NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | position | program | type |
4689 | 1fjd | cing | recoord | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H GLY 28 HT1 GLY 28 77.087 -21.798 -15.427 2 2H GLY 28 HT2 GLY 28 78.077 -20.957 -14.332 3 3H GLY 28 HT3 GLY 28 77.995 -22.653 -14.278 4 1HA GLY 28 HA2 GLY 28 79.949 -22.418 -15.398 5 2HA GLY 28 HA1 GLY 28 78.808 -22.451 -16.743 6 H SER 29 HN SER 29 79.676 -19.911 -14.372 7 HA SER 29 HA SER 29 80.372 -18.144 -16.695 8 1HB SER 29 HB2 SER 29 79.354 -16.330 -15.191 9 2HB SER 29 HB1 SER 29 78.219 -17.486 -15.888 10 HG SER 29 HG SER 29 79.338 -17.539 -13.284 11 H GLY 30 HN GLY 30 82.559 -19.219 -15.854 12 1HA GLY 30 HA2 GLY 30 84.676 -18.383 -15.095 13 2HA GLY 30 HA1 GLY 30 83.825 -17.194 -14.108 14 HA PRO 31 HA PRO 31 85.072 -21.274 -11.831 15 1HB PRO 31 HB2 PRO 31 87.295 -19.900 -10.622 16 2HB PRO 31 HB1 PRO 31 87.333 -21.313 -11.691 17 1HG PRO 31 HG2 PRO 31 88.129 -18.620 -12.295 18 2HG PRO 31 HG1 PRO 31 88.158 -20.025 -13.363 19 1HD PRO 31 HD2 PRO 31 86.369 -17.758 -13.460 20 2HD PRO 31 HD1 PRO 31 86.406 -19.169 -14.544 21 H LYS 32 HN LYS 32 83.116 -20.628 -10.669 22 HA LYS 32 HA LYS 32 83.693 -18.973 -8.236 23 1HB LYS 32 HB2 LYS 32 81.663 -18.697 -10.385 24 2HB LYS 32 HB1 LYS 32 81.067 -18.470 -8.741 25 1HG LYS 32 HG2 LYS 32 83.269 -16.984 -8.532 26 2HG LYS 32 HG1 LYS 32 83.061 -16.855 -10.278 27 1HD LYS 32 HD2 LYS 32 80.871 -16.274 -8.263 28 2HD LYS 32 HD1 LYS 32 81.898 -15.036 -8.987 29 1HE LYS 32 HE2 LYS 32 80.482 -16.957 -10.811 30 2HE LYS 32 HE1 LYS 32 79.563 -15.618 -10.096 31 1HZ LYS 32 HZ1 LYS 32 80.986 -15.289 -12.280 32 2HZ LYS 32 HZ2 LYS 32 82.237 -15.054 -11.155 33 3HZ LYS 32 HZ3 LYS 32 80.860 -14.060 -11.118 34 H GLY 33 HN GLY 33 83.636 -20.558 -6.651 35 1HA GLY 33 HA2 GLY 33 81.101 -22.022 -6.295 36 2HA GLY 33 HA1 GLY 33 82.535 -23.023 -6.516 37 H GLY 34 HN GLY 34 82.467 -19.911 -4.833 38 1HA GLY 34 HA1 GLY 34 82.565 -21.249 -2.204 39 2HA GLY 34 HA2 GLY 34 84.027 -20.390 -2.688 40 H GLY 35 HN GLY 35 83.588 -18.055 -3.448 41 1HA GLY 35 HA1 GLY 35 82.723 -15.914 -3.007 42 2HA GLY 35 HA2 GLY 35 81.204 -16.702 -2.555 43 H ASN 36 HN ASN 36 84.477 -15.980 -1.326 44 HA ASN 36 HA ASN 36 83.298 -15.934 1.435 45 1HB ASN 36 HB2 ASN 36 85.424 -17.481 0.267 46 2HB ASN 36 HB1 ASN 36 86.098 -16.429 1.512 47 1HD2 ASN 36 HD21 ASN 36 84.365 -16.351 3.542 48 2HD2 ASN 36 HD22 ASN 36 83.910 -17.894 4.082 49 H ALA 37 HN ALA 37 84.755 -14.125 -1.011 50 HA ALA 37 HA ALA 37 85.445 -11.964 0.932 51 1HB ALA 37 HB1 ALA 37 87.193 -12.304 -1.452 52 2HB ALA 37 HB2 ALA 37 87.352 -13.542 -0.206 53 3HB ALA 37 HB3 ALA 37 87.625 -11.847 0.196 54 H VAL 38 HN VAL 38 85.093 -9.861 0.005 55 HA VAL 38 HA VAL 38 84.027 -9.706 -2.778 56 HB VAL 38 HB VAL 38 82.042 -8.463 -1.783 57 1HG1 VAL 38 HG11 VAL 38 82.518 -11.380 -1.138 58 2HG1 VAL 38 HG12 VAL 38 81.667 -10.707 -2.529 59 3HG1 VAL 38 HG13 VAL 38 80.953 -10.599 -0.921 60 1HG2 VAL 38 HG21 VAL 38 83.470 -8.321 0.467 61 2HG2 VAL 38 HG22 VAL 38 82.628 -9.833 0.806 62 3HG2 VAL 38 HG23 VAL 38 81.707 -8.360 0.500 63 H LYS 39 HN LYS 39 84.188 -7.430 -3.661 64 HA LYS 39 HA LYS 39 86.138 -5.902 -2.072 65 1HB LYS 39 HB2 LYS 39 85.846 -6.412 -4.675 66 2HB LYS 39 HB1 LYS 39 84.857 -4.954 -4.602 67 1HG LYS 39 HG2 LYS 39 87.305 -4.541 -5.142 68 2HG LYS 39 HG1 LYS 39 86.705 -3.654 -3.732 69 1HD LYS 39 HD2 LYS 39 88.052 -4.791 -2.309 70 2HD LYS 39 HD1 LYS 39 87.696 -6.338 -3.089 71 1HE LYS 39 HE2 LYS 39 89.486 -4.310 -4.446 72 2HE LYS 39 HE1 LYS 39 90.139 -5.455 -3.258 73 1HZ LYS 39 HZ1 LYS 39 88.368 -6.315 -5.475 74 2HZ LYS 39 HZ2 LYS 39 89.378 -7.276 -4.504 75 3HZ LYS 39 HZ3 LYS 39 90.052 -6.235 -5.665 76 H VAL 40 HN VAL 40 85.081 -4.941 -0.354 77 HA VAL 40 HA VAL 40 82.514 -3.532 -0.824 78 HB VAL 40 HB VAL 40 82.519 -3.537 1.682 79 1HG1 VAL 40 HG11 VAL 40 82.357 -5.769 -0.139 80 2HG1 VAL 40 HG12 VAL 40 81.411 -5.463 1.318 81 3HG1 VAL 40 HG13 VAL 40 82.950 -6.318 1.428 82 1HG2 VAL 40 HG21 VAL 40 84.322 -4.235 2.896 83 2HG2 VAL 40 HG22 VAL 40 85.217 -3.791 1.443 84 3HG2 VAL 40 HG23 VAL 40 84.758 -5.472 1.718 85 H ARG 41 HN ARG 41 82.219 -1.378 -0.261 86 HA ARG 41 HA ARG 41 84.597 0.257 0.518 87 1HB ARG 41 HB2 ARG 41 82.600 0.895 -1.688 88 2HB ARG 41 HB1 ARG 41 84.025 1.842 -1.263 89 1HG ARG 41 HG2 ARG 41 85.402 -0.243 -1.777 90 2HG ARG 41 HG1 ARG 41 83.937 -0.928 -2.479 91 1HD ARG 41 HD2 ARG 41 83.834 1.288 -3.861 92 2HD ARG 41 HD1 ARG 41 85.549 1.445 -3.421 93 HE ARG 41 HE ARG 41 85.389 -1.169 -4.249 94 1HH1 ARG 41 HH21 ARG 41 84.958 1.948 -5.592 95 2HH1 ARG 41 HH22 ARG 41 84.830 1.386 -7.225 96 1HH2 ARG 41 HH11 ARG 41 84.950 -1.970 -6.360 97 2HH2 ARG 41 HH12 ARG 41 84.825 -0.833 -7.660 98 H HIS 42 HN HIS 42 83.896 2.157 1.814 99 HA HIS 42 HA HIS 42 80.955 2.135 2.407 100 1HB HIS 42 HB2 HIS 42 82.875 2.609 4.632 101 2HB HIS 42 HB1 HIS 42 81.321 1.770 4.645 102 HD1 HIS 42 HD1 HIS 42 81.475 -0.598 3.069 103 HD2 HIS 42 HD2 HIS 42 84.944 0.828 4.884 104 HE1 HIS 42 HE1 HIS 42 83.091 -2.546 3.156 105 H ILE 43 HN ILE 43 80.043 4.033 3.073 106 HA ILE 43 HA ILE 43 81.654 6.493 3.418 107 HB ILE 43 HB ILE 43 80.198 5.723 1.008 108 1HG1 ILE 43 HG12 ILE 43 81.549 8.372 1.438 109 2HG1 ILE 43 HG11 ILE 43 82.514 6.889 1.446 110 1HG2 ILE 43 HG21 ILE 43 78.870 7.694 0.634 111 2HG2 ILE 43 HG22 ILE 43 79.436 8.431 2.132 112 3HG2 ILE 43 HG23 ILE 43 78.369 7.032 2.187 113 1HD1 ILE 43 HD11 ILE 43 81.060 8.201 -0.798 114 2HD1 ILE 43 HD12 ILE 43 81.027 6.438 -0.764 115 3HD1 ILE 43 HD13 ILE 43 82.569 7.291 -0.817 116 H LEU 44 HN LEU 44 80.747 7.491 5.243 117 HA LEU 44 HA LEU 44 77.855 6.883 5.810 118 1HB LEU 44 HB2 LEU 44 78.810 5.841 7.603 119 2HB LEU 44 HB1 LEU 44 80.376 6.603 7.306 120 HG LEU 44 HG LEU 44 79.559 8.668 8.393 121 1HD1 LEU 44 HD11 LEU 44 77.293 7.603 9.780 122 2HD1 LEU 44 HD12 LEU 44 77.030 7.384 8.051 123 3HD1 LEU 44 HD13 LEU 44 77.351 8.993 8.698 124 1HD2 LEU 44 HD21 LEU 44 79.917 6.075 9.684 125 2HD2 LEU 44 HD22 LEU 44 78.946 7.175 10.665 126 3HD2 LEU 44 HD23 LEU 44 80.563 7.651 10.143 127 H CYS 45 HN CYS 45 76.629 8.656 6.677 128 HA CYS 45 HA CYS 45 78.001 11.319 6.611 129 1HB CYS 45 HB2 CYS 45 75.230 10.662 5.569 130 2HB CYS 45 HB1 CYS 45 76.124 12.175 5.352 131 HG CYS 45 HG CYS 45 77.420 9.602 4.191 132 H GLU 46 HN GLU 46 78.035 11.305 8.955 133 HA GLU 46 HA GLU 46 76.011 10.685 10.758 134 1HB GLU 46 HB2 GLU 46 78.366 12.378 10.605 135 2HB GLU 46 HB1 GLU 46 77.138 13.112 11.636 136 1HG GLU 46 HG2 GLU 46 77.408 10.231 12.084 137 2HG GLU 46 HG1 GLU 46 78.904 11.110 12.401 138 H LYS 47 HN LYS 47 76.214 13.474 8.606 139 HA LYS 47 HA LYS 47 73.932 14.854 9.835 140 1HB LYS 47 HB2 LYS 47 75.343 15.272 7.179 141 2HB LYS 47 HB1 LYS 47 74.349 16.451 8.036 142 1HG LYS 47 HG2 LYS 47 76.026 16.102 9.996 143 2HG LYS 47 HG1 LYS 47 77.078 15.400 8.767 144 1HD LYS 47 HD2 LYS 47 76.622 17.539 7.406 145 2HD LYS 47 HD1 LYS 47 75.983 18.212 8.905 146 1HE LYS 47 HE2 LYS 47 78.466 16.973 9.551 147 2HE LYS 47 HE1 LYS 47 78.733 17.968 8.107 148 1HZ LYS 47 HZ1 LYS 47 77.825 18.760 10.778 149 2HZ LYS 47 HZ2 LYS 47 77.146 19.578 9.453 150 3HZ LYS 47 HZ3 LYS 47 78.828 19.590 9.691 151 H HIS 48 HN HIS 48 74.386 12.336 7.544 152 HA HIS 48 HA HIS 48 72.874 11.193 6.136 153 1HB HIS 48 HB2 HIS 48 71.163 12.583 8.192 154 2HB HIS 48 HB1 HIS 48 70.430 11.582 6.939 155 HD1 HIS 48 HD1 HIS 48 73.735 10.858 8.642 156 HD2 HIS 48 HD2 HIS 48 69.863 9.320 8.503 157 HE1 HIS 48 HE1 HIS 48 73.798 8.653 9.887 158 H GLY 49 HN GLY 49 73.580 14.246 5.778 159 1HA GLY 49 HA2 GLY 49 71.341 14.956 3.942 160 2HA GLY 49 HA1 GLY 49 72.544 16.095 4.566 161 H LYS 50 HN LYS 50 74.844 14.430 4.071 162 HA LYS 50 HA LYS 50 75.131 14.902 1.168 163 1HB LYS 50 HB2 LYS 50 77.508 14.460 1.682 164 2HB LYS 50 HB1 LYS 50 76.831 15.630 2.815 165 1HG LYS 50 HG2 LYS 50 76.491 12.844 3.663 166 2HG LYS 50 HG1 LYS 50 78.179 13.333 3.531 167 1HD LYS 50 HD2 LYS 50 76.855 15.498 4.757 168 2HD LYS 50 HD1 LYS 50 76.222 14.052 5.544 169 1HE LYS 50 HE2 LYS 50 78.163 13.786 6.686 170 2HE LYS 50 HE1 LYS 50 79.094 13.817 5.171 171 1HZ LYS 50 HZ1 LYS 50 79.658 15.717 6.570 172 2HZ LYS 50 HZ2 LYS 50 78.027 16.192 6.620 173 3HZ LYS 50 HZ3 LYS 50 78.884 16.236 