LEU 71 HD22 LEU 71 38.595 0.681 -12.621 828 HD23 LEU 71 HD23 LEU 71 38.068 0.450 -14.289 Start of MODEL 7 1 H GLY 12 H GLY 12 5.630 -12.572 -1.810 2 HA2 GLY 12 HA2 GLY 12 7.546 -11.995 0.232 3 HA3 GLY 12 HA3 GLY 12 8.219 -13.055 -0.997 4 HA PRO 13 HA PRO 13 9.026 -9.576 -3.580 5 HB2 PRO 13 HB2 PRO 13 8.180 -10.279 -6.084 6 HB3 PRO 13 HB3 PRO 13 9.650 -10.911 -5.336 7 HG2 PRO 13 HG2 PRO 13 6.967 -12.185 -5.625 8 HG3 PRO 13 HG3 PRO 13 8.576 -12.925 -5.716 9 HD2 PRO 13 HD2 PRO 13 6.938 -13.090 -3.508 10 HD3 PRO 13 HD3 PRO 13 8.706 -13.206 -3.431 11 H MET 14 H MET 14 7.357 -8.386 -2.335 12 HA MET 14 HA MET 14 4.775 -7.985 -3.548 13 HB2 MET 14 HB2 MET 14 6.195 -6.680 -1.215 14 HB3 MET 14 HB3 MET 14 4.595 -6.164 -1.763 15 HG2 MET 14 HG2 MET 14 5.360 -8.939 -0.833 16 HG3 MET 14 HG3 MET 14 4.330 -7.786 0.037 17 HE1 MET 14 HE1 MET 14 1.906 -10.615 -1.096 18 HE2 MET 14 HE2 MET 14 2.773 -9.855 0.240 19 HE3 MET 14 HE3 MET 14 3.634 -10.904 -0.886 20 H LEU 15 H LEU 15 5.173 -7.220 -5.622 21 HA LEU 15 HA LEU 15 6.866 -4.962 -6.135 22 HB2 LEU 15 HB2 LEU 15 5.561 -6.968 -7.671 23 HB3 LEU 15 HB3 LEU 15 4.951 -5.416 -8.246 24 HG LEU 15 HG LEU 15 7.308 -4.619 -8.518 25 HD11 LEU 15 HD11 LEU 15 9.038 -5.778 -7.677 26 HD12 LEU 15 HD12 LEU 15 8.536 -7.231 -8.542 27 HD13 LEU 15 HD13 LEU 15 7.879 -6.885 -6.939 28 HD21 LEU 15 HD21 LEU 15 6.110 -5.545 -10.428 29 HD22 LEU 15 HD22 LEU 15 6.576 -7.180 -9.955 30 HD23 LEU 15 HD23 LEU 15 7.802 -6.036 -10.493 31 H CYS 16 H CYS 16 6.274 -2.840 -6.606 32 HA CYS 16 HA CYS 16 4.416 -1.558 -5.095 33 HB2 CYS 16 HB2 CYS 16 6.266 -0.562 -6.568 34 HB3 CYS 16 HB3 CYS 16 5.048 -0.540 -7.857 35 H SER 17 H SER 17 2.322 -1.134 -5.056 36 HA SER 17 HA SER 17 0.496 -2.563 -6.670 37 HB2 SER 17 HB2 SER 17 -0.009 -0.189 -4.856 38 HB3 SER 17 HB3 SER 17 -1.241 -1.301 -5.466 39 HG SER 17 HG SER 17 0.503 -2.874 -4.436 40 H THR 18 H THR 18 1.771 0.718 -6.860 41 HA THR 18 HA THR 18 -0.161 1.660 -8.742 42 HB THR 18 HB THR 18 1.391 3.563 -9.047 43 HG1 THR 18 HG1 THR 18 3.324 2.270 -8.739 44 HG21 THR 18 HG21 THR 18 0.986 2.723 -6.167 45 HG22 THR 18 HG22 THR 18 -0.226 3.513 -7.175 46 HG23 THR 18 HG23 THR 18 1.252 4.371 -6.735 47 H GLY 19 H GLY 19 2.535 -0.435 -9.109 48 HA2 GLY 19 HA2 GLY 19 3.296 -1.517 -11.017 49 HA3 GLY 19 HA3 GLY 19 2.126 -0.597 -11.954 50 H CYS 20 H CYS 20 4.786 0.574 -9.882 51 HA CYS 20 HA CYS 20 5.631 2.327 -12.017 52 HB2 CYS 20 HB2 CYS 20 7.101 3.351 -10.382 53 HB3 CYS 20 HB3 CYS 20 5.524 3.086 -9.636 54 H GLY 21 H GLY 21 6.542 -0.818 -10.923 55 HA2 GLY 21 HA2 GLY 21 7.971 -2.232 -12.198 56 HA3 GLY 21 HA3 GLY 21 8.778 -0.806 -12.831 57 H PHE 22 H PHE 22 8.462 -0.426 -9.507 58 HA PHE 22 HA PHE 22 11.171 -1.503 -9.061 59 HB2 PHE 22 HB2 PHE 22 9.825 0.957 -7.947 60 HB3 PHE 22 HB3 PHE 22 11.344 0.312 -7.306 61 HD1 PHE 22 HD1 PHE 22 13.356 0.230 -8.697 62 HD2 PHE 22 HD2 PHE 22 9.764 2.090 -10.079 63 HE1 PHE 22 HE1 PHE 22 14.629 1.327 -10.505 64 HE2 PHE 22 HE2 PHE 22 11.031 3.201 -11.885 65 HZ PHE 22 HZ PHE 22 13.466 2.817 -12.101 66 H TYR 23 H TYR 23 11.428 -1.424 -6.401 67 HA TYR 23 HA TYR 23 9.546 -3.480 -5.547 68 HB2 TYR 23 HB2 TYR 23 12.307 -2.704 -4.814 69 HB3 TYR 23 HB3 TYR 23 11.305 -3.351 -3.511 70 HD1 TYR 23 HD1 TYR 23 12.805 -4.039 -6.784 71 HD2 TYR 23 HD2 TYR 23 10.635 -5.679 -3.496 72 HE1 TYR 23 HE1 TYR 23 13.227 -6.305 -7.655 73 HE2 TYR 23 HE2 TYR 23 11.047 -7.959 -4.351 74 HH TYR 23 HH TYR 23 13.318 -8.634 -6.803 75 H GLY 24 H GLY 24 8.149 -3.293 -3.851 76 HA2 GLY 24 HA2 GLY 24 7.825 -0.597 -2.702 77 HA3 GLY 24 HA3 GLY 24 6.571 -1.831 -2.795 78 H ASN 25 H ASN 25 7.834 -0.239 -0.507 79 HA ASN 25 HA ASN 25 8.925 -2.391 1.139 80 HB2 ASN 25 HB2 ASN 25 9.167 0.481 1.091 81 HB3 ASN 25 HB3 ASN 25 8.586 -0.045 2.673 82 HD21 ASN 25 HD21 ASN 25 10.529 0.384 3.770 83 HD22 ASN 25 HD22 ASN 25 11.958 -0.544 3.500 84 HA PRO 26 HA PRO 26 4.764 -3.029 2.821 85 HB2 PRO 26 HB2 PRO 26 5.404 -4.743 4.820 86 HB3 PRO 26 HB3 PRO 26 5.266 -5.237 3.125 87 HG2 PRO 26 HG2 PRO 26 7.710 -4.589 4.725 88 HG3 PRO 26 HG3 PRO 26 7.447 -5.923 3.586 89 HD2 PRO 26 HD2 PRO 26 8.818 -3.685 2.896 90 HD3 PRO 26 HD3 PRO 26 7.818 -4.567 1.727 91 H ARG 27 H ARG 27 7.524 -1.807 4.569 92 HA ARG 27 HA ARG 27 6.188 -1.152 7.005 93 HB2 ARG 27 HB2 ARG 27 8.617 0.154 5.736 94 HB3 ARG 27 HB3 ARG 27 8.117 0.323 7.419 95 HG2 ARG 27 HG2 ARG 27 8.330 -2.162 7.667 96 HG3 ARG 27 HG3 ARG 27 9.005 -2.215 6.041 97 HD2 ARG 27 HD2 ARG 27 10.875 -2.138 7.546 98 HD3 ARG 27 HD3 ARG 27 10.753 -0.555 6.772 99 HE ARG 27 HE ARG 27 9.302 -0.779 8.491 100 HH11 ARG 27 HH11 ARG 27 12.620 -1.118 8.312 101 HH12 ARG 27 HH12 ARG 27 13.240 -0.436 9.779 102 HH21 ARG 27 HH21 ARG 27 10.145 0.522 10.990 103 HH22 ARG 27 HH22 ARG 27 11.852 0.481 11.276 104 H THR 28 H THR 28 6.758 0.538 3.941 105 HA THR 28 HA THR 28 5.455 2.965 4.797 106 HB THR 28 HB THR 28 5.798 3.700 2.476 107 HG1 THR 28 HG1 THR 28 5.552 1.196 1.907 108 HG21 THR 28 HG21 THR 28 8.299 3.299 2.322 109 HG22 THR 28 HG22 THR 28 8.136 2.225 3.708 110 HG23 THR 28 HG23 THR 28 7.734 3.937 3.867 111 H ASN 29 H ASN 29 3.896 3.296 2.258 112 HA ASN 29 HA ASN 29 1.521 1.841 3.108 113 HB2 ASN 29 HB2 ASN 29 2.076 4.187 1.317 114 HB3 ASN 29 HB3 ASN 29 0.522 3.345 1.197 115 HD21 ASN 29 HD21 ASN 29 -0.949 4.538 2.356 116 HD22 ASN 29 HD22 ASN 29 -0.664 5.194 3.928 117 H GLY 30 H GLY 30 3.755 0.423 1.648 118 HA2 GLY 30 HA2 GLY 30 3.690 -1.430 0.219 119 HA3 GLY 30 HA3 GLY 30 2.087 -0.935 -0.315 120 H MET 31 H MET 31 4.302 1.665 -0.371 121 HA MET 31 HA MET 31 4.757 1.280 -3.264 122 HB2 MET 31 HB2 MET 31 3.800 3.632 -1.681 123 HB3 MET 31 HB3 MET 31 4.758 3.930 -3.142 124 HG2 MET 31 HG2 MET 31 2.512 3.926 -3.869 125 HG3 MET 31 HG3 MET 31 3.135 2.332 -4.326 126 HE1 MET 31 HE1 MET 31 -0.723 2.837 -2.666 127 HE2 MET 31 HE2 MET 31 0.140 3.174 -4.166 128 HE3 MET 31 HE3 MET 31 0.343 4.239 -2.773 129 H CYS 32 H CYS 32 6.611 2.472 -4.129 130 HA CYS 32 HA CYS 32 8.952 2.044 -2.577 131 HB2 CYS 32 HB2 CYS 32 10.137 2.956 -4.564 132 HB3 CYS 32 HB3 CYS 32 8.926 1.758 -5.022 133 H SER 33 H SER 33 10.635 4.194 -2.951 134 HA SER 33 HA SER 33 9.661 5.993 -0.932 135 HB2 SER 33 HB2 SER 33 11.904 7.061 -1.160 136 HB3 SER 33 HB3 SER 33 12.006 5.318 -0.908 137 HG SER 33 HG SER 33 13.128 5.330 -2.674 138 H VAL 34 H VAL 34 9.747 6.075 -4.375 139 HA VAL 34 HA VAL 34 9.700 8.943 -4.612 140 HB VAL 34 HB VAL 34 9.020 6.936 -6.759 141 HG11 VAL 34 HG11 VAL 34 9.746 8.704 -8.275 142 HG12 VAL 34 HG12 VAL 34 10.167 9.727 -6.901 143 HG13 VAL 34 HG13 VAL 34 8.480 9.317 -7.208 144 HG21 VAL 34 HG21 VAL 34 11.412 7.048 -7.394 145 HG22 VAL 34 HG22 VAL 34 11.190 6.332 -5.796 146 HG23 VAL 34 HG23 VAL 34 11.731 8.003 -5.948 147 H CYS 35 H CYS 35 7.300 6.347 -5.003 148 HA CYS 35 HA CYS 35 5.167 8.181 -5.608 149 HB2 CYS 35 HB2 CYS 35 5.148 5.221 -5.002 150 HB3 CYS 35 HB3 CYS 35 3.757 6.142 -5.591 151 H TYR 36 H TYR 36 6.493 6.839 -2.723 152 HA TYR 36 HA TYR 36 4.253 6.805 -1.047 153 HB2 TYR 36 HB2 TYR 36 6.382 5.770 -0.411 154 HB3 TYR 36 HB3 TYR 36 7.154 7.354 -0.343 155 HD1 TYR 36 HD1 TYR 36 3.769 6.384 0.961 156 HD2 TYR 36 HD2 TYR 36 7.796 7.555 1.880 157 HE1 TYR 36 HE1 TYR 36 3.160 6.596 3.359 158 HE2 TYR 36 HE2 TYR 36 7.192 7.771 4.275 159 HH TYR 36 HH TYR 36 4.279 6.553 5.575 160 H LYS 37 H LYS 37 6.571 9.485 -1.609 161 HA LYS 37 HA LYS 37 5.177 11.248 0.157 162 HB2 LYS 37 HB2 LYS 37 6.648 13.019 -0.748 163 HB3 LYS 37 HB3 LYS 37 7.569 11.588 -0.288 164 HG2 LYS 37 HG2 LYS 37 7.602 10.863 -2.648 165 HG3 LYS 37 HG3 LYS 37 6.716 12.330 -3.091 166 HD2 LYS 37 HD2 LYS 37 8.593 13.650 -2.018 167 HD3 LYS 37 HD3 LYS 37 9.499 12.130 -1.937 168 HE2 LYS 37 HE2 LYS 37 9.062 11.888 -4.434 169 HE3 LYS 37 HE3 LYS 37 8.515 13.575 -4.394 170 HZ1 LYS 37 HZ1 LYS 37 10.658 14.224 -3.497 171 HZ2 LYS 37 HZ2 LYS 37 10.859 13.428 -4.976 172 HZ3 LYS 37 HZ3 LYS 37 11.191 12.619 -3.529 173 H GLU 38 H GLU 38 5.276 10.805 -3.348 174 HA GLU 38 HA GLU 38 3.728 12.960 -4.158 175 HB2 GLU 38 HB2 GLU 38 4.177 10.209 -5.289 176 HB3 GLU 38 HB3 GLU 38 3.050 11.325 -6.074 177 HG2 GLU 38 HG2 GLU 38 5.841 12.193 -5.348 178 HG3 GLU 38 HG3 GLU 38 5.495 11.365 -6.875 179 H HIS 39 H HIS 39 2.642 9.771 -2.973 180 HA HIS 39 HA HIS 39 -0.118 10.523 -3.451 181 HB2 HIS 39 HB2 HIS 39 -0.747 8.301 -2.958 182 HB3 HIS 39 HB3 HIS 39 0.796 8.156 -3.790 183 HD1 HIS 39 HD1 HIS 39 2.014 6.260 -2.799 184 HD2 HIS 39 HD2 HIS 39 0.038 8.468 0.138 185 HE1 HIS 39 HE1 HIS 39 2.473 5.102 -0.600 186 HE2 HIS 39 HE2 HIS 39 1.592 6.663 1.193 187 H LEU 40 H LEU 40 2.066 10.321 -0.730 188 HA LEU 40 HA LEU 40 0.189 10.478 1.370 189 HB2 LEU 40 HB2 LEU 40 2.685 9.969 1.536 190 HB3 LEU 40 HB3 LEU 40 2.948 11.712 1.416 191 HG LEU 40 HG LEU 40 1.316 11.952 3.376 192 HD11 LEU 40 HD11 LEU 40 0.416 9.613 3.143 193 HD12 LEU 40 HD12 LEU 40 0.989 10.001 4.768 194 HD13 LEU 40 HD13 LEU 40 1.985 9.019 3.698 195 HD21 LEU 40 HD21 LEU 40 3.105 11.266 5.031 196 HD22 LEU 40 HD22 LEU 40 3.668 12.319 3.730 197 HD23 LEU 40 HD23 LEU 40 3.999 10.589 3.670 198 H GLN 41 H GLN 41 1.529 12.933 -0.742 199 HA GLN 41 HA GLN 41 0.856 15.213 0.794 200 HB2 GLN 41 HB2 GLN 41 1.611 14.669 -2.042 201 HB3 GLN 41 HB3 GLN 41 0.856 16.228 -1.684 202 HG2 GLN 41 HG2 GLN 41 2.540 16.710 0.001 203 HG3 GLN 41 HG3 GLN 41 3.272 15.117 -0.240 204 HE21 GLN 41 HE21 GLN 41 2.933 18.321 -1.591 205 HE22 GLN 41 HE22 GLN 41 4.090 18.099 -2.854 206 H ARG 42 H ARG 42 -0.929 13.376 -1.663 207 HA ARG 42 HA ARG 42 -3.163 15.200 -1.676 208 HB2 ARG 42 HB2 ARG 42 -2.710 12.462 -2.865 209 HB3 ARG 42 HB3 ARG 42 -4.246 13.327 -3.027 210 HG2 ARG 42 HG2 ARG 42 -3.228 15.118 -4.216 211 HG3 ARG 42 HG3 ARG 42 -1.603 14.557 -3.789 212 HD2 ARG 42 HD2 ARG 42 -2.092 12.449 -5.063 213 HD3 ARG 42 HD3 ARG 42 -3.570 13.219 -5.650 214 HE ARG 42 HE ARG 42 -0.860 13.461 -6.247 215 HH11 ARG 42 HH11 ARG 42 -4.034 15.245 -6.073 216 HH12 ARG 42 HH12 ARG 42 -3.748 16.475 -7.259 217 HH21 ARG 42 HH21 ARG 42 -0.600 15.333 -8.116 218 HH22 ARG 42 HH22 ARG 42 -1.826 16.521 -8.403 219 H GLN 43 H GLN 43 -2.303 12.237 -0.014 220 HA GLN 43 HA GLN 43 -4.934 11.696 0.989 221 HB2 GLN 43 HB2 GLN 43 -2.888 10.087 0.692 222 HB3 GLN 43 HB3 GLN 43 -2.418 10.685 2.287 223 HG2 GLN 43 HG2 GLN 43 -3.706 8.869 2.885 224 HG3 GLN 43 HG3 GLN 43 -4.931 10.146 2.882 225 HE21 GLN 43 HE21 GLN 43 -6.629 8.652 2.359 226 HE22 GLN 43 HE22 GLN 43 -6.750 7.944 0.788 227 H GLN 44 H GLN 44 -2.045 13.354 2.159 228 HA GLN 44 HA GLN 44 -3.022 13.796 4.811 229 HB2 GLN 44 HB2 GLN 44 -0.573 13.812 3.976 230 HB3 GLN 44 HB3 GLN 44 -0.905 15.479 3.484 231 HG2 GLN 44 HG2 GLN 44 -1.439 16.129 5.721 232 HG3 GLN 44 HG3 GLN 44 -1.438 14.446 6.268 233 HE21 GLN 44 HE21 GLN 44 0.825 16.622 4.534 234 HE22 GLN 44 HE22 GLN 44 2.203 16.128 5.452 235 H ASN 45 H ASN 45 -2.927 15.715 1.828 236 HA ASN 45 HA ASN 45 -3.895 18.129 2.957 237 HB2 ASN 45 HB2 ASN 45 -3.700 17.028 0.166 238 HB3 ASN 45 HB3 ASN 45 -4.607 18.517 0.456 239 HD21 ASN 45 HD21 ASN 45 -1.937 18.032 -0.908 240 HD22 ASN 45 HD22 ASN 45 -0.858 19.113 -0.101 241 H SER 46 H SER 46 -5.512 15.386 1.385 242 HA SER 46 HA SER 46 -8.125 16.554 1.522 243 HB2 SER 46 HB2 SER 46 -7.241 14.673 -0.058 244 HB3 SER 46 HB3 SER 46 -7.644 13.595 1.285 245 HG SER 46 HG SER 46 -9.375 15.333 -0.138 246 H1 MET 1 H1 MET 1 21.905 0.854 9.684 247 H2 MET 1 H2 MET 1 22.658 1.379 8.263 248 H3 MET 1 H3 MET 1 23.564 1.181 9.678 249 HA MET 1 HA MET 1 23.183 -1.176 9.650 250 HB2 MET 1 HB2 MET 1 22.016 -2.230 7.814 251 HB3 MET 1 HB3 MET 1 20.958 -1.018 8.522 252 HG2 MET 1 HG2 MET 1 21.515 0.527 6.704 253 HG3 MET 1 HG3 MET 1 22.577 -0.685 5.999 254 HE1 MET 1 HE1 MET 1 19.937 -0.882 3.292 255 HE2 MET 1 HE2 MET 1 21.649 -0.854 3.717 256 HE3 MET 1 HE3 MET 1 20.634 0.547 4.054 257 H GLN 2 H GLN 2 24.794 -2.461 8.747 258 HA GLN 2 HA GLN 2 26.569 -1.053 6.883 259 HB2 GLN 2 HB2 GLN 2 28.305 -2.463 7.569 260 HB3 GLN 2 HB3 GLN 2 27.399 -2.150 9.041 261 HG2 GLN 2 HG2 GLN 2 26.314 -4.324 8.865 262 HG3 GLN 2 HG3 GLN 2 27.151 -4.634 7.347 263 HE21 GLN 2 HE21 GLN 2 29.572 -3.260 8.564 264 HE22 GLN 2 HE22 GLN 2 30.287 -4.483 9.552 265 H ILE 3 H ILE 3 27.135 -1.793 4.945 266 HA ILE 3 HA ILE 3 26.168 -4.414 4.074 267 HB ILE 3 HB ILE 3 25.327 -3.779 2.048 268 HG12 ILE 3 HG12 ILE 3 26.964 -2.198 1.277 269 HG13 ILE 3 HG13 ILE 3 25.335 -1.628 0.969 270 HG21 ILE 3 HG21 ILE 3 23.760 -3.386 3.827 271 HG22 ILE 3 HG22 ILE 3 23.455 -2.326 2.451 272 HG23 ILE 3 HG23 ILE 3 24.243 -1.691 3.895 273 HD11 ILE 3 HD11 ILE 3 27.344 -0.127 1.960 274 HD12 ILE 3 HD12 ILE 3 26.557 -0.634 3.453 275 HD13 ILE 3 HD13 ILE 3 25.629 0.220 2.216 276 H PHE 4 H PHE 4 27.380 -5.186 2.179 277 HA PHE 4 HA PHE 4 30.194 -4.284 2.394 278 HB2 PHE 4 HB2 PHE 4 29.190 -7.047 1.644 279 HB3 PHE 4 HB3 PHE 4 30.859 -6.587 2.027 280 HD1 PHE 4 HD1 PHE 4 31.348 -5.732 4.405 281 HD2 PHE 4 HD2 PHE 4 27.718 -7.713 3.318 282 HE1 PHE 4 HE1 PHE 4 30.860 -6.154 6.791 283 HE2 PHE 4 HE2 PHE 4 27.241 -8.159 5.707 284 HZ PHE 4 HZ PHE 4 28.813 -7.370 7.440 285 H VAL 5 H VAL 5 31.320 -3.874 0.611 286 HA VAL 5 HA VAL 5 30.069 -4.288 -2.037 287 HB VAL 5 HB VAL 5 31.808 -1.953 -1.181 288 HG11 VAL 5 HG11 VAL 5 32.300 -2.391 -3.474 289 HG12 VAL 5 HG12 VAL 5 31.164 -1.043 -3.457 290 HG13 VAL 5 HG13 VAL 5 30.600 -2.668 -3.855 291 HG21 VAL 5 HG21 VAL 5 28.970 -1.779 -2.158 292 HG22 VAL 5 HG22 VAL 5 29.917 -0.567 -1.285 293 HG23 VAL 5 HG23 VAL 5 29.339 -2.009 -0.449 294 H LYS 6 H LYS 6 31.061 -6.060 -2.641 295 HA LYS 6 HA LYS 6 33.860 -6.620 -2.217 296 HB2 LYS 6 HB2 LYS 6 31.741 -7.873 -3.976 297 HB3 LYS 6 HB3 LYS 6 33.369 -8.513 -3.786 298 HG2 LYS 6 HG2 LYS 6 32.984 -8.926 -1.431 299 HG3 LYS 6 HG3 LYS 6 31.380 -8.186 -1.536 300 HD2 LYS 6 HD2 LYS 6 31.233 -10.642 -1.624 301 HD3 LYS 6 HD3 LYS 6 30.682 -9.910 -3.132 302 HE2 LYS 6 HE2 LYS 6 33.017 -10.312 -4.036 303 HE3 LYS 6 HE3 LYS 6 33.309 -11.300 -2.602 304 HZ1 LYS 6 HZ1 LYS 6 31.204 -11.736 -4.629 305 HZ2 LYS 6 HZ2 LYS 6 31.437 -12.674 -3.242 306 HZ3 LYS 6 HZ3 LYS 6 32.621 -12.643 -4.449 307 H THR 7 H THR 7 35.501 -6.115 -3.463 308 HA THR 7 HA THR 7 35.013 -5.056 -6.177 309 HB THR 7 HB THR 7 37.235 -4.117 -6.121 310 HG1 THR 7 HG1 THR 7 37.488 -5.847 -3.951 311 HG21 THR 7 HG21 THR 7 36.225 -3.544 -3.350 312 HG22 THR 7 HG22 THR 7 35.357 -2.956 -4.771 313 HG23 THR 7 HG23 THR 7 37.021 -2.445 -4.475 314 H LEU 8 H LEU 8 36.752 -5.745 -7.771 315 HA LEU 8 HA LEU 8 36.564 -8.605 -7.887 316 HB2 LEU 8 HB2 LEU 8 37.696 -6.700 -9.921 317 HB3 LEU 8 HB3 LEU 8 37.284 -8.392 -10.197 318 HG LEU 8 HG LEU 8 35.375 -6.178 -9.447 319 HD11 LEU 8 HD11 LEU 8 36.224 -6.222 -11.792 320 HD12 LEU 8 HD12 LEU 8 34.474 -6.385 -11.634 321 HD13 LEU 8 HD13 LEU 8 35.465 -7.803 -11.969 322 HD21 LEU 8 HD21 LEU 8 34.916 -9.135 -9.661 323 HD22 LEU 8 HD22 LEU 8 33.622 -7.983 -9.992 324 HD23 LEU 8 HD23 LEU 8 34.388 -8.018 -8.402 325 H THR 9 H THR 9 39.042 -6.458 -7.017 326 HA THR 9 HA THR 9 41.305 -8.135 -7.189 327 HB THR 9 HB THR 9 42.120 -6.877 -5.169 328 HG1 THR 9 HG1 THR 9 39.684 -5.447 -5.490 329 HG21 THR 9 HG21 THR 9 41.143 -5.355 -7.576 330 HG22 THR 9 HG22 THR 9 42.740 -6.056 -7.321 331 HG23 THR 9 HG23 THR 9 42.222 -4.668 -6.365 332 H GLY 10 H GLY 10 38.615 -8.037 -4.972 333 HA2 GLY 10 HA2 GLY 10 37.965 -10.233 -3.980 334 HA3 GLY 10 HA3 GLY 10 39.648 -10.393 -3.495 335 H LYS 11 H LYS 11 39.731 -7.458 -2.873 336 HA LYS 11 HA LYS 11 39.163 -7.498 -0.115 337 HB2 LYS 11 HB2 LYS 11 40.698 -5.897 -1.453 338 HB3 LYS 11 HB3 LYS 11 39.228 -4.962 -1.744 339 HG2 LYS 11 HG2 LYS 11 39.128 -5.450 0.971 340 HG3 LYS 11 HG3 LYS 11 40.842 -5.172 0.678 341 HD2 LYS 11 HD2 LYS 11 38.642 -3.315 -0.224 342 HD3 LYS 11 HD3 LYS 11 39.525 -3.131 1.286 343 HE2 LYS 11 HE2 LYS 11 40.855 -3.149 -1.419 344 HE3 LYS 11 HE3 LYS 11 40.303 -1.678 -0.621 345 HZ1 LYS 11 HZ1 LYS 11 42.314 -3.587 0.408 346 HZ2 LYS 11 HZ2 LYS 11 41.755 -2.222 1.236 347 HZ3 LYS 11 HZ3 LYS 11 42.617 -2.041 -0.207 348 H THR 12 H THR 12 37.549 -6.571 1.084 349 HA THR 12 HA THR 12 35.005 -5.922 -0.298 350 HB THR 12 HB THR 12 35.433 -7.391 2.317 351 HG1 THR 12 HG1 THR 12 35.590 -8.926 0.847 352 HG21 THR 12 HG21 THR 12 32.829 -6.650 0.973 353 HG22 THR 12 HG22 THR 12 33.418 -5.996 2.501 354 HG23 THR 12 HG23 THR 12 32.984 -7.703 2.377 355 H ILE 13 H ILE 13 34.234 -4.020 0.106 356 HA ILE 13 HA ILE 13 35.351 -2.304 2.222 357 HB ILE 13 HB ILE 13 33.149 -1.439 0.402 358 HG12 ILE 13 HG12 ILE 13 34.563 -2.409 -1.256 359 HG13 ILE 13 HG13 ILE 13 34.744 -0.667 -1.336 360 HG21 ILE 13 HG21 ILE 13 33.932 0.030 2.170 361 HG22 ILE 13 HG22 ILE 13 34.181 0.741 0.578 362 HG23 ILE 13 HG23 ILE 13 35.546 0.048 1.456 363 HD11 ILE 13 HD11 ILE 13 36.876 -1.872 -1.654 364 HD12 ILE 13 HD12 ILE 13 36.695 -2.564 -0.045 365 HD13 ILE 13 HD13 ILE 13 36.911 -0.824 -0.229 366 H THR 14 H THR 14 34.259 -2.015 4.079 367 HA THR 14 HA THR 14 31.409 -2.797 4.236 368 HB THR 14 HB THR 14 33.383 -2.181 6.456 369 HG1 THR 14 HG1 THR 14 33.822 -4.169 5.490 370 HG21 THR 14 HG21 THR 14 31.039 -1.647 7.076 371 HG22 THR 14 HG22 THR 14 31.684 -3.007 7.997 372 HG23 THR 14 HG23 THR 14 30.579 -3.295 6.654 373 H LEU 15 H LEU 15 29.916 -1.304 4.359 374 HA LEU 15 HA LEU 15 30.675 1.489 4.968 375 HB2 LEU 15 HB2 LEU 15 28.623 0.516 2.985 376 HB3 LEU 15 HB3 LEU 15 28.910 2.207 3.376 377 HG LEU 15 HG LEU 15 30.980 0.360 2.165 378 HD11 LEU 15 HD11 LEU 15 29.355 2.517 0.823 379 HD12 LEU 15 HD12 LEU 15 28.993 0.795 0.697 380 HD13 LEU 15 HD13 LEU 15 30.519 1.434 0.061 381 HD21 LEU 15 HD21 LEU 15 30.968 3.209 3.030 382 HD22 LEU 15 HD22 LEU 15 31.824 2.809 1.537 383 HD23 LEU 15 HD23 LEU 15 32.279 2.025 3.050 384 H GLU 16 H GLU 16 29.419 2.628 6.274 385 HA GLU 16 HA GLU 16 27.039 1.414 7.518 386 HB2 GLU 16 HB2 GLU 16 28.753 2.314 9.044 387 HB3 GLU 16 HB3 GLU 16 28.660 3.878 8.242 388 HG2 GLU 16 HG2 GLU 16 27.429 3.911 10.347 389 HG3 GLU 16 HG3 GLU 16 26.347 4.137 8.977 390 H VAL 17 H VAL 17 25.241 1.821 6.488 391 HA VAL 17 HA VAL 17 24.797 4.463 5.268 392 HB VAL 17 HB VAL 17 23.763 3.439 3.335 393 HG11 VAL 17 HG11 VAL 17 26.235 3.949 3.388 394 HG12 VAL 17 HG12 VAL 17 25.701 2.806 2.149 395 HG13 VAL 17 HG13 VAL 17 26.484 2.213 3.615 396 HG21 VAL 17 HG21 VAL 17 24.647 0.769 4.407 397 HG22 VAL 17 HG22 VAL 17 23.829 1.066 2.871 398 HG23 VAL 17 HG23 VAL 17 22.988 1.368 4.395 399 H GLU 18 H GLU 18 22.508 4.674 4.546 400 HA GLU 18 HA GLU 18 20.508 3.336 6.264 401 HB2 GLU 18 HB2 GLU 18 20.502 6.147 5.113 402 HB3 GLU 18 HB3 GLU 18 19.159 5.420 5.986 403 HG2 GLU 18 HG2 GLU 18 21.899 6.002 7.093 404 HG3 GLU 18 HG3 GLU 18 20.426 6.894 7.445 405 H SER 19 H SER 19 18.538 2.776 5.193 406 HA SER 19 HA SER 19 18.677 1.907 2.524 407 HB2 SER 19 HB2 SER 19 16.185 2.516 4.138 408 HB3 SER 19 HB3 SER 19 16.243 1.566 2.650 409 HG SER 19 HG SER 19 17.265 0.933 5.202 410 H SER 20 H SER 20 17.624 4.915 3.876 411 HA SER 20 HA SER 20 16.414 6.034 1.567 412 HB2 SER 20 HB2 SER 20 16.614 8.199 2.842 413 HB3 SER 20 HB3 SER 20 15.741 6.904 3.664 414 HG SER 20 HG SER 20 18.331 7.913 4.178 415 H ASP 21 H ASP 21 19.701 5.561 2.237 416 HA ASP 21 HA ASP 21 20.823 7.874 1.044 417 HB2 ASP 21 HB2 ASP 21 21.906 5.076 1.341 418 HB3 ASP 21 HB3 ASP 21 22.849 6.397 0.657 419 H THR 22 H THR 22 21.017 8.522 -0.917 420 