5.153 174 H ILE 51 HN ILE 51 74.300 12.277 3.211 175 HA ILE 51 HA ILE 51 75.517 10.055 1.989 176 HB ILE 51 HB ILE 51 73.884 10.163 3.951 177 1HG1 ILE 51 HG12 ILE 51 72.667 7.970 3.096 178 2HG1 ILE 51 HG11 ILE 51 73.787 8.140 1.737 179 1HG2 ILE 51 HG21 ILE 51 71.801 10.009 1.759 180 2HG2 ILE 51 HG22 ILE 51 72.180 11.496 2.629 181 3HG2 ILE 51 HG23 ILE 51 71.524 10.108 3.498 182 1HD1 ILE 51 HD11 ILE 51 74.333 7.060 4.305 183 2HD1 ILE 51 HD12 ILE 51 75.208 8.588 4.202 184 3HD1 ILE 51 HD13 ILE 51 75.475 7.335 2.990 185 H MET 52 HN MET 52 72.796 12.041 0.885 186 HA MET 52 HA MET 52 72.416 10.449 -1.537 187 1HB MET 52 HB2 MET 52 71.015 12.391 -0.035 188 2HB MET 52 HB1 MET 52 71.334 13.136 -1.602 189 1HG MET 52 HG2 MET 52 70.416 10.314 -1.650 190 2HG MET 52 HG1 MET 52 69.222 11.512 -1.153 191 1HE MET 52 HE1 MET 52 72.178 12.436 -3.948 192 2HE MET 52 HE2 MET 52 71.583 11.159 -5.005 193 3HE MET 52 HE3 MET 52 72.058 10.775 -3.353 194 H GLU 53 HN GLU 53 73.758 13.617 -0.702 195 HA GLU 53 HA GLU 53 74.634 14.440 -3.255 196 1HB GLU 53 HB2 GLU 53 74.869 15.273 -0.616 197 2HB GLU 53 HB1 GLU 53 76.533 14.873 -1.040 198 1HG GLU 53 HG2 GLU 53 76.190 16.258 -3.153 199 2HG GLU 53 HG1 GLU 53 74.679 16.817 -2.433 200 H ALA 54 HN ALA 54 75.749 12.032 -0.990 201 HA ALA 54 HA ALA 54 78.241 11.452 -2.476 202 1HB ALA 54 HB1 ALA 54 77.686 11.226 0.073 203 2HB ALA 54 HB2 ALA 54 78.616 9.937 -0.690 204 3HB ALA 54 HB3 ALA 54 76.889 9.725 -0.397 205 H MET 55 HN MET 55 74.932 10.339 -2.217 206 HA MET 55 HA MET 55 75.340 7.886 -3.772 207 1HB MET 55 HB2 MET 55 73.411 9.017 -2.096 208 2HB MET 55 HB1 MET 55 72.638 9.003 -3.688 209 1HG MET 55 HG2 MET 55 73.457 6.565 -3.860 210 2HG MET 55 HG1 MET 55 73.763 6.673 -2.120 211 1HE MET 55 HE1 MET 55 72.582 6.512 -0.535 212 2HE MET 55 HE2 MET 55 71.016 5.706 -0.501 213 3HE MET 55 HE3 MET 55 71.100 7.458 -0.342 214 H GLU 56 HN GLU 56 74.377 11.223 -4.423 215 HA GLU 56 HA GLU 56 73.561 10.752 -7.180 216 1HB GLU 56 HB2 GLU 56 73.517 12.809 -5.206 217 2HB GLU 56 HB1 GLU 56 74.337 13.462 -6.624 218 1HG GLU 56 HG2 GLU 56 72.477 12.993 -8.040 219 2HG GLU 56 HG1 GLU 56 71.724 11.955 -6.829 220 H LYS 57 HN LYS 57 76.366 12.489 -5.746 221 HA LYS 57 HA LYS 57 77.860 12.998 -8.036 222 1HB LYS 57 HB2 LYS 57 78.854 11.921 -5.371 223 2HB LYS 57 HB1 LYS 57 79.817 12.837 -6.528 224 1HG LYS 57 HG2 LYS 57 77.260 14.092 -5.674 225 2HG LYS 57 HG1 LYS 57 78.523 13.991 -4.450 226 1HD LYS 57 HD2 LYS 57 79.506 14.867 -7.066 227 2HD LYS 57 HD1 LYS 57 78.324 15.965 -6.363 228 1HE LYS 57 HE2 LYS 57 79.937 15.332 -4.194 229 2HE LYS 57 HE1 LYS 57 81.091 15.445 -5.536 230 1HZ LYS 57 HZ1 LYS 57 78.921 17.427 -5.249 231 2HZ LYS 57 HZ2 LYS 57 80.411 17.587 -6.050 232 3HZ LYS 57 HZ3 LYS 57 80.349 17.606 -4.352 233 H LEU 58 HN LEU 58 78.337 10.069 -6.020 234 HA LEU 58 HA LEU 58 79.933 8.567 -7.752 235 1HB LEU 58 HB2 LEU 58 77.894 8.039 -5.643 236 2HB LEU 58 HB1 LEU 58 78.384 6.656 -6.633 237 HG LEU 58 HG LEU 58 80.815 7.579 -6.142 238 1HD1 LEU 58 HD11 LEU 58 79.812 9.595 -4.949 239 2HD1 LEU 58 HD12 LEU 58 81.039 8.709 -4.044 240 3HD1 LEU 58 HD13 LEU 58 79.332 8.485 -3.666 241 1HD2 LEU 58 HD21 LEU 58 79.571 6.305 -3.746 242 2HD2 LEU 58 HD22 LEU 58 81.015 5.837 -4.645 243 3HD2 LEU 58 HD23 LEU 58 79.417 5.454 -5.284 244 H LYS 59 HN LYS 59 76.414 9.057 -7.912 245 HA LYS 59 HA LYS 59 76.054 7.088 -10.057 246 1HB LYS 59 HB2 LYS 59 74.053 7.210 -8.997 247 2HB LYS 59 HB1 LYS 59 74.502 8.713 -8.204 248 1HG LYS 59 HG2 LYS 59 73.832 9.998 -10.159 249 2HG LYS 59 HG1 LYS 59 73.486 8.517 -11.053 250 1HD LYS 59 HD2 LYS 59 72.087 8.438 -8.544 251 2HD LYS 59 HD1 LYS 59 71.734 9.968 -9.346 252 1HE LYS 59 HE2 LYS 59 71.332 8.546 -11.475 253 2HE LYS 59 HE1 LYS 59 71.254 7.163 -10.366 254 1HZ LYS 59 HZ1 LYS 59 69.085 8.370 -10.771 255 2HZ LYS 59 HZ2 LYS 59 69.745 9.679 -9.912 256 3HZ LYS 59 HZ3 LYS 59 69.526 8.179 -9.144 257 H SER 60 HN SER 60 76.504 10.568 -9.789 258 HA SER 60 HA SER 60 75.824 11.047 -12.622 259 1HB SER 60 HB2 SER 60 77.154 12.979 -10.727 260 2HB SER 60 HB1 SER 60 75.985 13.317 -12.003 261 HG SER 60 HG SER 60 75.523 12.008 -9.537 262 H GLY 61 HN GLY 61 78.535 10.073 -10.821 263 1HA GLY 61 HA2 GLY 61 80.657 9.490 -11.677 264 2HA GLY 61 HA1 GLY 61 80.260 10.325 -13.185 265 H MET 62 HN MET 62 79.869 11.806 -10.016 266 HA MET 62 HA MET 62 81.628 14.020 -10.803 267 1HB MET 62 HB2 MET 62 79.363 13.795 -9.350 268 2HB MET 62 HB1 MET 62 80.550 13.711 -8.049 269 1HG MET 62 HG2 MET 62 80.453 15.994 -8.159 270 2HG MET 62 HG1 MET 62 81.557 15.776 -9.514 271 1HE MET 62 HE1 MET 62 77.712 14.691 -9.448 272 2HE MET 62 HE2 MET 62 77.001 16.285 -9.688 273 3HE MET 62 HE3 MET 62 78.009 15.983 -8.276 274 H ARG 63 HN ARG 63 82.359 14.314 -7.873 275 HA ARG 63 HA ARG 63 84.992 13.171 -8.005 276 1HB ARG 63 HB2 ARG 63 83.333 14.262 -5.721 277 2HB ARG 63 HB1 ARG 63 85.077 13.961 -5.655 278 1HG ARG 63 HG2 ARG 63 85.549 15.830 -6.809 279 2HG ARG 63 HG1 ARG 63 84.254 15.549 -7.978 280 1HD ARG 63 HD2 ARG 63 82.815 16.922 -6.860 281 2HD ARG 63 HD1 ARG 63 83.251 16.215 -5.286 282 HE ARG 63 HE ARG 63 85.490 17.612 -5.771 283 1HH1 ARG 63 HH11 ARG 63 82.932 18.762 -4.372 284 2HH1 ARG 63 HH12 ARG 63 82.873 20.324 -5.120 285 1HH2 ARG 63 HH21 ARG 63 85.118 19.496 -7.631 286 2HH2 ARG 63 HH22 ARG 63 84.112 20.740 -6.966 287 H PHE 64 HN PHE 64 85.476 11.061 -7.664 288 HA PHE 64 HA PHE 64 83.616 9.326 -6.157 289 1HB PHE 64 HB2 PHE 64 85.914 9.074 -8.048 290 2HB PHE 64 HB1 PHE 64 85.700 7.761 -6.890 291 HD1 PHE 64 HD1 PHE 64 83.017 7.189 -6.564 292 HD2 PHE 64 HD2 PHE 64 84.907 8.712 -10.108 293 HE1 PHE 64 HE1 PHE 64 81.176 6.264 -7.944 294 HE2 PHE 64 HE2 PHE 64 83.065 7.788 -11.488 295 HZ PHE 64 HZ PHE 64 81.199 6.563 -10.405 296 H ASN 65 HN ASN 65 86.757 10.890 -5.912 297 HA ASN 65 HA ASN 65 87.476 9.393 -3.464 298 1HB ASN 65 HB2 ASN 65 88.826 10.573 -5.587 299 2HB ASN 65 HB1 ASN 65 89.125 11.679 -4.247 300 1HD2 ASN 65 HD21 ASN 65 91.424 10.866 -4.341 301 2HD2 ASN 65 HD22 ASN 65 91.807 9.393 -3.588 302 H GLU 66 HN GLU 66 86.644 12.741 -4.379 303 HA GLU 66 HA GLU 66 87.052 13.829 -1.761 304 1HB GLU 66 HB2 GLU 66 86.659 15.693 -2.980 305 2HB GLU 66 HB1 GLU 66 86.291 14.666 -4.359 306 1HG GLU 66 HG2 GLU 66 84.018 14.874 -4.092 307 2HG GLU 66 HG1 GLU 66 84.121 15.106 -2.348 308 H VAL 67 HN VAL 67 84.029 12.846 -3.435 309 HA VAL 67 HA VAL 67 82.289 13.137 -1.250 310 HB VAL 67 HB VAL 67 80.961 11.404 -2.433 311 1HG1 VAL 67 HG11 VAL 67 82.396 13.162 -4.416 312 2HG1 VAL 67 HG12 VAL 67 81.113 13.732 -3.347 313 3HG1 VAL 67 HG13 VAL 67 80.763 12.504 -4.570 314 1HG2 VAL 67 HG21 VAL 67 83.577 10.966 -3.833 315 2HG2 VAL 67 HG22 VAL 67 82.041 10.429 -4.517 316 3HG2 VAL 67 HG23 VAL 67 82.593 9.785 -2.969 317 H ALA 68 HN ALA 68 84.254 10.279 -2.233 318 HA ALA 68 HA ALA 68 83.541 8.636 0.001 319 1HB ALA 68 HB1 ALA 68 85.475 7.333 -0.729 320 2HB ALA 68 HB2 ALA 68 86.127 8.726 -1.594 321 3HB ALA 68 HB3 ALA 68 84.648 7.950 -2.159 322 H ALA 69 HN ALA 69 85.846 11.218 -0.484 323 HA ALA 69 HA ALA 69 87.447 10.789 1.848 324 1HB ALA 69 HB1 ALA 69 87.841 12.315 -0.176 325 2HB ALA 69 HB2 ALA 69 88.220 13.015 1.395 326 3HB ALA 69 HB3 ALA 69 86.718 13.443 0.580 327 H GLN 70 HN GLN 70 85.080 13.492 1.466 328 HA GLN 70 HA GLN 70 84.674 13.331 4.356 329 1HB GLN 70 HB2 GLN 70 84.601 15.319 2.305 330 2HB GLN 70 HB1 GLN 70 83.083 15.338 3.175 331 1HG GLN 70 HG2 GLN 70 85.850 15.875 4.166 332 2HG GLN 70 HG1 GLN 70 84.361 16.762 4.512 333 1HE2 GLN 70 HE21 GLN 70 82.873 14.203 5.280 334 2HE2 GLN 70 HE22 GLN 70 83.514 13.719 6.772 335 H TYR 71 HN TYR 71 82.472 13.323 1.496 336 HA TYR 71 HA TYR 71 80.057 13.155 2.826 337 1HB TYR 71 HB2 TYR 71 80.992 11.620 0.385 338 2HB TYR 71 HB1 TYR 71 79.315 11.710 0.886 339 HD1 TYR 71 HD1 TYR 71 79.151 12.720 -1.516 340 HD2 TYR 71 HD2 TYR 71 81.082 14.706 1.774 341 HE1 TYR 71 HE1 TYR 71 78.900 14.895 -2.675 342 HE2 TYR 71 HE2 TYR 71 80.828 16.872 0.612 343 HH TYR 71 HH TYR 71 79.698 17.926 -1.086 344 H SER 72 HN SER 72 82.549 10.706 2.659 345 HA SER 72 HA SER 72 80.986 8.519 3.748 346 1HB SER 72 HB2 SER 72 83.151 7.455 3.878 347 2HB SER 72 HB1 SER 72 83.167 8.461 2.429 348 HG SER 72 HG SER 72 84.612 8.674 4.745 349 H GLU 73 