HA THR 22 HA THR 22 19.995 7.109 -3.188 421 HB THR 22 HB THR 22 20.884 8.917 -4.534 422 HG1 THR 22 HG1 THR 22 22.323 10.399 -3.743 423 HG21 THR 22 HG21 THR 22 19.732 9.960 -1.947 424 HG22 THR 22 HG22 THR 22 18.823 9.434 -3.366 425 HG23 THR 22 HG23 THR 22 19.834 10.877 -3.449 426 H ILE 23 H ILE 23 21.215 6.270 -4.959 427 HA ILE 23 HA ILE 23 23.453 4.691 -4.324 428 HB ILE 23 HB ILE 23 22.418 5.616 -6.985 429 HG12 ILE 23 HG12 ILE 23 20.779 4.366 -5.795 430 HG13 ILE 23 HG13 ILE 23 21.402 3.360 -7.095 431 HG21 ILE 23 HG21 ILE 23 23.609 3.713 -8.017 432 HG22 ILE 23 HG22 ILE 23 24.441 3.439 -6.480 433 HG23 ILE 23 HG23 ILE 23 24.679 4.951 -7.357 434 HD11 ILE 23 HD11 ILE 23 21.143 1.947 -5.221 435 HD12 ILE 23 HD12 ILE 23 21.898 3.116 -4.138 436 HD13 ILE 23 HD13 ILE 23 22.878 2.259 -5.329 437 H ASP 24 H ASP 24 23.233 7.842 -5.858 438 HA ASP 24 HA ASP 24 25.927 8.303 -6.463 439 HB2 ASP 24 HB2 ASP 24 24.106 9.751 -7.248 440 HB3 ASP 24 HB3 ASP 24 23.802 10.275 -5.590 441 H ASN 25 H ASN 25 24.136 8.831 -3.480 442 HA ASN 25 HA ASN 25 26.166 10.031 -1.934 443 HB2 ASN 25 HB2 ASN 25 23.828 10.141 -1.305 444 HB3 ASN 25 HB3 ASN 25 23.757 8.390 -1.147 445 HD21 ASN 25 HD21 ASN 25 23.599 7.851 0.824 446 HD22 ASN 25 HD22 ASN 25 24.440 8.523 2.174 447 H VAL 26 H VAL 26 25.267 6.641 -2.391 448 HA VAL 26 HA VAL 26 27.094 5.471 -0.575 449 HB VAL 26 HB VAL 26 25.789 4.379 -3.070 450 HG11 VAL 26 HG11 VAL 26 26.367 2.114 -2.184 451 HG12 VAL 26 HG12 VAL 26 27.428 2.886 -1.006 452 HG13 VAL 26 HG13 VAL 26 27.775 3.023 -2.731 453 HG21 VAL 26 HG21 VAL 26 25.187 3.393 -0.339 454 HG22 VAL 26 HG22 VAL 26 24.115 3.629 -1.723 455 HG23 VAL 26 HG23 VAL 26 24.624 5.013 -0.753 456 H LYS 27 H LYS 27 27.368 6.104 -4.065 457 HA LYS 27 HA LYS 27 29.943 5.087 -4.470 458 HB2 LYS 27 HB2 LYS 27 28.462 7.293 -5.915 459 HB3 LYS 27 HB3 LYS 27 29.992 6.608 -6.470 460 HG2 LYS 27 HG2 LYS 27 28.971 4.389 -6.590 461 HG3 LYS 27 HG3 LYS 27 27.431 5.064 -6.046 462 HD2 LYS 27 HD2 LYS 27 27.314 6.468 -8.022 463 HD3 LYS 27 HD3 LYS 27 28.890 5.874 -8.570 464 HE2 LYS 27 HE2 LYS 27 28.002 3.621 -8.751 465 HE3 LYS 27 HE3 LYS 27 26.425 4.153 -8.146 466 HZ1 LYS 27 HZ1 LYS 27 27.753 5.062 -10.633 467 HZ2 LYS 27 HZ2 LYS 27 26.239 5.578 -10.080 468 HZ3 LYS 27 HZ3 LYS 27 26.466 3.968 -10.545 469 H SER 28 H SER 28 28.899 8.281 -3.449 470 HA SER 28 HA SER 28 31.410 9.554 -3.270 471 HB2 SER 28 HB2 SER 28 29.248 10.761 -3.154 472 HB3 SER 28 HB3 SER 28 28.960 10.046 -1.563 473 HG SER 28 HG SER 28 30.036 11.743 -0.885 474 H LYS 29 H LYS 29 29.619 7.590 -0.942 475 HA LYS 29 HA LYS 29 31.427 7.738 1.225 476 HB2 LYS 29 HB2 LYS 29 29.497 5.545 0.457 477 HB3 LYS 29 HB3 LYS 29 30.406 5.573 1.964 478 HG2 LYS 29 HG2 LYS 29 29.305 7.665 2.603 479 HG3 LYS 29 HG3 LYS 29 28.398 7.649 1.083 480 HD2 LYS 29 HD2 LYS 29 27.430 5.461 1.714 481 HD3 LYS 29 HD3 LYS 29 28.288 5.549 3.250 482 HE2 LYS 29 HE2 LYS 29 26.272 7.595 2.349 483 HE3 LYS 29 HE3 LYS 29 25.859 6.199 3.341 484 HZ1 LYS 29 HZ1 LYS 29 26.203 8.153 4.674 485 HZ2 LYS 29 HZ2 LYS 29 27.761 8.352 4.046 486 HZ3 LYS 29 HZ3 LYS 29 27.403 7.009 5.009 487 H ILE 30 H ILE 30 31.344 5.663 -1.608 488 HA ILE 30 HA ILE 30 33.482 3.922 -0.892 489 HB ILE 30 HB ILE 30 32.262 4.630 -3.545 490 HG12 ILE 30 HG12 ILE 30 32.153 2.117 -1.875 491 HG13 ILE 30 HG13 ILE 30 30.915 3.362 -1.910 492 HG21 ILE 30 HG21 ILE 30 34.719 3.954 -3.735 493 HG22 ILE 30 HG22 ILE 30 33.560 3.037 -4.697 494 HG23 ILE 30 HG23 ILE 30 34.202 2.354 -3.202 495 HD11 ILE 30 HD11 ILE 30 30.177 1.541 -3.270 496 HD12 ILE 30 HD12 ILE 30 31.704 1.509 -4.153 497 HD13 ILE 30 HD13 ILE 30 30.599 2.872 -4.350 498 H GLN 31 H GLN 31 33.329 6.901 -2.801 499 HA GLN 31 HA GLN 31 36.045 7.192 -3.426 500 HB2 GLN 31 HB2 GLN 31 34.209 8.555 -4.373 501 HB3 GLN 31 HB3 GLN 31 34.018 9.353 -2.811 502 HG2 GLN 31 HG2 GLN 31 36.315 10.201 -2.956 503 HG3 GLN 31 HG3 GLN 31 36.499 9.419 -4.528 504 HE21 GLN 31 HE21 GLN 31 36.865 11.289 -5.599 505 HE22 GLN 31 HE22 GLN 31 35.649 12.480 -5.894 506 H ASP 32 H ASP 32 34.234 8.024 -0.539 507 HA ASP 32 HA ASP 32 36.302 9.372 0.830 508 HB2 ASP 32 HB2 ASP 32 33.709 8.172 1.731 509 HB3 ASP 32 HB3 ASP 32 34.844 8.887 2.878 510 H LYS 33 H LYS 33 35.697 5.973 0.502 511 HA LYS 33 HA LYS 33 37.675 5.422 2.597 512 HB2 LYS 33 HB2 LYS 33 35.680 3.637 1.246 513 HB3 LYS 33 HB3 LYS 33 37.017 2.990 2.198 514 HG2 LYS 33 HG2 LYS 33 36.166 4.611 4.042 515 HG3 LYS 33 HG3 LYS 33 34.668 4.616 3.106 516 HD2 LYS 33 HD2 LYS 33 34.475 2.911 4.796 517 HD3 LYS 33 HD3 LYS 33 34.670 2.114 3.233 518 HE2 LYS 33 HE2 LYS 33 37.049 1.764 3.687 519 HE3 LYS 33 HE3 LYS 33 36.884 2.592 5.235 520 HZ1 LYS 33 HZ1 LYS 33 35.390 0.869 5.959 521 HZ2 LYS 33 HZ2 LYS 33 36.877 0.213 5.489 522 HZ3 LYS 33 HZ3 LYS 33 35.534 0.081 4.470 523 H GLU 34 H GLU 34 37.186 4.944 -0.845 524 HA GLU 34 HA GLU 34 39.722 3.476 -1.008 525 HB2 GLU 34 HB2 GLU 34 37.348 3.547 -2.858 526 HB3 GLU 34 HB3 GLU 34 38.876 2.774 -3.268 527 HG2 GLU 34 HG2 GLU 34 37.169 2.083 -0.880 528 HG3 GLU 34 HG3 GLU 34 37.251 1.162 -2.379 529 H GLY 35 H GLY 35 38.167 6.342 -2.174 530 HA2 GLY 35 HA2 GLY 35 39.259 8.265 -3.029 531 HA3 GLY 35 HA3 GLY 35 40.652 7.273 -3.432 532 H ILE 36 H ILE 36 37.986 5.629 -4.420 533 HA ILE 36 HA ILE 36 38.464 6.029 -7.209 534 HB ILE 36 HB ILE 36 36.171 4.546 -5.906 535 HG12 ILE 36 HG12 ILE 36 38.784 3.448 -6.973 536 HG13 ILE 36 HG13 ILE 36 38.472 3.753 -5.266 537 HG21 ILE 36 HG21 ILE 36 35.967 3.388 -8.060 538 HG22 ILE 36 HG22 ILE 36 37.294 4.351 -8.713 539 HG23 ILE 36 HG23 ILE 36 35.774 5.129 -8.272 540 HD11 ILE 36 HD11 ILE 36 37.211 1.679 -7.047 541 HD12 ILE 36 HD12 ILE 36 36.502 2.147 -5.498 542 HD13 ILE 36 HD13 ILE 36 38.118 1.452 -5.551 543 HA PRO 37 HA PRO 37 35.793 9.588 -7.838 544 HB2 PRO 37 HB2 PRO 37 36.146 8.545 -10.625 545 HB3 PRO 37 HB3 PRO 37 36.244 10.216 -10.039 546 HG2 PRO 37 HG2 PRO 37 38.521 8.917 -10.536 547 HG3 PRO 37 HG3 PRO 37 38.381 9.846 -9.023 548 HD2 PRO 37 HD2 PRO 37 38.089 6.870 -9.437 549 HD3 PRO 37 HD3 PRO 37 38.947 7.735 -8.149 550 HA PRO 38 HA PRO 38 31.936 7.310 -7.744 551 HB2 PRO 38 HB2 PRO 38 30.927 10.057 -8.352 552 HB3 PRO 38 HB3 PRO 38 30.337 8.890 -7.152 553 HG2 PRO 38 HG2 PRO 38 31.869 10.905 -6.310 554 HG3 PRO 38 HG3 PRO 38 32.221 9.263 -5.719 555 HD2 PRO 38 HD2 PRO 38 33.608 10.809 -7.910 556 HD3 PRO 38 HD3 PRO 38 34.320 9.828 -6.617 557 H ASP 39 H ASP 39 32.584 9.649 -10.294 558 HA ASP 39 HA ASP 39 30.627 8.627 -12.116 559 HB2 ASP 39 HB2 ASP 39 31.599 10.274 -13.684 560 HB3 ASP 39 HB3 ASP 39 31.136 10.965 -12.140 561 H GLN 40 H GLN 40 33.087 6.990 -11.171 562 HA GLN 40 HA GLN 40 33.520 5.719 -13.770 563 HB2 GLN 40 HB2 GLN 40 35.529 6.999 -12.879 564 HB3 GLN 40 HB3 GLN 40 35.563 5.808 -11.577 565 HG2 GLN 40 HG2 GLN 40 35.626 4.044 -13.430 566 HG3 GLN 40 HG3 GLN 40 36.052 5.368 -14.512 567 HE21 GLN 40 HE21 GLN 40 37.082 5.224 -11.172 568 HE22 GLN 40 HE22 GLN 40 38.756 4.949 -11.500 569 H GLN 41 H GLN 41 31.997 5.376 -11.016 570 HA GLN 41 HA GLN 41 32.545 2.566 -10.507 571 HB2 GLN 41 HB2 GLN 41 30.765 4.571 -9.092 572 HB3 GLN 41 HB3 GLN 41 31.114 2.943 -8.516 573 HG2 GLN 41 HG2 GLN 41 33.483 3.555 -8.250 574 HG3 GLN 41 HG3 GLN 41 33.113 5.188 -8.825 575 HE21 GLN 41 HE21 GLN 41 33.534 6.308 -7.004 576 HE22 GLN 41 HE22 GLN 41 32.671 6.127 -5.519 577 H ARG 42 H ARG 42 31.219 1.047 -11.176 578 HA ARG 42 HA ARG 42 28.395 1.659 -11.812 579 HB2 ARG 42 HB2 ARG 42 30.246 -0.362 -13.109 580 HB3 ARG 42 HB3 ARG 42 28.503 -0.321 -13.388 581 HG2 ARG 42 HG2 ARG 42 28.660 1.870 -14.377 582 HG3 ARG 42 HG3 ARG 42 30.363 1.993 -13.932 583 HD2 ARG 42 HD2 ARG 42 30.278 1.468 -16.245 584 HD3 ARG 42 HD3 ARG 42 30.800 0.005 -15.414 585 HE ARG 42 HE ARG 42 27.984 -0.002 -15.776 586 HH11 ARG 42 HH11 ARG 42 30.941 -0.400 -17.610 587 HH12 ARG 42 HH12 ARG 42 30.193 -1.377 -18.830 588 HH21 ARG 42 HH21 ARG 42 27.018 -1.224 -17.443 589 HH22 ARG 42 HH22 ARG 42 27.994 -1.837 -18.735 590 H LEU 43 H LEU 43 27.265 0.964 -10.154 591 HA LEU 43 HA LEU 43 28.173 -1.343 -8.582 592 HB2 LEU 43 HB2 LEU 43 26.031 0.702 -8.007 593 HB3 LEU 43 HB3 LEU 43 26.453 -0.625 -6.935 594 HG LEU 43 HG LEU 43 28.262 1.665 -7.734 595 HD11 LEU 43 HD11 LEU 43 26.425 2.212 -6.154 596 HD12 LEU 43 HD12 LEU 43 28.026 2.354 -5.422 597 HD13 LEU 43 HD13 LEU 43 27.019 0.948 -5.077 598 HD21 LEU 43 HD21 LEU 43 29.725 0.701 -5.894 599 HD22 LEU 43 HD22 LEU 43 29.691 -0.215 -7.407 600 HD23 LEU 43 HD23 LEU 43 28.754 -0.767 -6.017 601 H ILE 44 H ILE 44 27.119 -3.161 -8.352 602 HA ILE 44 HA ILE 44 24.602 -3.573 -9.850 603 HB ILE 44 HB ILE 44 27.003 -5.391 -9.624 604 HG12 ILE 44 HG12 ILE 44 26.680 -5.476 -12.149 605 HG13 ILE 44 HG13 ILE 44 25.589 -4.113 -11.954 606 HG21 ILE 44 HG21 ILE 44 24.792 -6.641 -9.352 607 HG22 ILE 44 HG22 ILE 44 25.878 -7.200 -10.623 608 HG23 ILE 44 HG23 ILE 44 24.476 -6.211 -11.032 609 HD11 ILE 44 HD11 ILE 44 27.800 -3.371 -12.649 610 HD12 ILE 44 HD12 ILE 44 28.524 -4.157 -11.245 611 HD13 ILE 44 HD13 ILE 44 27.438 -2.786 -11.026 612 H PHE 45 H PHE 45 23.028 -4.563 -8.851 613 HA PHE 45 HA PHE 45 23.487 -6.375 -6.622 614 HB2 PHE 45 HB2 PHE 45 23.114 -4.226 -5.467 615 HB3 PHE 45 HB3 PHE 45 21.613 -4.000 -6.380 616 HD1 PHE 45 HD1 PHE 45 23.272 -6.303 -3.968 617 HD2 PHE 45 HD2 PHE 45 19.596 -4.879 -5.617 618 HE1 PHE 45 HE1 PHE 45 22.015 -7.609 -2.286 619 HE2 PHE 45 HE2 PHE 45 18.332 -6.173 -3.925 620 HZ PHE 45 HZ PHE 45 19.546 -7.542 -2.267 621 H ALA 46 H ALA 46 22.464 -8.124 -7.141 622 HA ALA 46 HA ALA 46 21.038 -9.644 -8.034 623 HB1 ALA 46 HB1 ALA 46 19.612 -8.811 -6.272 624 HB2 ALA 46 HB2 ALA 46 18.629 -9.201 -7.683 625 HB3 ALA 46 HB3 ALA 46 19.018 -7.521 -7.318 626 H GLY 47 H GLY 47 22.378 -8.358 -9.933 627 HA2 GLY 47 HA2 GLY 47 22.533 -8.136 -12.215 628 HA3 GLY 47 HA3 GLY 47 20.949 -8.879 -12.324 629 H LYS 48 H LYS 48 21.565 -5.915 -10.603 630 HA LYS 48 HA LYS 48 20.185 -4.305 -12.669 631 HB2 LYS 48 HB2 LYS 48 19.773 -4.400 -9.676 632 HB3 LYS 48 HB3 LYS 48 19.289 -3.001 -10.632 633 HG2 LYS 48 HG2 LYS 48 17.808 -4.410 -11.977 634 HG3 LYS 48 HG3 LYS 48 18.310 -5.824 -11.050 635 HD2 LYS 48 HD2 LYS 48 17.091 -3.425 -9.710 636 HD3 LYS 48 HD3 LYS 48 16.090 -4.683 -10.424 637 HE2 LYS 48 HE2 LYS 48 18.214 -5.265 -8.358 638 HE3 LYS 48 HE3 LYS 48 16.539 -4.887 -7.940 639 HZ1 LYS 48 HZ1 LYS 48 17.454 -7.138 -9.621 640 HZ2 LYS 48 HZ2 LYS 48 15.837 -6.751 -9.306 641 HZ3 LYS 48 HZ3 LYS 48 16.851 -7.240 -8.044 642 H GLN 49 H GLN 49 21.265 -2.546 -13.254 643 HA GLN 49 HA GLN 49 23.615 -1.621 -11.812 644 HB2 GLN 49 HB2 GLN 49 22.209 -0.355 -14.184 645 HB3 GLN 49 HB3 GLN 49 23.812 0.060 -13.579 646 HG2 GLN 49 HG2 GLN 49 24.422 -2.388 -14.020 647 HG3 GLN 49 HG3 GLN 49 22.939 -2.454 -14.978 648 HE21 GLN 49 HE21 GLN 49 23.795 -2.645 -16.955 649 HE22 GLN 49 HE22 GLN 49 24.801 -1.466 -17.718 650 H LEU 50 H LEU 50 23.690 0.010 -10.422 651 HA LEU 50 HA LEU 50 21.161 0.979 -9.415 652 HB2 LEU 50 HB2 LEU 50 23.942 1.518 -8.370 653 HB3 LEU 50 HB3 LEU 50 22.425 1.768 -7.510 654 HG LEU 50 HG LEU 50 23.619 -0.868 -8.359 655 HD11 LEU 50 HD11 LEU 50 24.531 0.323 -6.345 656 HD12 LEU 50 HD12 LEU 50 23.918 -1.306 -6.061 657 HD13 LEU 50 HD13 LEU 50 22.950 0.094 -5.599 658 HD21 LEU 50 HD21 LEU 50 21.357 -1.357 -8.612 659 HD22 LEU 50 HD22 LEU 50 20.880 -0.267 -7.310 660 HD23 LEU 50 HD23 LEU 50 21.671 -1.798 -6.930 661 H GLU 51 H GLU 51 20.399 2.958 -9.371 662 HA GLU 51 HA GLU 51 21.528 4.866 -11.293 663 HB2 GLU 51 HB2 GLU 51 18.714 4.496 -10.266 664 HB3 GLU 51 HB3 GLU 51 19.185 5.703 -11.455 665 HG2 GLU 51 HG2 GLU 51 19.836 2.875 -12.074 666 HG3 GLU 51 HG3 GLU 51 18.131 3.317 -12.088 667 H ASP 52 H ASP 52 22.036 6.880 -10.664 668 HA ASP 52 HA ASP 52 22.734 7.366 -8.033 669 HB2 ASP 52 HB2 ASP 52 22.370 9.231 -10.351 670 HB3 ASP 52 HB3 ASP 52 22.917 9.822 -8.781 671 H GLY 53 H GLY 53 19.886 8.619 -9.712 672 HA2 GLY 53 HA2 GLY 53 18.905 10.112 -7.454 673 HA3 GLY 53 HA3 GLY 53 18.104 9.901 -8.996 674 H ARG 54 H ARG 54 18.907 6.882 -7.750 675 HA ARG 54 HA ARG 54 16.252 6.556 -6.490 676 HB2 ARG 54 HB2 ARG 54 18.044 4.427 -7.674 677 HB3 ARG 54 HB3 ARG 54 16.446 4.157 -7.002 678 HG2 ARG 54 HG2 ARG 54 17.126 5.693 -9.510 679 HG3 ARG 54 HG3 ARG 54 16.375 4.111 -9.427 680 HD2 ARG 54 HD2 ARG 54 15.144 6.676 -8.411 681 HD3 ARG 54 HD3 ARG 54 14.784 5.928 -9.968 682 HE ARG 54 HE ARG 54 14.357 4.357 -7.553 683 HH11 ARG 54 HH11 ARG 54 12.858 6.170 -10.176 684 HH12 ARG 54 HH12 ARG 54 11.275 5.573 -9.804 685 HH21 ARG 54 HH21 ARG 54 12.268 3.789 -6.992 686 HH22 ARG 54 HH22 ARG 54 10.940 4.242 -8.007 687 H THR 55 H THR 55 16.159 5.191 -4.598 688 HA THR 55 HA THR 55 18.584 5.467 -2.953 689 HB THR 55 HB THR 55 17.088 5.222 -1.002 690 HG1 THR 55 HG1 THR 55 15.485 4.019 -2.439 691 HG21 THR 55 HG21 THR 55 17.542 7.485 -1.894 692 HG22 THR 55 HG22 THR 55 15.944 7.380 -1.156 693 HG23 THR 55 HG23 THR 55 16.107 7.365 -2.913 694 H LEU 56 H LEU 56 18.727 3.761 -1.164 695 HA LEU 56 HA LEU 56 19.149 1.220 -2.313 696 HB2 LEU 56 HB2 LEU 56 18.967 2.054 0.573 697 HB3 LEU 56 HB3 LEU 56 19.488 0.449 0.064 698 HG LEU 56 HG LEU 56 20.844 3.070 -0.630 699 HD11 LEU 56 HD11 LEU 56 21.020 2.330 1.741 700 HD12 LEU 56 HD12 LEU 56 22.571 2.345 0.895 701 HD13 LEU 56 HD13 LEU 56 21.731 0.820 1.172 702 HD21 LEU 56 HD21 LEU 56 21.294 1.552 -2.433 703 HD22 LEU 56 HD22 LEU 56 21.540 0.212 -1.304 704 HD23 LEU 56 HD23 LEU 56 22.711 1.534 -1.374 705 H SER 57 H SER 57 16.530 2.462 -0.350 706 HA SER 57 HA SER 57 15.060 0.150 0.161 707 HB2 SER 57 HB2 SER 57 13.148 1.615 0.527 708 HB3 SER 57 HB3 SER 57 14.596 2.384 1.171 709 HG SER 57 HG SER 57 14.586 3.805 -0.475 710 H ASP 58 H ASP 58 15.219 2.112 -2.745 711 HA ASP 58 HA ASP 58 12.924 1.069 -4.051 712 HB2 ASP 58 HB2 ASP 58 15.358 2.535 -5.032 713 HB3 ASP 58 HB3 ASP 58 14.120 1.963 -6.143 714 H TYR 59 H TYR 59 16.164 -0.116 -3.738 715 HA TYR 59 HA TYR 59 15.724 -2.188 -5.777 716 HB2 TYR 59 HB2 TYR 59 18.182 -1.184 -4.355 717 HB3 TYR 59 HB3 TYR 59 18.190 -2.633 -5.355 718 HD1 TYR 59 HD1 TYR 59 17.504 -2.412 -7.789 719 HD2 TYR 59 HD2 TYR 59 18.437 0.934 -5.318 720 HE1 TYR 59 HE1 TYR 59 18.041 -1.090 -9.795 721 HE2 TYR 59 HE2 TYR 59 18.983 2.264 -7.314 722 HH TYR 59 HH TYR 59 19.281 2.209 -9.515 723 H ASN 60 H ASN 60 15.445 -1.714 -2.492 724 HA ASN 60 HA ASN 60 14.966 -3.030 -0.734 725 HB2 ASN 60 HB2 ASN 60 13.878 -4.416 -2.653 726 HB3 ASN 60 HB3 ASN 60 15.202 -5.535 -2.349 727 HD21 ASN 60 HD21 ASN 60 13.858 -7.133 -1.599 728 HD22 ASN 60 HD22 ASN 60 13.058 -7.045 -0.072 729 H ILE 61 H ILE 61 17.664 -2.372 -1.566 730 HA ILE 61 HA ILE 61 19.456 -4.410 -0.611 731 HB ILE 61 HB ILE 61 19.871 -1.435 -0.980 732 HG12 ILE 61 HG12 ILE 61 20.648 -3.763 -2.741 733 HG13 ILE 61 HG13 ILE 61 19.270 -2.708 -3.025 734 HG21 ILE 61 HG21 ILE 61 21.493 -2.356 0.607 735 HG22 ILE 61 HG22 ILE 61 22.293 -1.910 -0.906 736 HG23 ILE 61 HG23 ILE 61 21.934 -3.606 -0.552 737 HD11 ILE 61 HD11 ILE 61 22.171 -1.857 -3.054 738 HD12 ILE 61 HD12 ILE 61 20.779 -0.825 -3.400 739 HD13 ILE 61 HD13 ILE 61 21.167 -2.171 -4.473 740 H GLN 62 H GLN 62 19.231 -5.085 1.392 741 HA GLN 62 HA GLN 62 18.591 -3.161 3.513 742 HB2 GLN 62 HB2 GLN 62 18.298 -6.168 3.450 743 HB3 GLN 62 HB3 GLN 62 17.836 -5.136 4.796 744 HG2 GLN 62 HG2 GLN 62 16.226 -3.990 3.252 745 HG3 GLN 62 HG3 GLN 62 16.602 -5.218 2.043 746 HE21 GLN 62 HE21 GLN 62 16.896 -7.217 4.304 747 HE22 GLN 62 HE22 GLN 62 15.270 -7.644 4.699 748 H LYS 63 H LYS 63 19.414 -4.455 5.745 749 HA LYS 63 HA LYS 63 22.196 -3.930 5.818 750 HB2 LYS 63 HB2 LYS 63 22.153 -4.733 8.095 751 HB3 LYS 63 HB3 LYS 63 20.692 -3.805 7.801 752 HG2 LYS 63 HG2 LYS 63 19.433 -5.907 7.512 753 HG3 LYS 63 HG3 LYS 63 20.905 -6.814 7.883 754 HD2 LYS 63 HD2 LYS 63 21.017 -5.689 10.079 755 HD3 LYS 63 HD3 LYS 63 19.507 -4.851 9.705 756 HE2 LYS 63 HE2 LYS 63 18.421 -7.095 9.430 757 HE3 LYS 63 HE3 LYS 63 19.913 -7.826 10.040 758 HZ1 LYS 63 HZ1 LYS 63 18.232 -5.854 11.464 759 HZ2 LYS 63 HZ2 LYS 63 19.675 -6.516 12.046 760 HZ3 LYS 63 HZ3 LYS 63 18.326 -7.508 11.805 761 H GLU 64 H GLU 64 23.939 -5.219 5.728 762 HA GLU 64 HA GLU 64 25.291 -7.044 5.483 763 HB2 GLU 64 HB2 GLU 64 22.932 -8.203 6.610 764 HB3 GLU 64 HB3 GLU 64 23.560 -9.285 5.376 765 HG2 GLU 64 HG2 GLU 64 24.426 -9.785 7.615 766 HG3 GLU 64 HG3 GLU 64 25.703 -9.369 6.475 767 H SER 65 H SER 65 23.178 -6.009 3.285 768 HA SER 65 HA SER 65 23.282 -8.044 1.260 769 HB2 SER 65 HB2 SER 65 22.885 -5.048 1.044 770 HB3 SER 65 HB3 SER 65 22.713 -6.163 -0.312 771 HG SER 65 HG SER 65 21.258 -7.018 1.793 772 H THR 66 H THR 66 24.736 -8.333 -0.373 773 HA THR 66 HA THR 66 27.023 -6.485 -0.403 774 HB THR 66 HB THR 66 28.617 -8.034 -0.492 775 HG1 THR 66 HG1 THR 66 28.586 -9.256 -2.167 776 HG21 THR 66 HG21 THR 66 26.658 -8.921 1.260 777 HG22 THR 66 HG22 THR 66 28.342 -9.451 1.220 778 HG23 THR 66 HG23 THR 66 27.107 -10.357 0.342 779 H LEU 67 H LEU 67 27.557 -5.584 -2.113 780 HA LEU 67 HA LEU 67 26.127 -6.053 -4.653 781 HB2 LEU 67 HB2 LEU 67 27.418 -3.634 -3.375 782 HB3 LEU 67 HB3 LEU 67 26.959 -3.644 -5.065 783 HG LEU 67 HG LEU 67 24.594 -3.894 -4.426 784 HD11 LEU 67 HD11 LEU 67 24.943 -5.053 -2.214 785 HD12 LEU 67 HD12 LEU 67 23.807 -3.704 -2.171 786 HD13 LEU 67 HD13 LEU 67 25.449 -3.496 -1.558 787 HD21 LEU 67 HD21 LEU 67 25.544 -1.688 -4.733 788 HD22 LEU 67 HD22 LEU 67 26.069 -1.659 -3.050 789 HD23 LEU 67 HD23 LEU 67 24.346 -1.654 -3.435 790 H HIS 68 H HIS 68 27.426 -5.558 -6.565 791 HA HIS 68 HA HIS 68 30.301 -6.130 -6.222 792 HB2 HIS 68 HB2 HIS 68 28.377 -7.016 -8.366 793 HB3 HIS 68 HB3 HIS 68 30.124 -6.998 -8.648 794 HD1 HIS 68 HD1 HIS 68 27.585 -8.767 -6.449 795 HD2 HIS 68 HD2 HIS 68 31.559 -8.866 -7.518 796 HE1 HIS 68 HE1 HIS 68 28.493 -10.949 -5.528 797 HE2 HIS 68 HE2 HIS 68 30.966 -10.882 -6.092 798 H LEU 69 H LEU 69 31.751 -5.089 -7.438 799 HA LEU 69 HA LEU 69 30.884 -2.574 -8.730 800 HB2 LEU 69 HB2 LEU 69 32.100 -2.173 -6.658 801 HB3 LEU 69 HB3 LEU 69 33.394 -3.247 -7.171 802 HG LEU 69 HG LEU 69 33.898 -1.686 -9.041 803 HD11 LEU 69 HD11 LEU 69 31.968 0.178 -7.665 804 HD12 LEU 69 HD12 LEU 69 31.680 -0.612 -9.217 805 HD13 LEU 69 HD13 LEU 69 33.000 0.552 -9.047 806 HD21 LEU 69 HD21 LEU 69 35.281 -1.525 -7.134 807 HD22 LEU 69 HD22 LEU 69 34.036 -0.681 -6.214 808 HD23 LEU 69 HD23 LEU 69 34.838 0.130 -7.560 809 H VAL 70 H VAL 70 31.343 -2.349 -10.791 810 HA VAL 70 HA VAL 70 33.506 -3.930 -12.021 811 HB VAL 70 HB VAL 70 30.946 -2.806 -13.245 812 HG11 VAL 70 HG11 VAL 70 32.660 -2.518 -14.892 813 HG12 VAL 70 HG12 VAL 70 31.670 -3.896 -15.372 814 HG13 VAL 70 HG13 VAL 70 33.249 -4.161 -14.637 815 HG21 VAL 70 HG21 VAL 70 30.866 -4.983 -11.896 816 HG22 VAL 70 HG22 VAL 70 31.751 -5.700 -13.242 817 HG23 VAL 70 HG23 VAL 70 30.152 -5.000 -13.507 818 H LEU 71 H LEU 71 35.062 -2.708 -13.084 819 HA LEU 71 HA LEU 71 35.026 0.139 -12.465 820 HB2 LEU 71 HB2 LEU 71 36.976 -1.762 -12.187 821 HB3 LEU 71 HB3 LEU 71 37.429 -1.021 -13.712 822 HG LEU 71 HG LEU 71 37.044 1.190 -12.312 823 HD11 LEU 71 HD11 LEU 71 36.320 -0.123 -10.325 824 HD12 LEU 71 HD12 LEU 71 37.641 1.004 -10.016 825 HD13 LEU 71 HD13 LEU 71 37.975 -0.720 -10.183 826 HD21 LEU 71 HD21 LEU 71 39.566 -0.492 -12.475 827 HD22 LEU 71 HD22 LEU 71 39.565 1.115 -11.747 