HN GLU 73 81.878 11.425 5.152 350 HA GLU 73 HA GLU 73 82.497 12.093 7.353 351 1HB GLU 73 HB2 GLU 73 79.927 11.491 6.881 352 2HB GLU 73 HB1 GLU 73 80.243 10.347 8.188 353 1HG GLU 73 HG2 GLU 73 81.190 13.165 8.486 354 2HG GLU 73 HG1 GLU 73 79.472 12.835 8.707 355 H ASP 74 HN ASP 74 84.100 9.931 6.642 356 HA ASP 74 HA ASP 74 85.010 8.940 9.170 357 1HB ASP 74 HB2 ASP 74 84.187 6.678 9.109 358 2HB ASP 74 HB1 ASP 74 82.788 7.711 8.824 359 H LYS 75 HN LYS 75 85.677 6.260 7.751 360 HA LYS 75 HA LYS 75 88.237 6.934 6.729 361 1HB LYS 75 HB2 LYS 75 87.608 4.696 7.454 362 2HB LYS 75 HB1 LYS 75 86.371 4.598 6.201 363 1HG LYS 75 HG2 LYS 75 88.149 3.428 5.223 364 2HG LYS 75 HG1 LYS 75 88.373 5.050 4.567 365 1HD LYS 75 HD2 LYS 75 90.136 5.537 6.071 366 2HD LYS 75 HD1 LYS 75 89.710 4.197 7.136 367 1HE LYS 75 HE2 LYS 75 91.290 2.989 6.028 368 2HE LYS 75 HE1 LYS 75 90.187 2.994 4.639 369 1HZ LYS 75 HZ1 LYS 75 91.090 5.160 4.002 370 2HZ LYS 75 HZ2 LYS 75 92.316 3.986 4.045 371 3HZ LYS 75 HZ3 LYS 75 92.170 5.113 5.308 372 H ALA 76 HN ALA 76 86.136 5.273 4.464 373 HA ALA 76 HA ALA 76 85.344 7.311 2.709 374 1HB ALA 76 HB1 ALA 76 87.359 8.196 2.151 375 2HB ALA 76 HB2 ALA 76 87.565 6.751 1.161 376 3HB ALA 76 HB3 ALA 76 88.239 6.807 2.790 377 H ARG 77 HN ARG 77 84.583 6.470 0.692 378 HA ARG 77 HA ARG 77 84.329 3.514 0.629 379 1HB ARG 77 HB2 ARG 77 82.482 5.329 0.432 380 2HB ARG 77 HB1 ARG 77 83.065 5.540 -1.215 381 1HG ARG 77 HG2 ARG 77 82.175 3.559 -1.903 382 2HG ARG 77 HG1 ARG 77 82.623 2.738 -0.409 383 1HD ARG 77 HD2 ARG 77 80.720 3.699 0.763 384 2HD ARG 77 HD1 ARG 77 80.316 4.701 -0.644 385 HE ARG 77 HE ARG 77 80.237 1.701 -0.672 386 1HH1 ARG 77 HH11 ARG 77 80.000 4.342 -2.690 387 2HH1 ARG 77 HH12 ARG 77 78.429 3.964 -3.314 388 1HH2 ARG 77 HH21 ARG 77 77.855 1.406 -1.048 389 2HH2 ARG 77 HH22 ARG 77 77.211 2.304 -2.377 390 H GLN 78 HN GLN 78 84.764 6.001 -1.902 391 HA GLN 78 HA GLN 78 85.893 4.267 -3.860 392 1HB GLN 78 HB2 GLN 78 85.947 7.220 -3.273 393 2HB GLN 78 HB1 GLN 78 86.792 6.571 -4.682 394 1HG GLN 78 HG2 GLN 78 84.584 7.251 -5.399 395 2HG GLN 78 HG1 GLN 78 84.622 5.491 -5.387 396 1HE2 GLN 78 HE21 GLN 78 83.323 4.380 -3.769 397 2HE2 GLN 78 HE22 GLN 78 82.193 5.202 -2.805 398 H GLY 79 HN GLY 79 87.908 6.946 -2.825 399 1HA GLY 79 HA2 GLY 79 90.346 5.530 -3.003 400 2HA GLY 79 HA1 GLY 79 90.132 7.023 -2.084 401 H GLY 80 HN GLY 80 87.997 5.730 -0.429 402 1HA GLY 80 HA1 GLY 80 89.799 4.525 1.556 403 2HA GLY 80 HA2 GLY 80 88.094 4.906 1.800 404 H ASP 81 HN ASP 81 88.173 3.369 -1.093 405 HA ASP 81 HA ASP 81 86.747 1.101 -0.488 406 1HB ASP 81 HB2 ASP 81 87.336 1.844 -2.748 407 2HB ASP 81 HB1 ASP 81 89.032 1.426 -2.465 408 H LEU 82 HN LEU 82 87.365 0.108 1.502 409 HA LEU 82 HA LEU 82 89.802 -0.591 2.546 410 1HB LEU 82 HB2 LEU 82 87.129 -1.933 2.366 411 2HB LEU 82 HB1 LEU 82 88.456 -2.811 3.125 412 HG LEU 82 HG LEU 82 88.851 -0.789 4.581 413 1HD1 LEU 82 HD11 LEU 82 87.838 0.963 3.323 414 2HD1 LEU 82 HD12 LEU 82 86.811 0.747 4.739 415 3HD1 LEU 82 HD13 LEU 82 86.318 0.082 3.182 416 1HD2 LEU 82 HD21 LEU 82 87.664 -2.056 6.017 417 2HD2 LEU 82 HD22 LEU 82 86.721 -2.735 4.690 418 3HD2 LEU 82 HD23 LEU 82 86.202 -1.238 5.465 419 H GLY 83 HN GLY 83 88.078 -3.150 0.766 420 1HA GLY 83 HA2 GLY 83 89.475 -3.798 -1.404 421 2HA GLY 83 HA1 GLY 83 90.703 -4.157 -0.182 422 H TRP 84 HN TRP 84 90.589 -6.416 -0.838 423 HA TRP 84 HA TRP 84 88.279 -8.039 -0.892 424 1HB TRP 84 HB2 TRP 84 91.208 -8.381 -0.379 425 2HB TRP 84 HB1 TRP 84 90.154 -9.757 -0.063 426 HD1 TRP 84 HD1 TRP 84 92.077 -8.326 -2.741 427 HE1 TRP 84 HE1 TRP 84 91.230 -9.088 -5.057 428 HE3 TRP 84 HE3 TRP 84 87.568 -10.278 -1.409 429 HZ2 TRP 84 HZ2 TRP 84 88.925 -10.366 -6.188 430 HZ3 TRP 84 HZ3 TRP 84 86.065 -11.260 -3.111 431 HH2 TRP 84 HH2 TRP 84 86.728 -11.303 -5.498 432 H MET 85 HN MET 85 86.905 -8.720 0.712 433 HA MET 85 HA MET 85 87.888 -8.667 3.541 434 1HB MET 85 HB2 MET 85 85.712 -7.143 2.207 435 2HB MET 85 HB1 MET 85 85.330 -7.803 3.797 436 1HG MET 85 HG2 MET 85 87.846 -6.212 3.245 437 2HG MET 85 HG1 MET 85 86.346 -5.465 3.795 438 1HE MET 85 HE1 MET 85 89.341 -5.878 4.619 439 2HE MET 85 HE2 MET 85 89.584 -6.515 6.243 440 3HE MET 85 HE3 MET 85 88.752 -4.978 6.024 441 H THR 86 HN THR 86 87.411 -10.592 4.524 442 HA THR 86 HA THR 86 85.307 -12.313 3.278 443 HB THR 86 HB THR 86 86.685 -14.034 4.730 444 HG1 THR 86 HG1 THR 86 88.763 -13.362 5.095 445 1HG2 THR 86 HG21 THR 86 86.983 -14.542 2.549 446 2HG2 THR 86 HG22 THR 86 88.519 -13.691 2.721 447 3HG2 THR 86 HG23 THR 86 87.109 -12.848 2.077 448 H ARG 87 HN ARG 87 83.789 -13.344 4.657 449 HA ARG 87 HA ARG 87 82.846 -11.856 6.906 450 1HB ARG 87 HB2 ARG 87 81.777 -13.640 5.280 451 2HB ARG 87 HB1 ARG 87 82.294 -14.784 6.518 452 1HG ARG 87 HG2 ARG 87 80.907 -12.347 7.499 453 2HG ARG 87 HG1 ARG 87 79.912 -13.494 6.600 454 1HD ARG 87 HD2 ARG 87 81.557 -15.008 8.381 455 2HD ARG 87 HD1 ARG 87 80.804 -13.701 9.314 456 HE ARG 87 HE ARG 87 78.652 -14.486 7.980 457 1HH1 ARG 87 HH21 ARG 87 80.916 -16.192 9.870 458 2HH1 ARG 87 HH22 ARG 87 80.092 -17.712 9.757 459 1HH2 ARG 87 HH11 ARG 87 77.711 -16.557 7.517 460 2HH2 ARG 87 HH12 ARG 87 78.278 -17.919 8.425 461 H GLY 88 HN GLY 88 82.887 -12.436 9.173 462 1HA GLY 88 HA2 GLY 88 83.669 -13.739 11.052 463 2HA GLY 88 HA1 GLY 88 84.849 -14.514 9.985 464 H SER 89 HN SER 89 85.674 -11.913 8.817 465 HA SER 89 HA SER 89 87.264 -10.894 11.151 466 1HB SER 89 HB2 SER 89 87.905 -11.100 8.188 467 2HB SER 89 HB1 SER 89 88.990 -10.427 9.412 468 HG SER 89 HG SER 89 88.624 -12.558 10.491 469 H MET 90 HN MET 90 84.599 -10.006 9.748 470 HA MET 90 HA MET 90 85.425 -7.216 9.048 471 1HB MET 90 HB2 MET 90 83.755 -9.116 7.847 472 2HB MET 90 HB1 MET 90 82.643 -7.962 8.586 473 1HG MET 90 HG2 MET 90 84.183 -6.150 7.523 474 2HG MET 90 HG1 MET 90 84.768 -7.467 6.506 475 1HE MET 90 HE1 MET 90 83.444 -7.513 3.929 476 2HE MET 90 HE2 MET 90 82.158 -8.634 4.370 477 3HE MET 90 HE3 MET 90 83.737 -8.771 5.138 478 H VAL 91 HN VAL 91 82.511 -8.718 10.508 479 HA VAL 91 HA VAL 91 82.720 -7.536 13.072 480 HB VAL 91 HB VAL 91 82.726 -5.378 12.165 481 1HG1 VAL 91 HG11 VAL 91 81.223 -6.675 9.992 482 2HG1 VAL 91 HG12 VAL 91 82.378 -5.344 9.924 483 3HG1 VAL 91 HG13 VAL 91 80.695 -5.029 10.346 484 1HG2 VAL 91 HG21 VAL 91 80.946 -4.527 13.259 485 2HG2 VAL 91 HG22 VAL 91 80.445 -6.197 13.529 486 3HG2 VAL 91 HG23 VAL 91 79.807 -5.296 12.154 487 H GLY 92 HN GLY 92 79.751 -6.955 11.254 488 1HA GLY 92 HA2 GLY 92 78.573 -9.545 11.725 489 2HA GLY 92 HA1 GLY 92 78.073 -8.391 12.970 490 HA PRO 93 HA PRO 93 74.901 -6.819 10.393 491 1HB PRO 93 HB2 PRO 93 75.525 -4.053 10.896 492 2HB PRO 93 HB1 PRO 93 74.262 -5.042 11.648 493 1HG PRO 93 HG2 PRO 93 76.717 -4.105 12.827 494 2HG PRO 93 HG1 PRO 93 75.446 -5.068 13.582 495 1HD PRO 93 HD2 PRO 93 78.082 -5.931 12.807 496 2HD PRO 93 HD1 PRO 93 76.785 -6.912 13.529 497 H PHE 94 HN PHE 94 77.753 -4.647 10.194 498 HA PHE 94 HA PHE 94 77.450 -3.665 7.605 499 1HB PHE 94 HB2 PHE 94 79.264 -3.396 9.515 500 2HB PHE 94 HB1 PHE 94 80.133 -4.613 8.568 501 HD1 PHE 94 HD1 PHE 94 80.648 -4.166 6.150 502 HD2 PHE 94 HD2 PHE 94 79.083 -1.135 8.761 503 HE1 PHE 94 HE1 PHE 94 81.369 -2.416 4.551 504 HE2 PHE 94 HE2 PHE 94 79.807 0.616 7.161 505 HZ PHE 94 HZ PHE 94 80.952 -0.024 5.056 506 H GLN 95 HN GLN 95 78.769 -6.826 8.591 507 HA GLN 95 HA GLN 95 79.297 -7.590 5.785 508 1HB GLN 95 HB2 GLN 95 80.855 -8.239 7.532 509 2HB GLN 95 HB1 GLN 95 79.556 -8.970 8.474 510 1HG GLN 95 HG2 GLN 95 80.092 -9.904 5.664 511 2HG GLN 95 HG1 GLN 95 81.067 -10.515 7.000 512 1HE2 GLN 95 HE21 GLN 95 79.665 -11.347 8.947 513 2HE2 GLN 95 HE22 GLN 95 78.255 -12.203 8.546 514 H GLU 96 HN GLU 96 76.917 -8.197 8.325 515 HA GLU 96 HA GLU 96 75.620 -10.487 7.269 516 1HB GLU 96 HB2 GLU 96 75.023 -8.213 9.077 517 2HB GLU 96 HB1 GLU 96 73.616 -9.057 8.431 518 1HG GLU 96 HG2 GLU 96 75.041 -11.204 9.105 519 2HG GLU 96 HG1 GLU 96 75.773 -10.069 10.239 520 H ALA 97 HN ALA 97 75.375 -7.079 6.353 521 HA ALA 97 HA ALA 97 73.074 -7.556 4.575 522 1HB ALA 97 HB1 ALA 97 74.806 -5.256 5.436 523 2HB ALA 97 HB2 ALA 97 73.059 -5.446 5.587 524 3HB ALA 97 HB3 ALA 97 73.773 -5.074 4.018 525 H ALA 98 HN ALA 98 75.988 -5.751 3.729 526 HA ALA 98 HA ALA 98 76.125 -6.197 1.027 527 1HB ALA 98 HB1 ALA 98 77.830 -5.358 3.109 528 2HB ALA 98 HB2 ALA 98 78.094 -5.147 1.378 529 3HB ALA 98 HB3 ALA 98 78.749 -6.561 2.205 530 H PHE 99 HN PHE 99 78.200 -8.211 3.133 531 HA PHE 99 HA PHE 99 78.849 -10.248 1.397 532 1HB PHE 99 HB2 PHE 99 79.037 -9.754 4.088 533 2HB PHE 99 HB1 PHE 99 77.983 -11.176 4.064 534 HD1 PHE 99 HD1 PHE 99 81.283 -9.844 2.996 535 HD2 PHE 99 HD2 PHE 99 78.810 -13.332 3.414 536 HE1 PHE 99 HE1 PHE 99 83.246 -11.291 2.541 537 HE2 PHE 99 HE2 PHE 99 80.773 -14.778 2.960 538 HZ PHE 99 HZ PHE 99 82.990 -13.757 2.524 539 H ALA 100 HN ALA 100 76.064 -10.534 3.617 540 HA ALA 100 HA ALA 100 74.894 -12.809 2.388 541 1HB ALA 100 HB1 ALA 100 73.287 -10.603 3.659 542 2HB ALA 100 HB2 ALA 100 74.454 -11.506 4.626 543 3HB ALA 100 HB3 ALA 100 73.113 -12.348 3.849 544 H LEU 101 HN LEU 101 75.034 -9.529 1.313 545 HA LEU 101 HA LEU 101 72.753 -9.936 -0.569 546 1HB LEU 101 HB2 LEU 101 74.289 -7.594 0.547 547 2HB LEU 101 HB1 LEU 101 73.299 -7.402 -0.905 548 HG LEU 101 HG LEU 101 72.217 -8.637 1.635 549 1HD1 LEU 101 HD11 LEU 101 72.498 -6.560 2.533 550 2HD1 LEU 101 HD12 LEU 101 71.105 -6.146 1.533 551 3HD1 LEU 101 HD13 LEU 101 72.738 -5.806 0.957 552 1HD2 LEU 101 HD21 LEU 101 71.222 -8.047 -1.044 553 2HD2 LEU 101 HD22 LEU 101 70.224 -7.305 0.207 554 3HD2 LEU 101 HD23 LEU 101 70.504 -9.046 0.220 555 HA PRO 102 HA PRO 102 75.476 -10.642 -3.965 556 1HB PRO 102 HB2 PRO 102 73.822 -9.133 -5.776 557 2HB PRO 102 HB1 PRO 102 73.903 -10.890 -5.575 558 1HG PRO 102 HG2 PRO 102 71.775 -9.135 -4.800 559 2HG PRO 102 HG1 PRO 102 71.882 -10.881 -4.548 560 1HD PRO 102 HD2 PRO 102 72.125 -8.772 -2.571 561 2HD PRO 102 HD1 PRO 102 72.154 -10.535 -2.315 562 H VAL 103 HN VAL 103 76.798 -9.400 -5.580 563 HA VAL 103 HA VAL 103 78.225 -7.247 -4.632 564 HB VAL 103 HB VAL 103 77.397 -8.133 -7.390 565 1HG1 VAL 103 HG11 VAL 103 78.952 -5.679 -6.624 566 2HG1 VAL 103 HG12 VAL 103 77.773 -5.889 -7.918 567 3HG1 VAL 103 HG13 VAL 103 79.393 -6.567 -8.082 568 1HG2 VAL 103 HG21 VAL 103 79.774 -8.793 -7.484 569 2HG2 VAL 103 HG22 VAL 103 78.981 -9.499 -6.076 570 3HG2 VAL 103 HG23 VAL 103 80.031 -8.094 -5.886 571 H SER 104 HN SER 104 78.148 -4.904 -5.135 572 HA SER 104 HA SER 104 75.834 -3.619 -6.273 573 1HB SER 104 HB2 SER 104 74.486 -3.252 -4.410 574 2HB SER 104 HB1 SER 104 75.125 -4.859 -4.039 575 HG SER 104 HG SER 104 76.125 -4.045 -2.402 576 H GLY 105 HN GLY 105 75.852 -1.516 -4.093 577 1HA GLY 105 HA2 GLY 105 77.576 -0.002 -3.162 578 2HA GLY 105 HA1 GLY 105 78.586 -0.407 -4.547 579 H MET 106 HN MET 106 78.114 2.246 -3.975 580 HA MET 106 HA MET 106 77.519 4.226 -5.090 581 1HB MET 106 HB2 MET 106 78.107 2.455 -6.931 582 2HB MET 106 HB1 MET 106 76.374 2.464 -7.230 583 1HG MET 106 HG2 MET 106 76.961 5.163 -7.099 584 2HG MET 106 HG1 MET 106 78.412 4.498 -7.856 585 1HE MET 106 HE1 MET 106 74.416 4.951 -8.291 586 2HE MET 106 HE2 MET 106 74.853 3.364 -7.673 587 3HE MET 106 HE3 MET 106 74.175 3.512 -9.289 588 H ASP 107 HN ASP 107 75.287 4.982 -6.497 589 HA ASP 107 HA ASP 107 73.182 4.829 -4.486 590 1HB ASP 107 HB2 ASP 107 73.687 6.882 -5.687 591 2HB ASP 107 HB1 ASP 107 73.394 6.091 -7.235 592 H LYS 108 HN LYS 108 73.981 2.443 -6.438 593 HA LYS 108 HA LYS 108 71.154 1.630 -6.883 594 1HB LYS 108 HB2 LYS 108 72.231 2.658 -8.951 595 2HB LYS 108 HB1 LYS 108 73.372 1.306 -8.928 596 1HG LYS 108 HG2 LYS 108 70.802 0.164 -8.641 597 2HG LYS 108 HG1 LYS 108 70.657 1.370 -9.920 598 1HD LYS 108 HD2 LYS 108 73.095 0.111 -10.442 599 2HD LYS 108 HD1 LYS 108 72.027 -1.205 -9.955 600 1HE LYS 108 HE2 LYS 108 70.614 0.619 -11.713 601 2HE LYS 108 HE1 LYS 108 72.103 0.040 -12.484 602 1HZ LYS 108 HZ1 LYS 108 70.564 -1.657 -12.882 603 2HZ LYS 108 HZ2 LYS 108 69.879 -1.541 -11.332 604 3HZ LYS 108 HZ3 LYS 108 71.424 -2.219 -11.533 605 HA PRO 109 HA PRO 109 74.306 -1.500 -5.152 606 1HB PRO 109 HB2 PRO 109 72.788 -1.578 -2.708 607 2HB PRO 109 HB1 PRO 109 74.457 -1.034 -2.942 608 1HG PRO 109 HG2 PRO 109 72.191 0.581 -2.336 609 2HG PRO 109 HG1 PRO 109 73.825 1.132 -2.726 610 1HD PRO 109 HD2 PRO 109 71.424 1.270 -4.375 611 2HD PRO 109 HD1 PRO 109 73.025 2.007 -4.632 612 H VAL 110 HN VAL 110 72.924 -3.338 -3.362 613 HA VAL 110 HA VAL 110 71.393 -4.832 -5.331 614 HB VAL 110 HB VAL 110 73.062 -5.514 -3.409 615 1HG1 VAL 110 HG11 VAL 110 71.077 -4.473 -1.824 616 2HG1 VAL 110 HG12 VAL 110 72.272 -5.652 -1.284 617 3HG1 VAL 110 HG13 VAL 110 70.679 -6.192 -1.814 618 1HG2 VAL 110 HG21 VAL 110 72.455 -7.602 -3.974 619 2HG2 VAL 110 HG22 VAL 110 71.215 -6.839 -4.969 620 3HG2 VAL 110 HG23 VAL 110 70.823 -7.389 -3.338 621 H PHE 111 HN PHE 111 69.460 -6.032 -3.672 622 HA PHE 111 HA PHE 111 67.183 -4.427 -3.983 623 1HB PHE 111 HB2 PHE 111 67.802 -6.559 -1.913 624 2HB PHE 111 HB1 PHE 111 66.179 -6.038 -2.383 625 HD1 PHE 111 HD1 PHE 111 65.470 -6.310 -4.819 626 HD2 PHE 111 HD2 PHE 111 68.993 -8.153 -3.193 627 HE1 PHE 111 HE1 PHE 111 65.521 -7.896 -6.726 628 HE2 PHE 111 HE2 PHE 111 69.045 -9.737 -5.099 629 HZ PHE 111 HZ PHE 111 67.309 -9.609 -6.866 630 H THR 112 HN THR 112 69.229 -4.798 -1.093 631 HA THR 112 HA THR 112 67.703 -3.126 0.651 632 HB THR 112 HB THR 112 69.628 -4.738 1.147 633 HG1 THR 112 HG1 THR 112 68.726 -3.227 2.656 634 1HG2 THR 112 HG21 THR 112 71.012 -2.896 -0.490 635 2HG2 THR 112 HG22 THR 112 71.690 -4.271 0.382 636 3HG2 THR 112 HG23 THR 112 71.646 -2.681 1.142 637 H ASP 113 HN ASP 113 69.507 -1.197 1.552 638 HA ASP 113 HA ASP 113 69.652 0.711 -0.766 639 1HB ASP 113 HB2 ASP 113 69.173 1.412 2.140 640 2HB ASP 113 HB1 ASP 113 68.857 2.407 0.719 641 HA PRO 114 HA PRO 114 73.906 1.177 0.130 642 1HB PRO 114 HB2 PRO 114 73.908 4.025 -0.235 643 2HB PRO 114 HB1 PRO 114 74.443 2.770 -1.364 644 1HG PRO 114 HG2 PRO 114 72.088 4.394 -1.546 645 2HG PRO 114 HG1 PRO 114 72.588 3.096 -2.632 646 1HD PRO 114 HD2 PRO 114 70.422 3.084 -0.696 647 2HD PRO 114 HD1 PRO 114 70.869 1.811 -1.855 648 HA PRO 115 HA PRO 115 73.881 4.377 3.756 649 1HB PRO 115 HB2 PRO 115 71.161 5.199 4.212 650 2HB PRO 115 HB1 PRO 115 72.526 6.198 3.696 651 1HG PRO 115 HG2 PRO 115 70.257 5.423 2.146 652 2HG PRO 115 HG1 PRO 115 71.678 6.328 1.598 653 1HD PRO 115 HD2 PRO 115 70.955 3.557 1.026 654 2HD PRO 115 HD1 PRO 115 72.272 4.526 0.344 655 H VAL 116 HN VAL 116 73.976 1.946 4.430 656 HA VAL 116 HA VAL 116 71.541 0.930 5.756 657 HB VAL 116 HB VAL 116 72.753 -1.102 5.847 658 1HG1 VAL 116 HG11 VAL 116 74.264 -0.365 3.496 659 2HG1 VAL 116 HG12 VAL 116 72.669 0.387 3.460 660 3HG1 VAL 116 HG13 VAL 116 72.814 -1.364 3.613 661 1HG2 VAL 116 HG21 VAL 116 74.753 -0.157 6.965 662 2HG2 VAL 116 HG22 VAL 116 75.285 0.498 5.415 663 3HG2 VAL 116 HG23 VAL 116 75.184 -1.248 5.646 664 H LYS 117 HN LYS 117 71.429 0.534 8.024 665 HA LYS 117 HA LYS 117 73.263 2.232 9.655 666 1HB LYS 117 HB2 LYS 117 70.859 2.679 9.756 667 2HB LYS 117 HB1 LYS 117 70.543 0.985 10.157 668 1HG LYS 117 HG2 LYS 117 71.637 1.194 12.281 669 2HG LYS 117 HG1 LYS 117 72.306 2.775 11.852 670 1HD LYS 117 HD2 LYS 117 70.344 3.869 12.288 671 2HD LYS 117 HD1 LYS 117 69.350 2.532 11.690 672 1HE LYS 117 HE2 LYS 117 69.489 1.360 13.743 673 2HE LYS 117 HE1 LYS 117 70.906 2.285 14.276 674 1HZ LYS 117 HZ1 LYS 117 68.143 3.316 13.874 675 2HZ LYS 117 HZ2 LYS 117 69.490 4.301 14.193 676 3HZ LYS 117 HZ3 LYS 117 68.964 3.174 15.351 677 H THR 118 HN THR 118 74.277 1.341 11.535 678 HA THR 118 HA THR 118 73.915 -1.506 12.192 679 HB THR 118 HB THR 118 75.358 -1.546 10.194 680 HG1 THR 118 HG1 THR 118 76.523 -2.110 12.698 681 1HG2 THR 118 HG21 THR 118 77.357 0.064 11.787 682 2HG2 THR 118 HG22 THR 118 76.241 0.809 10.642 683 3HG2 THR 118 HG23 THR 118 77.428 -0.369 10.079 684 H LYS 119 HN LYS 119 76.037 1.355 12.571 685 HA LYS 119 HA LYS 119 75.685 1.432 15.437 686 1HB LYS 119 HB2 LYS 119 77.994 0.647 15.999 687 2HB LYS 119 HB1 LYS 119 77.003 -0.623 15.281 688 1HG LYS 119 HG2 LYS 119 78.406 -0.822 13.526 689 2HG LYS 119 HG1 LYS 119 78.365 0.919 13.230 690 1HD LYS 119 HD2 LYS 119 80.613 0.590 13.774 691 2HD LYS 119 HD1 LYS 119 79.931 1.024 15.342 692 1HE LYS 119 HE2 LYS 119 80.141 -1.126 16.174 693 2HE LYS 119 HE1 LYS 119 79.909 -1.873 14.581 694 1HZ LYS 119 HZ1 LYS 119 82.067 -1.041 