828 HD23 LEU 71 HD23 LEU 71 39.129 0.916 -13.444 Start of MODEL 8 1 H GLY 12 H GLY 12 7.559 -10.291 0.866 2 HA2 GLY 12 HA2 GLY 12 10.289 -10.086 1.728 3 HA3 GLY 12 HA3 GLY 12 10.059 -11.370 0.549 4 HA PRO 13 HA PRO 13 10.619 -8.248 -2.541 5 HB2 PRO 13 HB2 PRO 13 9.423 -9.431 -4.697 6 HB3 PRO 13 HB3 PRO 13 11.024 -9.878 -4.101 7 HG2 PRO 13 HG2 PRO 13 8.399 -11.241 -3.701 8 HG3 PRO 13 HG3 PRO 13 10.009 -11.950 -3.920 9 HD2 PRO 13 HD2 PRO 13 8.754 -11.728 -1.478 10 HD3 PRO 13 HD3 PRO 13 10.515 -11.790 -1.676 11 H MET 14 H MET 14 9.109 -6.878 -1.276 12 HA MET 14 HA MET 14 6.359 -6.761 -2.158 13 HB2 MET 14 HB2 MET 14 7.998 -5.119 -0.215 14 HB3 MET 14 HB3 MET 14 6.334 -4.693 -0.636 15 HG2 MET 14 HG2 MET 14 7.202 -7.373 0.465 16 HG3 MET 14 HG3 MET 14 6.437 -6.087 1.417 17 HE1 MET 14 HE1 MET 14 3.440 -8.312 1.380 18 HE2 MET 14 HE2 MET 14 4.768 -7.551 2.257 19 HE3 MET 14 HE3 MET 14 5.051 -9.030 1.339 20 H LEU 15 H LEU 15 6.537 -6.319 -4.372 21 HA LEU 15 HA LEU 15 8.010 -4.070 -5.369 22 HB2 LEU 15 HB2 LEU 15 6.720 -6.355 -6.464 23 HB3 LEU 15 HB3 LEU 15 5.952 -4.944 -7.191 24 HG LEU 15 HG LEU 15 8.209 -4.061 -7.808 25 HD11 LEU 15 HD11 LEU 15 10.088 -4.980 -6.987 26 HD12 LEU 15 HD12 LEU 15 9.615 -6.572 -7.580 27 HD13 LEU 15 HD13 LEU 15 9.082 -6.029 -5.986 28 HD21 LEU 15 HD21 LEU 15 6.914 -5.330 -9.437 29 HD22 LEU 15 HD22 LEU 15 7.537 -6.847 -8.783 30 HD23 LEU 15 HD23 LEU 15 8.626 -5.726 -9.599 31 H CYS 16 H CYS 16 7.227 -2.080 -6.077 32 HA CYS 16 HA CYS 16 5.426 -0.696 -4.587 33 HB2 CYS 16 HB2 CYS 16 7.058 0.175 -6.366 34 HB3 CYS 16 HB3 CYS 16 5.731 -0.066 -7.517 35 H SER 17 H SER 17 3.318 -0.392 -4.401 36 HA SER 17 HA SER 17 1.462 -2.150 -5.603 37 HB2 SER 17 HB2 SER 17 0.953 0.436 -4.107 38 HB3 SER 17 HB3 SER 17 -0.246 -0.824 -4.425 39 HG SER 17 HG SER 17 1.692 -2.123 -3.359 40 H THR 18 H THR 18 2.475 1.134 -6.387 41 HA THR 18 HA THR 18 0.319 1.672 -8.184 42 HB THR 18 HB THR 18 1.697 3.594 -8.911 43 HG1 THR 18 HG1 THR 18 3.737 2.474 -8.615 44 HG21 THR 18 HG21 THR 18 1.615 3.172 -5.915 45 HG22 THR 18 HG22 THR 18 0.261 3.731 -6.900 46 HG23 THR 18 HG23 THR 18 1.710 4.729 -6.737 47 H GLY 19 H GLY 19 3.114 -0.296 -8.513 48 HA2 GLY 19 HA2 GLY 19 3.776 -1.605 -10.313 49 HA3 GLY 19 HA3 GLY 19 2.463 -0.905 -11.251 50 H CYS 20 H CYS 20 5.208 0.715 -9.643 51 HA CYS 20 HA CYS 20 5.730 2.173 -12.083 52 HB2 CYS 20 HB2 CYS 20 7.243 3.528 -10.771 53 HB3 CYS 20 HB3 CYS 20 5.780 3.262 -9.823 54 H GLY 21 H GLY 21 6.854 -0.774 -10.790 55 HA2 GLY 21 HA2 GLY 21 8.276 -2.232 -12.021 56 HA3 GLY 21 HA3 GLY 21 9.006 -0.833 -12.791 57 H PHE 22 H PHE 22 8.817 -0.219 -9.492 58 HA PHE 22 HA PHE 22 11.531 -1.286 -9.040 59 HB2 PHE 22 HB2 PHE 22 10.377 1.402 -8.309 60 HB3 PHE 22 HB3 PHE 22 11.876 0.777 -7.605 61 HD1 PHE 22 HD1 PHE 22 13.744 0.093 -9.159 62 HD2 PHE 22 HD2 PHE 22 10.392 2.407 -10.450 63 HE1 PHE 22 HE1 PHE 22 15.007 0.789 -11.162 64 HE2 PHE 22 HE2 PHE 22 11.651 3.119 -12.453 65 HZ PHE 22 HZ PHE 22 13.961 2.308 -12.811 66 H TYR 23 H TYR 23 12.100 -1.483 -6.696 67 HA TYR 23 HA TYR 23 10.068 -2.992 -5.373 68 HB2 TYR 23 HB2 TYR 23 12.903 -2.251 -4.721 69 HB3 TYR 23 HB3 TYR 23 11.872 -3.014 -3.506 70 HD1 TYR 23 HD1 TYR 23 12.875 -3.421 -7.067 71 HD2 TYR 23 HD2 TYR 23 11.843 -5.343 -3.400 72 HE1 TYR 23 HE1 TYR 23 13.342 -5.609 -8.101 73 HE2 TYR 23 HE2 TYR 23 12.306 -7.546 -4.416 74 HH TYR 23 HH TYR 23 13.940 -7.910 -7.386 75 H GLY 24 H GLY 24 8.909 -2.524 -3.530 76 HA2 GLY 24 HA2 GLY 24 8.607 0.308 -2.890 77 HA3 GLY 24 HA3 GLY 24 7.564 -1.006 -2.356 78 H ASN 25 H ASN 25 7.561 -0.924 -0.180 79 HA ASN 25 HA ASN 25 9.868 -1.648 1.294 80 HB2 ASN 25 HB2 ASN 25 9.992 0.986 0.712 81 HB3 ASN 25 HB3 ASN 25 8.993 1.050 2.166 82 HD21 ASN 25 HD21 ASN 25 10.644 2.038 3.415 83 HD22 ASN 25 HD22 ASN 25 12.038 1.156 3.923 84 HA PRO 26 HA PRO 26 6.149 -2.721 3.682 85 HB2 PRO 26 HB2 PRO 26 7.366 -4.151 5.636 86 HB3 PRO 26 HB3 PRO 26 7.011 -4.809 4.031 87 HG2 PRO 26 HG2 PRO 26 9.574 -3.701 5.113 88 HG3 PRO 26 HG3 PRO 26 9.316 -5.155 4.128 89 HD2 PRO 26 HD2 PRO 26 10.207 -2.826 3.058 90 HD3 PRO 26 HD3 PRO 26 9.160 -3.934 2.149 91 H ARG 27 H ARG 27 8.959 -0.994 4.814 92 HA ARG 27 HA ARG 27 7.888 -0.280 7.386 93 HB2 ARG 27 HB2 ARG 27 10.097 0.965 5.718 94 HB3 ARG 27 HB3 ARG 27 9.723 1.423 7.381 95 HG2 ARG 27 HG2 ARG 27 10.066 -0.993 8.025 96 HG3 ARG 27 HG3 ARG 27 10.676 -1.268 6.396 97 HD2 ARG 27 HD2 ARG 27 12.605 -0.846 7.743 98 HD3 ARG 27 HD3 ARG 27 12.328 0.610 6.779 99 HE ARG 27 HE ARG 27 10.990 0.501 8.609 100 HH11 ARG 27 HH11 ARG 27 14.308 0.433 8.231 101 HH12 ARG 27 HH12 ARG 27 14.948 1.359 9.548 102 HH21 ARG 27 HH21 ARG 27 11.855 2.198 10.850 103 HH22 ARG 27 HH22 ARG 27 13.573 2.345 11.013 104 H THR 28 H THR 28 8.082 1.259 4.183 105 HA THR 28 HA THR 28 6.632 3.610 5.014 106 HB THR 28 HB THR 28 6.751 4.236 2.631 107 HG1 THR 28 HG1 THR 28 6.705 1.719 2.189 108 HG21 THR 28 HG21 THR 28 9.279 4.061 2.356 109 HG22 THR 28 HG22 THR 28 9.284 3.104 3.836 110 HG23 THR 28 HG23 THR 28 8.718 4.777 3.867 111 H ASN 29 H ASN 29 4.897 3.682 2.571 112 HA ASN 29 HA ASN 29 2.712 2.079 3.642 113 HB2 ASN 29 HB2 ASN 29 2.951 4.370 1.715 114 HB3 ASN 29 HB3 ASN 29 1.472 3.398 1.735 115 HD21 ASN 29 HD21 ASN 29 -0.022 4.522 2.933 116 HD22 ASN 29 HD22 ASN 29 0.301 5.278 4.453 117 H GLY 30 H GLY 30 4.965 0.781 2.101 118 HA2 GLY 30 HA2 GLY 30 4.971 -1.141 0.764 119 HA3 GLY 30 HA3 GLY 30 3.302 -0.807 0.315 120 H MET 31 H MET 31 5.278 1.961 -0.004 121 HA MET 31 HA MET 31 5.584 1.471 -2.899 122 HB2 MET 31 HB2 MET 31 4.528 3.812 -1.363 123 HB3 MET 31 HB3 MET 31 5.365 4.115 -2.896 124 HG2 MET 31 HG2 MET 31 3.087 3.889 -3.473 125 HG3 MET 31 HG3 MET 31 3.815 2.331 -3.897 126 HE1 MET 31 HE1 MET 31 0.038 2.597 -2.012 127 HE2 MET 31 HE2 MET 31 0.774 2.929 -3.579 128 HE3 MET 31 HE3 MET 31 0.971 4.075 -2.252 129 H CYS 32 H CYS 32 7.272 2.768 -3.937 130 HA CYS 32 HA CYS 32 9.727 2.630 -2.502 131 HB2 CYS 32 HB2 CYS 32 10.699 3.549 -4.629 132 HB3 CYS 32 HB3 CYS 32 9.664 2.145 -4.888 133 H SER 33 H SER 33 11.215 4.852 -3.069 134 HA SER 33 HA SER 33 10.178 6.726 -1.159 135 HB2 SER 33 HB2 SER 33 12.325 7.969 -1.661 136 HB3 SER 33 HB3 SER 33 12.546 6.303 -1.121 137 HG SER 33 HG SER 33 12.805 5.719 -3.310 138 H VAL 34 H VAL 34 9.643 6.434 -4.433 139 HA VAL 34 HA VAL 34 9.527 9.297 -4.975 140 HB VAL 34 HB VAL 34 8.991 6.958 -6.810 141 HG11 VAL 34 HG11 VAL 34 9.107 8.609 -8.614 142 HG12 VAL 34 HG12 VAL 34 9.358 9.891 -7.429 143 HG13 VAL 34 HG13 VAL 34 7.821 9.029 -7.480 144 HG21 VAL 34 HG21 VAL 34 11.194 7.480 -7.765 145 HG22 VAL 34 HG22 VAL 34 11.338 7.069 -6.054 146 HG23 VAL 34 HG23 VAL 34 11.411 8.754 -6.568 147 H CYS 35 H CYS 35 7.305 6.508 -5.152 148 HA CYS 35 HA CYS 35 5.005 8.131 -5.652 149 HB2 CYS 35 HB2 CYS 35 5.218 5.235 -4.810 150 HB3 CYS 35 HB3 CYS 35 3.759 6.017 -5.432 151 H TYR 36 H TYR 36 6.576 6.994 -2.774 152 HA TYR 36 HA TYR 36 4.438 7.011 -0.969 153 HB2 TYR 36 HB2 TYR 36 6.618 6.043 -0.408 154 HB3 TYR 36 HB3 TYR 36 7.364 7.641 -0.467 155 HD1 TYR 36 HD1 TYR 36 4.080 6.687 1.084 156 HD2 TYR 36 HD2 TYR 36 8.131 7.966 1.701 157 HE1 TYR 36 HE1 TYR 36 3.608 7.012 3.499 158 HE2 TYR 36 HE2 TYR 36 7.663 8.296 4.114 159 HH TYR 36 HH TYR 36 4.854 7.102 5.645 160 H LYS 37 H LYS 37 6.668 9.694 -1.802 161 HA LYS 37 HA LYS 37 5.348 11.524 -0.048 162 HB2 LYS 37 HB2 LYS 37 6.730 13.269 -1.126 163 HB3 LYS 37 HB3 LYS 37 7.703 11.878 -0.650 164 HG2 LYS 37 HG2 LYS 37 7.611 11.032 -2.968 165 HG3 LYS 37 HG3 LYS 37 6.674 12.461 -3.432 166 HD2 LYS 37 HD2 LYS 37 8.585 13.863 -2.540 167 HD3 LYS 37 HD3 LYS 37 9.523 12.364 -2.435 168 HE2 LYS 37 HE2 LYS 37 8.945 11.987 -4.886 169 HE3 LYS 37 HE3 LYS 37 8.371 13.665 -4.900 170 HZ1 LYS 37 HZ1 LYS 37 10.550 14.392 -4.165 171 HZ2 LYS 37 HZ2 LYS 37 10.679 13.524 -5.611 172 HZ3 LYS 37 HZ3 LYS 37 11.110 12.796 -4.147 173 H GLU 38 H GLU 38 5.251 10.902 -3.525 174 HA GLU 38 HA GLU 38 3.618 12.988 -4.351 175 HB2 GLU 38 HB2 GLU 38 4.051 10.190 -5.366 176 HB3 GLU 38 HB3 GLU 38 2.860 11.248 -6.138 177 HG2 GLU 38 HG2 GLU 38 5.671 12.194 -5.622 178 HG3 GLU 38 HG3 GLU 38 5.253 11.283 -7.083 179 H HIS 39 H HIS 39 2.662 9.848 -2.944 180 HA HIS 39 HA HIS 39 -0.134 10.532 -3.294 181 HB2 HIS 39 HB2 HIS 39 -0.692 8.329 -2.654 182 HB3 HIS 39 HB3 HIS 39 0.802 8.165 -3.567 183 HD1 HIS 39 HD1 HIS 39 2.110 6.341 -2.555 184 HD2 HIS 39 HD2 HIS 39 0.268 8.667 0.377 185 HE1 HIS 39 HE1 HIS 39 2.719 5.305 -0.332 186 HE2 HIS 39 HE2 HIS 39 1.915 6.943 1.429 187 H LEU 40 H LEU 40 2.209 10.504 -0.701 188 HA LEU 40 HA LEU 40 0.454 10.740 1.495 189 HB2 LEU 40 HB2 LEU 40 2.964 10.278 1.539 190 HB3 LEU 40 HB3 LEU 40 3.187 12.017 1.315 191 HG LEU 40 HG LEU 40 1.668 12.333 3.354 192 HD11 LEU 40 HD11 LEU 40 0.799 9.972 3.294 193 HD12 LEU 40 HD12 LEU 40 1.459 10.452 4.860 194 HD13 LEU 40 HD13 LEU 40 2.409 9.430 3.784 195 HD21 LEU 40 HD21 LEU 40 3.563 11.761 4.933 196 HD22 LEU 40 HD22 LEU 40 4.030 12.754 3.550 197 HD23 LEU 40 HD23 LEU 40 4.388 11.029 3.559 198 H GLN 41 H GLN 41 1.622 13.103 -0.813 199 HA GLN 41 HA GLN 41 0.997 15.449 0.642 200 HB2 GLN 41 HB2 GLN 41 1.597 14.771 -2.202 201 HB3 GLN 41 HB3 GLN 41 0.835 16.334 -1.879 202 HG2 GLN 41 HG2 GLN 41 2.605 16.928 -0.324 203 HG3 GLN 41 HG3 GLN 41 3.351 15.337 -0.527 204 HE21 GLN 41 HE21 GLN 41 2.875 18.462 -2.016 205 HE22 GLN 41 HE22 GLN 41 3.960 18.192 -3.332 206 H ARG 42 H ARG 42 -0.893 13.460 -1.609 207 HA ARG 42 HA ARG 42 -3.157 15.246 -1.582 208 HB2 ARG 42 HB2 ARG 42 -2.723 12.458 -2.656 209 HB3 ARG 42 HB3 ARG 42 -4.282 13.290 -2.770 210 HG2 ARG 42 HG2 ARG 42 -3.368 15.032 -4.106 211 HG3 ARG 42 HG3 ARG 42 -1.712 14.520 -3.748 212 HD2 ARG 42 HD2 ARG 42 -2.233 12.341 -4.882 213 HD3 ARG 42 HD3 ARG 42 -3.758 13.056 -5.420 214 HE ARG 42 HE ARG 42 -1.093 13.311 -6.185 215 HH11 ARG 42 HH11 ARG 42 -4.283 15.051 -5.916 216 HH12 ARG 42 HH12 ARG 42 -4.090 16.222 -7.178 217 HH21 ARG 42 HH21 ARG 42 -0.977 15.087 -8.160 218 HH22 ARG 42 HH22 ARG 42 -2.239 16.240 -8.434 219 H GLN 43 H GLN 43 -2.147 12.386 0.174 220 HA GLN 43 HA GLN 43 -4.705 11.857 1.357 221 HB2 GLN 43 HB2 GLN 43 -2.650 10.267 1.021 222 HB3 GLN 43 HB3 GLN 43 -2.098 10.953 2.554 223 HG2 GLN 43 HG2 GLN 43 -3.316 9.151 3.317 224 HG3 GLN 43 HG3 GLN 43 -4.563 10.406 3.322 225 HE21 GLN 43 HE21 GLN 43 -6.260 8.862 2.976 226 HE22 GLN 43 HE22 GLN 43 -6.459 8.072 1.453 227 H GLN 44 H GLN 44 -1.784 13.618 2.268 228 HA GLN 44 HA GLN 44 -2.612 14.181 4.948 229 HB2 GLN 44 HB2 GLN 44 -0.217 14.192 3.970 230 HB3 GLN 44 HB3 GLN 44 -0.608 15.826 3.415 231 HG2 GLN 44 HG2 GLN 44 -1.023 16.582 5.644 232 HG3 GLN 44 HG3 GLN 44 -0.959 14.929 6.274 233 HE21 GLN 44 HE21 GLN 44 1.159 17.048 4.302 234 HE22 GLN 44 HE22 GLN 44 2.596 16.624 5.160 235 H ASN 45 H ASN 45 -2.727 15.944 1.871 236 HA ASN 45 HA ASN 45 -3.672 18.398 2.932 237 HB2 ASN 45 HB2 ASN 45 -3.620 17.159 0.193 238 HB3 ASN 45 HB3 ASN 45 -4.536 18.646 0.461 239 HD21 ASN 45 HD21 ASN 45 -1.942 18.132 -1.031 240 HD22 ASN 45 HD22 ASN 45 -0.837 19.270 -0.346 241 H SER 46 H SER 46 -5.327 15.553 1.599 242 HA SER 46 HA SER 46 -7.949 16.686 1.832 243 HB2 SER 46 HB2 SER 46 -7.123 14.740 0.299 244 HB3 SER 46 HB3 SER 46 -7.428 13.727 1.717 245 HG SER 46 HG SER 46 -9.270 15.362 0.312 246 H1 MET 1 H1 MET 1 21.631 1.185 9.610 247 H2 MET 1 H2 MET 1 22.356 1.638 8.152 248 H3 MET 1 H3 MET 1 23.284 1.536 9.561 249 HA MET 1 HA MET 1 22.938 -0.825 9.675 250 HB2 MET 1 HB2 MET 1 21.764 -2.000 7.920 251 HB3 MET 1 HB3 MET 1 20.697 -0.765 8.573 252 HG2 MET 1 HG2 MET 1 21.204 0.680 6.662 253 HG3 MET 1 HG3 MET 1 22.274 -0.553 6.011 254 HE1 MET 1 HE1 MET 1 19.600 -0.947 3.360 255 HE2 MET 1 HE2 MET 1 21.318 -0.868 3.756 256 HE3 MET 1 HE3 MET 1 20.285 0.535 4.028 257 H GLN 2 H GLN 2 24.559 -2.135 8.823 258 HA GLN 2 HA GLN 2 26.284 -0.810 6.855 259 HB2 GLN 2 HB2 GLN 2 28.052 -2.153 7.595 260 HB3 GLN 2 HB3 GLN 2 27.161 -1.768 9.060 261 HG2 GLN 2 HG2 GLN 2 26.110 -3.965 9.025 262 HG3 GLN 2 HG3 GLN 2 26.930 -4.350 7.514 263 HE21 GLN 2 HE21 GLN 2 29.345 -2.871 8.612 264 HE22 GLN 2 HE22 GLN 2 30.094 -4.024 9.660 265 H ILE 3 H ILE 3 26.835 -1.653 4.955 266 HA ILE 3 HA ILE 3 25.897 -4.333 4.251 267 HB ILE 3 HB ILE 3 25.019 -3.828 2.206 268 HG12 ILE 3 HG12 ILE 3 26.617 -2.270 1.318 269 HG13 ILE 3 HG13 ILE 3 24.975 -1.744 1.003 270 HG21 ILE 3 HG21 ILE 3 23.470 -3.357 3.980 271 HG22 ILE 3 HG22 ILE 3 23.129 -2.383 2.550 272 HG23 ILE 3 HG23 ILE 3 23.925 -1.654 3.944 273 HD11 ILE 3 HD11 ILE 3 26.974 -0.157 1.875 274 HD12 ILE 3 HD12 ILE 3 26.218 -0.588 3.408 275 HD13 ILE 3 HD13 ILE 3 25.258 0.179 2.138 276 H PHE 4 H PHE 4 27.095 -5.195 2.383 277 HA PHE 4 HA PHE 4 29.895 -4.239 2.505 278 HB2 PHE 4 HB2 PHE 4 28.926 -7.056 1.930 279 HB3 PHE 4 HB3 PHE 4 30.593 -6.549 2.261 280 HD1 PHE 4 HD1 PHE 4 31.101 -5.551 4.579 281 HD2 PHE 4 HD2 PHE 4 27.488 -7.647 3.663 282 HE1 PHE 4 HE1 PHE 4 30.655 -5.843 6.992 283 HE2 PHE 4 HE2 PHE 4 27.052 -7.961 6.077 284 HZ PHE 4 HZ PHE 4 28.636 -7.049 7.741 285 H VAL 5 H VAL 5 30.991 -3.916 0.685 286 HA VAL 5 HA VAL 5 29.710 -4.499 -1.917 287 HB VAL 5 HB VAL 5 31.424 -2.093 -1.221 288 HG11 VAL 5 HG11 VAL 5 31.889 -2.656 -3.492 289 HG12 VAL 5 HG12 VAL 5 30.732 -1.326 -3.535 290 HG13 VAL 5 HG13 VAL 5 30.190 -2.980 -3.831 291 HG21 VAL 5 HG21 VAL 5 28.569 -2.020 -2.164 292 HG22 VAL 5 HG22 VAL 5 29.508 -0.746 -1.378 293 HG23 VAL 5 HG23 VAL 5 28.965 -2.145 -0.451 294 H LYS 6 H LYS 6 30.720 -6.289 -2.433 295 HA LYS 6 HA LYS 6 33.533 -6.781 -2.018 296 HB2 LYS 6 HB2 LYS 6 31.410 -8.166 -3.672 297 HB3 LYS 6 HB3 LYS 6 33.050 -8.768 -3.470 298 HG2 LYS 6 HG2 LYS 6 32.707 -9.051 -1.089 299 HG3 LYS 6 HG3 LYS 6 31.089 -8.343 -1.212 300 HD2 LYS 6 HD2 LYS 6 30.981 -10.802 -1.156 301 HD3 LYS 6 HD3 LYS 6 30.396 -10.165 -2.695 302 HE2 LYS 6 HE2 LYS 6 32.725 -10.584 -3.611 303 HE3 LYS 6 HE3 LYS 6 33.053 -11.484 -2.127 304 HZ1 LYS 6 HZ1 LYS 6 30.926 -12.067 -4.093 305 HZ2 LYS 6 HZ2 LYS 6 31.194 -12.921 -2.658 306 HZ3 LYS 6 HZ3 LYS 6 32.360 -12.941 -3.883 307 H THR 7 H THR 7 35.148 -6.325 -3.317 308 HA THR 7 HA THR 7 34.607 -5.432 -6.079 309 HB THR 7 HB THR 7 36.813 -4.457 -6.110 310 HG1 THR 7 HG1 THR 7 37.125 -6.055 -3.849 311 HG21 THR 7 HG21 THR 7 35.833 -3.740 -3.360 312 HG22 THR 7 HG22 THR 7 34.936 -3.249 -4.800 313 HG23 THR 7 HG23 THR 7 36.596 -2.696 -4.559 314 H LEU 8 H LEU 8 36.334 -6.184 -7.656 315 HA LEU 8 HA LEU 8 36.189 -9.048 -7.606 316 HB2 LEU 8 HB2 LEU 8 37.262 -7.247 -9.762 317 HB3 LEU 8 HB3 LEU 8 36.873 -8.958 -9.934 318 HG LEU 8 HG LEU 8 34.938 -6.732 -9.284 319 HD11 LEU 8 HD11 LEU 8 35.757 -6.900 -11.636 320 HD12 LEU 8 HD12 LEU 8 34.011 -7.079 -11.442 321 HD13 LEU 8 HD13 LEU 8 35.020 -8.499 -11.710 322 HD21 LEU 8 HD21 LEU 8 34.525 -9.704 -9.321 323 HD22 LEU 8 HD22 LEU 8 33.208 -8.594 -9.697 324 HD23 LEU 8 HD23 LEU 8 33.997 -8.526 -8.121 325 H THR 9 H THR 9 38.645 -6.817 -6.897 326 HA THR 9 HA THR 9 40.931 -8.467 -7.008 327 HB THR 9 HB THR 9 41.753 -7.085 -5.073 328 HG1 THR 9 HG1 THR 9 39.292 -5.712 -5.440 329 HG21 THR 9 HG21 THR 9 40.719 -5.717 -7.549 330 HG22 THR 9 HG22 THR 9 42.332 -6.378 -7.279 331 HG23 THR 9 HG23 THR 9 41.805 -4.945 -6.397 332 H GLY 10 H GLY 10 38.273 -8.282 -4.760 333 HA2 GLY 10 HA2 GLY 10 37.669 -10.429 -3.633 334 HA3 GLY 10 HA3 GLY 10 39.361 -10.535 -3.165 335 H LYS 11 H LYS 11 39.408 -7.567 -2.712 336 HA LYS 11 HA LYS 11 38.880 -7.458 0.050 337 HB2 LYS 11 HB2 LYS 11 40.369 -5.912 -1.401 338 HB3 LYS 11 HB3 LYS 11 38.881 -5.017 -1.723 339 HG2 LYS 11 HG2 LYS 11 38.828 -5.351 1.017 340 HG3 LYS 11 HG3 LYS 11 40.533 -5.064 0.683 341 HD2 LYS 11 HD2 LYS 11 38.289 -3.297 -0.290 342 HD3 LYS 11 HD3 LYS 11 39.190 -3.012 1.193 343 HE2 LYS 11 HE2 LYS 11 40.482 -3.166 -1.527 344 HE3 LYS 11 HE3 LYS 11 39.919 -1.660 -0.806 345 HZ1 LYS 11 HZ1 LYS 11 41.975 -3.476 0.300 346 HZ2 LYS 11 HZ2 LYS 11 41.405 -2.074 1.058 347 HZ3 LYS 11 HZ3 LYS 11 42.245 -1.963 -0.407 348 H THR 12 H THR 12 37.267 -6.488 1.218 349 HA THR 12 HA THR 12 34.693 -5.957 -0.160 350 HB THR 12 HB THR 12 35.184 -7.266 2.528 351 HG1 THR 12 HG1 THR 12 35.343 -8.882 1.147 352 HG21 THR 12 HG21 THR 12 32.547 -6.645 1.182 353 HG22 THR 12 HG22 THR 12 33.148 -5.894 2.661 354 HG23 THR 12 HG23 THR 12 32.740 -7.610 2.641 355 H ILE 13 H ILE 13 33.898 -4.048 0.145 356 HA ILE 13 HA ILE 13 35.018 -2.196 2.143 357 HB ILE 13 HB ILE 13 32.778 -1.470 0.310 358 HG12 ILE 13 HG12 ILE 13 34.183 -2.512 -1.312 359 HG13 ILE 13 HG13 ILE 13 34.335 -0.774 -1.495 360 HG21 ILE 13 HG21 ILE 13 33.562 0.110 1.977 361 HG22 ILE 13 HG22 ILE 13 33.777 0.733 0.344 362 HG23 ILE 13 HG23 ILE 13 35.165 0.112 1.240 363 HD11 ILE 13 HD11 ILE 13 36.481 -1.964 -1.774 364 HD12 ILE 13 HD12 ILE 13 36.334 -2.566 -0.125 365 HD13 ILE 13 HD13 ILE 13 36.520 -0.836 -0.411 366 H THR 14 H THR 14 33.947 -1.817 3.997 367 HA THR 14 HA THR 14 31.114 -2.631 4.241 368 HB THR 14 HB THR 14 33.108 -1.859 6.391 369 HG1 THR 14 HG1 THR 14 33.564 -3.892 5.535 370 HG21 THR 14 HG21 THR 14 30.766 -1.325 7.015 371 HG22 THR 14 HG22 THR 14 31.446 -2.619 8.002 372 HG23 THR 14 HG23 THR 14 30.326 -3.001 6.696 373 H LEU 15 H LEU 15 29.598 -1.154 4.300 374 HA LEU 15 HA LEU 15 30.322 1.680 4.737 375 HB2 LEU 15 HB2 LEU 15 28.258 0.563 2.843 376 HB3 LEU 15 HB3 LEU 15 28.524 2.277 3.132 377 HG LEU 15 HG LEU 15 30.606 0.395 1.998 378 HD11 LEU 15 HD11 LEU 15 28.927 2.446 0.559 379 HD12 LEU 15 HD12 LEU 15 28.593 0.713 0.538 380 HD13 LEU 15 HD13 LEU 15 30.098 1.340 -0.157 381 HD21 LEU 15 HD21 LEU 15 30.560 3.288 2.699 382 HD22 LEU 15 HD22 LEU 15 31.401 2.817 1.219 383 HD23 LEU 15 HD23 LEU 15 31.889 2.127 2.766 384 H GLU 16 H GLU 16 29.066 2.874 5.995 385 HA GLU 16 HA GLU 16 26.725 1.696 7.342 386 HB2 GLU 16 HB2 GLU 16 28.445 2.710 8.787 387 HB3 GLU 16 HB3 GLU 16 28.316 4.223 7.898 388 HG2 GLU 16 HG2 GLU 16 27.114 4.357 10.016 389 HG3 GLU 16 HG3 GLU 16 26.009 4.488 8.651 390 H VAL 17 H VAL 17 24.906 2.016 6.316 391 HA VAL 17 HA VAL 17 24.401 4.577 4.953 392 HB VAL 17 HB VAL 17 23.357 3.426 3.098 393 HG11 VAL 17 HG11 VAL 17 25.821 3.977 3.084 394 HG12 VAL 17 HG12 VAL 17 25.288 2.758 1.920 395 HG13 VAL 17 HG13 VAL 17 26.100 2.261 3.407 396 HG21 VAL 17 HG21 VAL 17 24.299 0.836 4.308 397 HG22 VAL 17 HG22 VAL 17 23.455 1.034 2.769 398 HG23 VAL 17 HG23 VAL 17 22.631 1.410 4.285 399 H GLU 18 H GLU 18 22.100 4.711 4.254 400 HA GLU 18 HA GLU 18 20.147 3.443 6.075 401 HB2 GLU 18 HB2 GLU 18 20.079 6.184 4.766 402 HB3 GLU 18 HB3 GLU 18 18.759 5.488 5.700 403 HG2 GLU 18 HG2 GLU 18 21.507 6.175 6.730 404 HG3 GLU 18 HG3 GLU 18 20.025 7.063 7.053 405 H SER 19 H SER 19 18.170 2.794 5.067 406 HA SER 19 HA SER 19 18.290 1.781 2.448 407 HB2 SER 19 HB2 SER 19 15.829 2.414 4.101 408 HB3 SER 19 HB3 SER 19 15.845 1.431 2.634 409 HG SER 19 HG SER 19 16.870 0.849 5.179 410 H SER 20 H SER 20 17.222 4.843 3.649 411 HA SER 20 HA SER 20 15.936 5.812 1.313 412 HB2 SER 20 HB2 SER 20 16.143 8.050 2.456 413 HB3 SER 20 HB3 SER 20 15.309 6.795 3.376 414 HG SER 20 HG SER 20 17.899 7.861 3.758 415 H ASP 21 H ASP 21 19.245 5.414 1.918 416 HA ASP 21 HA ASP 21 20.306 7.665 0.564 417 HB2 ASP 21 HB2 ASP 21 21.432 4.903 0.992 418 HB3 ASP 21 HB3 ASP 21 22.340 6.192 0.208 419 H THR 22 H THR 22 20.439 8.201 -1.436 420 HA THR 22 HA THR 22 19.373 6.647 -3.593 421 HB THR 22 