13.904 695 2HZ LYS 119 HZ2 LYS 119 82.240 -1.975 15.313 696 3HZ LYS 119 HZ3 LYS 119 82.286 -0.279 15.403 697 H PHE 120 HN PHE 120 75.933 3.168 12.951 698 HA PHE 120 HA PHE 120 77.378 5.365 14.192 699 1HB PHE 120 HB2 PHE 120 78.864 3.459 12.760 700 2HB PHE 120 HB1 PHE 120 78.701 4.832 11.656 701 HD1 PHE 120 HD1 PHE 120 80.617 3.502 14.293 702 HD2 PHE 120 HD2 PHE 120 79.026 7.214 12.829 703 HE1 PHE 120 HE1 PHE 120 82.331 4.745 15.584 704 HE2 PHE 120 HE2 PHE 120 80.740 8.458 14.120 705 HZ PHE 120 HZ PHE 120 82.393 7.223 15.497 706 H GLY 121 HN GLY 121 74.793 4.607 12.719 707 1HA GLY 121 HA2 GLY 121 73.340 6.220 11.642 708 2HA GLY 121 HA1 GLY 121 74.773 7.010 10.966 709 H TYR 122 HN TYR 122 73.775 6.857 8.840 710 HA TYR 122 HA TYR 122 73.475 4.107 7.727 711 1HB TYR 122 HB2 TYR 122 72.835 6.838 6.566 712 2HB TYR 122 HB1 TYR 122 72.288 5.283 5.941 713 HD1 TYR 122 HD1 TYR 122 71.926 4.115 8.854 714 HD2 TYR 122 HD2 TYR 122 70.534 7.657 6.863 715 HE1 TYR 122 HE1 TYR 122 69.968 4.201 10.375 716 HE2 TYR 122 HE2 TYR 122 68.577 7.743 8.383 717 HH TYR 122 HH TYR 122 67.417 6.636 9.949 718 H HIS 123 HN HIS 123 75.173 3.276 6.548 719 HA HIS 123 HA HIS 123 77.063 5.235 5.284 720 1HB HIS 123 HB2 HIS 123 78.689 3.215 5.598 721 2HB HIS 123 HB1 HIS 123 78.280 4.187 7.006 722 HD1 HIS 123 HD1 HIS 123 78.235 0.763 5.774 723 HD2 HIS 123 HD2 HIS 123 76.108 2.938 8.624 724 HE1 HIS 123 HE1 HIS 123 77.128 -0.935 7.292 725 H ILE 124 HN ILE 124 77.738 4.734 3.142 726 HA ILE 124 HA ILE 124 75.937 2.894 1.684 727 HB ILE 124 HB ILE 124 78.156 4.594 0.528 728 1HG1 ILE 124 HG12 ILE 124 75.370 5.529 1.307 729 2HG1 ILE 124 HG11 ILE 124 76.856 5.988 2.146 730 1HG2 ILE 124 HG21 ILE 124 77.141 4.145 -1.428 731 2HG2 ILE 124 HG22 ILE 124 75.567 4.598 -0.782 732 3HG2 ILE 124 HG23 ILE 124 76.167 2.954 -0.564 733 1HD1 ILE 124 HD11 ILE 124 76.971 7.719 0.689 734 2HD1 ILE 124 HD12 ILE 124 75.744 7.013 -0.363 735 3HD1 ILE 124 HD13 ILE 124 77.431 6.523 -0.523 736 H ILE 125 HN ILE 125 76.588 0.772 1.701 737 HA ILE 125 HA ILE 125 79.480 0.104 1.653 738 HB ILE 125 HB ILE 125 76.870 -1.292 2.224 739 1HG1 ILE 125 HG12 ILE 125 79.467 -1.230 3.781 740 2HG1 ILE 125 HG11 ILE 125 78.204 -0.005 3.968 741 1HG2 ILE 125 HG21 ILE 125 78.697 -3.257 2.655 742 2HG2 ILE 125 HG22 ILE 125 79.381 -2.493 1.221 743 3HG2 ILE 125 HG23 ILE 125 77.735 -3.123 1.183 744 1HD1 ILE 125 HD11 ILE 125 78.032 -2.969 4.551 745 2HD1 ILE 125 HD12 ILE 125 76.594 -1.961 4.385 746 3HD1 ILE 125 HD13 ILE 125 77.764 -1.626 5.662 747 H MET 126 HN MET 126 80.447 -0.620 -0.223 748 HA MET 126 HA MET 126 78.663 -1.339 -2.506 749 1HB MET 126 HB2 MET 126 79.555 0.592 -3.340 750 2HB MET 126 HB1 MET 126 80.795 0.634 -2.087 751 1HG MET 126 HG2 MET 126 82.294 -0.635 -3.327 752 2HG MET 126 HG1 MET 126 81.025 -1.351 -4.331 753 1HE MET 126 HE1 MET 126 81.668 2.000 -2.996 754 2HE MET 126 HE2 MET 126 80.412 2.634 -4.057 755 3HE MET 126 HE3 MET 126 82.097 3.069 -4.340 756 H VAL 127 HN VAL 127 78.844 -3.597 -2.369 757 HA VAL 127 HA VAL 127 81.505 -4.859 -2.039 758 HB VAL 127 HB VAL 127 78.617 -5.728 -2.202 759 1HG1 VAL 127 HG11 VAL 127 79.233 -7.690 -3.125 760 2HG1 VAL 127 HG12 VAL 127 80.138 -8.014 -1.648 761 3HG1 VAL 127 HG13 VAL 127 80.942 -7.266 -3.029 762 1HG2 VAL 127 HG21 VAL 127 80.039 -4.929 -0.094 763 2HG2 VAL 127 HG22 VAL 127 80.585 -6.606 -0.129 764 3HG2 VAL 127 HG23 VAL 127 78.867 -6.241 0.039 765 H GLU 128 HN GLU 128 82.719 -5.469 -3.846 766 HA GLU 128 HA GLU 128 81.295 -6.014 -6.379 767 1HB GLU 128 HB2 GLU 128 82.211 -3.495 -5.780 768 2HB GLU 128 HB1 GLU 128 83.596 -4.183 -6.641 769 1HG GLU 128 HG2 GLU 128 81.720 -5.014 -8.321 770 2HG GLU 128 HG1 GLU 128 80.807 -3.668 -7.623 771 H GLY 129 HN GLY 129 82.169 -8.131 -6.237 772 1HA GLY 129 HA2 GLY 129 84.023 -9.305 -7.474 773 2HA GLY 129 HA1 GLY 129 85.129 -8.292 -6.536 774 H ARG 130 HN ARG 130 82.525 -10.666 -6.092 775 HA ARG 130 HA ARG 130 83.251 -11.225 -3.373 776 1HB ARG 130 HB2 ARG 130 81.092 -11.687 -4.769 777 2HB ARG 130 HB1 ARG 130 81.947 -13.151 -5.246 778 1HG ARG 130 HG2 ARG 130 81.469 -14.142 -3.286 779 2HG ARG 130 HG1 ARG 130 82.172 -12.791 -2.398 780 1HD ARG 130 HD2 ARG 130 79.827 -12.970 -1.758 781 2HD ARG 130 HD1 ARG 130 79.990 -11.536 -2.790 782 HE ARG 130 HE ARG 130 79.167 -12.925 -4.684 783 1HH1 ARG 130 HH11 ARG 130 79.602 -14.997 -2.083 784 2HH1 ARG 130 HH12 ARG 130 78.064 -15.781 -2.222 785 1HH2 ARG 130 HH21 ARG 130 76.865 -13.586 -4.623 786 2HH2 ARG 130 HH22 ARG 130 76.515 -14.982 -3.660 787 H LYS 131 HN LYS 131 83.717 -13.856 -3.038 788 HA LYS 131 HA LYS 131 85.979 -14.587 -4.864 789 1HB LYS 131 HB2 LYS 131 86.105 -13.657 -2.206 790 2HB LYS 131 HB1 LYS 131 86.412 -15.390 -2.116 791 1HG LYS 131 HG2 LYS 131 88.026 -14.987 -4.109 792 2HG LYS 131 HG1 LYS 131 87.930 -13.286 -3.653 793 1HD LYS 131 HD2 LYS 131 88.771 -13.754 -1.444 794 2HD LYS 131 HD1 LYS 131 88.640 -15.493 -1.703 795 1HE LYS 131 HE2 LYS 131 90.750 -15.501 -2.527 796 2HE LYS 131 HE1 LYS 131 90.228 -14.406 -3.830 797 1HZ LYS 131 HZ1 LYS 131 90.276 -12.698 -1.836 798 2HZ LYS 131 HZ2 LYS 131 91.675 -13.036 -2.739 799 3HZ LYS 131 HZ3 LYS 131 91.434 -13.778 -1.230 Start of MODEL 2 1 1H GLY 28 HT1 GLY 28 82.159 -8.993 -12.413 2 2H GLY 28 HT2 GLY 28 82.937 -8.354 -13.781 3 3H GLY 28 HT3 GLY 28 83.770 -9.408 -12.741 4 1HA GLY 28 HA2 GLY 28 81.343 -10.217 -14.235 5 2HA GLY 28 HA1 GLY 28 82.974 -10.421 -14.876 6 H SER 29 HN SER 29 81.490 -10.899 -11.648 7 HA SER 29 HA SER 29 83.077 -12.939 -10.665 8 1HB SER 29 HB2 SER 29 80.614 -11.761 -10.104 9 2HB SER 29 HB1 SER 29 80.223 -13.471 -10.287 10 HG SER 29 HG SER 29 81.368 -13.941 -8.575 11 H GLY 30 HN GLY 30 83.709 -14.829 -11.627 12 1HA GLY 30 HA2 GLY 30 81.732 -16.229 -13.385 13 2HA GLY 30 HA1 GLY 30 83.473 -16.277 -13.660 14 HA PRO 31 HA PRO 31 81.951 -19.933 -11.058 15 1HB PRO 31 HB2 PRO 31 83.302 -21.619 -12.961 16 2HB PRO 31 HB1 PRO 31 81.563 -21.523 -12.625 17 1HG PRO 31 HG2 PRO 31 82.969 -20.583 -14.950 18 2HG PRO 31 HG1 PRO 31 81.239 -20.488 -14.615 19 1HD PRO 31 HD2 PRO 31 83.164 -18.336 -14.619 20 2HD PRO 31 HD1 PRO 31 81.420 -18.240 -14.283 21 H LYS 32 HN LYS 32 83.521 -19.316 -9.465 22 HA LYS 32 HA LYS 32 86.157 -20.649 -9.757 23 1HB LYS 32 HB2 LYS 32 85.908 -18.055 -10.488 24 2HB LYS 32 HB1 LYS 32 86.203 -17.845 -8.761 25 1HG LYS 32 HG2 LYS 32 88.384 -18.360 -9.005 26 2HG LYS 32 HG1 LYS 32 87.988 -19.844 -9.872 27 1HD LYS 32 HD2 LYS 32 88.710 -18.880 -11.773 28 2HD LYS 32 HD1 LYS 32 87.407 -17.700 -11.633 29 1HE LYS 32 HE2 LYS 32 88.793 -16.085 -10.702 30 2HE LYS 32 HE1 LYS 32 89.869 -17.289 -9.967 31 1HZ LYS 32 HZ1 LYS 32 89.611 -16.648 -12.861 32 2HZ LYS 32 HZ2 LYS 32 90.518 -17.948 -12.251 33 3HZ LYS 32 HZ3 LYS 32 90.960 -16.350 -11.878 34 H GLY 33 HN GLY 33 84.967 -21.950 -8.052 35 1HA GLY 33 HA2 GLY 33 85.008 -22.558 -5.764 36 2HA GLY 33 HA1 GLY 33 85.700 -20.980 -5.392 37 H GLY 34 HN GLY 34 84.291 -20.265 -3.804 38 1HA GLY 34 HA1 GLY 34 81.417 -20.041 -4.610 39 2HA GLY 34 HA2 GLY 34 81.895 -20.411 -2.953 40 H GLY 35 HN GLY 35 81.873 -18.667 -1.629 41 1HA GLY 35 HA2 GLY 35 82.817 -16.055 -2.677 42 2HA GLY 35 HA1 GLY 35 81.192 -16.120 -1.976 43 H ASN 36 HN ASN 36 84.601 -16.109 -1.286 44 HA ASN 36 HA ASN 36 83.996 -16.273 1.649 45 1HB ASN 36 HB2 ASN 36 85.723 -17.738 0.031 46 2HB ASN 36 HB1 ASN 36 86.784 -16.558 0.800 47 1HD2 ASN 36 HD21 ASN 36 86.312 -19.581 1.302 48 2HD2 ASN 36 HD22 ASN 36 86.044 -19.673 2.975 49 H ALA 37 HN ALA 37 85.297 -14.321 -0.920 50 HA ALA 37 HA ALA 37 85.929 -12.172 1.057 51 1HB ALA 37 HB1 ALA 37 88.020 -11.771 -0.037 52 2HB ALA 37 HB2 ALA 37 87.580 -12.792 -1.405 53 3HB ALA 37 HB3 ALA 37 87.934 -13.521 0.161 54 H VAL 38 HN VAL 38 85.524 -10.058 0.209 55 HA VAL 38 HA VAL 38 84.475 -9.782 -2.558 56 HB VAL 38 HB VAL 38 82.319 -9.061 -1.801 57 1HG1 VAL 38 HG11 VAL 38 82.750 -11.533 -1.723 58 2HG1 VAL 38 HG12 VAL 38 81.489 -11.004 -0.610 59 3HG1 VAL 38 HG13 VAL 38 83.104 -11.368 -0.003 60 1HG2 VAL 38 HG21 VAL 38 83.211 -7.731 0.127 61 2HG2 VAL 38 HG22 VAL 38 83.391 -9.234 1.030 62 3HG2 VAL 38 HG23 VAL 38 81.786 -8.683 0.547 63 H LYS 39 HN LYS 39 84.574 -7.412 -3.272 64 HA LYS 39 HA LYS 39 86.398 -5.908 -1.491 65 1HB LYS 39 HB2 LYS 39 