HB THR 22 20.202 8.384 -5.065 422 HG1 THR 22 HG1 THR 22 21.644 9.925 -4.401 423 HG21 THR 22 HG21 THR 22 19.108 9.562 -2.512 424 HG22 THR 22 HG22 THR 22 18.168 8.945 -3.872 425 HG23 THR 22 HG23 THR 22 19.158 10.391 -4.067 426 H ILE 23 H ILE 23 20.555 5.719 -5.344 427 HA ILE 23 HA ILE 23 22.829 4.206 -4.683 428 HB ILE 23 HB ILE 23 21.712 4.962 -7.363 429 HG12 ILE 23 HG12 ILE 23 20.120 3.766 -6.058 430 HG13 ILE 23 HG13 ILE 23 20.721 2.692 -7.314 431 HG21 ILE 23 HG21 ILE 23 22.898 3.016 -8.315 432 HG22 ILE 23 HG22 ILE 23 23.774 2.840 -6.789 433 HG23 ILE 23 HG23 ILE 23 23.969 4.301 -7.759 434 HD11 ILE 23 HD11 ILE 23 20.530 1.389 -5.355 435 HD12 ILE 23 HD12 ILE 23 21.300 2.627 -4.362 436 HD13 ILE 23 HD13 ILE 23 22.257 1.713 -5.529 437 H ASP 24 H ASP 24 22.528 7.259 -6.390 438 HA ASP 24 HA ASP 24 25.198 7.714 -7.094 439 HB2 ASP 24 HB2 ASP 24 23.340 9.093 -7.912 440 HB3 ASP 24 HB3 ASP 24 23.073 9.710 -6.279 441 H ASN 25 H ASN 25 23.483 8.395 -4.098 442 HA ASN 25 HA ASN 25 25.539 9.705 -2.682 443 HB2 ASN 25 HB2 ASN 25 23.217 9.825 -1.996 444 HB3 ASN 25 HB3 ASN 25 23.172 8.086 -1.735 445 HD21 ASN 25 HD21 ASN 25 23.074 7.661 0.268 446 HD22 ASN 25 HD22 ASN 25 23.944 8.420 1.552 447 H VAL 26 H VAL 26 24.671 6.284 -2.916 448 HA VAL 26 HA VAL 26 26.560 5.242 -1.087 449 HB VAL 26 HB VAL 26 25.201 3.992 -3.477 450 HG11 VAL 26 HG11 VAL 26 25.832 1.789 -2.479 451 HG12 VAL 26 HG12 VAL 26 26.915 2.640 -1.377 452 HG13 VAL 26 HG13 VAL 26 27.214 2.681 -3.116 453 HG21 VAL 26 HG21 VAL 26 24.687 3.160 -0.677 454 HG22 VAL 26 HG22 VAL 26 23.574 3.304 -2.042 455 HG23 VAL 26 HG23 VAL 26 24.092 4.747 -1.169 456 H LYS 27 H LYS 27 26.732 5.674 -4.615 457 HA LYS 27 HA LYS 27 29.308 4.663 -5.030 458 HB2 LYS 27 HB2 LYS 27 27.761 6.765 -6.559 459 HB3 LYS 27 HB3 LYS 27 29.283 6.066 -7.116 460 HG2 LYS 27 HG2 LYS 27 28.288 3.833 -7.079 461 HG3 LYS 27 HG3 LYS 27 26.755 4.521 -6.531 462 HD2 LYS 27 HD2 LYS 27 26.565 5.806 -8.583 463 HD3 LYS 27 HD3 LYS 27 28.135 5.199 -9.140 464 HE2 LYS 27 HE2 LYS 27 27.270 2.930 -9.165 465 HE3 LYS 27 HE3 LYS 27 25.703 3.478 -8.548 466 HZ1 LYS 27 HZ1 LYS 27 26.951 4.257 -11.119 467 HZ2 LYS 27 HZ2 LYS 27 25.447 4.787 -10.553 468 HZ3 LYS 27 HZ3 LYS 27 25.682 3.155 -10.932 469 H SER 28 H SER 28 28.252 7.899 -4.168 470 HA SER 28 HA SER 28 30.751 9.209 -4.133 471 HB2 SER 28 HB2 SER 28 28.577 10.397 -4.026 472 HB3 SER 28 HB3 SER 28 28.342 9.773 -2.388 473 HG SER 28 HG SER 28 29.414 11.517 -1.842 474 H LYS 29 H LYS 29 29.047 7.364 -1.646 475 HA LYS 29 HA LYS 29 30.913 7.658 0.457 476 HB2 LYS 29 HB2 LYS 29 28.989 5.403 -0.128 477 HB3 LYS 29 HB3 LYS 29 29.938 5.528 1.349 478 HG2 LYS 29 HG2 LYS 29 28.829 7.640 1.897 479 HG3 LYS 29 HG3 LYS 29 27.881 7.527 0.406 480 HD2 LYS 29 HD2 LYS 29 26.958 5.369 1.188 481 HD3 LYS 29 HD3 LYS 29 27.856 5.555 2.692 482 HE2 LYS 29 HE2 LYS 29 25.792 7.523 1.731 483 HE3 LYS 29 HE3 LYS 29 25.423 6.183 2.814 484 HZ1 LYS 29 HZ1 LYS 29 25.777 8.216 4.021 485 HZ2 LYS 29 HZ2 LYS 29 27.315 8.396 3.339 486 HZ3 LYS 29 HZ3 LYS 29 27.000 7.106 4.388 487 H ILE 30 H ILE 30 30.778 5.419 -2.248 488 HA ILE 30 HA ILE 30 32.956 3.748 -1.491 489 HB ILE 30 HB ILE 30 31.655 4.287 -4.144 490 HG12 ILE 30 HG12 ILE 30 31.625 1.874 -2.331 491 HG13 ILE 30 HG13 ILE 30 30.370 3.100 -2.404 492 HG21 ILE 30 HG21 ILE 30 34.114 3.627 -4.364 493 HG22 ILE 30 HG22 ILE 30 32.942 2.642 -5.239 494 HG23 ILE 30 HG23 ILE 30 33.632 2.055 -3.725 495 HD11 ILE 30 HD11 ILE 30 29.619 1.195 -3.636 496 HD12 ILE 30 HD12 ILE 30 31.121 1.130 -4.556 497 HD13 ILE 30 HD13 ILE 30 29.994 2.468 -4.801 498 H GLN 31 H GLN 31 32.713 6.610 -3.565 499 HA GLN 31 HA GLN 31 35.409 6.892 -4.280 500 HB2 GLN 31 HB2 GLN 31 33.531 8.178 -5.254 501 HB3 GLN 31 HB3 GLN 31 33.371 9.062 -3.736 502 HG2 GLN 31 HG2 GLN 31 35.654 9.927 -3.993 503 HG3 GLN 31 HG3 GLN 31 35.805 9.056 -5.521 504 HE21 GLN 31 HE21 GLN 31 36.117 10.866 -6.708 505 HE22 GLN 31 HE22 GLN 31 34.878 12.024 -7.037 506 H ASP 32 H ASP 32 33.667 7.871 -1.397 507 HA ASP 32 HA ASP 32 35.753 9.318 -0.166 508 HB2 ASP 32 HB2 ASP 32 33.201 8.145 0.875 509 HB3 ASP 32 HB3 ASP 32 34.358 8.938 1.948 510 H LYS 33 H LYS 33 35.182 5.899 -0.279 511 HA LYS 33 HA LYS 33 37.223 5.494 1.788 512 HB2 LYS 33 HB2 LYS 33 35.215 3.612 0.597 513 HB3 LYS 33 HB3 LYS 33 36.585 3.035 1.548 514 HG2 LYS 33 HG2 LYS 33 35.764 4.752 3.319 515 HG3 LYS 33 HG3 LYS 33 34.242 4.686 2.425 516 HD2 LYS 33 HD2 LYS 33 34.115 3.081 4.216 517 HD3 LYS 33 HD3 LYS 33 34.277 2.196 2.697 518 HE2 LYS 33 HE2 LYS 33 36.674 1.899 3.105 519 HE3 LYS 33 HE3 LYS 33 36.540 2.814 4.607 520 HZ1 LYS 33 HZ1 LYS 33 35.087 1.120 5.469 521 HZ2 LYS 33 HZ2 LYS 33 36.569 0.454 4.997 522 HZ3 LYS 33 HZ3 LYS 33 35.200 0.247 4.024 523 H GLU 34 H GLU 34 36.648 4.811 -1.606 524 HA GLU 34 HA GLU 34 39.196 3.363 -1.754 525 HB2 GLU 34 HB2 GLU 34 36.772 3.301 -3.539 526 HB3 GLU 34 HB3 GLU 34 38.298 2.522 -3.946 527 HG2 GLU 34 HG2 GLU 34 36.667 1.953 -1.475 528 HG3 GLU 34 HG3 GLU 34 36.718 0.948 -2.919 529 H GLY 35 H GLY 35 37.575 6.141 -3.040 530 HA2 GLY 35 HA2 GLY 35 38.618 8.022 -4.034 531 HA3 GLY 35 HA3 GLY 35 40.013 7.024 -4.419 532 H ILE 36 H ILE 36 37.341 5.295 -5.237 533 HA ILE 36 HA ILE 36 37.739 5.538 -8.055 534 HB ILE 36 HB ILE 36 35.501 4.108 -6.605 535 HG12 ILE 36 HG12 ILE 36 38.098 2.978 -7.678 536 HG13 ILE 36 HG13 ILE 36 37.829 3.379 -5.984 537 HG21 ILE 36 HG21 ILE 36 35.254 2.824 -8.682 538 HG22 ILE 36 HG22 ILE 36 36.549 3.763 -9.427 539 HG23 ILE 36 HG23 ILE 36 35.033 4.549 -8.989 540 HD11 ILE 36 HD11 ILE 36 36.545 1.190 -7.607 541 HD12 ILE 36 HD12 ILE 36 35.873 1.741 -6.070 542 HD13 ILE 36 HD13 ILE 36 37.496 1.061 -6.126 543 HA PRO 37 HA PRO 37 35.007 9.025 -8.814 544 HB2 PRO 37 HB2 PRO 37 35.299 7.825 -11.545 545 HB3 PRO 37 HB3 PRO 37 35.391 9.528 -11.060 546 HG2 PRO 37 HG2 PRO 37 37.670 8.227 -11.544 547 HG3 PRO 37 HG3 PRO 37 37.559 9.242 -10.084 548 HD2 PRO 37 HD2 PRO 37 37.292 6.244 -10.317 549 HD3 PRO 37 HD3 PRO 37 38.173 7.191 -9.105 550 HA PRO 38 HA PRO 38 31.182 6.715 -8.483 551 HB2 PRO 38 HB2 PRO 38 30.124 9.410 -9.220 552 HB3 PRO 38 HB3 PRO 38 29.581 8.307 -7.940 553 HG2 PRO 38 HG2 PRO 38 31.109 10.386 -7.257 554 HG3 PRO 38 HG3 PRO 38 31.498 8.783 -6.581 555 HD2 PRO 38 HD2 PRO 38 32.805 10.216 -8.896 556 HD3 PRO 38 HD3 PRO 38 33.566 9.319 -7.570 557 H ASP 39 H ASP 39 31.733 8.908 -11.179 558 HA ASP 39 HA ASP 39 29.740 7.760 -12.885 559 HB2 ASP 39 HB2 ASP 39 30.648 9.323 -14.571 560 HB3 ASP 39 HB3 ASP 39 30.220 10.098 -13.059 561 H GLN 40 H GLN 40 32.244 6.206 -11.915 562 HA GLN 40 HA GLN 40 32.624 4.792 -14.447 563 HB2 GLN 40 HB2 GLN 40 34.638 6.142 -13.688 564 HB3 GLN 40 HB3 GLN 40 34.723 5.031 -12.321 565 HG2 GLN 40 HG2 GLN 40 34.759 3.163 -14.070 566 HG3 GLN 40 HG3 GLN 40 35.139 4.426 -15.238 567 HE21 GLN 40 HE21 GLN 40 36.260 4.489 -11.925 568 HE22 GLN 40 HE22 GLN 40 37.928 4.214 -12.282 569 H GLN 41 H GLN 41 31.178 4.591 -11.638 570 HA GLN 41 HA GLN 41 31.777 1.824 -10.981 571 HB2 GLN 41 HB2 GLN 41 30.011 3.888 -9.636 572 HB3 GLN 41 HB3 GLN 41 30.397 2.300 -8.977 573 HG2 GLN 41 HG2 GLN 41 32.762 2.953 -8.813 574 HG3 GLN 41 HG3 GLN 41 32.357 4.545 -9.471 575 HE21 GLN 41 HE21 GLN 41 32.813 5.774 -7.731 576 HE22 GLN 41 HE22 GLN 41 31.993 5.671 -6.214 577 H ARG 42 H ARG 42 30.454 0.254 -11.525 578 HA ARG 42 HA ARG 42 27.604 0.797 -12.117 579 HB2 ARG 42 HB2 ARG 42 29.444 -1.276 -13.345 580 HB3 ARG 42 HB3 ARG 42 27.694 -1.270 -13.579 581 HG2 ARG 42 HG2 ARG 42 27.799 0.860 -14.694 582 HG3 ARG 42 HG3 ARG 42 29.510 1.028 -14.307 583 HD2 ARG 42 HD2 ARG 42 29.368 0.369 -16.582 584 HD3 ARG 42 HD3 ARG 42 29.931 -1.038 -15.682 585 HE ARG 42 HE ARG 42 27.108 -1.096 -15.964 586 HH11 ARG 42 HH11 ARG 42 30.019 -1.568 -17.854 587 HH12 ARG 42 HH12 ARG 42 29.251 -2.622 -18.994 588 HH21 ARG 42 HH21 ARG 42 26.112 -2.424 -17.532 589 HH22 ARG 42 HH22 ARG 42 27.060 -3.101 -18.811 590 H LEU 43 H LEU 43 26.529 0.188 -10.390 591 HA LEU 43 HA LEU 43 27.508 -2.014 -8.714 592 HB2 LEU 43 HB2 LEU 43 25.357 0.038 -8.198 593 HB3 LEU 43 HB3 LEU 43 25.824 -1.220 -7.064 594 HG LEU 43 HG LEU 43 27.582 1.040 -8.044 595 HD11 LEU 43 HD11 LEU 43 25.782 1.657 -6.448 596 HD12 LEU 43 HD12 LEU 43 27.400 1.860 -5.769 597 HD13 LEU 43 HD13 LEU 43 26.420 0.464 -5.316 598 HD21 LEU 43 HD21 LEU 43 29.106 0.199 -6.191 599 HD22 LEU 43 HD22 LEU 43 29.043 -0.803 -7.647 600 HD23 LEU 43 HD23 LEU 43 28.150 -1.284 -6.201 601 H ILE 44 H ILE 44 26.484 -3.827 -8.349 602 HA ILE 44 HA ILE 44 23.932 -4.353 -9.750 603 HB ILE 44 HB ILE 44 26.360 -6.128 -9.486 604 HG12 ILE 44 HG12 ILE 44 25.972 -6.364 -11.992 605 HG13 ILE 44 HG13 ILE 44 24.870 -5.003 -11.845 606 HG21 ILE 44 HG21 ILE 44 24.174 -7.384 -9.081 607 HG22 ILE 44 HG22 ILE 44 25.233 -8.005 -10.348 608 HG23 ILE 44 HG23 ILE 44 23.807 -7.056 -10.775 609 HD11 ILE 44 HD11 ILE 44 27.051 -4.280 -12.644 610 HD12 ILE 44 HD12 ILE 44 27.822 -4.974 -11.218 611 HD13 ILE 44 HD13 ILE 44 26.726 -3.605 -11.048 612 H PHE 45 H PHE 45 22.398 -5.301 -8.652 613 HA PHE 45 HA PHE 45 22.916 -7.030 -6.389 614 HB2 PHE 45 HB2 PHE 45 22.708 -4.806 -5.295 615 HB3 PHE 45 HB3 PHE 45 21.125 -4.601 -6.063 616 HD1 PHE 45 HD1 PHE 45 23.002 -6.835 -3.747 617 HD2 PHE 45 HD2 PHE 45 19.189 -5.429 -5.069 618 HE1 PHE 45 HE1 PHE 45 21.910 -8.069 -1.903 619 HE2 PHE 45 HE2 PHE 45 18.092 -6.650 -3.215 620 HZ PHE 45 HZ PHE 45 19.457 -7.974 -1.640 621 H ALA 46 H ALA 46 21.647 -8.700 -6.544 622 HA ALA 46 HA ALA 46 20.089 -10.178 -7.279 623 HB1 ALA 46 HB1 ALA 46 18.784 -9.062 -5.588 624 HB2 ALA 46 HB2 ALA 46 17.733 -9.475 -6.943 625 HB3 ALA 46 HB3 ALA 46 18.292 -7.816 -6.737 626 H GLY 47 H GLY 47 21.488 -9.110 -9.320 627 HA2 GLY 47 HA2 GLY 47 21.607 -9.113 -11.616 628 HA3 GLY 47 HA3 GLY 47 19.996 -9.807 -11.627 629 H LYS 48 H LYS 48 20.744 -6.716 -10.209 630 HA LYS 48 HA LYS 48 19.395 -5.258 -12.404 631 HB2 LYS 48 HB2 LYS 48 19.019 -5.004 -9.409 632 HB3 LYS 48 HB3 LYS 48 18.493 -3.763 -10.545 633 HG2 LYS 48 HG2 LYS 48 16.996 -5.345 -11.632 634 HG3 LYS 48 HG3 LYS 48 17.566 -6.634 -10.572 635 HD2 LYS 48 HD2 LYS 48 16.345 -4.129 -9.451 636 HD3 LYS 48 HD3 LYS 48 15.338 -5.462 -10.001 637 HE2 LYS 48 HE2 LYS 48 17.539 -5.828 -7.968 638 HE3 LYS 48 HE3 LYS 48 15.884 -5.401 -7.522 639 HZ1 LYS 48 HZ1 LYS 48 16.612 -7.778 -9.113 640 HZ2 LYS 48 HZ2 LYS 48 15.084 -7.389 -8.501 641 HZ3 LYS 48 HZ3 LYS 48 16.342 -7.792 -7.444 642 H GLN 49 H GLN 49 20.515 -3.581 -13.137 643 HA GLN 49 HA GLN 49 22.905 -2.611 -11.791 644 HB2 GLN 49 HB2 GLN 49 21.515 -1.505 -14.253 645 HB3 GLN 49 HB3 GLN 49 23.136 -1.090 -13.694 646 HG2 GLN 49 HG2 GLN 49 23.669 -3.583 -13.933 647 HG3 GLN 49 HG3 GLN 49 22.177 -3.684 -14.873 648 HE21 GLN 49 HE21 GLN 49 23.010 -4.064 -16.833 649 HE22 GLN 49 HE22 GLN 49 24.044 -2.984 -17.697 650 H LEU 50 H LEU 50 23.038 -0.874 -10.543 651 HA LEU 50 HA LEU 50 20.549 0.253 -9.605 652 HB2 LEU 50 HB2 LEU 50 23.353 0.793 -8.625 653 HB3 LEU 50 HB3 LEU 50 21.851 1.159 -7.780 654 HG LEU 50 HG LEU 50 22.959 -1.574 -8.413 655 HD11 LEU 50 HD11 LEU 50 23.924 -0.247 -6.510 656 HD12 LEU 50 HD12 LEU 50 23.265 -1.828 -6.089 657 HD13 LEU 50 HD13 LEU 50 22.342 -0.366 -5.739 658 HD21 LEU 50 HD21 LEU 50 20.682 -2.013 -8.611 659 HD22 LEU 50 HD22 LEU 50 20.248 -0.805 -7.403 660 HD23 LEU 50 HD23 LEU 50 20.997 -2.323 -6.900 661 H GLU 51 H GLU 51 19.847 2.249 -9.721 662 HA GLU 51 HA GLU 51 21.016 3.957 -11.801 663 HB2 GLU 51 HB2 GLU 51 18.199 3.758 -10.734 664 HB3 GLU 51 HB3 GLU 51 18.696 4.846 -12.022 665 HG2 GLU 51 HG2 GLU 51 18.852 1.831 -12.148 666 HG3 GLU 51 HG3 GLU 51 17.532 2.794 -12.809 667 H ASP 52 H ASP 52 21.471 6.059 -11.388 668 HA ASP 52 HA ASP 52 22.302 6.753 -8.844 669 HB2 ASP 52 HB2 ASP 52 21.777 8.431 -11.271 670 HB3 ASP 52 HB3 ASP 52 22.398 9.147 -9.783 671 H GLY 53 H GLY 53 19.344 7.832 -10.450 672 HA2 GLY 53 HA2 GLY 53 18.459 9.477 -8.260 673 HA3 GLY 53 HA3 GLY 53 17.579 9.137 -9.735 674 H ARG 54 H ARG 54 18.506 6.234 -8.312 675 HA ARG 54 HA ARG 54 15.921 5.954 -6.910 676 HB2 ARG 54 HB2 ARG 54 17.736 3.779 -7.968 677 HB3 ARG 54 HB3 ARG 54 16.173 3.525 -7.213 678 HG2 ARG 54 HG2 ARG 54 16.756 4.766 -9.897 679 HG3 ARG 54 HG3 ARG 54 15.928 3.254 -9.578 680 HD2 ARG 54 HD2 ARG 54 14.902 6.021 -8.932 681 HD3 ARG 54 HD3 ARG 54 14.368 5.001 -10.271 682 HE ARG 54 HE ARG 54 14.091 3.832 -7.654 683 HH11 ARG 54 HH11 ARG 54 12.427 5.728 -10.114 684 HH12 ARG 54 HH12 ARG 54 10.867 5.417 -9.425 685 HH21 ARG 54 HH21 ARG 54 12.080 3.644 -6.693 686 HH22 ARG 54 HH22 ARG 54 10.672 4.254 -7.495 687 H THR 55 H THR 55 16.026 4.462 -4.995 688 HA THR 55 HA THR 55 18.493 4.987 -3.457 689 HB THR 55 HB THR 55 17.147 5.073 -1.428 690 HG1 THR 55 HG1 THR 55 15.302 3.915 -3.032 691 HG21 THR 55 HG21 THR 55 17.420 7.200 -2.571 692 HG22 THR 55 HG22 THR 55 15.805 7.125 -1.869 693 HG23 THR 55 HG23 THR 55 16.027 6.870 -3.601 694 H LEU 56 H LEU 56 18.619 3.463 -1.478 695 HA LEU 56 HA LEU 56 18.946 0.813 -2.387 696 HB2 LEU 56 HB2 LEU 56 18.843 1.923 0.408 697 HB3 LEU 56 HB3 LEU 56 19.309 0.262 0.048 698 HG LEU 56 HG LEU 56 20.724 2.763 -0.917 699 HD11 LEU 56 HD11 LEU 56 20.925 2.248 1.511 700 HD12 LEU 56 HD12 LEU 56 22.458 2.137 0.641 701 HD13 LEU 56 HD13 LEU 56 21.582 0.671 1.077 702 HD21 LEU 56 HD21 LEU 56 21.097 1.068 -2.574 703 HD22 LEU 56 HD22 LEU 56 21.327 -0.165 -1.326 704 HD23 LEU 56 HD23 LEU 56 22.533 1.110 -1.541 705 H SER 57 H SER 57 16.402 2.314 -0.509 706 HA SER 57 HA SER 57 14.880 0.074 0.206 707 HB2 SER 57 HB2 SER 57 13.074 1.606 0.637 708 HB3 SER 57 HB3 SER 57 14.572 2.431 1.064 709 HG SER 57 HG SER 57 14.418 3.273 -1.198 710 H ASP 58 H ASP 58 15.139 1.760 -2.832 711 HA ASP 58 HA ASP 58 12.732 0.666 -3.985 712 HB2 ASP 58 HB2 ASP 58 15.039 2.082 -5.329 713 HB3 ASP 58 HB3 ASP 58 13.476 1.739 -6.059 714 H TYR 59 H TYR 59 15.405 -0.890 -3.162 715 HA TYR 59 HA TYR 59 15.217 -2.800 -5.401 716 HB2 TYR 59 HB2 TYR 59 17.701 -1.758 -4.046 717 HB3 TYR 59 HB3 TYR 59 17.687 -3.201 -5.057 718 HD1 TYR 59 HD1 TYR 59 16.958 -2.971 -7.470 719 HD2 TYR 59 HD2 TYR 59 17.901 0.372 -5.000 720 HE1 TYR 59 HE1 TYR 59 17.436 -1.631 -9.480 721 HE2 TYR 59 HE2 TYR 59 18.389 1.720 -6.999 722 HH TYR 59 HH TYR 59 18.641 1.681 -9.207 723 H ASN 60 H ASN 60 15.016 -2.225 -2.122 724 HA ASN 60 HA ASN 60 14.587 -3.493 -0.315 725 HB2 ASN 60 HB2 ASN 60 13.470 -4.948 -2.161 726 HB3 ASN 60 HB3 ASN 60 14.816 -6.042 -1.862 727 HD21 ASN 60 HD21 ASN 60 13.532 -7.638 -1.022 728 HD22 ASN 60 HD22 ASN 60 12.763 -7.515 0.519 729 H ILE 61 H ILE 61 17.264 -2.844 -1.254 730 HA ILE 61 HA ILE 61 19.095 -4.829 -0.260 731 HB ILE 61 HB ILE 61 19.469 -1.872 -0.785 732 HG12 ILE 61 HG12 ILE 61 20.241 -4.288 -2.426 733 HG13 ILE 61 HG13 ILE 61 18.857 -3.254 -2.750 734 HG21 ILE 61 HG21 ILE 61 21.131 -2.666 0.819 735 HG22 ILE 61 HG22 ILE 61 21.903 -2.319 -0.734 736 HG23 ILE 61 HG23 ILE 61 21.566 -3.989 -0.259 737 HD11 ILE 61 HD11 ILE 61 21.750 -2.377 -2.847 738 HD12 ILE 61 HD12 ILE 61 20.340 -1.399 -3.272 739 HD13 ILE 61 HD13 ILE 61 20.758 -2.813 -4.243 740 H GLN 62 H GLN 62 18.928 -5.416 1.776 741 HA GLN 62 HA GLN 62 18.332 -3.406 3.829 742 HB2 GLN 62 HB2 GLN 62 18.058 -6.414 3.904 743 HB3 GLN 62 HB3 GLN 62 17.625 -5.327 5.215 744 HG2 GLN 62 HG2 GLN 62 15.967 -4.258 3.666 745 HG3 GLN 62 HG3 GLN 62 16.319 -5.535 2.502 746 HE21 GLN 62 HE21 GLN 62 16.686 -7.432 4.840 747 HE22 GLN 62 HE22 GLN 62 15.075 -7.851 5.297 748 H LYS 63 H LYS 63 19.223 -4.596 6.091 749 HA LYS 63 HA LYS 63 22.004 -4.054 6.064 750 HB2 LYS 63 HB2 LYS 63 22.027 -4.756 8.375 751 HB3 LYS 63 HB3 LYS 63 20.553 -3.850 8.081 752 HG2 LYS 63 HG2 LYS 63 19.301 -5.970 7.918 753 HG3 LYS 63 HG3 LYS 63 20.788 -6.853 8.288 754 HD2 LYS 63 HD2 LYS 63 20.952 -5.632 10.428 755 HD3 LYS 63 HD3 LYS 63 19.427 -4.818 10.060 756 HE2 LYS 63 HE2 LYS 63 18.348 -7.078 9.912 757 HE3 LYS 63 HE3 LYS 63 19.861 -7.774 10.513 758 HZ1 LYS 63 HZ1 LYS 63 18.206 -5.751 11.896 759 HZ2 LYS 63 HZ2 LYS 63 19.669 -6.379 12.466 760 HZ3 LYS 63 HZ3 LYS 63 18.321 -7.388 12.304 761 H GLU 64 H GLU 64 23.753 -5.335 5.984 762 HA GLU 64 HA GLU 64 25.109 -7.161 5.781 763 HB2 GLU 64 HB2 GLU 64 22.789 -8.284 7.023 764 HB3 GLU 64 HB3 GLU 64 23.391 -9.414 5.820 765 HG2 GLU 64 HG2 GLU 64 24.321 -9.812 8.054 766 HG3 GLU 64 HG3 GLU 64 25.564 -9.440 6.863 767 H SER 65 H SER 65 22.931 -6.235 3.598 768 HA SER 65 HA SER 65 22.994 -8.355 1.663 769 HB2 SER 65 HB2 SER 65 22.570 -5.374 1.328 770 HB3 SER 65 HB3 SER 65 22.370 -6.549 0.026 771 HG SER 65 HG SER 65 20.977 -7.320 2.205 772 H THR 66 H THR 66 24.406 -8.709 0.004 773 HA THR 66 HA THR 66 26.678 -6.849 -0.167 774 HB THR 66 HB THR 66 28.280 -8.394 -0.233 775 HG1 THR 66 HG1 THR 66 28.211 -9.687 -1.852 776 HG21 THR 66 HG21 THR 66 26.375 -9.215 1.608 777 HG22 THR 66 HG22 THR 66 28.060 -9.736 1.546 778 HG23 THR 66 HG23 THR 66 26.808 -10.686 0.742 779 H LEU 67 H LEU 67 27.160 -6.023 -1.930 780 HA LEU 67 HA LEU 67 25.665 -6.609 -4.406 781 HB2 LEU 67 HB2 LEU 67 26.973 -4.130 -3.270 782 HB3 LEU 67 HB3 LEU 67 26.468 -4.218 -4.945 783 HG LEU 67 HG LEU 67 24.124 -4.451 -4.233 784 HD11 LEU 67 HD11 LEU 67 24.541 -5.511 -1.980 785 HD12 LEU 67 HD12 LEU 67 23.397 -4.168 -1.966 786 HD13 LEU 67 HD13 LEU 67 25.054 -3.924 -1.408 787 HD21 LEU 67 HD21 LEU 67 25.050 -2.256 -4.660 788 HD22 LEU 67 HD22 LEU 67 25.621 -2.151 -2.994 789 HD23 LEU 67 HD23 LEU 67 23.887 -2.172 -3.333 790 H HIS 68 H HIS 68 26.909 -6.192 -6.374 791 HA HIS 68 HA HIS 68 29.796 -6.733 -6.083 792 HB2 HIS 68 HB2 HIS 68 27.821 -7.722 -8.135 793 HB3 HIS 68 HB3 HIS 68 29.560 -7.707 -8.465 794 HD1 HIS 68 HD1 HIS 68 27.092 -9.391 -6.122 795 HD2 HIS 68 HD2 HIS 68 31.037 -9.515 -7.293 796 HE1 HIS 68 HE1 HIS 68 28.040 -11.527 -5.132 797 HE2 HIS 68 HE2 HIS 68 30.496 -11.470 -5.766 798 H LEU 69 H LEU 69 31.205 -5.739 -7.384 799 HA LEU 69 HA LEU 69 30.287 -3.287 -8.758 800 HB2 LEU 69 HB2 LEU 69 31.555 -2.787 -6.741 801 HB3 LEU 69 HB3 LEU 69 32.842 -3.875 -7.241 802 HG LEU 69 HG LEU 69 33.285 -2.397 -9.190 803 HD11 LEU 69 HD11 LEU 69 31.381 -0.483 -7.844 804 HD12 LEU 69 HD12 LEU 69 31.057 -1.341 -9.351 805 HD13 LEU 69 HD13 LEU 69 32.373 -0.163 -9.269 806 HD21 LEU 69 HD21 LEU 69 34.719 -2.145 -7.331 807 HD22 LEU 69 HD22 LEU 69 33.493 -1.268 -6.415 808 HD23 LEU 69 HD23 LEU 69 34.253 -0.512 -7.816 809 H VAL 70 H VAL 70 30.689 -3.148 -10.839 810 HA VAL 70 HA VAL 70 32.830 -4.769 -12.059 811 HB VAL 70 HB VAL 70 30.229 -3.715 -13.259 812 HG11 VAL 70 HG11 VAL 70 31.896 -3.490 -14.963 813 HG12 VAL 70 HG12 VAL 70 30.903 -4.893 -15.357 814 HG13 VAL 70 HG13 VAL 70 32.503 -5.117 -14.654 815 HG21 VAL 70 HG21 VAL 70 30.201 -5.830 -11.815 816 HG22 VAL 70 HG22 VAL 70 31.053 -6.601 -13.152 817 HG23 VAL 70 HG23 VAL 70 29.443 -5.922 -13.405 818 H LEU 71 H LEU 71 34.347 -3.586 -13.215 819 HA LEU 71 HA LEU 71 34.309 -0.715 -12.719 820 HB2 LEU 71 HB2 LEU 71 36.278 -2.591 -12.413 821 HB3 LEU 71 HB3 LEU 71 36.685 -1.915 -13.981 822 HG LEU 71 HG LEU 71 36.323 0.353 -12.668 823 HD11 LEU 71 HD11 LEU 71 35.663 -0.876 -10.606 824 HD12 LEU 71 HD12 LEU 71 36.984 0.269 -10.382 825 HD13 LEU 71 HD13 LEU 71 37.325 -1.458 -10.483 826 HD21 LEU 71 HD21 LEU 71 38.852 -1.321 -12.825 827 HD22 LEU 71 HD22 LEU 71 38.859 0.315 -12.168 828 HD23 LEU 71 HD23 LEU 71 38.380 0.041 -13.843 Start of MODEL 9 1 H GLY 12 H GLY 12 7.113 -11.754 -1.550 2 HA2 GLY 12 HA2 GLY 12 9.023 -11.158 0.470 3 HA3 GLY 12 HA3 GLY 12 9.734 -12.199 -0.755 4 HA PRO 13 HA PRO 13 10.400 -8.734 -3.397 5 HB2 PRO 13 HB2 PRO 13 9.391 -9.386 -5.853 6 HB3 PRO 13 HB3 PRO 13 10.891 -10.056 -5.205 7 HG2 PRO 13 HG2 PRO 13 8.171 -11.275 -5.347 8 HG3 PRO 13 HG3 PRO 13 9.756 -12.044 -5.543 9 HD2 PRO 13 HD2 PRO 13 8.250 -12.209 -3.243 10 HD3 PRO 13 HD3 PRO 13 10.018 -12.360 -3.275 11 H MET 14 H MET 14 8.834 -7.529 -2.038 12 HA MET 14 HA MET 14 6.170 -7.095 -2.964 13 HB2 MET 14 HB2 MET 14 7.935 -5.763 -0.916 14 HB3 MET 14 HB3 MET 14 6.373 -5.058 -1.350 15 HG2 MET 14 HG2 MET 14 6.666 -7.949 -0.547 16 HG3 MET 14 HG3 MET 14 6.346 -6.665 0.634 17 HE1 MET 14 HE1 MET 14 2.816 -7.600 0.802 18 HE2 MET 14 HE2 MET 14 3.866 -6.306 1.384 19 HE3 MET 14 HE3 MET 14 4.439 -7.974 1.382 20 H LEU 15 H LEU 15 6.532 -6.619 -5.199 21 HA LEU 15 HA LEU 15 8.041 -4.320 -6.009 22 HB2 LEU 15 HB2 LEU 15 6.838 -6.563 -7.275 23 HB3 LEU 15 HB3 LEU 15 6.102 -5.127 -7.986 24 HG LEU 15 HG LEU 15 8.384 -4.205 -8.430 25 HD11 LEU 15 HD11 LEU 15 10.219 -5.146 -7.539 26 HD12 LEU 15 HD12 LEU 15 9.795 -6.715 -8.227 27 HD13 LEU 15 HD13 LEU 15 9.166 -6.243 -6.645 28 HD21 LEU 15 HD21 LEU 15 7.198 -5.411 -10.185 29 HD22 LEU 15 HD22 LEU 15 7.795 -6.950 -9.561 30 HD23 LEU 15 HD23 LEU 15 8.920 -5.788 -10.262 31 H CYS 16 H CYS 16 7.284 -2.305 -6.677 32 HA CYS 16 HA CYS 16 5.385 -0.999 -5.239 33 HB2 CYS 16 HB2 CYS 16 7.113 -0.043 -6.879 34 HB3 CYS 16 HB3 CYS 16 5.858 -0.242 -8.115 35 H SER 17 H SER 17 3.267 -0.717 -5.166 36 HA SER 17 HA SER 17 1.501 -2.433 -6.550 37 HB2 SER 17 HB2 SER 17 0.883 0.083 -4.977 38 HB3 SER 17 HB3 SER 17 -0.285 -1.171 -5.419 39 HG SER 17 HG SER 17 1.599 -2.501 -4.296 40 H THR 18 H THR 18 2.530 0.888 -7.132 41 HA THR 18 HA THR 18 0.479 1.489 -9.028 42 HB THR 18 HB THR 18 1.880 3.449 -9.590 43 HG1 THR 18 HG1 THR 18 3.909 2.331 -9.220 44 HG21 THR 18 HG21 THR 18 1.624 2.898 -6.625 45 HG22 THR 18 HG22 THR 18 0.329 3.491 -7.663 46 HG23 THR 18 HG23 THR 18 1.755 4.489 -7.372 47 H GLY 19 H GLY 19 3.306 -0.445 -9.274 48 HA2 GLY 19 HA2 GLY 19 4.085 -1.671 -11.087 49 HA3 GLY 19 HA3 GLY 19 2.823 -0.939 -12.069 50 H CYS 20 H CYS 20 5.454 0.627 -10.234 51 HA CYS 20 HA CYS 20 6.115 2.172 -12.591 52 HB2 CYS 20 HB2 CYS 20 7.506 3.515 -11.134 53 HB3 CYS 20 HB3 CYS 20 5.974 3.212 -10.316 54 H GLY 21 H GLY 21 7.237 -0.761 -11.211 55 HA2 GLY 21 HA2 GLY 21 8.769 -2.184 -12.347 56 HA3 GLY 21 HA3 GLY 21 9.493 -0.771 -13.095 57 H PHE 22 H PHE 22 9.110 -0.128 -9.819 58 HA PHE 22 HA PHE 22 11.862 -1.023 -9.247 59 HB2 PHE 22 HB2 PHE 22 10.418 1.516 -8.522 60 HB3 PHE 22 HB3 PHE 22 11.870 0.992 -7.655 61 HD1 PHE 22 HD1 PHE 22 13.976 0.567 -8.949 62 HD2 PHE 22 HD2 PHE 22 10.593 2.546 -10.654 63 HE1 PHE 22 HE1 PHE 22 15.408 1.435 -10.762 64 HE2 PHE 22 HE2 PHE 22 12.020 3.429 -12.467 65 HZ PHE 22 HZ PHE 22 14.430 2.870 -12.523 66 H TYR 23 H TYR 23 12.307 -1.174 -6.830 67 HA TYR 23 HA TYR 23 10.297 -2.912 -5.694 68 HB2 TYR 23 HB2 TYR 23 13.151 -2.294 -5.138 69 HB3 TYR 23 HB3 TYR 23 12.172 -2.887 -3.793 70 HD1 TYR 23 HD1 TYR 23 13.560 -3.659 -7.084 71 HD2 TYR 23 HD2 TYR 23 11.304 -5.166 -3.790 72 HE1 TYR 23 HE1 TYR 23 13.821 -5.944 -7.971 73 HE2 TYR 23 HE2 TYR 23 11.554 -7.464 -4.662 74 HH TYR 23 HH TYR 23 13.758 -8.279 -7.132 75 H GLY 24 H GLY 24 9.064 -2.547 -3.897 76 HA2 GLY 24 HA2 GLY 24 9.117 0.201 -2.799 77 HA3 GLY 24 HA3 GLY 24 7.682 -0.815 -2.893 78 H ASN 25 H ASN 25 8.515 0.428 -0.508 79 HA ASN 25 HA ASN 25 9.811 -1.632 1.095 80 HB2 ASN 25 HB2 ASN 25 8.857 1.171 1.717 81 HB3 ASN 25 HB3 ASN 25 9.469 0.064 2.948 82 HD21 ASN 25 HD21 ASN 25 11.289 1.387 3.405 83 HD22 ASN 25 HD22 ASN 25 12.606 1.516 2.296 84 HA PRO 26 HA PRO 26 5.715 -3.218 2.212 85 HB2 PRO 26 HB2 PRO 26 6.477 -4.957 4.147 86 HB3 PRO 26 HB3 PRO 26 6.621 -5.307 2.418 87 HG2 PRO 26 HG2 PRO 26 8.699 -4.349 4.346 88 HG3 PRO 26 HG3 PRO 26 8.836 -5.595 3.091 89 HD2 PRO 26 HD2 PRO 26 9.786 -3.079 2.734 90 HD3 PRO 26 HD3 PRO 26 9.115 -4.025 1.391 91 H ARG 27 H ARG 27 7.968 -1.654 4.365 92 HA ARG 27 HA ARG 27 6.189 -1.476 6.619 93 HB2 ARG 27 HB2 ARG 27 8.728 -0.018 5.851 94 HB3 ARG 27 HB3 ARG 27 7.828 0.368 7.319 95 HG2 ARG 27 HG2 ARG 27 7.992 -2.047 7.976 96 HG3 ARG 27 HG3 ARG 27 9.054 -2.296 6.593 97 HD2 ARG 27 HD2 ARG 27 10.622 -1.889 8.257 98 HD3 ARG 27 HD3 ARG 27 10.400 -0.273 7.574 99 HE ARG 27 HE ARG 27 8.764 -1.005 9.058 100 HH11 ARG 27 HH11 ARG 27 12.016 -0.259 9.206 101 HH12 ARG 27 HH12 ARG 27 12.252 0.505 10.743 102 HH21 ARG 27 HH21 ARG 27 8.918 0.363 11.657 103 HH22 ARG 27 HH22 ARG 27 10.516 0.851 12.114 104 H THR 28 H THR 28 6.881 0.432 3.746 105 HA THR 28 HA THR 28 5.302 2.702 4.568 106 HB THR 28 HB THR 28 5.749 3.548 2.305 107 HG1 THR 28 HG1 THR 28 6.003 0.921 1.786 108 HG21 THR 28 HG21 THR 28 8.321 3.240 2.325 109 HG22 THR 28 HG22 THR 28 8.056 2.286 3.781 110 HG23 THR 28 HG23 THR 28 7.566 3.981 3.736 111 H ASN 29 H ASN 29 3.913 2.982 1.928 112 HA ASN 29 HA ASN 29 1.623 1.292 2.551 113 HB2 ASN 29 HB2 ASN 29 2.093 3.740 0.875 114 HB3 ASN 29 HB3 ASN 29 0.636 2.769 0.612 115 HD21 ASN 29 HD21 ASN 29 -1.020 3.785 1.688 116 HD22 ASN 29 HD22 ASN 29 -0.914 4.408 3.296 117 H GLY 30 H GLY 30 4.080 0.132 1.227 118 HA2 GLY 30 HA2 GLY 30 4.290 -1.670 -0.254 119 HA3 GLY 30 HA3 GLY 30 2.694 -1.299 -0.896 120 H MET 31 H MET 31 4.660 1.488 -0.709 121 HA MET 31 HA MET 31 5.361 1.247 -3.566 122 HB2 MET 31 HB2 MET 31 4.079 3.447 -1.996 123 HB3 MET 31 HB3 MET 31 5.111 3.880 -3.370 124 HG2 MET 31 HG2 MET 31 2.934 3.703 -4.268 125 HG3 MET 31 HG3 MET 31 3.732 2.187 -4.720 126 HE1 MET 31 HE1 MET 31 -0.268 2.289 -3.349 127 HE2 MET 31 HE2 MET 31 0.669 2.755 -4.767 128 HE3 MET 31 HE3 MET 31 0.671 3.783 -3.334 129 H CYS 32 H CYS 32 7.157 2.629 -4.252 130 HA CYS 32 HA CYS 32 9.382 2.402 -2.469 131 HB2 CYS 32 HB2 CYS 32 10.681 3.323 -4.379 132 HB3 CYS 32 HB3 CYS 32 9.624 2.004 -4.884 133 H SER 33 H SER 33 10.894 4.718 -2.905 134 HA SER 33 HA SER 33 9.755 6.447 -0.954 135 HB2 SER 33 HB2 SER 33 11.772 7.828 -1.308 136 HB3 SER 33 HB3 SER 33 12.190 6.121 -1.141 137 HG SER 33 HG SER 33 13.258 6.662 -2.917 138 H VAL 34 H VAL 34 9.762 6.512 -4.433 139 HA VAL 34 HA VAL 34 9.117 9.304 -4.655 140 HB VAL 34 HB VAL 34 8.867 7.185 -6.790 141 HG11 VAL 34 HG11 VAL 34 9.153 9.076 -8.324 142 HG12 VAL 34 HG12 VAL 34 9.283 10.173 -6.949 143 HG13 VAL 34 HG13 VAL 34 7.762 9.340 -7.270 144 HG21 VAL 34 HG21 VAL 34 11.151 7.854 -7.468 145 HG22 VAL 34 HG22 VAL 34 11.133 7.130 -5.859 146 HG23 VAL 34 HG23 VAL 34 11.256 8.880 -6.041 147 H CYS 35 H CYS 35 7.281 6.344 -5.468 148 HA CYS 35 HA CYS 35 4.844 7.618 -5.991 149 HB2 CYS 35 HB2 CYS 35 5.399 4.792 -5.077 150 HB3 CYS 35 HB3 CYS 35 3.859 5.350 -5.744 151 H TYR 36 H TYR 36 6.183 6.417 -2.962 152 HA TYR 36 HA TYR 36 3.858 6.447 -1.406 153 HB2 TYR 36 HB2 TYR 36 5.927 5.375 -0.649 154 HB3 TYR 36 HB3 TYR 36 6.729 6.944 -0.555 155 HD1 TYR 36 HD1 TYR 36 3.261 6.057 0.579 156 HD2 TYR 36 HD2 TYR 36 7.257 7.154 1.696 157 HE1 TYR 36 HE1 TYR 36 2.532 6.306 2.939 158 HE2 TYR 36 HE2 TYR 36 6.533 7.408 4.055 159 HH TYR 36 HH TYR 36 3.532 6.264 5.211 160 H LYS 37 H LYS 37 6.258 9.072 -1.870 161 HA LYS 37 HA LYS 37 4.810 10.882 -0.196 162 HB2 LYS 37 HB2 LYS 37 6.363 12.614 -1.039 163 HB3 LYS 37 HB3 LYS 37 7.228 11.168 -0.518 164 HG2 LYS 37 HG2 LYS 37 7.371 10.418 -2.866 165 HG3 LYS 37 HG3 LYS 37 6.540 11.898 -3.370 166 HD2 LYS 37 HD2 LYS 37 8.385 13.190 -2.212 167 HD3 LYS 37 HD3 LYS 37 9.253 11.654 -2.067 168 HE2 LYS 37 HE2 LYS 37 8.943 11.395 -4.582 169 HE3 LYS 37 HE3 LYS 37 8.430 13.092 -4.587 170 HZ1 LYS 37 HZ1 LYS 37 10.537 13.707 -3.584 171 HZ2 LYS 37 HZ2 LYS 37 10.798 12.892 -5.043 172 HZ3 LYS 37 HZ3 LYS 37 11.037 12.091 -3.572 173 H GLU 38 H GLU 38 5.084 10.400 -3.687 174 HA GLU 38 HA GLU 38 3.626 12.577 -4.598 175 HB2 GLU 38 HB2 GLU 38 4.076 9.807 -5.677 176 HB3 GLU 38 HB3 GLU 38 3.016 10.938 -6.532 177 HG2 GLU 38 HG2 GLU 38 5.782 11.756 -5.667 178 HG3 GLU 38 HG3 GLU 38 5.500 10.919 -7.203 179 H HIS 39 H HIS 39 2.413 9.424 -3.442 180 HA HIS 39 HA HIS 39 -0.302 10.227 -4.071 181 HB2 HIS 39 HB2 HIS 39 -1.002 8.024 -3.592 182 HB3 HIS 39 HB3 HIS 39 0.578 7.838 -4.340 183 HD1 HIS 39 HD1 HIS 39 1.703 5.928 -3.268 184 HD2 HIS 39 HD2 HIS 39 -0.378 8.208 -0.460 185 HE1 HIS 39 HE1 HIS 39 2.022 4.785 -1.037 186 HE2 HIS 39 HE2 HIS 39 1.080 6.382 0.692 187 H LEU 40 H LEU 40 1.732 10.008 -1.237 188 HA LEU 40 HA LEU 40 -0.250 10.227 0.759 189 HB2 LEU 40 HB2 LEU 40 2.222 9.669 1.061 190 HB3 LEU 40 HB3 LEU 40 2.528 11.404 0.938 191 HG LEU 40 HG LEU 40 0.801 11.699 2.808 192 HD11 LEU 40 HD11 LEU 40 -0.134 9.376 2.550 193 HD12 LEU 40 HD12 LEU 40 0.360 9.769 4.199 194 HD13 LEU 40 HD13 LEU 40 1.390 8.755 3.192 195 HD21 LEU 40 HD21 LEU 40 2.486 10.994 4.561 196 HD22 LEU 40 HD22 LEU 40 3.137 12.021 3.282 197 HD23 LEU 40 HD23 LEU 40 3.435 10.284 3.256 198 H GLN 41 H GLN 41 1.249 12.631 -1.302 199 HA GLN 41 HA GLN 41 0.545 14.941 0.174 200 HB2 GLN 41 HB2 GLN 41 1.436 14.352 -2.612 201 HB3 GLN 41 HB3 GLN 41 0.697 15.929 -2.310 202 HG2 GLN 41 HG2 GLN 41 2.300 16.394 -0.543 203 HG3 GLN 41 HG3 GLN 41 3.009 14.784 -0.730 204 HE21 GLN 41 HE21 GLN 41 2.810 17.980 -2.126 205 HE22 GLN 41 HE22 GLN 41 4.026 17.722 -3.325 206 H ARG 42 H ARG 42 -1.146 13.115 -2.356 207 HA ARG 42 HA ARG 42 -3.338 14.983 -2.503 208 HB2 ARG 42 HB2 ARG 42 -2.880 12.225 -3.642 209 HB3 ARG 42 HB3 ARG 42 -4.387 13.119 -3.892 210 HG2 ARG 42 HG2 ARG 42 -3.271 14.876 -5.042 211 HG3 ARG 42 HG3 ARG 42 -1.683 14.287 -4.526 212 HD2 ARG 42 HD2 ARG 42 -2.148 12.176 -5.803 213 HD3 ARG 42 HD3 ARG 42 -3.577 12.970 -6.475 214 HE ARG 42 HE ARG 42 -0.835 13.152 -6.929 215 HH11 ARG 42 HH11 ARG 42 -3.975 15.001 -6.941 216 HH12 ARG 42 HH12 ARG 42 -3.602 16.212 -8.121 217 HH21 ARG 42 HH21 ARG 42 -0.438 14.997 -8.801 218 HH22 ARG 42 HH22 ARG 42 -1.623 16.207 -9.163 219 H GLN 43 H GLN 43 -2.628 12.022 -0.770 220 HA GLN 43 HA GLN 43 -5.320 11.545 0.097 221 HB2 GLN 43 HB2 GLN 43 -3.294 9.891 -0.076 222 HB3 GLN 43 HB3 GLN 43 -2.896 10.497 1.536 223 HG2 GLN 43 HG2 GLN 43 -4.252 8.714 2.082 224 HG3 GLN 43 HG3 GLN 43 -5.448 10.014 2.003 225 HE21 GLN 43 HE21 GLN 43 -7.147 8.550 1.404 226 HE22 GLN 43 HE22 GLN 43 -7.200 7.829 -0.165 227 H GLN 44 H GLN 44 -2.461 13.156 1.402 228 HA GLN 44 HA GLN 44 -3.567 13.646 3.995 229 HB2 GLN 44 HB2 GLN 44 -1.078 13.603 3.290 230 HB3 GLN 44 HB3 GLN 44 -1.348 15.271 2.766 231 HG2 GLN 44 HG2 GLN 44 -1.986 15.955 4.965 232 HG3 GLN 44 HG3 GLN 44 -2.049 14.278 5.527 233 HE21 GLN 44 HE21 GLN 44 0.347 16.389 3.894 234 HE22 GLN 44 HE22 GLN 44 1.664 15.877 4.887 235 H ASN 45 H ASN 45 -3.275 15.530 1.002 236 HA ASN 45 HA ASN 45 -4.251 17.976 2.057 237 HB2 ASN 45 HB2 ASN 45 -3.933 16.842 -0.710 238 HB3 ASN 45 HB3 ASN 45 -4.821 18.352 -0.482 239 HD21 ASN 45 HD21 ASN 45 -2.095 17.798 -1.698 240 HD22 ASN 45 HD22 ASN 45 -1.038 18.866 -0.847 241 H SER 46 H SER 46 -5.839 15.250 0.427 242 HA SER 46 HA SER 46 -8.431 16.472 0.416 243 HB2 SER 46 HB2 SER 46 -7.505 14.557 -1.097 244 HB3 SER 46 HB3 SER 46 -8.000 13.502 0.232 245 HG SER 46 HG SER 46 -9.617 15.260 -1.297 246 H1 MET 1 H1 MET 1 22.555 0.170 10.222 247 H2 MET 1 H2 MET 1 23.240 0.774 8.799 248 H3 MET 1 H3 MET 1 24.212 0.502 10.156 249 HA MET 1 HA MET 1 23.831 -1.852 10.016 250 HB2 MET 1 HB2 MET 1 22.580 -2.806 8.180 251 HB3 MET 1 HB3 MET 1 21.556 -1.640 9.003 252 HG2 MET 1 HG2 MET 1 22.026 0.007 7.250 253 HG3 MET 1 HG3 MET 1 23.053 -1.160 6.429 254 HE1 MET 1 HE1 MET 1 20.290 -1.216 3.842 255 HE2 MET 1 HE2 MET 1 22.021 -1.206 4.187 256 HE3 MET 1 HE3 MET 1 21.021 0.172 4.650 257 H GLN 2 H GLN 2 25.399 -3.079 8.967 258 HA GLN 2 HA GLN 2 27.084 -1.565 7.103 259 HB2 GLN 2 HB2 GLN 2 28.851 -3.005 7.629 260 HB3 GLN 2 HB3 GLN 2 28.014 -2.776 9.156 261 HG2 GLN 2 HG2 GLN 2 26.924 -4.941 8.911 262 HG3 GLN 2 HG3 GLN 2 27.689 -5.162 7.339 263 HE21 GLN 2 HE21 GLN 2 30.163 -3.851 8.515 264 HE22 GLN 2 HE22 GLN 2 30.925 -5.126 9.400 265 H ILE 3 H ILE 3 27.559 -2.194 5.102 266 HA ILE 3 HA ILE 3 26.552 -4.765 4.135 267 HB ILE 3 HB ILE 3 25.618 -4.021 2.189 268 HG12 ILE 3 HG12 ILE 3 27.216 -2.394 1.430 269 HG13 ILE 3 HG13 ILE 3 25.574 -1.813 1.231 270 HG21 ILE 3 HG21 ILE 3 24.136 -3.733 4.057 271 HG22 ILE 3 HG22 ILE 3 23.766 -2.599 2.758 272 HG23 ILE 3 HG23 ILE 3 24.620 -2.043 4.199 273 HD11 ILE 3 HD11 ILE 3 27.626 -0.363 2.209 274 HD12 ILE 3 HD12 ILE 3 26.910 -0.955 3.707 275 HD13 ILE 3 HD13 ILE 3 25.924 -0.037 2.565 276 H PHE 4 H PHE 4 27.675 -5.427 2.142 277 HA PHE 4 HA PHE 4 30.495 -4.529 2.276 278 HB2 PHE 4 HB2 PHE 4 29.460 -7.249 1.423 279 HB3 PHE 4 HB3 PHE 4 31.145 -6.805 1.751 280 HD1 PHE 4 HD1 PHE 4 31.744 -6.083 4.148 281 HD2 PHE 4 HD2 PHE 4 28.067 -8.011 3.124 282 HE1 PHE 4 HE1 PHE 4 31.369 -6.638 6.528 283 HE2 PHE 4 HE2 PHE 4 27.704 -8.591 5.503 284 HZ PHE 4 HZ PHE 4 29.355 -7.894 7.202 285 H VAL 5 H VAL 5 31.537 -4.016 0.469 286 HA VAL 5 HA VAL 5 30.163 -4.285 -2.138 287 HB VAL 5 HB VAL 5 31.939 -1.996 -1.235 288 HG11 VAL 5 HG11 VAL 5 32.322 -2.305 -3.569 289 HG12 VAL 5 HG12 VAL 5 31.187 -0.965 -3.424 290 HG13 VAL 5 HG13 VAL 5 30.606 -2.566 -3.885 291 HG21 VAL 5 HG21 VAL 5 29.056 -1.779 -2.068 292 HG22 VAL 5 HG22 VAL 5 30.042 -0.614 -1.174 293 HG23 VAL 5 HG23 VAL 5 29.505 -2.102 -0.393 294 H LYS 6 H LYS 6 31.125 -6.019 -2.885 295 HA LYS 6 HA LYS 6 33.941 -6.591 -2.624 296 HB2 LYS 6 HB2 LYS 6 31.744 -7.753 -4.350 297 HB3 LYS 6 HB3 LYS 6 33.380 -8.396 -4.273 298 HG2 LYS 6 HG2 LYS 6 33.107 -8.941 -1.929 299 HG3 LYS 6 HG3 LYS 6 31.499 -8.201 -1.917 300 HD2 LYS 6 HD2 LYS 6 31.348 -10.649 -2.134 301 HD3 LYS 6 HD3 LYS 6 30.726 -9.836 -3.570 302 HE2 LYS 6 HE2 LYS 6 33.016 -10.181 -4.606 303 HE3 LYS 6 HE3 LYS 6 33.378 -11.247 -3.244 304 HZ1 LYS 6 HZ1 LYS 6 31.179 -11.574 -5.190 305 HZ2 LYS 6 HZ2 LYS 6 31.477 -12.589 -3.870 306 HZ3 LYS 6 HZ3 LYS 6 32.603 -12.486 -5.128 307 H THR 7 H THR 7 35.522 -6.013 -3.916 308 HA THR 7 HA THR 7 34.907 -4.807 -6.541 309 HB THR 7 HB THR 7 37.128 -3.866 -6.536 310 HG1 THR 7 HG1 THR 7 37.485 -5.712 -4.481 311 HG21 THR 7 HG21 THR 7 36.249 -3.449 -3.694 312 HG22 THR 7 HG22 THR 7 35.315 -2.787 -5.038 313 HG23 THR 7 HG23 THR 7 36.991 -2.287 -4.792 314 H LEU 8 H LEU 8 36.570 -5.400 -8.250 315 HA LEU 8 HA LEU 8 36.378 -8.248 -8.517 316 HB2 LEU 8 HB2 LEU 8 37.412 -6.231 -10.493 317 HB3 LEU 8 HB3 LEU 8 36.989 -7.907 -10.842 318 HG LEU 8 HG LEU 8 35.115 -5.743 -9.881 319 HD11 LEU 8 HD11 LEU 8 35.853 -5.654 -12.262 320 HD12 LEU 8 HD12 LEU 8 34.111 -5.831 -12.032 321 HD13 LEU 8 HD13 LEU 8 35.087 -7.225 -12.491 322 HD21 LEU 8 HD21 LEU 8 34.649 -8.685 -10.236 323 HD22 LEU 8 HD22 LEU 8 33.338 -7.522 -10.443 324 HD23 LEU 8 HD23 LEU 8 34.179 -7.642 -8.895 325 H THR 9 H THR 9 38.893 -6.146 -7.646 326 HA THR 9 HA THR 9 41.145 -7.804 -8.018 327 HB THR 9 HB THR 9 42.053 -6.658 -5.970 328 HG1 THR 9 HG1 THR 9 39.605 -5.220 -6.097 329 HG21 THR 9 HG21 THR 9 40.964 -5.007 -8.240 330 HG22 THR 9 HG22 THR 9 42.573 -5.716 -8.100 331 HG23 THR 9 HG23 THR 9 42.099 -4.385 -7.045 332 H GLY 10 H GLY 10 38.564 -7.838 -5.674 333 HA2 GLY 10 HA2 GLY 10 37.961 -10.089 -4.778 334 HA3 GLY 10 HA3 GLY 10 39.665 -10.270 -4.382 335 H LYS 11 H LYS 11 39.776 -7.374 -3.600 336 HA LYS 11 HA LYS 11 39.340 -7.568 -0.827 337 HB2 LYS 11 HB2 LYS 11 40.808 -5.891 -2.143 338 HB3 LYS 11 HB3 LYS 11 39.325 -4.946 -2.313 339 HG2 LYS 11 HG2 LYS 11 39.353 -5.584 0.373 340 HG3 LYS 11 HG3 LYS 11 41.052 -5.285 0.016 341 HD2 LYS 11 HD2 LYS 11 38.811 -3.388 -0.677 342 HD3 LYS 11 HD3 LYS 11 39.764 -3.286 0.798 343 HE2 LYS 11 HE2 LYS 11 40.964 -3.149 -1.963 344 HE3 LYS 11 HE3 LYS 11 40.450 -1.726 -1.059 345 HZ1 LYS 11 HZ1 LYS 11 42.508 -3.682 -0.234 346 HZ2 LYS 11 HZ2 LYS 11 41.987 -2.368 0.694 347 HZ3 LYS 11 HZ3 LYS 11 42.782 -2.103 -0.776 348 H THR 12 H THR 12 37.781 -6.716 0.497 349 HA THR 12 HA THR 12 35.174 -5.999 -0.725 350 HB THR 12 HB THR 12 35.728 -7.610 1.782 351 HG1 THR 12 HG1 THR 12 35.815 -9.061 0.222 352 HG21 THR 12 HG21 THR 12 33.061 -6.804 0.603 353 HG22 THR 12 HG22 THR 12 33.721 -6.233 2.135 354 HG23 THR 12 HG23 THR 12 33.283 -7.932 1.937 355 H ILE 13 H ILE 13 34.423 -4.125 -0.182 356 HA ILE 13 HA ILE 13 35.637 -2.525 1.973 357 HB ILE 13 HB ILE 13 33.353 -1.569 0.309 358 HG12 ILE 13 HG12 ILE 13 34.688 -2.439 -1.464 359 HG13 ILE 13 HG13 ILE 13 34.863 -0.694 -1.455 360 HG21 ILE 13 HG21 ILE 13 34.217 -0.197 2.118 361 HG22 ILE 13 HG22 ILE 13 34.390 0.603 0.558 362 HG23 ILE 13 HG23 ILE 13 35.796 -0.134 1.332 363 HD11 ILE 13 HD11 ILE 13 36.978 -1.873 -1.939 364 HD12 ILE 13 HD12 ILE 13 36.874 -2.655 -0.365 365 HD13 ILE 13 HD13 ILE 13 37.080 -0.906 -0.461 366 H THR 14 H THR 14 34.635 -2.345 3.893 367 HA THR 14 HA THR 14 31.795 -3.142 4.140 368 HB THR 14 HB THR 14 33.871 -2.645 6.294 369 HG1 THR 14 HG1 THR 14 34.264 -4.574 5.200 370 HG21 THR 14 HG21 THR 14 31.559 -2.154 7.053 371 HG22 THR 14 HG22 THR 14 32.248 -3.560 7.866 372 HG23 THR 14 HG23 THR 14 31.081 -3.778 6.563 373 H LEU 15 H LEU 15 30.308 -1.663 4.416 374 HA LEU 15 HA LEU 15 31.093 1.095 5.143 375 HB2 LEU 15 HB2 LEU 15 28.951 0.226 3.206 376 HB3 LEU 15 HB3 LEU 15 29.255 1.893 3.677 377 HG LEU 15 HG LEU 15 31.268 0.124 2.270 378 HD11 LEU 15 HD11 LEU 15 29.580 2.346 1.128 379 HD12 LEU 15 HD12 LEU 15 29.214 0.631 0.924 380 HD13 LEU 15 HD13 LEU 15 30.706 1.311 0.254 381 HD21 LEU 15 HD21 LEU 15 31.293 2.919 3.293 382 HD22 LEU 15 HD22 LEU 15 32.078 2.608 1.741 383 HD23 LEU 15 HD23 LEU 15 32.605 1.741 3.185 384 H GLU 16 H GLU 16 29.899 2.155 6.568 385 HA GLU 16 HA GLU 16 27.581 0.866 7.854 386 HB2 GLU 16 HB2 GLU 16 29.365 1.685 9.344 387 HB3 GLU 16 HB3 GLU 16 29.233 3.291 8.636 388 HG2 GLU 16 HG2 GLU 16 28.102 3.202 10.795 389 HG3 GLU 16 HG3 GLU 16 26.957 3.500 9.491 390 H VAL 17 H VAL 17 25.737 1.323 6.932 391 HA VAL 17 HA VAL 17 25.233 4.027 5.884 392 HB VAL 17 HB VAL 17 24.111 3.110 3.947 393 HG11 VAL 17 HG11 VAL 17 26.582 3.623 3.912 394 HG12 VAL 17 HG12 VAL 17 25.991 2.550 2.637 395 HG13 VAL 17 HG13 VAL 17 26.843 1.878 4.030 396 HG21 VAL 17 HG21 VAL 17 25.045 0.386 4.825 397 HG22 VAL 17 HG22 VAL 17 24.156 0.767 3.348 398 HG23 VAL 17 HG23 VAL 17 23.388 0.980 4.924 399 H GLU 18 H GLU 18 22.913 4.271 5.282 400 HA GLU 18 HA GLU 18 20.998 2.832 7.015 401 HB2 GLU 18 HB2 GLU 18 20.935 5.703 6.024 402 HB3 GLU 18 HB3 GLU 18 19.634 4.923 6.917 403 HG2 GLU 18 HG2 GLU 18 22.424 5.453 7.926 404 HG3 GLU 18 HG3 GLU 18 20.969 6.321 8.396 405 H SER 19 H SER 19 18.980 2.328 6.007 406 HA SER 19 HA SER 19 18.992 1.603 3.296 407 HB2 SER 19 HB2 SER 19 16.594 2.120 5.076 408 HB3 SER 19 HB3 SER 19 16.546 1.293 3.516 409 HG SER 19 HG SER 19 17.074 0.228 5.872 410 H SER 20 H SER 20 18.021 4.541 4.845 411 HA SER 20 HA SER 20 16.711 5.782 2.655 412 HB2 SER 20 HB2 SER 20 16.987 7.877 4.028 413 HB3 SER 20 HB3 SER 20 16.144 6.546 4.823 414 HG SER 20 HG SER 20 18.761 7.516 5.266 415 H ASP 21 H ASP 21 20.023 5.261 3.144 416 HA ASP 21 HA ASP 21 21.103 7.625 2.018 417 HB2 ASP 21 HB2 ASP 21 22.180 4.812 2.121 418 HB3 ASP 21 HB3 ASP 21 23.099 6.161 1.462 419 H THR 22 H THR 22 21.210 8.371 0.084 420 HA THR 22 HA THR 22 20.072 7.080 -2.204 421 HB THR 22 HB THR 22 20.909 8.950 -3.497 422 HG1 THR 22 HG1 THR 22 22.394 10.385 -2.701 423 HG21 THR 22 HG21 THR 22 19.887 9.865 -0.810 424 HG22 THR 22 HG22 THR 22 18.909 9.416 -2.207 425 HG23 THR 22 HG23 THR 22 19.925 10.857 -2.267 426 H ILE 23 H ILE 23 21.202 6.327 -4.069 427 HA ILE 23 HA ILE 23 23.456 4.708 -3.623 428 HB ILE 23 HB ILE 23 22.303 5.771 -6.181 429 HG12 ILE 23 HG12 ILE 23 20.713 4.469 -4.980 430 HG13 ILE 23 HG13 ILE 23 21.268 3.528 -6.358 431 HG21 ILE 23 HG21 ILE 23 23.431 3.917 -7.363 432 HG22 ILE 23 HG22 ILE 23 24.333 3.562 -5.884 433 HG23 ILE 23 HG23 ILE 23 24.539 5.116 -6.694 434 HD11 ILE 23 HD11 ILE 23 21.087 2.023 -4.547 435 HD12 ILE 23 HD12 ILE 23 21.900 3.132 -3.442 436 HD13 ILE 23 HD13 ILE 23 22.816 2.333 -4.720 437 H ASP 24 H ASP 24 23.186 7.933 -4.983 438 HA ASP 24 HA ASP 24 25.851 8.412 -5.691 439 HB2 ASP 24 HB2 ASP 24 24.006 9.907 -6.316 440 HB3 ASP 24 HB3 ASP 24 23.784 10.348 -4.620 441 H ASN 25 H ASN 25 24.207 8.797 -2.603 442 HA ASN 25 HA ASN 25 26.315 9.907 -1.097 443 HB2 ASN 25 HB2 ASN 25 24.010 9.995 -0.353 444 HB3 ASN 25 HB3 ASN 25 23.934 8.239 -0.280 445 HD21 ASN 25 HD21 ASN 25 23.864 7.602 1.667 446 HD22 ASN 25 HD22 ASN 25 24.774 8.200 3.007 447 H VAL 26 H VAL 26 25.373 6.549 -1.682 448 HA VAL 26 HA VAL 26 27.273 5.279 -0.014 449 HB VAL 26 HB VAL 26 25.845 4.321 -2.496 450 HG11 VAL 26 HG11 VAL 26 26.449 2.012 -1.758 451 HG12 VAL 26 HG12 VAL 26 27.570 2.718 -0.593 452 HG13 VAL 26 HG13 VAL 26 27.836 2.942 -2.323 453 HG21 VAL 26 HG21 VAL 26 25.366 3.200 0.206 454 HG22 VAL 26 HG22 VAL 26 24.231 3.511 -1.112 455 HG23 VAL 26 HG23 VAL 26 24.795 4.842 -0.099 456 H LYS 27 H LYS 27 27.388 6.087 -3.477 457 HA LYS 27 HA LYS 27 29.934 5.082 -4.055 458 HB2 LYS 27 HB2 LYS 27 28.403 7.365 -5.315 459 HB3 LYS 27 HB3 LYS 27 29.899 6.701 -5.976 460 HG2 LYS 27 HG2 LYS 27 28.858 4.496 -6.160 461 HG3 LYS 27 HG3 LYS 27 27.350 5.149 -5.508 462 HD2 LYS 27 HD2 LYS 27 27.150 6.653 -7.405 463 HD3 LYS 27 HD3 LYS 27 28.696 6.080 -8.056 464 HE2 LYS 27 HE2 LYS 27 27.784 3.843 -8.308 465 HE3 LYS 27 HE3 LYS 27 26.241 4.350 -7.603 466 HZ1 LYS 27 HZ1 LYS 27 27.456 5.380 -10.101 467 HZ2 LYS 27 HZ2 LYS 27 25.974 5.873 -9.451 468 HZ3 LYS 27 HZ3 LYS 27 26.168 4.287 -10.008 469 H SER 28 H SER 28 28.961 8.224 -2.826 470 HA SER 28 HA SER 28 31.488 9.475 -2.702 471 HB2 SER 28 HB2 SER 28 29.341 10.684 -2.423 472 HB3 SER 28 HB3 SER 28 29.124 9.891 -0.857 473 HG SER 28 HG SER 28 30.242 11.546 -0.148 474 H LYS 29 H LYS 29 29.794 7.403 -0.395 475 HA LYS 29 HA LYS 29 31.704 7.434 1.688 476 HB2 LYS 29 HB2 LYS 29 29.724 5.291 0.905 477 HB3 LYS 29 HB3 LYS 29 30.703 5.238 2.366 478 HG2 LYS 29 HG2 LYS 29 29.648 7.298 3.162 479 HG3 LYS 29 HG3 LYS 29 28.670 7.365 1.687 480 HD2 LYS 29 HD2 LYS 29 27.717 5.152 2.252 481 HD3 LYS 29 HD3 LYS 29 28.647 5.158 3.747 482 HE2 LYS 29 HE2 LYS 29 26.605 7.256 3.047 483 HE3 LYS 29 HE3 LYS 29 26.231 5.813 3.987 484 HZ1 LYS 29 HZ1 LYS 29 26.650 7.696 5.399 485 HZ2 LYS 29 HZ2 LYS 29 28.177 7.921 4.709 486 HZ3 LYS 29 HZ3 LYS 29 27.856 6.530 5.618 487 H ILE 30 H ILE 30 31.472 5.504 -1.238 488 HA ILE 30 HA ILE 30 33.629 3.721 -0.712 489 HB ILE 30 HB ILE 30 32.290 4.568 -3.264 490 HG12 ILE 30 HG12 ILE 30 32.244 1.974 -1.721 491 HG13 ILE 30 HG13 ILE 30 31.014 3.224 -1.635 492 HG21 ILE 30 HG21 ILE 30 34.731 3.891 -3.606 493 HG22 ILE 30 HG22 ILE 30 33.523 3.030 -4.556 494 HG23 ILE 30 HG23 ILE 30 34.229 2.268 -3.130 495 HD11 ILE 30 HD11 ILE 30 30.200 1.478 -3.049 496 HD12 ILE 30 HD12 ILE 30 31.684 1.485 -4.003 497 HD13 ILE 30 HD13 ILE 30 30.580 2.861 -4.078 498 H GLN 31 H GLN 31 33.407 6.794 -2.459 499 HA GLN 31 HA GLN 31 36.094 7.103 -3.196 500 HB2 GLN 31 HB2 GLN 31 34.224 8.520 -3.986 501 HB3 GLN 31 HB3 GLN 31 34.111 9.240 -2.378 502 HG2 GLN 31 HG2 GLN 31 36.405 10.083 -2.589 503 HG3 GLN 31 HG3 GLN 31 36.510 9.382 -4.205 504 HE21 GLN 31 HE21 GLN 31 36.838 11.303 -5.195 505 HE22 GLN 31 HE22 GLN 31 35.616 12.512 -5.371 506 H ASP 32 H ASP 32 34.425 7.795 -0.189 507 HA ASP 32 HA ASP 32 36.564 9.063 1.147 508 HB2 ASP 32 HB2 ASP 32 34.010 7.831 2.110 509 HB3 ASP 32 HB3 ASP 32 35.202 8.481 3.236 510 H LYS 33 H LYS 33 35.921 5.687 0.678 511 HA LYS 33 HA LYS 33 37.993 5.022 2.646 512 HB2 LYS 33 HB2 LYS 33 35.924 3.317 1.303 513 HB3 LYS 33 HB3 LYS 33 37.300 2.617 2.155 514 HG2 LYS 33 HG2 LYS 33 36.547 4.146 4.118 515 HG3 LYS 33 HG3 LYS 33 35.008 4.205 3.254 516 HD2 LYS 33 HD2 LYS 33 34.882 2.417 4.864 517 HD3 LYS 33 HD3 LYS 33 34.997 1.700 3.255 518 HE2 LYS 33 HE2 LYS 33 37.393 1.318 3.578 519 HE3 LYS 33 HE3 LYS 33 37.307 2.066 5.172 520 HZ1 LYS 33 HZ1 LYS 33 35.838 0.314 5.877 521 HZ2 LYS 33 HZ2 LYS 33 37.296 -0.323 5.305 522 HZ3 LYS 33 HZ3 LYS 33 35.906 -0.398 4.345 523 H GLU 34 H GLU 34 37.339 4.722 -0.789 524 HA GLU 34 HA GLU 34 39.855 3.252 -1.146 525 HB2 GLU 34 HB2 GLU 34 37.396 3.428 -2.875 526 HB3 GLU 34 HB3 GLU 34 38.898 2.670 -3.397 527 HG2 GLU 34 HG2 GLU 34 37.301 1.867 -0.968 528 HG3 GLU 34 HG3 GLU 34 37.305 1.023 -2.513 529 H GLY 35 H GLY 35 38.266 6.182 -2.091 530 HA2 GLY 35 HA2 GLY 35 39.330 8.140 -2.897 531 HA3 GLY 35 HA3 GLY 35 40.695 7.164 -3.416 532 H ILE 36 H ILE 36 37.974 5.584 -4.359 533 HA ILE 36 HA ILE 36 38.323 6.123 -7.144 534 HB ILE 36 HB ILE 36 36.084 4.587 -5.810 535 HG12 ILE 36 HG12 ILE 36 38.636 3.531 -7.054 536 HG13 ILE 36 HG13 ILE 36 38.407 3.751 -5.321 537 HG21 ILE 36 HG21 ILE 36 35.771 3.539 -8.008 538 HG22 ILE 36 HG22 ILE 36 37.071 4.530 -8.673 539 HG23 ILE 36 HG23 ILE 36 35.580 5.291 -8.122 540 HD11 ILE 36 HD11 ILE 36 37.050 1.775 -7.142 541 HD12 ILE 36 HD12 ILE 36 36.417 2.168 -5.541 542 HD13 ILE 36 HD13 ILE 36 38.025 1.470 -5.704 543 HA PRO 37 HA PRO 37 35.651 9.721 -7.464 544 HB2 PRO 37 HB2 PRO 37 35.864 8.819 -10.315 545 HB3 PRO 37 HB3 PRO 37 36.001 10.457 -9.651 546 HG2 PRO 37 HG2 PRO 37 38.244 9.175 -10.319 547 HG3 PRO 37 HG3 PRO 37 38.182 10.027 -8.756 548 HD2 PRO 37 HD2 PRO 37 37.848 7.078 -9.307 549 HD3 PRO 37 HD3 PRO 37 38.771 7.872 -8.017 550 HA PRO 38 HA PRO 38 31.785 7.459 -7.303 551 HB2 PRO 38 HB2 PRO 38 30.770 10.237 -7.724 552 HB3 PRO 38 HB3 PRO 38 30.228 9.014 -6.558 553 HG2 PRO 38 HG2 PRO 38 31.810 10.976 -5.689 554 HG3 PRO 38 HG3 PRO 38 32.179 9.304 -5.198 555 HD2 PRO 38 HD2 PRO 38 33.472 10.954 -7.372 556 HD3 PRO 38 HD3 PRO 38 34.238 9.905 -6.166 557 H ASP 39 H ASP 39 32.329 9.921 -9.760 558 HA ASP 39 HA ASP 39 30.282 9.001 -11.535 559 HB2 ASP 39 HB2 ASP 39 31.190 10.723 -13.063 560 HB3 ASP 39 HB3 ASP 39 30.806 11.336 -11.467 561 H GLN 40 H GLN 40 32.772 7.306 -10.793 562 HA GLN 40 HA GLN 40 33.074 6.169 -13.470 563 HB2 GLN 40 HB2 GLN 40 35.131 7.392 -12.613 564 HB3 GLN 40 HB3 GLN 40 35.218 6.138 -11.375 565 HG2 GLN 40 HG2 GLN 40 35.182 4.468 -13.316 566 HG3 GLN 40 HG3 GLN 40 35.566 5.843 -14.349 567 HE21 GLN 40 HE21 GLN 40 36.750 5.527 -11.072 568 HE22 GLN 40 HE22 GLN 40 38.404 5.261 -11.493 569 H GLN 41 H GLN 41 31.679 5.692 -10.669 570 HA GLN 41 HA GLN 41 32.231 2.859 -10.328 571 HB2 GLN 41 HB2 GLN 41 30.535 4.797 -8.730 572 HB3 GLN 41 HB3 GLN 41 30.900 3.140 -8.255 573 HG2 GLN 41 HG2 GLN 41 33.282 3.727 -8.070 574 HG3 GLN 41 HG3 GLN 41 32.897 5.389 -8.545 575 HE21 GLN 41 HE21 GLN 41 33.411 6.412 -6.693 576 HE22 GLN 41 HE22 GLN 41 32.618 6.161 -5.178 577 H ARG 42 H ARG 42 30.866 1.381 -11.010 578 HA ARG 42 HA ARG 42 28.020 2.038 -11.480 579 HB2 ARG 42 HB2 ARG 42 29.792 0.077 -12.963 580 HB3 ARG 42 HB3 ARG 42 28.039 0.139 -13.157 581 HG2 ARG 42 HG2 ARG 42 28.165 2.376 -14.039 582 HG3 ARG 42 HG3 ARG 42 29.887 2.469 -13.672 583 HD2 ARG 42 HD2 ARG 42 29.689 2.064 -16.001 584 HD3 ARG 42 HD3 ARG 42 30.239 0.557 -15.269 585 HE ARG 42 HE ARG 42 27.411 0.582 -15.498 586 HH11 ARG 42 HH11 ARG 42 30.276 0.264 -17.489 587 HH12 ARG 42 HH12 ARG 42 29.465 -0.647 -18.720 588 HH21 ARG 42 HH21 ARG 42 26.358 -0.549 -17.177 589 HH22 ARG 42 HH22 ARG 42 27.268 -1.101 -18.543 590 H LEU 43 H LEU 43 26.964 1.264 -9.807 591 HA LEU 43 HA LEU 43 27.929 -1.124 -8.398 592 HB2 LEU 43 HB2 LEU 43 25.830 0.899 -7.619 593 HB3 LEU 43 HB3 LEU 43 26.293 -0.483 -6.637 594 HG LEU 43 HG LEU 43 28.078 1.837 -7.405 595 HD11 LEU 43 HD11 LEU 43 26.322 2.312 -5.714 596 HD12 LEU 43 HD12 LEU 43 27.956 2.409 -5.051 597 HD13 LEU 43 HD13 LEU 43 26.957 0.991 -4.731 598 HD21 LEU 43 HD21 LEU 43 29.619 0.774 -5.687 599 HD22 LEU 43 HD22 LEU 43 29.509 -0.064 -7.241 600 HD23 LEU 43 HD23 LEU 43 28.633 -0.681 -5.837 601 H ILE 44 H ILE 44 26.874 -2.947 -8.211 602 HA ILE 44 HA ILE 44 24.286 -3.271 -9.607 603 HB ILE 44 HB ILE 44 26.684 -5.108 -9.587 604 HG12 ILE 44 HG12 ILE 44 26.241 -5.063 -12.095 605 HG13 ILE 44 HG13 ILE 44 25.171 -3.706 -11.779 606 HG21 ILE 44 HG21 ILE 44 24.478 -6.360 -9.275 607 HG22 ILE 44 HG22 ILE 44 25.499 -6.861 -10.622 608 HG23 ILE 44 HG23 ILE 44 24.087 -5.845 -10.914 609 HD11 ILE 44 HD11 ILE 44 27.351 -2.942 -12.540 610 HD12 ILE 44 HD12 ILE 44 28.135 -3.801 -11.213 611 HD13 ILE 44 HD13 ILE 44 27.070 -2.438 -10.876 612 H PHE 45 H PHE 45 22.755 -4.303 -8.585 613 HA PHE 45 HA PHE 45 23.280 -6.276 -6.532 614 HB2 PHE 45 HB2 PHE 45 23.138 -4.181 -5.203 615 HB3 PHE 45 HB3 PHE 45 21.545 -3.864 -5.911 616 HD1 PHE 45 HD1 PHE 45 23.418 -6.371 -3.888 617 HD2 PHE 45 HD2 PHE 45 19.612 -4.759 -4.970 618 HE1 PHE 45 HE1 PHE 45 22.337 -7.777 -2.167 619 HE2 PHE 45 HE2 PHE 45 18.525 -6.154 -3.236 620 HZ PHE 45 HZ PHE 45 19.893 -7.667 -1.842 621 H ALA 46 H ALA 46 21.973 -7.897 -6.841 622 HA ALA 46 HA ALA 46 20.341 -9.255 -7.627 623 HB1 ALA 46 HB1 ALA 46 19.058 -8.133 -5.904 624 HB2 ALA 46 HB2 ALA 46 18.019 -8.498 -7.281 625 HB3 ALA 46 HB3 ALA 46 18.609 -6.856 -7.037 626 H GLY 47 H GLY 47 21.832 -8.136 -9.581 627 HA2 GLY 47 HA2 GLY 47 22.006 -8.028 -11.870 628 HA3 GLY 47 HA3 GLY 47 20.373 -8.658 -11.953 629 H LYS 48 H LYS 48 21.196 -5.675 -10.359 630 HA LYS 48 HA LYS 48 19.977 -4.053 -12.514 631 HB2 LYS 48 HB2 LYS 48 19.450 -3.999 -9.534 632 HB3 LYS 48 HB3 LYS 48 19.062 -2.634 -10.580 633 HG2 LYS 48 HG2 LYS 48 17.573 -4.059 -11.907 634 HG3 LYS 48 HG3 LYS 48 17.968 -5.431 -10.872 635 HD2 LYS 48 HD2 LYS 48 16.805 -2.894 -9.754 636 HD3 LYS 48 HD3 LYS 48 15.784 -4.168 -10.407 637 HE2 LYS 48 HE2 LYS 48 17.800 -4.625 -8.202 638 HE3 LYS 48 HE3 LYS 48 16.105 -4.222 -7.912 639 HZ1 LYS 48 HZ1 LYS 48 17.079 -6.573 -9.414 640 HZ2 LYS 48 HZ2 LYS 48 15.459 -6.185 -9.119 641 HZ3 LYS 48 HZ3 LYS 48 16.478 -6.590 -7.832 642 H GLN 49 H GLN 49 21.165 -2.355 -13.081 643 HA GLN 49 HA GLN 49 23.526 -1.554 -11.585 644 HB2 GLN 49 HB2 GLN 49 22.269 -0.239 -14.012 645 HB3 GLN 49 HB3 GLN 49 23.876 0.085 -13.365 646 HG2 GLN 49 HG2 GLN 49 24.346 -2.400 -13.759 647 HG3 GLN 49 HG3 GLN 49 22.891 -2.390 -14.757 648 HE21 GLN 49 HE21 GLN 49 23.787 -2.660 -16.707 649 HE22 GLN 49 HE22 GLN 49 24.886 -1.558 -17.454 650 H LEU 50 H LEU 50 23.662 0.089 -10.214 651 HA LEU 50 HA LEU 50 21.169 1.224 -9.293 652 HB2 LEU 50 HB2 LEU 50 23.947 1.609 -8.174 653 HB3 LEU 50 HB3 LEU 50 22.424 1.964 -7.362 654 HG LEU 50 HG LEU 50 23.477 -0.752 -8.144 655 HD11 LEU 50 HD11 LEU 50 24.405 0.409 -6.118 656 HD12 LEU 50 HD12 LEU 50 23.684 -1.176 -5.832 657 HD13 LEU 50 HD13 LEU 50 22.791 0.287 -5.414 658 HD21 LEU 50 HD21 LEU 50 21.199 -1.106 -8.454 659 HD22 LEU 50 HD22 LEU 50 20.752 0.029 -7.182 660 HD23 LEU 50 HD23 LEU 50 21.437 -1.542 -6.759 661 H GLU 51 H GLU 51 20.530 3.247 -9.296 662 HA GLU 51 HA GLU 51 21.831 5.057 -11.205 663 HB2 GLU 51 HB2 GLU 51 18.978 4.669 -10.330 664 HB3 GLU 51 HB3 GLU 51 19.469 6.071 -11.271 665 HG2 GLU 51 HG2 GLU 51 20.129 3.340 -12.287 666 HG3 GLU 51 HG3 GLU 51 18.466 3.913 -12.409 667 H ASP 52 H ASP 52 22.238 7.154 -10.657 668 HA ASP 52 HA ASP 52 23.052 7.658 -8.062 669 HB2 ASP 52 HB2 ASP 52 22.528 9.513 -10.359 670 HB3 ASP 52 HB3 ASP 52 23.137 10.119 -8.817 671 H GLY 53 H GLY 53 20.095 8.838 -9.598 672 HA2 GLY 53 HA2 GLY 53 19.189 10.308 -7.295 673 HA3 GLY 53 HA3 GLY 53 18.318 10.076 -8.796 674 H ARG 54 H ARG 54 19.257 7.078 -7.592 675 HA ARG 54 HA ARG 54 16.656 6.665 -6.256 676 HB2 ARG 54 HB2 ARG 54 18.542 4.584 -7.373 677 HB3 ARG 54 HB3 ARG 54 16.948 4.274 -6.709 678 HG2 ARG 54 HG2 ARG 54 17.605 5.746 -9.261 679 HG3 ARG 54 HG3 ARG 54 16.899 4.147 -9.129 680 HD2 ARG 54 HD2 ARG 54 15.580 6.703 -8.205 681 HD3 ARG 54 HD3 ARG 54 15.269 5.910 -9.751 682 HE ARG 54 HE ARG 54 14.873 4.266 -7.416 683 HH11 ARG 54 HH11 ARG 54 13.262 6.417 -9.696 684 HH12 ARG 54 HH12 ARG 54 11.684 5.858 -9.246 685 HH21 ARG 54 HH21 ARG 54 12.809 3.740 -6.730 686 HH22 ARG 54 HH22 ARG 54 11.428 4.360 -7.572 687 H THR 55 H THR 55 16.791 4.968 -4.474 688 HA THR 55 HA THR 55 19.196 5.464 -2.833 689 HB THR 55 HB THR 55 17.787 5.387 -0.830 690 HG1 THR 55 HG1 THR 55 15.358 5.676 -1.903 691 HG21 THR 55 HG21 THR 55 18.160 7.590 -1.821 692 HG22 THR 55 HG22 THR 55 16.542 7.508 -1.125 693 HG23 THR 55 HG23 THR 55 16.759 7.383 -2.871 694 H LEU 56 H LEU 56 19.279 3.826 -0.943 695 HA LEU 56 HA LEU 56 19.647 1.237 -1.995 696 HB2 LEU 56 HB2 LEU 56 19.464 2.179 0.856 697 HB3 LEU 56 HB3 LEU 56 19.950 0.543 0.411 698 HG LEU 56 HG LEU 56 21.374 3.105 -0.366 699 HD11 LEU 56 HD11 LEU 56 21.515 2.447 2.032 700 HD12 LEU 56 HD12 LEU 56 23.072 2.395 1.199 701 HD13 LEU 56 HD13 LEU 56 22.193 0.901 1.522 702 HD21 LEU 56 HD21 LEU 56 21.801 1.514 -2.109 703 HD22 LEU 56 HD22 LEU 56 22.006 0.209 -0.931 704 HD23 LEU 56 HD23 LEU 56 23.209 1.500 -1.038 705 H SER 57 H SER 57 17.045 2.611 -0.100 706 HA SER 57 HA SER 57 15.527 0.236 0.286 707 HB2 SER 57 HB2 SER 57 13.683 1.795 0.909 708 HB3 SER 57 HB3 SER 57 15.192 2.157 1.746 709 HG SER 57 HG SER 57 14.883 3.472 -0.647 710 H ASP 58 H ASP 58 16.015 2.216 -2.438 711 HA ASP 58 HA ASP 58 13.455 1.725 -3.703 712 HB2 ASP 58 HB2 ASP 58 15.924 3.228 -4.426 713 HB3 ASP 58 HB3 ASP 58 14.845 2.733 -5.722 714 H TYR 59 H TYR 59 16.656 0.340 -3.812 715 HA TYR 59 HA TYR 59 15.929 -1.429 -6.038 716 HB2 TYR 59 HB2 TYR 59 18.503 -0.623 -4.736 717 HB3 TYR 59 HB3 TYR 59 18.424 -2.096 -5.699 718 HD1 TYR 59 HD1 TYR 59 17.688 -1.931 -8.104 719 HD2 TYR 59 HD2 TYR 59 18.711 1.479 -5.761 720 HE1 TYR 59 HE1 TYR 59 18.166 -0.669 -10.164 721 HE2 TYR 59 HE2 TYR 59 19.199 2.750 -7.810 722 HH TYR 59 HH TYR 59 19.425 2.632 -10.018 723 H ASN 60 H ASN 60 15.548 -1.430 -2.826 724 HA ASN 60 HA ASN 60 15.020 -2.965 -1.271 725 HB2 ASN 60 HB2 ASN 60 14.185 -4.168 -3.457 726 HB3 ASN 60 HB3 ASN 60 15.498 -5.280 -3.085 727 HD21 ASN 60 HD21 ASN 60 14.229 -6.988 -2.560 728 HD22 ASN 60 HD22 ASN 60 13.210 -7.034 -1.167 729 H ILE 61 H ILE 61 17.795 -2.183 -2.014 730 HA ILE 61 HA ILE 61 19.555 -4.237 -1.033 731 HB ILE 61 HB ILE 61 19.972 -1.255 -1.334 732 HG12 ILE 61 HG12 ILE 61 20.830 -3.554 -3.094 733 HG13 ILE 61 HG13 ILE 61 19.466 -2.493 -3.423 734 HG21 ILE 61 HG21 ILE 61 21.536 -2.160 0.300 735 HG22 ILE 61 HG22 ILE 61 22.399 -1.739 -1.185 736 HG23 ILE 61 HG23 ILE 61 22.013 -3.428 -0.825 737 HD11 ILE 61 HD11 ILE 61 22.358 -1.618 -3.290 738 HD12 ILE 61 HD12 ILE 61 20.974 -0.614 -3.734 739 HD13 ILE 61 HD13 ILE 61 21.454 -1.960 -4.769 740 H GLN 62 H GLN 62 19.257 -4.950 0.947 741 HA GLN 62 HA GLN 62 18.532 -3.071 3.080 742 HB2 GLN 62 HB2 GLN 62 18.250 -6.077 2.947 743 HB3 GLN 62 HB3 GLN 62 17.734 -5.072 4.293 744 HG2 GLN 62 HG2 GLN 62 16.181 -3.899 2.712 745 HG3 GLN 62 HG3 GLN 62 16.605 -5.102 1.494 746 HE21 GLN 62 HE21 GLN 62 16.819 -7.144 3.727 747 HE22 GLN 62 HE22 GLN 62 15.181 -7.582 4.050 748 H LYS 63 H LYS 63 19.272 -4.407 5.314 749 HA LYS 63 HA LYS 63 22.050 -3.877 5.504 750 HB2 LYS 63 HB2 LYS 63 21.923 -4.726 7.759 751 HB3 LYS 63 HB3 LYS 63 20.472 -3.796 7.430 752 HG2 LYS 63 HG2 LYS 63 19.231 -5.893 7.053 753 HG3 LYS 63 HG3 LYS 63 20.689 -6.806 7.461 754 HD2 LYS 63 HD2 LYS 63 20.715 -5.724 9.680 755 HD3 LYS 63 HD3 LYS 63 19.218 -4.881 9.266 756 HE2 LYS 63 HE2 LYS 63 18.149 -7.120 8.907 757 HE3 LYS 63 HE3 LYS 63 19.618 -7.861 9.559 758 HZ1 LYS 63 HZ1 LYS 63 17.880 -5.921 10.956 759 HZ2 LYS 63 HZ2 LYS 63 19.303 -6.591 11.580 760 HZ3 LYS 63 HZ3 LYS 63 17.967 -7.581 11.268 761 H GLU 64 H GLU 64 23.800 -5.162 5.455 762 HA GLU 64 HA GLU 64 25.163 -6.978 5.223 763 HB2 GLU 64 HB2 GLU 64 22.766 -8.166 6.238 764 HB3 GLU 64 HB3 GLU 64 23.444 -9.221 5.008 765 HG2 GLU 64 HG2 GLU 64 24.225 -9.763 7.268 766 HG3 GLU 64 HG3 GLU 64 25.543 -9.322 6.185 767 H SER 65 H SER 65 23.131 -5.905 2.968 768 HA SER 65 HA SER 65 23.318 -7.898 0.909 769 HB2 SER 65 HB2 SER 65 22.921 -4.899 0.738 770 HB3 SER 65 HB3 SER 65 22.804 -5.988 -0.645 771 HG SER 65 HG SER 65 21.272 -6.888 1.386 772 H THR 66 H THR 66 24.833 -8.154 -0.673 773 HA THR 66 HA THR 66 27.115 -6.299 -0.580 774 HB THR 66 HB THR 66 28.715 -7.845 -0.639 775 HG1 THR 66 HG1 THR 66 28.749 -9.034 -2.339 776 HG21 THR 66 HG21 THR 66 26.694 -8.771 1.020 777 HG22 THR 66 HG22 THR 66 28.378 -9.297 1.032 778 HG23 THR 66 HG23 THR 66 27.180 -10.188 0.091 779 H LEU 67 H LEU 67 27.711 -5.366 -2.250 780 HA LEU 67 HA LEU 67 26.378 -5.788 -4.851 781 HB2 LEU 67 HB2 LEU 67 27.613 -3.391 -3.479 782 HB3 LEU 67 HB3 LEU 67 27.218 -3.369 -5.186 783 HG LEU 67 HG LEU 67 24.832 -3.635 -4.640 784 HD11 LEU 67 HD11 LEU 67 25.100 -4.838 -2.439 785 HD12 LEU 67 HD12 LEU 67 23.960 -3.492 -2.412 786 HD13 LEU 67 HD13 LEU 67 25.577 -3.293 -1.735 787 HD21 LEU 67 HD21 LEU 67 25.788 -1.423 -4.867 788 HD22 LEU 67 HD22 LEU 67 26.249 -1.425 -3.165 789 HD23 LEU 67 HD23 LEU 67 24.541 -1.415 -3.616 790 H HIS 68 H HIS 68 27.748 -5.252 -6.704 791 HA HIS 68 HA HIS 68 30.609 -5.825 -6.263 792 HB2 HIS 68 HB2 HIS 68 28.769 -6.672 -8.494 793 HB3 HIS 68 HB3 HIS 68 30.526 -6.645 -8.710 794 HD1 HIS 68 HD1 HIS 68 27.909 -8.463 -6.644 795 HD2 HIS 68 HD2 HIS 68 31.923 -8.532 -7.564 796 HE1 HIS 68 HE1 HIS 68 28.788 -10.660 -5.732 797 HE2 HIS 68 HE2 HIS 68 31.281 -10.578 -6.201 798 H LEU 69 H LEU 69 32.102 -4.757 -7.404 799 HA LEU 69 HA LEU 69 31.275 -2.220 -8.676 800 HB2 LEU 69 HB2 LEU 69 32.413 -1.855 -6.553 801 HB3 LEU 69 HB3 LEU 69 33.728 -2.916 -7.038 802 HG LEU 69 HG LEU 69 34.298 -1.321 -8.857 803 HD11 LEU 69 HD11 LEU 69 32.312 0.514 -7.518 804 HD12 LEU 69 HD12 LEU 69 32.084 -0.246 -9.095 805 HD13 LEU 69 HD13 LEU 69 33.394 0.919 -8.852 806 HD21 LEU 69 HD21 LEU 69 35.608 -1.194 -6.896 807 HD22 LEU 69 HD22 LEU 69 34.326 -0.370 -6.007 808 HD23 LEU 69 HD23 LEU 69 35.177 0.468 -7.305 809 H VAL 70 H VAL 70 31.811 -1.951 -10.715 810 HA VAL 70 HA VAL 70 34.026 -3.503 -11.893 811 HB VAL 70 HB VAL 70 31.509 -2.363 -13.189 812 HG11 VAL 70 HG11 VAL 70 33.282 -2.038 -14.765 813 HG12 VAL 70 HG12 VAL 70 32.315 -3.408 -15.309 814 HG13 VAL 70 HG13 VAL 70 33.867 -3.685 -14.520 815 HG21 VAL 70 HG21 VAL 70 31.384 -4.565 -11.887 816 HG22 VAL 70 HG22 VAL 70 32.320 -5.254 -13.214 817 HG23 VAL 70 HG23 VAL 70 30.731 -4.551 -13.525 818 H LEU 71 H LEU 71 35.616 -2.260 -12.872 819 HA LEU 71 HA LEU 71 35.549 0.574 -12.199 820 HB2 LEU 71 HB2 LEU 71 37.493 -1.327 -11.884 821 HB3 LEU 71 HB3 LEU 71 38.001 -0.554 -13.377 822 HG LEU 71 HG LEU 71 37.557 1.628 -11.950 823 HD11 LEU 71 HD11 LEU 71 36.763 0.273 -10.016 824 HD12 LEU 71 HD12 LEU 71 38.068 1.396 -9.635 825 HD13 LEU 71 HD13 LEU 71 38.413 -0.324 -9.824 826 HD21 LEU 71 HD21 LEU 71 40.089 -0.049 -12.050 827 HD22 LEU 71 HD22 LEU 71 40.055 1.545 -11.291 828 HD23 LEU 71 HD23 LEU 71 39.684 1.378 -13.007 Start of MODEL 10 1 H GLY 12 H GLY 12 