86.198 -6.259 -4.141 66 2HB LYS 39 HB1 LYS 39 85.180 -4.826 -3.992 67 1HG LYS 39 HG2 LYS 39 87.620 -4.308 -4.413 68 2HG LYS 39 HG1 LYS 39 86.983 -3.585 -2.928 69 1HD LYS 39 HD2 LYS 39 88.398 -4.784 -1.645 70 2HD LYS 39 HD1 LYS 39 87.954 -6.285 -2.471 71 1HE LYS 39 HE2 LYS 39 89.887 -4.236 -3.625 72 2HE LYS 39 HE1 LYS 39 90.392 -5.695 -2.752 73 1HZ LYS 39 HZ1 LYS 39 90.207 -6.668 -4.763 74 2HZ LYS 39 HZ2 LYS 39 89.235 -5.429 -5.397 75 3HZ LYS 39 HZ3 LYS 39 88.539 -6.658 -4.454 76 H VAL 40 HN VAL 40 85.347 -4.937 0.201 77 HA VAL 40 HA VAL 40 82.694 -3.674 -0.294 78 HB VAL 40 HB VAL 40 82.684 -3.735 2.260 79 1HG1 VAL 40 HG11 VAL 40 82.834 -6.502 1.881 80 2HG1 VAL 40 HG12 VAL 40 82.396 -5.855 0.299 81 3HG1 VAL 40 HG13 VAL 40 81.396 -5.496 1.706 82 1HG2 VAL 40 HG21 VAL 40 85.290 -4.055 2.176 83 2HG2 VAL 40 HG22 VAL 40 84.878 -5.759 1.980 84 3HG2 VAL 40 HG23 VAL 40 84.348 -4.882 3.417 85 H ARG 41 HN ARG 41 82.497 -1.516 -0.248 86 HA ARG 41 HA ARG 41 84.720 0.138 0.910 87 1HB ARG 41 HB2 ARG 41 82.795 0.696 -1.380 88 2HB ARG 41 HB1 ARG 41 84.068 1.787 -0.830 89 1HG ARG 41 HG2 ARG 41 85.747 0.005 -1.339 90 2HG ARG 41 HG1 ARG 41 84.448 -0.985 -2.003 91 1HD ARG 41 HD2 ARG 41 84.041 1.393 -3.325 92 2HD ARG 41 HD1 ARG 41 85.812 1.352 -3.187 93 HE ARG 41 HE ARG 41 84.472 -1.152 -4.049 94 1HH1 ARG 41 HH11 ARG 41 85.383 1.839 -5.326 95 2HH1 ARG 41 HH12 ARG 41 86.342 1.186 -6.612 96 1HH2 ARG 41 HH21 ARG 41 86.100 -2.086 -5.486 97 2HH2 ARG 41 HH22 ARG 41 86.748 -1.036 -6.702 98 H HIS 42 HN HIS 42 84.003 1.786 2.383 99 HA HIS 42 HA HIS 42 81.034 1.798 2.864 100 1HB HIS 42 HB2 HIS 42 82.947 2.467 5.047 101 2HB HIS 42 HB1 HIS 42 81.415 1.592 5.127 102 HD1 HIS 42 HD1 HIS 42 81.609 -0.863 3.704 103 HD2 HIS 42 HD2 HIS 42 85.063 0.738 5.404 104 HE1 HIS 42 HE1 HIS 42 83.260 -2.773 3.904 105 H ILE 43 HN ILE 43 80.074 3.770 3.320 106 HA ILE 43 HA ILE 43 81.772 6.198 3.424 107 HB ILE 43 HB ILE 43 80.760 5.282 1.052 108 1HG1 ILE 43 HG12 ILE 43 81.100 8.179 1.881 109 2HG1 ILE 43 HG11 ILE 43 82.386 7.101 1.319 110 1HG2 ILE 43 HG21 ILE 43 78.823 6.655 0.441 111 2HG2 ILE 43 HG22 ILE 43 78.762 7.321 2.072 112 3HG2 ILE 43 HG23 ILE 43 78.426 5.615 1.803 113 1HD1 ILE 43 HD11 ILE 43 81.900 7.686 -0.796 114 2HD1 ILE 43 HD12 ILE 43 80.541 8.664 -0.244 115 3HD1 ILE 43 HD13 ILE 43 80.307 6.952 -0.602 116 H LEU 44 HN LEU 44 81.026 7.201 5.287 117 HA LEU 44 HA LEU 44 78.100 7.036 5.906 118 1HB LEU 44 HB2 LEU 44 79.003 6.096 7.779 119 2HB LEU 44 HB1 LEU 44 80.623 6.654 7.350 120 HG LEU 44 HG LEU 44 79.962 8.944 8.188 121 1HD1 LEU 44 HD11 LEU 44 77.410 7.893 8.129 122 2HD1 LEU 44 HD12 LEU 44 77.877 9.363 8.984 123 3HD1 LEU 44 HD13 LEU 44 77.808 7.826 9.846 124 1HD2 LEU 44 HD21 LEU 44 79.687 7.831 10.684 125 2HD2 LEU 44 HD22 LEU 44 81.224 8.057 9.848 126 3HD2 LEU 44 HD23 LEU 44 80.395 6.501 9.767 127 H CYS 45 HN CYS 45 77.081 8.984 6.615 128 HA CYS 45 HA CYS 45 78.655 11.500 6.163 129 1HB CYS 45 HB2 CYS 45 75.724 10.926 5.621 130 2HB CYS 45 HB1 CYS 45 76.590 12.414 5.218 131 HG CYS 45 HG CYS 45 77.102 11.269 3.076 132 H GLU 46 HN GLU 46 79.048 11.456 8.548 133 HA GLU 46 HA GLU 46 77.200 11.267 10.611 134 1HB GLU 46 HB2 GLU 46 79.803 12.094 10.271 135 2HB GLU 46 HB1 GLU 46 79.021 13.584 10.800 136 1HG GLU 46 HG2 GLU 46 77.911 11.923 12.578 137 2HG GLU 46 HG1 GLU 46 79.384 11.004 12.265 138 H LYS 47 HN LYS 47 77.496 13.847 8.241 139 HA LYS 47 HA LYS 47 75.686 15.659 9.697 140 1HB LYS 47 HB2 LYS 47 76.910 15.691 6.918 141 2HB LYS 47 HB1 LYS 47 76.042 17.040 7.650 142 1HG LYS 47 HG2 LYS 47 78.427 15.762 8.995 143 2HG LYS 47 HG1 LYS 47 78.607 17.079 7.837 144 1HD LYS 47 HD2 LYS 47 76.705 18.171 9.375 145 2HD LYS 47 HD1 LYS 47 77.434 17.111 10.581 146 1HE LYS 47 HE2 LYS 47 79.648 18.100 10.143 147 2HE LYS 47 HE1 LYS 47 78.946 19.134 8.885 148 1HZ LYS 47 HZ1 LYS 47 77.648 20.266 10.433 149 2HZ LYS 47 HZ2 LYS 47 79.122 20.074 11.256 150 3HZ LYS 47 HZ3 LYS 47 77.808 19.057 11.614 151 H HIS 48 HN HIS 48 75.412 13.040 7.481 152 HA HIS 48 HA HIS 48 73.554 12.122 6.348 153 1HB HIS 48 HB2 HIS 48 72.383 13.834 8.538 154 2HB HIS 48 HB1 HIS 48 71.339 12.922 7.448 155 HD1 HIS 48 HD1 HIS 48 74.684 11.588 8.518 156 HD2 HIS 48 HD2 HIS 48 70.660 10.986 9.429 157 HE1 HIS 48 HE1 HIS 48 74.578 9.491 9.935 158 H GLY 49 HN GLY 49 74.665 15.024 5.748 159 1HA GLY 49 HA2 GLY 49 72.319 16.002 4.189 160 2HA GLY 49 HA1 GLY 49 73.730 16.980 4.615 161 H LYS 50 HN LYS 50 74.992 14.073 3.772 162 HA LYS 50 HA LYS 50 75.146 14.767 0.857 163 1HB LYS 50 HB2 LYS 50 77.572 14.020 1.116 164 2HB LYS 50 HB1 LYS 50 77.155 15.535 1.916 165 1HG LYS 50 HG2 LYS 50 76.772 13.062 3.509 166 2HG LYS 50 HG1 LYS 50 78.440 13.521 3.179 167 1HD LYS 50 HD2 LYS 50 76.902 15.854 3.916 168 2HD LYS 50 HD1 LYS 50 76.728 14.604 5.150 169 1HE LYS 50 HE2 LYS 50 78.713 15.508 5.908 170 2HE LYS 50 HE1 LYS 50 79.410 14.440 4.669 171 1HZ LYS 50 HZ1 LYS 50 78.702 16.473 3.150 172 2HZ LYS 50 HZ2 LYS 50 80.213 16.424 3.924 173 3HZ LYS 50 HZ3 LYS 50 78.942 17.331 4.594 174 H ILE 51 HN ILE 51 74.876 12.278 3.305 175 HA ILE 51 HA ILE 51 75.648 9.971 1.920 176 HB ILE 51 HB ILE 51 74.672 10.245 4.262 177 1HG1 ILE 51 HG12 ILE 51 73.564 7.987 4.194 178 2HG1 ILE 51 HG11 ILE 51 73.641 8.060 2.427 179 1HG2 ILE 51 HG21 ILE 51 72.283 10.154 4.528 180 2HG2 ILE 51 HG22 ILE 51 72.044 9.937 2.794 181 3HG2 ILE 51 HG23 ILE 51 72.632 11.480 3.418 182 1HD1 ILE 51 HD11 ILE 51 76.077 8.362 4.206 183 2HD1 ILE 51 HD12 ILE 51 76.045 8.123 2.458 184 3HD1 ILE 51 HD13 ILE 51 75.560 6.815 3.537 185 H MET 52 HN MET 52 72.933 12.107 1.304 186 HA MET 52 HA MET 52 71.783 10.236 -0.659 187 1HB MET 52 HB2 MET 52 70.711 12.986 -0.559 188 2HB MET 52 HB1 MET 52 69.866 11.459 -0.413 189 1HG MET 52 HG2 MET 52 69.582 11.935 1.757 190 2HG MET 52 HG1 MET 52 71.293 11.629 1.976 191 1HE MET 52 HE1 MET 52 73.166 13.906 1.357 192 2HE MET 52 HE2 MET 52 72.413 15.374 0.750 193 3HE MET 52 HE3 MET 52 72.168 13.859 -0.099 194 H GLU 53 HN GLU 53 73.738 13.093 -0.476 195 HA GLU 53 HA GLU 53 73.656 13.734 -3.308 196 1HB GLU 53 HB2 GLU 53 74.666 14.829 -0.910 197 2HB GLU 53 HB1 GLU 53 76.098 14.436 -1.862 198 1HG GLU 53 HG2 GLU 53 74.894 15.592 -3.820 199 2HG GLU 53 HG1 GLU 53 73.785 16.229 -2.606 200 H ALA 54 HN ALA 54 75.302 11.641 -1.080 201 HA ALA 54 HA ALA 54 77.463 10.771 -2.811 202 1HB ALA 54 HB1 ALA 54 76.822 10.493 -0.193 203 2HB ALA 54 HB2 ALA 54 77.909 9.371 -1.012 204 3HB ALA 54 HB3 ALA 54 76.209 8.953 -0.795 205 H MET 55 HN MET 55 74.106 9.889 -2.273 206 HA MET 55 HA MET 55 74.099 7.480 -3.890 207 1HB MET 55 HB2 MET 55 71.989 9.485 -3.020 208 2HB MET 55 HB1 MET 55 71.604 7.981 -3.864 209 1HG MET 55 HG2 MET 55 73.348 7.273 -1.752 210 2HG MET 55 HG1 MET 55 72.161 8.392 -1.062 211 1HE MET 55 HE1 MET 55 70.384 5.331 0.130 212 2HE MET 55 HE2 MET 55 70.393 7.087 0.286 213 3HE MET 55 HE3 MET 55 71.911 6.195 0.361 214 H GLU 56 HN GLU 56 73.307 10.903 -4.501 215 HA GLU 56 HA GLU 56 72.715 10.487 -7.327 216 1HB GLU 56 HB2 GLU 56 73.006 12.753 -5.388 217 2HB GLU 56 HB1 GLU 56 73.050 13.125 -7.112 218 1HG GLU 56 HG2 GLU 56 70.909 11.648 -7.248 219 2HG GLU 56 HG1 GLU 56 70.816 11.898 -5.506 220 H LYS 57 HN LYS 57 75.361 12.266 -5.652 221 HA LYS 57 HA LYS 57 77.001 12.783 -7.838 222 1HB LYS 57 HB2 LYS 57 77.485 12.111 -4.952 223 2HB LYS 57 HB1 LYS 57 78.867 12.303 -6.024 224 1HG LYS 57 HG2 LYS 57 77.166 14.463 -6.618 225 2HG LYS 57 HG1 LYS 57 77.176 14.348 -4.856 226 1HD LYS 57 HD2 LYS 57 79.596 14.426 -4.810 227 2HD LYS 57 HD1 LYS 57 79.678 14.328 -6.560 228 1HE LYS 57 HE2 LYS 57 78.842 16.653 -4.841 229 2HE LYS 57 HE1 LYS 57 79.964 16.620 -6.216 230 1HZ LYS 57 HZ1 LYS 57 77.904 17.553 -6.962 231 2HZ LYS 57 HZ2 LYS 57 77.008 16.274 -6.296 232 3HZ LYS 57 HZ3 LYS 57 78.029 16.000 -7.626 233 H LEU 58 HN LEU 58 77.637 10.009 -5.686 234 HA LEU 58 HA LEU 58 79.337 8.512 -7.259 235 1HB LEU 58 HB2 LEU 58 76.957 7.553 -5.625 236 2HB LEU 58 HB1 LEU 58 78.327 6.541 -6.096 237 HG LEU 58 HG LEU 58 78.455 9.023 -4.354 238 1HD1 LEU 58 HD11 LEU 58 77.658 7.289 -2.985 239 2HD1 LEU 58 HD12 LEU 58 79.404 7.188 -2.762 240 3HD1 LEU 58 HD13 LEU 58 78.586 6.059 -3.842 241 1HD2 LEU 58 HD21 LEU 58 80.591 9.141 -5.087 242 2HD2 LEU 58 HD22 LEU 58 