6.794 -12.144 -3.692 2 HA2 GLY 12 HA2 GLY 12 8.763 -11.952 -1.628 3 HA3 GLY 12 HA3 GLY 12 9.371 -12.843 -3.015 4 HA PRO 13 HA PRO 13 10.295 -9.053 -5.063 5 HB2 PRO 13 HB2 PRO 13 9.414 -9.355 -7.634 6 HB3 PRO 13 HB3 PRO 13 10.864 -10.137 -7.000 7 HG2 PRO 13 HG2 PRO 13 8.137 -11.265 -7.445 8 HG3 PRO 13 HG3 PRO 13 9.718 -12.037 -7.656 9 HD2 PRO 13 HD2 PRO 13 8.085 -12.466 -5.481 10 HD3 PRO 13 HD3 PRO 13 9.849 -12.652 -5.438 11 H MET 14 H MET 14 8.674 -7.998 -3.642 12 HA MET 14 HA MET 14 6.074 -7.386 -4.644 13 HB2 MET 14 HB2 MET 14 7.743 -6.372 -2.348 14 HB3 MET 14 HB3 MET 14 6.218 -5.581 -2.768 15 HG2 MET 14 HG2 MET 14 6.421 -8.558 -2.338 16 HG3 MET 14 HG3 MET 14 6.056 -7.432 -1.018 17 HE1 MET 14 HE1 MET 14 2.506 -8.298 -1.162 18 HE2 MET 14 HE2 MET 14 3.543 -7.116 -0.361 19 HE3 MET 14 HE3 MET 14 4.089 -8.782 -0.550 20 H LEU 15 H LEU 15 6.567 -6.631 -6.774 21 HA LEU 15 HA LEU 15 8.157 -4.282 -7.195 22 HB2 LEU 15 HB2 LEU 15 6.991 -6.313 -8.807 23 HB3 LEU 15 HB3 LEU 15 6.317 -4.780 -9.362 24 HG LEU 15 HG LEU 15 8.635 -3.862 -9.558 25 HD11 LEU 15 HD11 LEU 15 10.403 -4.951 -8.702 26 HD12 LEU 15 HD12 LEU 15 9.992 -6.406 -9.611 27 HD13 LEU 15 HD13 LEU 15 9.284 -6.132 -8.017 28 HD21 LEU 15 HD21 LEU 15 7.531 -4.800 -11.517 29 HD22 LEU 15 HD22 LEU 15 8.067 -6.420 -11.069 30 HD23 LEU 15 HD23 LEU 15 9.248 -5.203 -11.551 31 H CYS 16 H CYS 16 7.469 -2.181 -7.633 32 HA CYS 16 HA CYS 16 5.515 -1.028 -6.139 33 HB2 CYS 16 HB2 CYS 16 7.345 0.093 -7.545 34 HB3 CYS 16 HB3 CYS 16 6.160 0.085 -8.862 35 H SER 17 H SER 17 3.401 -0.710 -6.142 36 HA SER 17 HA SER 17 1.688 -2.191 -7.832 37 HB2 SER 17 HB2 SER 17 1.022 0.113 -5.978 38 HB3 SER 17 HB3 SER 17 -0.139 -1.045 -6.642 39 HG SER 17 HG SER 17 1.658 -2.553 -5.605 40 H THR 18 H THR 18 2.800 1.154 -7.917 41 HA THR 18 HA THR 18 0.868 2.044 -9.824 42 HB THR 18 HB THR 18 2.329 4.027 -10.049 43 HG1 THR 18 HG1 THR 18 4.316 2.824 -9.722 44 HG21 THR 18 HG21 THR 18 1.900 3.101 -7.199 45 HG22 THR 18 HG22 THR 18 0.673 3.853 -8.219 46 HG23 THR 18 HG23 THR 18 2.096 4.773 -7.723 47 H GLY 19 H GLY 19 3.673 0.094 -10.172 48 HA2 GLY 19 HA2 GLY 19 4.533 -0.903 -12.085 49 HA3 GLY 19 HA3 GLY 19 3.339 -0.021 -13.029 50 H CYS 20 H CYS 20 5.888 1.232 -10.866 51 HA CYS 20 HA CYS 20 6.697 3.069 -12.946 52 HB2 CYS 20 HB2 CYS 20 8.064 4.137 -11.252 53 HB3 CYS 20 HB3 CYS 20 6.484 3.779 -10.558 54 H GLY 21 H GLY 21 7.686 -0.066 -11.979 55 HA2 GLY 21 HA2 GLY 21 9.233 -1.350 -13.253 56 HA3 GLY 21 HA3 GLY 21 10.025 0.137 -13.748 57 H PHE 22 H PHE 22 9.508 0.292 -10.431 58 HA PHE 22 HA PHE 22 12.206 -0.770 -9.885 59 HB2 PHE 22 HB2 PHE 22 10.807 1.613 -8.663 60 HB3 PHE 22 HB3 PHE 22 12.373 0.985 -8.130 61 HD1 PHE 22 HD1 PHE 22 14.270 0.892 -9.767 62 HD2 PHE 22 HD2 PHE 22 10.660 3.039 -10.556 63 HE1 PHE 22 HE1 PHE 22 15.415 2.142 -11.559 64 HE2 PHE 22 HE2 PHE 22 11.801 4.303 -12.346 65 HZ PHE 22 HZ PHE 22 14.180 3.853 -12.851 66 H TYR 23 H TYR 23 12.352 -0.835 -7.242 67 HA TYR 23 HA TYR 23 10.341 -2.838 -6.538 68 HB2 TYR 23 HB2 TYR 23 13.135 -2.268 -5.665 69 HB3 TYR 23 HB3 TYR 23 12.048 -3.070 -4.526 70 HD1 TYR 23 HD1 TYR 23 13.169 -3.263 -8.067 71 HD2 TYR 23 HD2 TYR 23 11.845 -5.396 -4.617 72 HE1 TYR 23 HE1 TYR 23 13.560 -5.388 -9.251 73 HE2 TYR 23 HE2 TYR 23 12.229 -7.539 -5.785 74 HH TYR 23 HH TYR 23 13.988 -7.770 -8.698 75 H GLY 24 H GLY 24 8.875 -2.578 -4.942 76 HA2 GLY 24 HA2 GLY 24 8.838 0.014 -3.535 77 HA3 GLY 24 HA3 GLY 24 7.445 -1.030 -3.801 78 H ASN 25 H ASN 25 9.021 0.144 -1.356 79 HA ASN 25 HA ASN 25 9.971 -2.052 0.142 80 HB2 ASN 25 HB2 ASN 25 9.082 0.735 0.809 81 HB3 ASN 25 HB3 ASN 25 9.324 -0.434 2.110 82 HD21 ASN 25 HD21 ASN 25 11.166 0.562 2.980 83 HD22 ASN 25 HD22 ASN 25 12.673 0.608 2.139 84 HA PRO 26 HA PRO 26 5.891 -3.828 1.027 85 HB2 PRO 26 HB2 PRO 26 6.673 -5.745 2.776 86 HB3 PRO 26 HB3 PRO 26 6.834 -5.909 1.020 87 HG2 PRO 26 HG2 PRO 26 8.883 -5.121 3.055 88 HG3 PRO 26 HG3 PRO 26 9.049 -6.227 1.677 89 HD2 PRO 26 HD2 PRO 26 9.955 -3.669 1.593 90 HD3 PRO 26 HD3 PRO 26 9.311 -4.482 0.154 91 H ARG 27 H ARG 27 8.101 -2.456 3.351 92 HA ARG 27 HA ARG 27 6.304 -2.547 5.596 93 HB2 ARG 27 HB2 ARG 27 8.820 -0.971 5.006 94 HB3 ARG 27 HB3 ARG 27 7.903 -0.757 6.498 95 HG2 ARG 27 HG2 ARG 27 8.109 -3.225 6.899 96 HG3 ARG 27 HG3 ARG 27 9.184 -3.308 5.508 97 HD2 ARG 27 HD2 ARG 27 10.733 -3.050 7.217 98 HD3 ARG 27 HD3 ARG 27 10.486 -1.376 6.706 99 HE ARG 27 HE ARG 27 8.871 -2.295 8.095 100 HH11 ARG 27 HH11 ARG 27 12.091 -1.503 8.344 101 HH12 ARG 27 HH12 ARG 27 12.302 -0.900 9.954 102 HH21 ARG 27 HH21 ARG 27 8.966 -1.198 10.820 103 HH22 ARG 27 HH22 ARG 27 10.552 -0.730 11.338 104 H THR 28 H THR 28 6.978 -0.338 2.944 105 HA THR 28 HA THR 28 5.352 1.805 3.986 106 HB THR 28 HB THR 28 5.796 2.892 1.828 107 HG1 THR 28 HG1 THR 28 6.104 0.340 1.039 108 HG21 THR 28 HG21 THR 28 8.373 2.629 1.835 109 HG22 THR 28 HG22 THR 28 8.117 1.523 3.182 110 HG23 THR 28 HG23 THR 28 7.596 3.206 3.310 111 H ASN 29 H ASN 29 3.973 2.335 1.378 112 HA ASN 29 HA ASN 29 1.712 0.548 1.803 113 HB2 ASN 29 HB2 ASN 29 2.146 3.167 0.396 114 HB3 ASN 29 HB3 ASN 29 0.709 2.202 0.021 115 HD21 ASN 29 HD21 ASN 29 -0.973 3.071 1.184 116 HD22 ASN 29 HD22 ASN 29 -0.889 3.523 2.848 117 H GLY 30 H GLY 30 4.199 -0.422 0.385 118 HA2 GLY 30 HA2 GLY 30 4.452 -2.054 -1.276 119 HA3 GLY 30 HA3 GLY 30 2.853 -1.648 -1.888 120 H MET 31 H MET 31 4.764 1.139 -1.393 121 HA MET 31 HA MET 31 5.488 1.212 -4.256 122 HB2 MET 31 HB2 MET 31 4.154 3.213 -2.474 123 HB3 MET 31 HB3 MET 31 5.187 3.806 -3.787 124 HG2 MET 31 HG2 MET 31 3.020 3.684 -4.715 125 HG3 MET 31 HG3 MET 31 3.850 2.239 -5.317 126 HE1 MET 31 HE1 MET 31 -0.161 2.124 -3.976 127 HE2 MET 31 HE2 MET 31 0.777 2.752 -5.331 128 HE3 MET 31 HE3 MET 31 0.750 3.625 -3.797 129 H CYS 32 H CYS 32 7.262 2.690 -4.777 130 HA CYS 32 HA CYS 32 9.475 2.326 -2.998 131 HB2 CYS 32 HB2 CYS 32 10.787 3.407 -4.798 132 HB3 CYS 32 HB3 CYS 32 9.721 2.164 -5.453 133 H SER 33 H SER 33 10.968 4.656 -3.129 134 HA SER 33 HA SER 33 9.649 6.236 -1.133 135 HB2 SER 33 HB2 SER 33 11.741 7.498 -1.031 136 HB3 SER 33 HB3 SER 33 12.092 5.768 -1.076 137 HG SER 33 HG SER 33 13.311 6.320 -2.696 138 H VAL 34 H VAL 34 9.998 6.521 -4.556 139 HA VAL 34 HA VAL 34 9.682 9.357 -4.715 140 HB VAL 34 HB VAL 34 9.289 7.272 -6.866 141 HG11 VAL 34 HG11 VAL 34 9.642 9.135 -8.423 142 HG12 VAL 34 HG12 VAL 34 9.780 10.245 -7.060 143 HG13 VAL 34 HG13 VAL 34 8.245 9.444 -7.389 144 HG21 VAL 34 HG21 VAL 34 11.588 7.814 -7.532 145 HG22 VAL 34 HG22 VAL 34 11.552 7.202 -5.877 146 HG23 VAL 34 HG23 VAL 34 11.720 8.932 -6.177 147 H CYS 35 H CYS 35 7.472 6.642 -5.413 148 HA CYS 35 HA CYS 35 5.235 8.382 -5.876 149 HB2 CYS 35 HB2 CYS 35 5.368 5.380 -5.552 150 HB3 CYS 35 HB3 CYS 35 3.968 6.285 -6.145 151 H TYR 36 H TYR 36 6.542 6.752 -3.113 152 HA TYR 36 HA TYR 36 4.252 6.469 -1.531 153 HB2 TYR 36 HB2 TYR 36 6.384 5.410 -0.951 154 HB3 TYR 36 HB3 TYR 36 7.113 6.992 -0.666 155 HD1 TYR 36 HD1 TYR 36 3.715 5.798 0.394 156 HD2 TYR 36 HD2 TYR 36 7.679 6.936 1.585 157 HE1 TYR 36 HE1 TYR 36 3.025 5.705 2.778 158 HE2 TYR 36 HE2 TYR 36 6.994 6.849 3.967 159 HH TYR 36 HH TYR 36 4.073 5.420 5.010 160 H LYS 37 H LYS 37 6.516 9.246 -1.687 161 HA LYS 37 HA LYS 37 5.023 10.753 0.228 162 HB2 LYS 37 HB2 LYS 37 6.475 12.652 -0.406 163 HB3 LYS 37 HB3 LYS 37 7.417 11.196 -0.090 164 HG2 LYS 37 HG2 LYS 37 7.544 10.761 -2.516 165 HG3 LYS 37 HG3 LYS 37 6.636 12.252 -2.812 166 HD2 LYS 37 HD2 LYS 37 8.443 13.473 -1.524 167 HD3 LYS 37 HD3 LYS 37 9.384 11.974 -1.594 168 HE2 LYS 37 HE2 LYS 37 9.033 12.026 -4.116 169 HE3 LYS 37 HE3 LYS 37 8.442 13.683 -3.893 170 HZ1 LYS 37 HZ1 LYS 37 10.538 14.265 -2.850 171 HZ2 LYS 37 HZ2 LYS 37 10.807 13.659 -4.407 172 HZ3 LYS 37 HZ3 LYS 37 11.113 12.689 -3.056 173 H GLU 38 H GLU 38 5.244 10.738 -3.299 174 HA GLU 38 HA GLU 38 3.668 12.941 -3.898 175 HB2 GLU 38 HB2 GLU 38 4.222 10.357 -5.335 176 HB3 GLU 38 HB3 GLU 38 3.093 11.536 -6.019 177 HG2 GLU 38 HG2 GLU 38 5.836 12.370 -5.097 178 HG3 GLU 38 HG3 GLU 38 5.560 11.725 -6.724 179 H HIS 39 H HIS 39 2.627 9.609 -3.143 180 HA HIS 39 HA HIS 39 -0.135 10.354 -3.621 181 HB2 HIS 39 HB2 HIS 39 -0.723 8.077 -3.422 182 HB3 HIS 39 HB3 HIS 39 0.850 8.066 -4.210 183 HD1 HIS 39 HD1 HIS 39 2.083 6.091 -3.413 184 HD2 HIS 39 HD2 HIS 39 -0.042 7.885 -0.303 185 HE1 HIS 39 HE1 HIS 39 2.503 4.686 -1.354 186 HE2 HIS 39 HE2 HIS 39 1.525 6.000 0.581 187 H LEU 40 H LEU 40 1.966 9.873 -0.871 188 HA LEU 40 HA LEU 40 0.020 9.734 1.167 189 HB2 LEU 40 HB2 LEU 40 2.521 9.263 1.356 190 HB3 LEU 40 HB3 LEU 40 2.743 11.012 1.456 191 HG LEU 40 HG LEU 40 1.044 10.980 3.374 192 HD11 LEU 40 HD11 LEU 40 0.212 8.667 2.830 193 HD12 LEU 40 HD12 LEU 40 0.723 8.869 4.509 194 HD13 LEU 40 HD13 LEU 40 1.777 8.043 3.363 195 HD21 LEU 40 HD21 LEU 40 2.796 10.138 4.995 196 HD22 LEU 40 HD22 LEU 40 3.373 11.352 3.849 197 HD23 LEU 40 HD23 LEU 40 3.750 9.649 3.595 198 H GLN 41 H GLN 41 1.362 12.454 -0.588 199 HA GLN 41 HA GLN 41 0.583 14.518 1.186 200 HB2 GLN 41 HB2 GLN 41 1.442 14.337 -1.666 201 HB3 GLN 41 HB3 GLN 41 0.636 15.824 -1.150 202 HG2 GLN 41 HG2 GLN 41 2.252 16.135 0.636 203 HG3 GLN 41 HG3 GLN 41 3.032 14.599 0.232 204 HE21 GLN 41 HE21 GLN 41 2.654 17.935 -0.736 205 HE22 GLN 41 HE22 GLN 41 3.856 17.892 -1.975 206 H ARG 42 H ARG 42 -1.076 12.953 -1.534 207 HA ARG 42 HA ARG 42 -3.355 14.715 -1.405 208 HB2 ARG 42 HB2 ARG 42 -2.793 12.152 -2.899 209 HB3 ARG 42 HB3 ARG 42 -4.344 12.998 -3.008 210 HG2 ARG 42 HG2 ARG 42 -3.337 14.939 -3.937 211 HG3 ARG 42 HG3 ARG 42 -1.713 14.367 -3.526 212 HD2 ARG 42 HD2 ARG 42 -2.105 12.418 -5.058 213 HD3 ARG 42 HD3 ARG 42 -3.583 13.221 -5.600 214 HE ARG 42 HE ARG 42 -0.848 13.586 -6.061 215 HH11 ARG 42 HH11 ARG 42 -4.086 15.273 -5.793 216 HH12 ARG 42 HH12 ARG 42 -3.794 16.643 -6.812 217 HH21 ARG 42 HH21 ARG 42 -0.591 15.681 -7.690 218 HH22 ARG 42 HH22 ARG 42 -1.839 16.868 -7.875 219 H GLN 43 H GLN 43 -2.471 11.594 -0.082 220 HA GLN 43 HA GLN 43 -5.119 10.878 0.758 221 HB2 GLN 43 HB2 GLN 43 -3.023 9.361 0.341 222 HB3 GLN 43 HB3 GLN 43 -2.620 9.772 2.012 223 HG2 GLN 43 HG2 GLN 43 -3.879 7.871 2.342 224 HG3 GLN 43 HG3 GLN 43 -5.136 9.112 2.449 225 HE21 GLN 43 HE21 GLN 43 -6.778 7.657 1.692 226 HE22 GLN 43 HE22 GLN 43 -6.832 7.140 0.045 227 H GLN 44 H GLN 44 -2.312 12.446 2.217 228 HA GLN 44 HA GLN 44 -3.383 12.543 4.867 229 HB2 GLN 44 HB2 GLN 44 -0.910 12.713 4.126 230 HB3 GLN 44 HB3 GLN 44 -1.269 14.420 3.827 231 HG2 GLN 44 HG2 GLN 44 -1.890 14.782 6.105 232 HG3 GLN 44 HG3 GLN 44 -1.864 13.045 6.445 233 HE21 GLN 44 HE21 GLN 44 0.397 15.464 5.064 234 HE22 GLN 44 HE22 GLN 44 1.757 14.892 5.963 235 H ASN 45 H ASN 45 -3.243 14.809 2.141 236 HA ASN 45 HA ASN 45 -4.308 17.048 3.517 237 HB2 ASN 45 HB2 ASN 45 -3.996 16.297 0.623 238 HB3 ASN 45 HB3 ASN 45 -4.949 17.720 1.057 239 HD21 ASN 45 HD21 ASN 45 -2.226 17.460 -0.261 240 HD22 ASN 45 HD22 ASN 45 -1.202 18.460 0.707 241 H SER 46 H SER 46 -5.803 14.480 1.572 242 HA SER 46 HA SER 46 -8.448 15.566 1.758 243 HB2 SER 46 HB2 SER 46 -7.467 13.909 -0.004 244 HB3 SER 46 HB3 SER 46 -7.884 12.669 1.185 245 HG SER 46 HG SER 46 -9.613 14.528 -0.079 246 H1 MET 1 H1 MET 1 23.278 -0.272 9.932 247 H2 MET 1 H2 MET 1 23.946 0.381 8.520 248 H3 MET 1 H3 MET 1 24.939 0.043 9.847 249 HA MET 1 HA MET 1 24.526 -2.299 9.622 250 HB2 MET 1 HB2 MET 1 23.230 -3.165 7.775 251 HB3 MET 1 HB3 MET 1 22.236 -2.019 8.662 252 HG2 MET 1 HG2 MET 1 22.694 -0.311 6.967 253 HG3 MET 1 HG3 MET 1 23.692 -1.456 6.081 254 HE1 MET 1 HE1 MET 1 20.882 -1.379 3.547 255 HE2 MET 1 HE2 MET 1 22.619 -1.402 3.859 256 HE3 MET 1 HE3 MET 1 21.644 -0.032 4.394 257 H GLN 2 H GLN 2 26.059 -3.500 8.498 258 HA GLN 2 HA GLN 2 27.729 -1.934 6.664 259 HB2 GLN 2 HB2 GLN 2 29.488 -3.414 7.098 260 HB3 GLN 2 HB3 GLN 2 28.682 -3.237 8.649 261 HG2 GLN 2 HG2 GLN 2 27.560 -5.377 8.339 262 HG3 GLN 2 HG3 GLN 2 28.293 -5.546 6.747 263 HE21 GLN 2 HE21 GLN 2 30.804 -4.310 7.926 264 HE22 GLN 2 HE22 GLN 2 31.566 -5.627 8.747 265 H ILE 3 H ILE 3 28.159 -2.490 4.631 266 HA ILE 3 HA ILE 3 27.104 -5.009 3.581 267 HB ILE 3 HB ILE 3 26.143 -4.178 1.686 268 HG12 ILE 3 HG12 ILE 3 27.747 -2.542 0.961 269 HG13 ILE 3 HG13 ILE 3 26.108 -1.935 0.816 270 HG21 ILE 3 HG21 ILE 3 24.700 -3.946 3.590 271 HG22 ILE 3 HG22 ILE 3 24.320 -2.758 2.344 272 HG23 ILE 3 HG23 ILE 3 25.207 -2.268 3.788 273 HD11 ILE 3 HD11 ILE 3 28.197 -0.549 1.810 274 HD12 ILE 3 HD12 ILE 3 27.501 -1.189 3.298 275 HD13 ILE 3 HD13 ILE 3 26.504 -0.217 2.210 276 H PHE 4 H PHE 4 28.182 -5.606 1.546 277 HA PHE 4 HA PHE 4 31.014 -4.747 1.661 278 HB2 PHE 4 HB2 PHE 4 29.929 -7.419 0.721 279 HB3 PHE 4 HB3 PHE 4 31.627 -7.007 1.036 280 HD1 PHE 4 HD1 PHE 4 32.277 -6.387 3.447 281 HD2 PHE 4 HD2 PHE 4 28.561 -8.232 2.417 282 HE1 PHE 4 HE1 PHE 4 31.940 -7.031 5.809 283 HE2 PHE 4 HE2 PHE 4 28.233 -8.899 4.779 284 HZ PHE 4 HZ PHE 4 29.924 -8.289 6.473 285 H VAL 5 H VAL 5 32.029 -4.176 -0.144 286 HA VAL 5 HA VAL 5 30.606 -4.326 -2.733 287 HB VAL 5 HB VAL 5 32.427 -2.095 -1.774 288 HG11 VAL 5 HG11 VAL 5 32.763 -2.316 -4.126 289 HG12 VAL 5 HG12 VAL 5 31.647 -0.969 -3.907 290 HG13 VAL 5 HG13 VAL 5 31.039 -2.545 -4.419 291 HG21 VAL 5 HG21 VAL 5 29.532 -1.813 -2.544 292 HG22 VAL 5 HG22 VAL 5 30.549 -0.695 -1.623 293 HG23 VAL 5 HG23 VAL 5 30.007 -2.206 -0.892 294 H LYS 6 H LYS 6 31.532 -6.040 -3.564 295 HA LYS 6 HA LYS 6 34.345 -6.656 -3.378 296 HB2 LYS 6 HB2 LYS 6 32.102 -7.722 -5.108 297 HB3 LYS 6 HB3 LYS 6 33.732 -8.388 -5.086 298 HG2 LYS 6 HG2 LYS 6 33.493 -9.020 -2.761 299 HG3 LYS 6 HG3 LYS 6 31.896 -8.264 -2.691 300 HD2 LYS 6 HD2 LYS 6 31.712 -10.698 -2.999 301 HD3 LYS 6 HD3 LYS 6 31.074 -9.822 -4.391 302 HE2 LYS 6 HE2 LYS 6 33.341 -10.153 -5.481 303 HE3 LYS 6 HE3 LYS 6 33.712 -11.277 -4.170 304 HZ1 LYS 6 HZ1 LYS 6 31.475 -11.501 -6.087 305 HZ2 LYS 6 HZ2 LYS 6 31.784 -12.570 -4.812 306 HZ3 LYS 6 HZ3 LYS 6 32.888 -12.431 -6.086 307 H THR 7 H THR 7 35.910 -6.046 -4.678 308 HA THR 7 HA THR 7 35.261 -4.729 -7.242 309 HB THR 7 HB THR 7 37.494 -3.814 -7.241 310 HG1 THR 7 HG1 THR 7 37.864 -5.746 -5.266 311 HG21 THR 7 HG21 THR 7 36.672 -3.502 -4.369 312 HG22 THR 7 HG22 THR 7 35.722 -2.777 -5.669 313 HG23 THR 7 HG23 THR 7 37.408 -2.305 -5.435 314 H LEU 8 H LEU 8 36.886 -5.274 -9.003 315 HA LEU 8 HA LEU 8 36.652 -8.108 -9.377 316 HB2 LEU 8 HB2 LEU 8 37.675 -6.027 -11.292 317 HB3 LEU 8 HB3 LEU 8 37.225 -7.682 -11.698 318 HG LEU 8 HG LEU 8 35.396 -5.538 -10.618 319 HD11 LEU 8 HD11 LEU 8 36.093 -5.363 -13.008 320 HD12 LEU 8 HD12 LEU 8 34.354 -5.528 -12.753 321 HD13 LEU 8 HD13 LEU 8 35.304 -6.914 -13.284 322 HD21 LEU 8 HD21 LEU 8 34.887 -8.457 -11.079 323 HD22 LEU 8 HD22 LEU 8 33.589 -7.271 -11.216 324 HD23 LEU 8 HD23 LEU 8 34.455 -7.462 -9.690 325 H THR 9 H THR 9 39.209 -6.071 -8.472 326 HA THR 9 HA THR 9 41.435 -7.739 -8.949 327 HB THR 9 HB THR 9 42.393 -6.686 -6.877 328 HG1 THR 9 HG1 THR 9 39.962 -5.215 -6.901 329 HG21 THR 9 HG21 THR 9 41.283 -4.934 -9.060 330 HG22 THR 9 HG22 THR 9 42.886 -5.667 -8.977 331 HG23 THR 9 HG23 THR 9 42.448 -4.373 -7.863 332 H GLY 10 H GLY 10 38.896 -7.835 -6.562 333 HA2 GLY 10 HA2 GLY 10 38.281 -10.113 -5.743 334 HA3 GLY 10 HA3 GLY 10 39.991 -10.329 -5.385 335 H LYS 11 H LYS 11 40.152 -7.467 -4.494 336 HA LYS 11 HA LYS 11 39.763 -7.765 -1.723 337 HB2 LYS 11 HB2 LYS 11 41.227 -6.054 -2.999 338 HB3 LYS 11 HB3 LYS 11 39.753 -5.085 -3.105 339 HG2 LYS 11 HG2 LYS 11 39.824 -5.829 -0.447 340 HG3 LYS 11 HG3 LYS 11 41.518 -5.536 -0.825 341 HD2 LYS 11 HD2 LYS 11 39.288 -3.588 -1.400 342 HD3 LYS 11 HD3 LYS 11 40.269 -3.555 0.060 343 HE2 LYS 11 HE2 LYS 11 41.421 -3.323 -2.717 344 HE3 LYS 11 HE3 LYS 11 40.941 -1.932 -1.748 345 HZ1 LYS 11 HZ1 LYS 11 42.990 -3.941 -1.039 346 HZ2 LYS 11 HZ2 LYS 11 42.502 -2.658 -0.050 347 HZ3 LYS 11 HZ3 LYS 11 43.272 -2.346 -1.523 348 H THR 12 H THR 12 38.241 -6.948 -0.338 349 HA THR 12 HA THR 12 35.620 -6.152 -1.483 350 HB THR 12 HB THR 12 36.199 -7.866 0.949 351 HG1 THR 12 HG1 THR 12 36.240 -9.256 -0.667 352 HG21 THR 12 HG21 THR 12 33.522 -6.984 -0.146 353 HG22 THR 12 HG22 THR 12 34.217 -6.482 1.395 354 HG23 THR 12 HG23 THR 12 33.754 -8.165 1.138 355 H ILE 13 H ILE 13 34.902 -4.294 -0.851 356 HA ILE 13 HA ILE 13 36.175 -2.793 1.340 357 HB ILE 13 HB ILE 13 33.873 -1.745 -0.242 358 HG12 ILE 13 HG12 ILE 13 35.163 -2.561 -2.073 359 HG13 ILE 13 HG13 ILE 13 35.361 -0.821 -1.999 360 HG21 ILE 13 HG21 ILE 13 34.786 -0.456 1.602 361 HG22 ILE 13 HG22 ILE 13 34.940 0.403 0.072 362 HG23 ILE 13 HG23 ILE 13 36.350 -0.380 0.789 363 HD11 ILE 13 HD11 ILE 13 37.451 -2.004 -2.568 364 HD12 ILE 13 HD12 ILE 13 37.366 -2.847 -1.024 365 HD13 ILE 13 HD13 ILE 13 37.591 -1.097 -1.055 366 H THR 14 H THR 14 35.209 -2.676 3.284 367 HA THR 14 HA THR 14 32.365 -3.450 3.554 368 HB THR 14 HB THR 14 34.486 -3.061 5.686 369 HG1 THR 14 HG1 THR 14 34.835 -4.952 4.511 370 HG21 THR 14 HG21 THR 14 32.195 -2.573 6.507 371 HG22 THR 14 HG22 THR 14 32.881 -4.018 7.251 372 HG23 THR 14 HG23 THR 14 31.687 -4.171 5.962 373 H LEU 15 H LEU 15 30.902 -1.965 3.914 374 HA LEU 15 HA LEU 15 31.735 0.753 4.733 375 HB2 LEU 15 HB2 LEU 15 29.545 -0.015 2.804 376 HB3 LEU 15 HB3 LEU 15 29.879 1.629 3.335 377 HG LEU 15 HG LEU 15 31.844 -0.106 1.822 378 HD11 LEU 15 HD11 LEU 15 30.164 2.178 0.799 379 HD12 LEU 15 HD12 LEU 15 29.773 0.478 0.535 380 HD13 LEU 15 HD13 LEU 15 31.262 1.166 -0.137 381 HD21 LEU 15 HD21 LEU 15 31.923 2.646 2.952 382 HD22 LEU 15 HD22 LEU 15 32.676 2.386 1.375 383 HD23 LEU 15 HD23 LEU 15 33.218 1.458 2.773 384 H GLU 16 H GLU 16 30.580 1.770 6.221 385 HA GLU 16 HA GLU 16 28.270 0.457 7.498 386 HB2 GLU 16 HB2 GLU 16 30.091 1.199 8.985 387 HB3 GLU 16 HB3 GLU 16 29.965 2.832 8.344 388 HG2 GLU 16 HG2 GLU 16 28.874 2.671 10.519 389 HG3 GLU 16 HG3 GLU 16 27.709 3.033 9.250 390 H VAL 17 H VAL 17 26.416 0.972 6.631 391 HA VAL 17 HA VAL 17 25.925 3.723 5.697 392 HB VAL 17 HB VAL 17 24.758 2.893 3.748 393 HG11 VAL 17 HG11 VAL 17 27.233 3.381 3.686 394 HG12 VAL 17 HG12 VAL 17 26.606 2.365 2.382 395 HG13 VAL 17 HG13 VAL 17 27.474 1.628 3.731 396 HG21 VAL 17 HG21 VAL 17 25.675 0.128 4.502 397 HG22 VAL 17 HG22 VAL 17 24.763 0.576 3.057 398 HG23 VAL 17 HG23 VAL 17 24.026 0.738 4.653 399 H GLU 18 H GLU 18 23.599 4.016 5.150 400 HA GLU 18 HA GLU 18 21.698 2.534 6.860 401 HB2 GLU 18 HB2 GLU 18 21.653 5.442 5.984 402 HB3 GLU 18 HB3 GLU 18 20.358 4.643 6.869 403 HG2 GLU 18 HG2 GLU 18 23.172 5.099 7.846 404 HG3 GLU 18 HG3 GLU 18 21.737 5.962 8.376 405 H SER 19 H SER 19 19.655 2.092 5.870 406 HA SER 19 HA SER 19 19.628 1.522 3.106 407 HB2 SER 19 HB2 SER 19 17.265 1.837 4.980 408 HB3 SER 19 HB3 SER 19 17.209 1.103 3.373 409 HG SER 19 HG SER 19 17.645 -0.207 5.501 410 H SER 20 H SER 20 18.670 4.325 4.883 411 HA SER 20 HA SER 20 17.222 5.672 2.850 412 HB2 SER 20 HB2 SER 20 17.538 7.684 4.339 413 HB3 SER 20 HB3 SER 20 16.762 6.288 5.091 414 HG SER 20 HG SER 20 19.384 7.281 5.453 415 H ASP 21 H ASP 21 20.563 5.187 3.126 416 HA ASP 21 HA ASP 21 21.541 7.640 2.097 417 HB2 ASP 21 HB2 ASP 21 22.668 4.848 1.963 418 HB3 ASP 21 HB3 ASP 21 23.528 6.254 1.343 419 H THR 22 H THR 22 21.529 8.508 0.213 420 HA THR 22 HA THR 22 20.287 7.341 -2.090 421 HB THR 22 HB THR 22 21.022 9.306 -3.303 422 HG1 THR 22 HG1 THR 22 22.524 10.717 -2.497 423 HG21 THR 22 HG21 THR 22 20.134 10.029 -0.511 424 HG22 THR 22 HG22 THR 22 19.089 9.651 -1.880 425 HG23 THR 22 HG23 THR 22 20.075 11.111 -1.901 426 H ILE 23 H ILE 23 21.325 6.729 -4.056 427 HA ILE 23 HA ILE 23 23.628 5.131 -3.837 428 HB ILE 23 HB ILE 23 22.319 6.329 -6.258 429 HG12 ILE 23 HG12 ILE 23 20.818 4.925 -5.057 430 HG13 ILE 23 HG13 ILE 23 21.312 4.082 -6.520 431 HG21 ILE 23 HG21 ILE 23 23.410 4.578 -7.613 432 HG22 ILE 23 HG22 ILE 23 24.396 4.148 -6.210 433 HG23 ILE 23 HG23 ILE 23 24.534 5.753 -6.930 434 HD11 ILE 23 HD11 ILE 23 21.254 2.464 -4.802 435 HD12 ILE 23 HD12 ILE 23 22.110 3.517 -3.673 436 HD13 ILE 23 HD13 ILE 23 22.967 2.817 -5.048 437 H ASP 24 H ASP 24 23.229 8.430 -4.972 438 HA ASP 24 HA ASP 24 25.843 9.005 -5.790 439 HB2 ASP 24 HB2 ASP 24 23.943 10.499 -6.218 440 HB3 ASP 24 HB3 ASP 24 23.807 10.827 -4.487 441 H ASN 25 H ASN 25 24.365 9.161 -2.600 442 HA ASN 25 HA ASN 25 26.534 10.217 -1.141 443 HB2 ASN 25 HB2 ASN 25 24.274 10.212 -0.270 444 HB3 ASN 25 HB3 ASN 25 24.231 8.453 -0.305 445 HD21 ASN 25 HD21 ASN 25 24.280 7.693 1.596 446 HD22 ASN 25 HD22 ASN 25 25.251 8.226 2.922 447 H VAL 26 H VAL 26 25.617 6.883 -1.887 448 HA VAL 26 HA VAL 26 27.628 5.550 -0.410 449 HB VAL 26 HB VAL 26 26.082 4.722 -2.868 450 HG11 VAL 26 HG11 VAL 26 26.762 2.383 -2.310 451 HG12 VAL 26 HG12 VAL 26 27.934 3.038 -1.165 452 HG13 VAL 26 HG13 VAL 26 28.101 3.375 -2.890 453 HG21 VAL 26 HG21 VAL 26 25.771 3.424 -0.221 454 HG22 VAL 26 HG22 VAL 26 24.559 3.795 -1.454 455 HG23 VAL 26 HG23 VAL 26 25.157 5.071 -0.390 456 H LYS 27 H LYS 27 27.539 6.578 -3.817 457 HA LYS 27 HA LYS 27 30.064 5.660 -4.593 458 HB2 LYS 27 HB2 LYS 27 28.429 7.986 -5.619 459 HB3 LYS 27 HB3 LYS 27 29.899 7.397 -6.401 460 HG2 LYS 27 HG2 LYS 27 28.886 5.187 -6.670 461 HG3 LYS 27 HG3 LYS 27 27.405 5.768 -5.898 462 HD2 LYS 27 HD2 LYS 27 27.075 7.383 -7.679 463 HD3 LYS 27 HD3 LYS 27 28.593 6.883 -8.449 464 HE2 LYS 27 HE2 LYS 27 27.705 4.649 -8.794 465 HE3 LYS 27 HE3 LYS 27 26.195 5.080 -7.975 466 HZ1 LYS 27 HZ1 LYS 27 27.254 6.289 -10.465 467 HZ2 LYS 27 HZ2 LYS 27 25.802 6.712 -9.706 468 HZ3 LYS 27 HZ3 LYS 27 25.991 5.169 -10.372 469 H SER 28 H SER 28 29.109 8.698 -3.117 470 HA SER 28 HA SER 28 31.618 9.990 -3.047 471 HB2 SER 28 HB2 SER 28 29.471 11.137 -2.576 472 HB3 SER 28 HB3 SER 28 29.353 10.241 -1.055 473 HG SER 28 HG SER 28 30.481 11.870 -0.302 474 H LYS 29 H LYS 29 30.089 7.742 -0.788 475 HA LYS 29 HA LYS 29 32.110 7.680 1.186 476 HB2 LYS 29 HB2 LYS 29 30.124 5.553 0.375 477 HB3 LYS 29 HB3 LYS 29 31.183 5.427 1.774 478 HG2 LYS 29 HG2 LYS 29 30.140 7.411 2.756 479 HG3 LYS 29 HG3 LYS 29 29.081 7.551 1.344 480 HD2 LYS 29 HD2 LYS 29 28.198 5.290 1.816 481 HD3 LYS 29 HD3 LYS 29 29.208 5.220 3.256 482 HE2 LYS 29 HE2 LYS 29 27.098 7.317 2.802 483 HE3 LYS 29 HE3 LYS 29 26.798 5.809 3.667 484 HZ1 LYS 29 HZ1 LYS 29 27.263 7.608 5.173 485 HZ2 LYS 29 HZ2 LYS 29 28.747 7.906 4.416 486 HZ3 LYS 29 HZ3 LYS 29 28.498 6.455 5.251 487 H ILE 30 H ILE 30 31.748 5.935 -1.842 488 HA ILE 30 HA ILE 30 33.960 4.164 -1.548 489 HB ILE 30 HB ILE 30 32.470 5.144 -3.965 490 HG12 ILE 30 HG12 ILE 30 32.550 2.457 -2.590 491 HG13 ILE 30 HG13 ILE 30 31.305 3.674 -2.359 492 HG21 ILE 30 HG21 ILE 30 34.898 4.539 -4.479 493 HG22 ILE 30 HG22 ILE 30 33.653 3.715 -5.416 494 HG23 ILE 30 HG23 ILE 30 34.451 2.880 -4.081 495 HD11 ILE 30 HD11 ILE 30 30.446 2.007 -3.835 496 HD12 ILE 30 HD12 ILE 30 31.874 2.103 -4.865 497 HD13 ILE 30 HD13 ILE 30 30.746 3.459 -4.792 498 H GLN 31 H GLN 31 33.591 7.337 -3.079 499 HA GLN 31 HA GLN 31 36.228 7.746 -3.940 500 HB2 GLN 31 HB2 GLN 31 34.295 9.174 -4.535 501 HB3 GLN 31 HB3 GLN 31 34.260 9.788 -2.880 502 HG2 GLN 31 HG2 GLN 31 36.524 10.687 -3.161 503 HG3 GLN 31 HG3 GLN 31 36.551 10.092 -4.822 504 HE21 GLN 31 HE21 GLN 31 36.791 12.077 -5.703 505 HE22 GLN 31 HE22 GLN 31 35.543 13.271 -5.736 506 H ASP 32 H ASP 32 34.717 8.214 -0.808 507 HA ASP 32 HA ASP 32 36.905 9.436 0.489 508 HB2 ASP 32 HB2 ASP 32 34.427 8.097 1.507 509 HB3 ASP 32 HB3 ASP 32 35.670 8.697 2.606 510 H LYS 33 H LYS 33 36.293 6.086 -0.161 511 HA LYS 33 HA LYS 33 38.479 5.340 1.647 512 HB2 LYS 33 HB2 LYS 33 36.369 3.683 0.311 513 HB3 LYS 33 HB3 LYS 33 37.800 2.957 1.043 514 HG2 LYS 33 HG2 LYS 33 37.132 4.344 3.136 515 HG3 LYS 33 HG3 LYS 33 35.547 4.426 2.362 516 HD2 LYS 33 HD2 LYS 33 35.540 2.538 3.858 517 HD3 LYS 33 HD3 LYS 33 35.577 1.926 2.203 518 HE2 LYS 33 HE2 LYS 33 37.994 1.573 2.371 519 HE3 LYS 33 HE3 LYS 33 37.983 2.217 4.012 520 HZ1 LYS 33 HZ1 LYS 33 36.583 0.395 4.681 521 HZ2 LYS 33 HZ2 LYS 33 38.019 -0.176 3.992 522 HZ3 LYS 33 HZ3 LYS 33 36.579 -0.218 3.104 523 H GLU 34 H GLU 34 37.644 5.244 -1.760 524 HA GLU 34 HA GLU 34 40.160 3.849 -2.345 525 HB2 GLU 34 HB2 GLU 34 37.607 4.084 -3.925 526 HB3 GLU 34 HB3 GLU 34 39.089 3.391 -4.574 527 HG2 GLU 34 HG2 GLU 34 37.642 2.404 -2.120 528 HG3 GLU 34 HG3 GLU 34 37.576 1.660 -3.714 529 H GLY 35 H GLY 35 38.473 6.799 -3.015 530 HA2 GLY 35 HA2 GLY 35 39.458 8.826 -3.749 531 HA3 GLY 35 HA3 GLY 35 40.809 7.912 -4.402 532 H ILE 36 H ILE 36 38.067 6.340 -5.297 533 HA ILE 36 HA ILE 36 38.253 7.061 -8.056 534 HB ILE 36 HB ILE 36 36.116 5.399 -6.705 535 HG12 ILE 36 HG12 ILE 36 38.614 4.476 -8.150 536 HG13 ILE 36 HG13 ILE 36 38.476 4.581 -6.396 537 HG21 ILE 36 HG21 ILE 36 35.701 4.486 -8.944 538 HG22 ILE 36 HG22 ILE 36 36.946 5.542 -9.616 539 HG23 ILE 36 HG23 ILE 36 35.474 6.238 -8.937 540 HD11 ILE 36 HD11 ILE 36 37.053 2.698 -8.266 541 HD12 ILE 36 HD12 ILE 36 36.504 2.976 -6.609 542 HD13 ILE 36 HD13 ILE 36 38.112 2.321 -6.904 543 HA PRO 37 HA PRO 37 35.508 10.619 -8.000 544 HB2 PRO 37 HB2 PRO 37 35.581 9.901 -10.911 545 HB3 PRO 37 HB3 PRO 37 35.726 11.497 -10.152 546 HG2 PRO 37 HG2 PRO 37 37.948 10.305 -11.020 547 HG3 PRO 37 HG3 PRO 37 37.958 11.056 -9.406 548 HD2 PRO 37 HD2 PRO 37 37.645 8.140 -10.125 549 HD3 PRO 37 HD3 PRO 37 38.624 8.869 -8.840 550 HA PRO 38 HA PRO 38 31.695 8.275 -7.776 551 HB2 PRO 38 HB2 PRO 38 30.612 11.053 -7.963 552 HB3 PRO 38 HB3 PRO 38 30.155 9.746 -6.852 553 HG2 PRO 38 HG2 PRO 38 31.752 11.682 -5.944 554 HG3 PRO 38 HG3 PRO 38 32.174 9.990 -5.582 555 HD2 PRO 38 HD2 PRO 38 33.318 11.799 -7.713 556 HD3 PRO 38 HD3 PRO 38 34.167 10.692 -6.619 557 H ASP 39 H ASP 39 32.062 10.897 -10.097 558 HA ASP 39 HA ASP 39 29.936 10.051 -11.816 559 HB2 ASP 39 HB2 ASP 39 30.731 11.882 -13.276 560 HB3 ASP 39 HB3 ASP 39 30.425 12.386 -11.626 561 H GLN 40 H GLN 40 32.491 8.362 -11.318 562 HA GLN 40 HA GLN 40 32.667 7.408 -14.088 563 HB2 GLN 40 HB2 GLN 40 34.744 8.609 -13.251 564 HB3 GLN 40 HB3 GLN 40 34.920 7.279 -12.105 565 HG2 GLN 40 HG2 GLN 40 34.804 5.736 -14.142 566 HG3 GLN 40 HG3 GLN 40 35.108 7.181 -15.104 567 HE21 GLN 40 HE21 GLN 40 36.476 6.682 -11.924 568 HE22 GLN 40 HE22 GLN 40 38.110 6.476 -12.449 569 H GLN 41 H GLN 41 31.433 6.725 -11.238 570 HA GLN 41 HA GLN 41 32.049 3.884 -11.109 571 HB2 GLN 41 HB2 GLN 41 30.412 5.683 -9.303 572 HB3 GLN 41 HB3 GLN 41 30.830 4.007 -8.955 573 HG2 GLN 41 HG2 GLN 41 33.208 4.628 -8.861 574 HG3 GLN 41 HG3 GLN 41 32.770 6.309 -9.207 575 HE21 GLN 41 HE21 GLN 41 33.368 7.223 -7.324 576 HE22 GLN 41 HE22 GLN 41 32.664 6.861 -5.789 577 H ARG 42 H ARG 42 30.674 2.425 -11.810 578 HA ARG 42 HA ARG 42 27.794 3.052 -12.083 579 HB2 ARG 42 HB2 ARG 42 29.515 1.224 -13.783 580 HB3 ARG 42 HB3 ARG 42 27.753 1.265 -13.877 581 HG2 ARG 42 HG2 ARG 42 27.793 3.555 -14.620 582 HG3 ARG 42 HG3 ARG 42 29.531 3.659 -14.340 583 HD2 ARG 42 HD2 ARG 42 29.213 3.396 -16.677 584 HD3 ARG 42 HD3 ARG 42 29.827 1.859 -16.074 585 HE ARG 42 HE ARG 42 26.990 1.841 -16.148 586 HH11 ARG 42 HH11 ARG 42 29.746 1.706 -18.306 587 HH12 ARG 42 HH12 ARG 42 28.883 0.860 -19.547 588 HH21 ARG 42 HH21 ARG 42 25.866 0.798 -17.837 589 HH22 ARG 42 HH22 ARG 42 26.708 0.351 -19.282 590 H LEU 43 H LEU 43 26.846 2.154 -10.408 591 HA LEU 43 HA LEU 43 27.926 -0.295 -9.210 592 HB2 LEU 43 HB2 LEU 43 25.840 1.629 -8.191 593 HB3 LEU 43 HB3 LEU 43 26.380 0.198 -7.327 594 HG LEU 43 HG LEU 43 28.081 2.598 -8.037 595 HD11 LEU 43 HD11 LEU 43 26.412 2.928 -6.230 596 HD12 LEU 43 HD12 LEU 43 28.079 3.017 -5.651 597 HD13 LEU 43 HD13 LEU 43 27.122 1.562 -5.368 598 HD21 LEU 43 HD21 LEU 43 29.732 1.457 -6.477 599 HD22 LEU 43 HD22 LEU 43 29.549 0.718 -8.074 600 HD23 LEU 43 HD23 LEU 43 28.763 -0.004 -6.667 601 H ILE 44 H ILE 44 26.914 -2.150 -9.083 602 HA ILE 44 HA ILE 44 24.258 -2.435 -10.354 603 HB ILE 44 HB ILE 44 26.682 -4.223 -10.582 604 HG12 ILE 44 HG12 ILE 44 26.103 -4.028 -13.054 605 HG13 ILE 44 HG13 ILE 44 25.030 -2.715 -12.595 606 HG21 ILE 44 HG21 ILE 44 24.518 -5.535 -10.231 607 HG22 ILE 44 HG22 ILE 44 25.473 -5.928 -11.661 608 HG23 ILE 44 HG23 ILE 44 24.029 -4.926 -11.812 609 HD11 ILE 44 HD11 ILE 44 27.150 -1.862 -13.422 610 HD12 ILE 44 HD12 ILE 44 28.020 -2.788 -12.197 611 HD13 ILE 44 HD13 ILE 44 26.954 -1.470 -11.716 612 H PHE 45 H PHE 45 22.803 -3.560 -9.321 613 HA PHE 45 HA PHE 45 23.472 -5.649 -7.429 614 HB2 PHE 45 HB2 PHE 45 23.369 -3.644 -5.962 615 HB3 PHE 45 HB3 PHE 45 21.733 -3.316 -6.563 616 HD1 PHE 45 HD1 PHE 45 23.758 -5.908 -4.808 617 HD2 PHE 45 HD2 PHE 45 19.871 -4.307 -5.578 618 HE1 PHE 45 HE1 PHE 45 22.796 -7.440 -3.124 619 HE2 PHE 45 HE2 PHE 45 18.905 -5.828 -3.882 620 HZ PHE 45 HZ PHE 45 20.371 -7.399 -2.663 621 H ALA 46 H ALA 46 22.177 -7.273 -7.770 622 HA ALA 46 HA ALA 46 20.509 -8.611 -8.511 623 HB1 ALA 46 HB1 ALA 46 19.279 -7.547 -6.715 624 HB2 ALA 46 HB2 ALA 46 18.198 -7.877 -8.069 625 HB3 ALA 46 HB3 ALA 46 18.789 -6.239 -7.795 626 H GLY 47 H GLY 47 21.937 -7.365 -10.468 627 HA2 GLY 47 HA2 GLY 47 22.042 -7.168 -12.755 628 HA3 GLY 47 HA3 GLY 47 20.430 -7.855 -12.818 629 H LYS 48 H LYS 48 21.193 -4.901 -11.141 630 HA LYS 48 HA LYS 48 19.886 -3.242 -13.209 631 HB2 LYS 48 HB2 LYS 48 19.350 -3.353 -10.235 632 HB3 LYS 48 HB3 LYS 48 18.921 -1.947 -11.208 633 HG2 LYS 48 HG2 LYS 48 17.503 -3.376 -12.630 634 HG3 LYS 48 HG3 LYS 48 17.914 -4.763 -11.621 635 HD2 LYS 48 HD2 LYS 48 16.614 -2.272 -10.531 636 HD3 LYS 48 HD3 LYS 48 15.695 -3.645 -11.134 637 HE2 LYS 48 HE2 LYS 48 17.732 -3.835 -8.908 638 HE3 LYS 48 HE3 LYS 48 16.001 -3.601 -8.649 639 HZ1 LYS 48 HZ1 LYS 48 17.245 -5.893 -10.036 640 HZ2 LYS 48 HZ2 LYS 48 15.585 -5.661 -9.810 641 HZ3 LYS 48 HZ3 LYS 48 16.594 -5.910 -8.475 642 H GLN 49 H GLN 49 20.901 -1.373 -13.620 643 HA GLN 49 HA GLN 49 23.295 -0.602 -12.158 644 HB2 GLN 49 HB2 GLN 49 21.845 0.887 -14.368 645 HB3 GLN 49 HB3 GLN 49 23.466 1.232 -13.767 646 HG2 GLN 49 HG2 GLN 49 24.040 -1.169 -14.447 647 HG3 GLN 49 HG3 GLN 49 22.535 -1.134 -15.371 648 HE21 GLN 49 HE21 GLN 49 23.342 -1.147 -17.377 649 HE22 GLN 49 HE22 GLN 49 24.341 0.089 -18.052 650 H LEU 50 H LEU 50 23.418 0.890 -10.625 651 HA LEU 50 HA LEU 50 20.924 1.782 -9.470 652 HB2 LEU 50 HB2 LEU 50 23.734 2.200 -8.449 653 HB3 LEU 50 HB3 LEU 50 22.241 2.383 -7.533 654 HG LEU 50 HG LEU 50 23.387 -0.173 -8.651 655 HD11 LEU 50 HD11 LEU 50 24.360 0.818 -6.560 656 HD12 LEU 50 HD12 LEU 50 23.737 -0.826 -6.413 657 HD13 LEU 50 HD13 LEU 50 22.796 0.533 -5.798 658 HD21 LEU 50 HD21 LEU 50 21.117 -0.620 -8.893 659 HD22 LEU 50 HD22 LEU 50 20.681 0.349 -7.485 660 HD23 LEU 50 HD23 LEU 50 21.466 -1.218 -7.268 661 H GLU 51 H GLU 51 20.184 3.754 -9.225 662 HA GLU 51 HA GLU 51 21.245 5.804 -11.028 663 HB2 GLU 51 HB2 GLU 51 18.507 5.455 -9.808 664 HB3 GLU 51 HB3 GLU 51 18.933 6.700 -10.973 665 HG2 GLU 51 HG2 GLU 51 18.956 3.718 -11.477 666 HG3 GLU 51 HG3 GLU 51 17.692 4.834 -11.988 667 H ASP 52 H ASP 52 21.792 7.784 -10.296 668 HA ASP 52 HA ASP 52 22.762 8.042 -7.718 669 HB2 ASP 52 HB2 ASP 52 22.164 10.100 -9.813 670 HB3 ASP 52 HB3 ASP 52 22.873 10.555 -8.263 671 H GLY 53 H GLY 53 19.758 9.418 -8.975 672 HA2 GLY 53 HA2 GLY 53 19.022 10.701 -6.506 673 HA3 GLY 53 HA3 GLY 53 18.063 10.621 -7.969 674 H ARG 54 H ARG 54 18.983 7.509 -7.083 675 HA ARG 54 HA ARG 54 16.445 7.037 -5.654 676 HB2 ARG 54 HB2 ARG 54 18.239 5.039 -7.042 677 HB3 ARG 54 HB3 ARG 54 16.695 4.673 -6.294 678 HG2 ARG 54 HG2 ARG 54 17.087 6.469 -8.691 679 HG3 ARG 54 HG3 ARG 54 16.616 4.783 -8.772 680 HD2 ARG 54 HD2 ARG 54 15.018 6.957 -7.417 681 HD3 ARG 54 HD3 ARG 54 14.726 6.366 -9.054 682 HE ARG 54 HE ARG 54 14.655 4.466 -6.843 683 HH11 ARG 54 HH11 ARG 54 12.805 6.250 -9.254 684 HH12 ARG 54 HH12 ARG 54 11.364 5.334 -8.955 685 HH21 ARG 54 HH21 ARG 54 12.715 3.466 -6.354 686 HH22 ARG 54 HH22 ARG 54 11.310 3.775 -7.318 687 H THR 55 H THR 55 16.706 5.050 -4.111 688 HA THR 55 HA THR 55 19.139 5.468 -2.489 689 HB THR 55 HB THR 55 17.661 4.917 -0.489 690 HG1 THR 55 HG1 THR 55 15.414 5.857 -1.747 691 HG21 THR 55 HG21 THR 55 18.410 7.196 -0.824 692 HG22 THR 55 HG22 THR 55 16.722 7.227 -0.319 693 HG23 THR 55 HG23 THR 55 17.140 7.486 -2.013 694 H LEU 56 H LEU 56 19.366 3.639 -0.813 695 HA LEU 56 HA LEU 56 19.748 1.190 -2.159 696 HB2 LEU 56 HB2 LEU 56 19.689 1.813 0.785 697 HB3 LEU 56 HB3 LEU 56 20.195 0.250 0.137 698 HG LEU 56 HG LEU 56 21.507 2.926 -0.421 699 HD11 LEU 56 HD11 LEU 56 21.791 2.018 1.879 700 HD12 LEU 56 HD12 LEU 56 23.302 2.107 0.969 701 HD13 LEU 56 HD13 LEU 56 22.483 0.560 1.170 702 HD21 LEU 56 HD21 LEU 56 21.884 1.548 -2.350 703 HD22 LEU 56 HD22 LEU 56 22.187 0.130 -1.333 704 HD23 LEU 56 HD23 LEU 56 23.347 1.465 -1.357 705 H SER 57 H SER 57 17.213 2.267 0.000 706 HA SER 57 HA SER 57 15.780 -0.130 0.326 707 HB2 SER 57 HB2 SER 57 13.861 1.339 0.931 708 HB3 SER 57 HB3 SER 57 15.351 1.796 1.756 709 HG SER 57 HG SER 57 14.842 3.033 -0.677 710 H ASP 58 H ASP 58 15.807 2.204 -2.280 711 HA ASP 58 HA ASP 58 13.384 1.434 -3.545 712 HB2 ASP 58 HB2 ASP 58 15.817 2.915 -4.516 713 HB3 ASP 58 HB3 ASP 58 14.457 2.568 -5.576 714 H TYR 59 H TYR 59 16.436 -0.075 -3.427 715 HA TYR 59 HA TYR 59 15.782 -1.805 -5.728 716 HB2 TYR 59 HB2 TYR 59 18.409 -1.039 -4.469 717 HB3 TYR 59 HB3 TYR 59 18.256 -2.370 -5.613 718 HD1 TYR 59 HD1 TYR 59 17.386 -1.875 -7.931 719 HD2 TYR 59 HD2 TYR 59 18.612 1.176 -5.218 720 HE1 TYR 59 HE1 TYR 59 17.778 -0.356 -9.828 721 HE2 TYR 59 HE2 TYR 59 19.013 2.702 -7.105 722 HH TYR 59 HH TYR 59 19.116 2.877 -9.319 723 H ASN 60 H ASN 60 15.448 -1.756 -2.529 724 HA ASN 60 HA ASN 60 15.066 -3.253 -0.900 725 HB2 ASN 60 HB2 ASN 60 14.058 -4.483 -2.951 726 HB3 ASN 60 HB3 ASN 60 15.443 -5.554 -2.773 727 HD21 ASN 60 HD21 ASN 60 14.262 -7.314 -2.175 728 HD22 ASN 60 HD22 ASN 60 13.437 -7.437 -0.664 729 H ILE 61 H ILE 61 17.769 -2.432 -1.722 730 HA ILE 61 HA ILE 61 19.615 -4.468 -0.869 731 HB ILE 61 HB ILE 61 19.953 -1.469 -1.101 732 HG12 ILE 61 HG12 ILE 61 20.776 -3.704 -2.962 733 HG13 ILE 61 HG13 ILE 61 19.388 -2.651 -3.206 734 HG21 ILE 61 HG21 ILE 61 21.602 -2.393 0.441 735 HG22 ILE 61 HG22 ILE 61 22.391 -1.895 -1.063 736 HG23 ILE 61 HG23 ILE 61 22.063 -3.606 -0.749 737 HD11 ILE 61 HD11 ILE 61 22.276 -1.757 -3.172 738 HD12 ILE 61 HD12 ILE 61 20.870 -0.741 -3.505 739 HD13 ILE 61 HD13 ILE 61 21.299 -2.044 -4.616 740 H GLN 62 H GLN 62 19.414 -5.241 1.101 741 HA GLN 62 HA GLN 62 18.734 -3.436 3.312 742 HB2 GLN 62 HB2 GLN 62 18.515 -6.443 3.108 743 HB3 GLN 62 HB3 GLN 62 18.033 -5.487 4.502 744 HG2 GLN 62 HG2 GLN 62 16.390 -4.309 3.018 745 HG3 GLN 62 HG3 GLN 62 16.791 -5.469 1.751 746 HE21 GLN 62 HE21 GLN 62 17.142 -7.565 3.915 747 HE22 GLN 62 HE22 GLN 62 15.529 -8.050 4.292 748 H LYS 63 H LYS 63 19.596 -4.813 5.479 749 HA LYS 63 HA LYS 63 22.364 -4.223 5.570 750 HB2 LYS 63 HB2 LYS 63 22.350 -5.133 7.805 751 HB3 LYS 63 HB3 LYS 63 20.866 -4.230 7.560 752 HG2 LYS 63 HG2 LYS 63 19.658 -6.345 7.176 753 HG3 LYS 63 HG3 LYS 63 21.153 -7.233 7.500 754 HD2 LYS 63 HD2 LYS 63 21.246 -6.209 9.744 755 HD3 LYS 63 HD3 LYS 63 19.714 -5.392 9.413 756 HE2 LYS 63 HE2 LYS 63 18.683 -7.646 9.038 757 HE3 LYS 63 HE3 LYS 63 20.194 -8.368 9.609 758 HZ1 LYS 63 HZ1 LYS 63 18.470 -6.506 11.129 759 HZ2 LYS 63 HZ2 LYS 63 19.931 -7.160 11.676 760 HZ3 LYS 63 HZ3 LYS 63 18.606 -8.172 11.391 761 H GLU 64 H GLU 64 24.141 -5.462 5.414 762 HA GLU 64 HA GLU 64 25.536 -7.238 5.079 763 HB2 GLU 64 HB2 GLU 64 23.210 -8.509 6.158 764 HB3 GLU 64 HB3 GLU 64 23.861 -9.515 4.873 765 HG2 GLU 64 HG2 GLU 64 24.745 -10.098 7.083 766 HG3 GLU 64 HG3 GLU 64 26.008 -9.598 5.962 767 H SER 65 H SER 65 23.390 -6.156 2.939 768 HA SER 65 HA SER 65 23.536 -8.088 0.820 769 HB2 SER 65 HB2 SER 65 23.064 -5.096 0.747 770 HB3 SER 65 HB3 SER 65 22.916 -6.152 -0.660 771 HG SER 65 HG SER 65 21.489 -7.141 1.406 772 H THR 66 H THR 66 24.991 -8.267 -0.828 773 HA THR 66 HA THR 66 27.232 -6.362 -0.777 774 HB THR 66 HB THR 66 28.863 -7.866 -0.942 775 HG1 THR 66 HG1 THR 66 28.855 -9.007 -2.673 776 HG21 THR 66 HG21 THR 66 26.932 -8.883 0.770 777 HG22 THR 66 HG22 THR 66 28.628 -9.368 0.701 778 HG23 THR 66 HG23 THR 66 27.413 -10.262 -0.216 779 H LEU 67 H LEU 67 27.737 -5.369 -2.443 780 HA LEU 67 HA LEU 67 26.310 -5.753 -5.000 781 HB2 LEU 67 HB2 LEU 67 27.545 -3.365 -3.612 782 HB3 LEU 67 HB3 LEU 67 27.080 -3.308 -5.299 783 HG LEU 67 HG LEU 67 24.724 -3.645 -4.668 784 HD11 LEU 67 HD11 LEU 67 25.111 -4.899 -2.512 785 HD12 LEU 67 HD12 LEU 67 23.942 -3.581 -2.404 786 HD13 LEU 67 HD13 LEU 67 25.581 -3.361 -1.786 787 HD21 LEU 67 HD21 LEU 67 25.619 -1.406 -4.873 788 HD22 LEU 67 HD22 LEU 67 26.150 -1.442 -3.190 789 HD23 LEU 67 HD23 LEU 67 24.425 -1.461 -3.572 790 H HIS 68 H HIS 68 27.589 -5.137 -6.889 791 HA HIS 68 HA HIS 68 30.480 -5.653 -6.579 792 HB2 HIS 68 HB2 HIS 68 28.570 -6.484 -8.759 793 HB3 HIS 68 HB3 HIS 68 30.317 -6.411 -9.045 794 HD1 HIS 68 HD1 HIS 68 27.826 -8.342 -6.924 795 HD2 HIS 68 HD2 HIS 68 31.799 -8.291 -8.006 796 HE1 HIS 68 HE1 HIS 68 28.793 -10.543 -6.109 797 HE2 HIS 68 HE2 HIS 68 31.261 -10.388 -6.675 798 H LEU 69 H LEU 69 31.899 -4.520 -7.750 799 HA LEU 69 HA LEU 69 30.965 -1.968 -8.918 800 HB2 LEU 69 HB2 LEU 69 32.178 -1.636 -6.835 801 HB3 LEU 69 HB3 LEU 69 33.497 -2.652 -7.401 802 HG LEU 69 HG LEU 69 33.955 -0.993 -9.196 803 HD11 LEU 69 HD11 LEU 69 31.985 0.756 -7.728 804 HD12 LEU 69 HD12 LEU 69 31.710 0.032 -9.314 805 HD13 LEU 69 HD13 LEU 69 33.002 1.220 -9.094 806 HD21 LEU 69 HD21 LEU 69 35.340 -0.889 -7.287 807 HD22 LEU 69 HD22 LEU 69 34.078 -0.121 -6.325 808 HD23 LEU 69 HD23 LEU 69 34.854 0.772 -7.633 809 H VAL 70 H VAL 70 31.412 -1.637 -10.969 810 HA VAL 70 HA VAL 70 33.609 -3.104 -12.278 811 HB VAL 70 HB VAL 70 31.017 -1.987 -13.440 812 HG11 VAL 70 HG11 VAL 70 32.717 -1.580 -15.075 813 HG12 VAL 70 HG12 VAL 70 31.759 -2.958 -15.618 814 HG13 VAL 70 HG13 VAL 70 33.348 -3.219 -14.900 815 HG21 VAL 70 HG21 VAL 70 30.995 -4.227 -12.195 816 HG22 VAL 70 HG22 VAL 70 31.892 -4.857 -13.576 817 HG23 VAL 70 HG23 VAL 70 30.276 -4.184 -13.804 818 H LEU 71 H LEU 71 35.128 -1.795 -13.285 819 HA LEU 71 HA LEU 71 35.027 1.018 -12.532 820 HB2 LEU 71 HB2 LEU 71 37.024 -0.845 -12.350 821 HB3 LEU 71 HB3 LEU 71 37.453 -0.022 -13.840 822 HG LEU 71 HG LEU 71 37.018 2.111 -12.335 823 HD11 LEU 71 HD11 LEU 71 36.335 0.688 -10.411 824 HD12 LEU 71 HD12 LEU 71 37.628 1.831 -10.051 825 HD13 LEU 71 HD13 LEU 71 38.004 0.126 -10.300 826 HD21 LEU 71 HD21 LEU 71 39.581 0.501 -12.583 827 HD22 LEU 71 HD22 LEU 71 39.542 2.072 -11.780 828 HD23 LEU 71 HD23 LEU 71 39.106 1.942 -13.485
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