80.464 7.591 -5.921 243 3HD2 LEU 58 HD23 LEU 58 80.867 7.639 -4.204 244 H LYS 59 HN LYS 59 75.820 8.844 -7.664 245 HA LYS 59 HA LYS 59 75.581 6.816 -9.736 246 1HB LYS 59 HB2 LYS 59 73.958 8.851 -8.346 247 2HB LYS 59 HB1 LYS 59 73.460 8.560 -10.011 248 1HG LYS 59 HG2 LYS 59 73.877 6.006 -9.121 249 2HG LYS 59 HG1 LYS 59 73.287 6.789 -7.656 250 1HD LYS 59 HD2 LYS 59 71.709 7.664 -9.901 251 2HD LYS 59 HD1 LYS 59 71.758 5.901 -9.875 252 1HE LYS 59 HE2 LYS 59 70.779 5.782 -7.732 253 2HE LYS 59 HE1 LYS 59 71.224 7.454 -7.338 254 1HZ LYS 59 HZ1 LYS 59 68.926 7.441 -7.943 255 2HZ LYS 59 HZ2 LYS 59 69.233 6.540 -9.351 256 3HZ LYS 59 HZ3 LYS 59 69.777 8.145 -9.230 257 H SER 60 HN SER 60 74.783 10.240 -10.130 258 HA SER 60 HA SER 60 74.981 10.647 -12.806 259 1HB SER 60 HB2 SER 60 76.546 12.639 -11.325 260 2HB SER 60 HB1 SER 60 74.992 12.820 -12.141 261 HG SER 60 HG SER 60 75.501 11.805 -9.547 262 H GLY 61 HN GLY 61 77.902 11.149 -10.771 263 1HA GLY 61 HA2 GLY 61 79.844 9.625 -11.675 264 2HA GLY 61 HA1 GLY 61 79.541 10.512 -13.174 265 H MET 62 HN MET 62 79.595 11.696 -9.792 266 HA MET 62 HA MET 62 81.353 13.917 -10.646 267 1HB MET 62 HB2 MET 62 80.796 13.505 -7.766 268 2HB MET 62 HB1 MET 62 80.613 14.955 -8.743 269 1HG MET 62 HG2 MET 62 78.695 12.621 -8.596 270 2HG MET 62 HG1 MET 62 78.438 14.245 -7.979 271 1HE MET 62 HE1 MET 62 75.941 14.648 -10.649 272 2HE MET 62 HE2 MET 62 76.534 15.232 -9.094 273 3HE MET 62 HE3 MET 62 76.229 13.514 -9.324 274 H ARG 63 HN ARG 63 82.585 14.013 -7.944 275 HA ARG 63 HA ARG 63 85.005 12.509 -8.482 276 1HB ARG 63 HB2 ARG 63 83.966 13.871 -5.990 277 2HB ARG 63 HB1 ARG 63 85.660 13.487 -6.335 278 1HG ARG 63 HG2 ARG 63 85.902 15.275 -7.675 279 2HG ARG 63 HG1 ARG 63 84.321 15.056 -8.431 280 1HD ARG 63 HD2 ARG 63 83.397 16.631 -7.069 281 2HD ARG 63 HD1 ARG 63 84.029 15.806 -5.623 282 HE ARG 63 HE ARG 63 86.212 17.062 -6.974 283 1HH1 ARG 63 HH11 ARG 63 84.284 17.349 -4.285 284 2HH1 ARG 63 HH12 ARG 63 84.472 19.062 -4.096 285 1HH2 ARG 63 HH21 ARG 63 86.057 19.492 -7.150 286 2HH2 ARG 63 HH22 ARG 63 85.476 20.274 -5.717 287 H PHE 64 HN PHE 64 85.512 10.472 -7.678 288 HA PHE 64 HA PHE 64 83.469 9.106 -6.019 289 1HB PHE 64 HB2 PHE 64 85.822 8.388 -7.728 290 2HB PHE 64 HB1 PHE 64 85.396 7.272 -6.429 291 HD1 PHE 64 HD1 PHE 64 83.342 6.000 -6.483 292 HD2 PHE 64 HD2 PHE 64 84.199 8.908 -9.526 293 HE1 PHE 64 HE1 PHE 64 81.476 5.115 -7.854 294 HE2 PHE 64 HE2 PHE 64 82.333 8.024 -10.896 295 HZ PHE 64 HZ PHE 64 80.969 6.128 -10.061 296 H ASN 65 HN ASN 65 86.708 10.477 -5.865 297 HA ASN 65 HA ASN 65 87.164 9.383 -3.153 298 1HB ASN 65 HB2 ASN 65 88.737 10.170 -5.356 299 2HB ASN 65 HB1 ASN 65 89.091 11.335 -4.082 300 1HD2 ASN 65 HD21 ASN 65 91.007 9.329 -4.942 301 2HD2 ASN 65 HD22 ASN 65 91.260 8.267 -3.642 302 H GLU 66 HN GLU 66 86.413 12.522 -4.680 303 HA GLU 66 HA GLU 66 86.868 14.122 -2.343 304 1HB GLU 66 HB2 GLU 66 84.823 14.486 -4.553 305 2HB GLU 66 HB1 GLU 66 85.459 15.750 -3.511 306 1HG GLU 66 HG2 GLU 66 87.361 14.078 -5.126 307 2HG GLU 66 HG1 GLU 66 86.498 15.404 -5.901 308 H VAL 67 HN VAL 67 83.742 12.934 -3.677 309 HA VAL 67 HA VAL 67 82.146 13.463 -1.444 310 HB VAL 67 HB VAL 67 80.931 11.323 -2.212 311 1HG1 VAL 67 HG11 VAL 67 81.567 13.402 -4.290 312 2HG1 VAL 67 HG12 VAL 67 80.357 13.569 -3.016 313 3HG1 VAL 67 HG13 VAL 67 80.149 12.352 -4.279 314 1HG2 VAL 67 HG21 VAL 67 82.396 9.923 -3.229 315 2HG2 VAL 67 HG22 VAL 67 83.347 11.234 -3.918 316 3HG2 VAL 67 HG23 VAL 67 81.803 10.786 -4.644 317 H ALA 68 HN ALA 68 83.852 10.390 -2.181 318 HA ALA 68 HA ALA 68 83.464 8.959 0.150 319 1HB ALA 68 HB1 ALA 68 85.593 9.276 -1.883 320 2HB ALA 68 HB2 ALA 68 84.824 7.803 -1.289 321 3HB ALA 68 HB3 ALA 68 86.131 8.549 -0.368 322 H ALA 69 HN ALA 69 85.878 11.527 -0.403 323 HA ALA 69 HA ALA 69 87.238 11.652 1.992 324 1HB ALA 69 HB1 ALA 69 86.944 13.246 -0.166 325 2HB ALA 69 HB2 ALA 69 87.710 13.811 1.318 326 3HB ALA 69 HB3 ALA 69 86.017 14.189 1.002 327 H GLN 70 HN GLN 70 84.261 13.625 1.511 328 HA GLN 70 HA GLN 70 83.825 13.471 4.437 329 1HB GLN 70 HB2 GLN 70 83.094 15.261 2.247 330 2HB GLN 70 HB1 GLN 70 81.739 14.921 3.315 331 1HG GLN 70 HG2 GLN 70 84.418 16.105 4.047 332 2HG GLN 70 HG1 GLN 70 82.813 16.806 4.289 333 1HE2 GLN 70 HE21 GLN 70 81.893 13.934 5.223 334 2HE2 GLN 70 HE22 GLN 70 82.463 13.838 6.816 335 H TYR 71 HN TYR 71 81.900 12.887 1.498 336 HA TYR 71 HA TYR 71 79.535 11.945 2.529 337 1HB TYR 71 HB2 TYR 71 81.239 10.907 0.254 338 2HB TYR 71 HB1 TYR 71 79.632 10.283 0.565 339 HD1 TYR 71 HD1 TYR 71 78.756 11.036 -1.543 340 HD2 TYR 71 HD2 TYR 71 80.459 13.868 1.211 341 HE1 TYR 71 HE1 TYR 71 77.734 12.897 -2.818 342 HE2 TYR 71 HE2 TYR 71 79.437 15.717 -0.068 343 HH TYR 71 HH TYR 71 78.269 15.408 -3.142 344 H SER 72 HN SER 72 82.674 10.384 2.646 345 HA SER 72 HA SER 72 81.552 7.904 3.743 346 1HB SER 72 HB2 SER 72 83.574 8.219 2.169 347 2HB SER 72 HB1 SER 72 84.445 8.721 3.612 348 HG SER 72 HG SER 72 84.666 6.699 4.042 349 H GLU 73 HN GLU 73 82.962 7.109 5.787 350 HA GLU 73 HA GLU 73 82.269 8.837 8.020 351 1HB GLU 73 HB2 GLU 73 83.468 6.962 9.273 352 2HB GLU 73 HB1 GLU 73 82.132 6.434 8.249 353 1HG GLU 73 HG2 GLU 73 83.508 5.246 6.902 354 2HG GLU 73 HG1 GLU 73 84.668 6.569 6.796 355 H ASP 74 HN ASP 74 83.959 10.392 6.528 356 HA ASP 74 HA ASP 74 85.970 11.638 6.699 357 1HB ASP 74 HB2 ASP 74 85.079 11.642 9.065 358 2HB ASP 74 HB1 ASP 74 86.095 10.239 9.391 359 H LYS 75 HN LYS 75 85.840 8.549 6.048 360 HA LYS 75 HA LYS 75 88.809 8.132 6.098 361 1HB LYS 75 HB2 LYS 75 87.690 6.754 7.794 362 2HB LYS 75 HB1 LYS 75 86.550 6.160 6.587 363 1HG LYS 75 HG2 LYS 75 88.014 4.608 5.844 364 2HG LYS 75 HG1 LYS 75 89.315 5.795 5.733 365 1HD LYS 75 HD2 LYS 75 90.241 4.716 7.495 366 2HD LYS 75 HD1 LYS 75 88.983 5.475 8.470 367 1HE LYS 75 HE2 LYS 75 87.671 3.541 8.516 368 2HE LYS 75 HE1 LYS 75 88.362 2.917 7.005 369 1HZ LYS 75 HZ1 LYS 75 90.123 3.388 9.316 370 2HZ LYS 75 HZ2 LYS 75 90.291 2.270 8.047 371 3HZ LYS 75 HZ3 LYS 75 89.171 1.984 9.292 372 H ALA 76 HN ALA 76 86.164 8.664 4.211 373 HA ALA 76 HA ALA 76 85.837 8.474 1.887 374 1HB ALA 76 HB1 ALA 76 88.206 7.038 1.180 375 2HB ALA 76 HB2 ALA 76 88.613 8.226 2.418 376 3HB ALA 76 HB3 ALA 76 87.838 8.742 0.920 377 H ARG 77 HN ARG 77 84.987 6.942 0.462 378 HA ARG 77 HA ARG 77 84.687 4.189 1.568 379 1HB ARG 77 HB2 ARG 77 82.622 5.287 1.145 380 2HB ARG 77 HB1 ARG 77 83.199 5.965 -0.374 381 1HG ARG 77 HG2 ARG 77 83.386 3.538 -1.196 382 2HG ARG 77 HG1 ARG 77 82.434 3.104 0.225 383 1HD ARG 77 HD2 ARG 77 81.172 5.354 -1.019 384 2HD ARG 77 HD1 ARG 77 81.480 4.135 -2.267 385 HE ARG 77 HE ARG 77 80.377 3.143 0.296 386 1HH1 ARG 77 HH21 ARG 77 79.483 4.660 -2.623 387 2HH1 ARG 77 HH22 ARG 77 78.163 3.587 -2.953 388 1HH2 ARG 77 HH11 ARG 77 78.847 1.502 -0.269 389 2HH2 ARG 77 HH12 ARG 77 77.803 1.797 -1.619 390 H GLN 78 HN GLN 78 84.974 5.690 -1.679 391 HA GLN 78 HA GLN 78 85.963 3.320 -2.973 392 1HB GLN 78 HB2 GLN 78 86.064 6.293 -3.547 393 2HB GLN 78 HB1 GLN 78 86.667 5.089 -4.694 394 1HG GLN 78 HG2 GLN 78 84.544 4.965 -5.467 395 2HG GLN 78 HG1 GLN 78 84.162 4.110 -3.972 396 1HE2 GLN 78 HE21 GLN 78 83.209 5.385 -2.193 397 2HE2 GLN 78 HE22 GLN 78 82.488 6.891 -2.497 398 H GLY 79 HN GLY 79 87.770 6.360 -2.421 399 1HA GLY 79 HA2 GLY 79 90.348 5.153 -2.617 400 2HA GLY 79 HA1 GLY 79 90.020 6.708 -1.844 401 H GLY 80 HN GLY 80 87.967 5.128 -0.155 402 1HA GLY 80 HA1 GLY 80 89.901 4.366 1.957 403 2HA GLY 80 HA2 GLY 80 88.176 4.658 2.193 404 H ASP 81 HN ASP 81 88.277 2.876 -0.543 405 HA ASP 81 HA ASP 81 87.009 0.593 0.268 406 1HB ASP 81 HB2 ASP 81 87.568 1.106 -2.047 407 2HB ASP 81 HB1 ASP 81 89.290 0.870 -1.717 408 H LEU 82 HN LEU 82 87.642 -0.161 2.347 409 HA LEU 82 HA LEU 82 90.092 -0.621 3.488 410 1HB LEU 82 HB2 LEU 82 87.493 -2.110 3.420 411 2HB LEU 82 HB1 LEU 82 88.848 -2.830 4.288 412 HG LEU 82 HG LEU 82 89.112 -0.646 5.522 413 1HD1 LEU 82 HD11 LEU 82 86.547 -0.057 4.028 414 2HD1 LEU 82 HD12 LEU 82 88.034 0.892 4.034 415 3HD1 LEU 82 HD13 LEU 82 87.030 0.818 5.480 416 1HD2 LEU 82 HD21 LEU 82 86.758 -2.465 5.708 417 2HD2 LEU 82 HD22 LEU 82 86.711 -0.995 6.680 418 3HD2 LEU 82 HD23 LEU 82 88.029 -2.148 6.890 419 H GLY 83 HN GLY 83 88.583 -2.634 0.965 420 1HA GLY 83 HA2 GLY 83 90.168 -3.625 -0.706 421 2HA GLY 83 HA1 GLY 83 91.219 -4.022 0.661 422 H TRP 84 HN TRP 84 90.944 -6.239 -0.400 423 HA TRP 84 HA TRP 84 88.619 -7.759 -0.554 424 1HB TRP 84 HB2 TRP 84 91.494 -8.242 0.101 425 2HB TRP 84 HB1 TRP 84 90.376 -9.583 0.339 426 HD1 TRP 84 HD1 TRP 84 92.463 -8.144 -2.217 427 HE1 TRP 84 HE1 TRP 84 91.710 -8.844 -4.585 428 HE3 TRP 84 HE3 TRP 84 87.856 -10.022 -1.135 429 HZ2 TRP 84 HZ2 TRP 84 89.435 -10.048 -5.848 430 HZ3 TRP 84 HZ3 TRP 84 86.417 -10.939 -2.925 431 HH2 TRP 84 HH2 TRP 84 87.191 -10.952 -5.281 432 H MET 85 HN MET 85 87.326 -8.900 0.938 433 HA MET 85 HA MET 85 88.037 -8.776 3.827 434 1HB MET 85 HB2 MET 85 85.808 -7.357 2.407 435 2HB MET 85 HB1 MET 85 85.525 -7.942 4.046 436 1HG MET 85 HG2 MET 85 87.869 -6.196 3.242 437 2HG MET 85 HG1 MET 85 86.382 -5.586 3.966 438 1HE MET 85 HE1 MET 85 87.556 -5.287 7.366 439 2HE MET 85 HE2 MET 85 86.371 -4.915 6.116 440 3HE MET 85 HE3 MET 85 88.064 -4.495 5.868 441 H THR 86 HN THR 86 87.334 -10.635 4.864 442 HA THR 86 HA THR 86 85.522 -12.438 3.309 443 HB THR 86 HB THR 86 86.687 -14.112 4.973 444 HG1 THR 86 HG1 THR 86 88.684 -13.384 5.642 445 1HG2 THR 86 HG21 THR 86 87.621 -14.717 3.033 446 2HG2 THR 86 HG22 THR 86 88.805 -13.419 3.195 447 3HG2 THR 86 HG23 THR 86 87.274 -13.121 2.371 448 H ARG 87 HN ARG 87 83.829 -13.489 4.442 449 HA ARG 87 HA ARG 87 82.522 -11.993 6.507 450 1HB ARG 87 HB2 ARG 87 81.741 -13.781 4.718 451 2HB ARG 87 HB1 ARG 87 82.036 -14.918 6.033 452 1HG ARG 87 HG2 ARG 87 80.549 -13.576 7.501 453 2HG ARG 87 HG1 ARG 87 80.223 -12.487 6.152 454 1HD ARG 87 HD2 ARG 87 78.400 -14.053 6.168 455 2HD ARG 87 HD1 ARG 87 79.470 -14.604 4.864 456 HE ARG 87 HE ARG 87 80.197 -15.737 7.448 457 1HH1 ARG 87 HH11 ARG 87 77.184 -16.081 6.370 458 2HH1 ARG 87 HH12 ARG 87 77.302 -17.724 5.835 459 1HH2 ARG 87 HH21 ARG 87 80.763 -17.825 6.051 460 2HH2 ARG 87 HH22 ARG 87 79.328 -18.713 5.656 461 H GLY 88 HN GLY 88 84.083 -11.771 8.253 462 1HA GLY 88 HA2 GLY 88 83.874 -13.691 10.330 463 2HA GLY 88 HA1 GLY 88 85.413 -13.969 9.502 464 H SER 89 HN SER 89 85.811 -11.149 8.827 465 HA SER 89 HA SER 89 86.639 -10.189 11.534 466 1HB SER 89 HB2 SER 89 88.119 -10.636 9.352 467 2HB SER 89 HB1 SER 89 87.586 -8.996 8.955 468 HG SER 89 HG SER 89 88.675 -9.684 11.471 469 H MET 90 HN MET 90 84.480 -9.533 8.927 470 HA MET 90 HA MET 90 84.221 -6.681 9.187 471 1HB MET 90 HB2 MET 90 83.406 -8.483 7.423 472 2HB MET 90 HB1 MET 90 81.956 -8.497 8.427 473 1HG MET 90 HG2 MET 90 81.289 -6.678 7.262 474 2HG MET 90 HG1 MET 90 82.537 -5.787 8.132 475 1HE MET 90 HE1 MET 90 83.073 -8.460 4.761 476 2HE MET 90 HE2 MET 90 82.068 -7.219 4.014 477 3HE MET 90 HE3 MET 90 81.537 -7.992 5.505 478 H VAL 91 HN VAL 91 81.184 -6.982 9.513 479 HA VAL 91 HA VAL 91 81.140 -7.217 12.507 480 HB VAL 91 HB VAL 91 79.325 -5.375 10.969 481 1HG1 VAL 91 HG11 VAL 91 78.801 -4.769 13.070 482 2HG1 VAL 91 HG12 VAL 91 80.471 -4.275 13.344 483 3HG1 VAL 91 HG13 VAL 91 79.971 -5.928 13.699 484 1HG2 VAL 91 HG21 VAL 91 82.236 -4.850 11.637 485 2HG2 VAL 91 HG22 VAL 91 81.076 -3.578 11.253 486 3HG2 VAL 91 HG23 VAL 91 81.483 -4.794 10.043 487 H GLY 92 HN GLY 92 78.250 -6.713 12.538 488 1HA GLY 92 HA2 GLY 92 77.367 -9.416 11.721 489 2HA GLY 92 HA1 GLY 92 76.476 -8.311 12.777 490 HA PRO 93 HA PRO 93 73.918 -6.972 9.491 491 1HB PRO 93 HB2 PRO 93 74.322 -4.154 9.920 492 2HB PRO 93 HB1 PRO 93 72.963 -5.156 10.454 493 1HG PRO 93 HG2 PRO 93 75.064 -4.022 12.058 494 2HG PRO 93 HG1 PRO 93 73.708 -5.018 12.591 495 1HD PRO 93 HD2 PRO 93 76.492 -5.760 12.427 496 2HD PRO 93 HD1 PRO 93 75.124 -6.766 12.957 497 H PHE 94 HN PHE 94 76.948 -5.102 9.786 498 HA PHE 94 HA PHE 94 77.196 -3.953 7.269 499 1HB PHE 94 HB2 PHE 94 78.771 -4.351 9.451 500 2HB PHE 94 HB1 PHE 94 79.566 -5.425 8.292 501 HD1 PHE 94 HD1 PHE 94 80.261 -4.487 6.034 502 HD2 PHE 94 HD2 PHE 94 79.008 -1.996 9.299 503 HE1 PHE 94 HE1 PHE 94 81.323 -2.528 4.945 504 HE2 PHE 94 HE2 PHE 94 80.069 -0.036 8.211 505 HZ PHE 94 HZ PHE 94 81.227 -0.302 6.035 506 H GLN 95 HN GLN 95 77.858 -7.347 8.151 507 HA GLN 95 HA GLN 95 78.708 -8.123 5.484 508 1HB GLN 95 HB2 GLN 95 77.797 -9.621 7.959 509 2HB GLN 95 HB1 GLN 95 78.467 -10.410 6.532 510 1HG GLN 95 HG2 GLN 95 80.518 -8.986 6.778 511 2HG GLN 95 HG1 GLN 95 79.852 -8.361 8.287 512 1HE2 GLN 95 HE21 GLN 95 78.637 -10.972 9.058 513 2HE2 GLN 95 HE22 GLN 95 79.930 -11.973 9.515 514 H GLU 96 HN GLU 96 75.755 -8.865 7.385 515 HA GLU 96 HA GLU 96 74.237 -10.283 5.581 516 1HB GLU 96 HB2 GLU 96 73.800 -8.407 7.776 517 2HB GLU 96 HB1 GLU 96 72.465 -8.391 6.624 518 1HG GLU 96 HG2 GLU 96 73.571 -11.035 7.496 519 2HG GLU 96 HG1 GLU 96 72.514 -10.156 8.602 520 H ALA 97 HN ALA 97 73.581 -6.793 5.812 521 HA ALA 97 HA ALA 97 72.271 -6.346 3.444 522 1HB ALA 97 HB1 ALA 97 73.928 -4.862 5.312 523 2HB ALA 97 HB2 ALA 97 72.475 -4.339 4.459 524 3HB ALA 97 HB3 ALA 97 74.053 -4.196 3.684 525 H ALA 98 HN ALA 98 75.766 -6.800 3.793 526 HA ALA 98 HA ALA 98 76.184 -6.326 0.890 527 1HB ALA 98 HB1 ALA 98 78.589 -7.062 2.071 528 2HB ALA 98 HB2 ALA 98 77.721 -6.266 3.384 529 3HB ALA 98 HB3 ALA 98 78.011 -5.408 1.870 530 H PHE 99 HN PHE 99 77.746 -8.743 2.978 531 HA PHE 99 HA PHE 99 78.230 -10.721 1.110 532 1HB PHE 99 HB2 PHE 99 77.668 -10.596 4.027 533 2HB PHE 99 HB1 PHE 99 77.607 -12.204 3.292 534 HD1 PHE 99 HD1 PHE 99 79.618 -12.328 1.318 535 HD2 PHE 99 HD2 PHE 99 79.719 -10.183 5.038 536 HE1 PHE 99 HE1 PHE 99 82.098 -12.413 1.301 537 HE2 PHE 99 HE2 PHE 99 82.198 -10.266 5.021 538 HZ PHE 99 HZ PHE 99 83.387 -11.382 3.152 539 H ALA 100 HN ALA 100 75.120 -9.937 2.576 540 HA ALA 100 HA ALA 100 73.827 -12.360 1.482 541 1HB ALA 100 HB1 ALA 100 72.026 -11.690 2.835 542 2HB ALA 100 HB2 ALA 100 72.445 -9.981 2.706 543 3HB ALA 100 HB3 ALA 100 73.414 -11.053 3.718 544 H LEU 101 HN LEU 101 74.778 -9.458 0.175 545 HA LEU 101 HA LEU 101 72.497 -9.430 -1.766 546 1HB LEU 101 HB2 LEU 101 74.099 -7.306 -0.359 547 2HB LEU 101 HB1 LEU 101 73.301 -6.938 -1.890 548 HG LEU 101 HG LEU 101 71.983 -7.969 0.639 549 1HD1 LEU 101 HD11 LEU 101 71.013 -5.524 -0.671 550 2HD1 LEU 101 HD12 LEU 101 72.666 -5.397 -0.070 551 3HD1 LEU 101 HD13 LEU 101 71.357 -5.827 1.032 552 1HD2 LEU 101 HD21 LEU 101 69.878 -7.528 -0.808 553 2HD2 LEU 101 HD22 LEU 101 70.792 -9.005 -1.118 554 3HD2 LEU 101 HD23 LEU 101 70.978 -7.612 -2.183 555 HA PRO 102 HA PRO 102 75.290 -9.890 -5.134 556 1HB PRO 102 HB2 PRO 102 74.574 -7.458 -6.496 557 2HB PRO 102 HB1 PRO 102 74.016 -9.104 -6.838 558 1HG PRO 102 HG2 PRO 102 72.550 -6.927 -5.627 559 2HG PRO 102 HG1 PRO 102 71.966 -8.545 -6.042 560 1HD PRO 102 HD2 PRO 102 72.449 -7.490 -3.422 561 2HD PRO 102 HD1 PRO 102 71.983 -9.157 -3.845 562 H VAL 103 HN VAL 103 77.003 -8.494 -6.450 563 HA VAL 103 HA VAL 103 78.383 -6.712 -4.482 564 HB VAL 103 HB VAL 103 79.145 -9.041 -5.839 565 1HG1 VAL 103 HG11 VAL 103 79.586 -7.948 -7.923 566 2HG1 VAL 103 HG12 VAL 103 81.153 -8.198 -7.149 567 3HG1 VAL 103 HG13 VAL 103 80.395 -6.602 -7.119 568 1HG2 VAL 103 HG21 VAL 103 81.397 -7.415 -4.962 569 2HG2 VAL 103 HG22 VAL 103 80.764 -8.912 -4.279 570 3HG2 VAL 103 HG23 VAL 103 80.061 -7.364 -3.816 571 H SER 104 HN SER 104 78.518 -4.568 -5.037 572 HA SER 104 HA SER 104 79.127 -3.482 -7.561 573 1HB SER 104 HB2 SER 104 76.364 -4.454 -7.198 574 2HB SER 104 HB1 SER 104 76.482 -2.818 -7.850 575 HG SER 104 HG SER 104 77.041 -3.666 -9.662 576 H GLY 105 HN GLY 105 77.095 -3.036 -4.650 577 1HA GLY 105 HA2 GLY 105 76.604 -1.098 -3.410 578 2HA GLY 105 HA1 GLY 105 78.307 -0.758 -3.677 579 H MET 106 HN MET 106 77.392 1.500 -3.567 580 HA MET 106 HA MET 106 77.252 3.523 -4.758 581 1HB MET 106 HB2 MET 106 78.367 2.116 -6.558 582 2HB MET 106 HB1 MET 106 76.749 1.814 -7.190 583 1HG MET 106 HG2 MET 106 77.014 4.623 -6.702 584 2HG MET 106 HG1 MET 106 78.403 4.081 -7.657 585 1HE MET 106 HE1 MET 106 78.384 3.458 -10.049 586 2HE MET 106 HE2 MET 106 78.037 5.166 -9.783 587 3HE MET 106 HE3 MET 106 77.160 4.279 -11.028 588 H ASP 107 HN ASP 107 74.994 2.085 -3.538 589 HA ASP 107 HA ASP 107 72.620 2.074 -3.547 590 1HB ASP 107 HB2 ASP 107 71.890 4.458 -3.651 591 2HB ASP 107 HB1 ASP 107 73.353 4.238 -2.692 592 H LYS 108 HN LYS 108 72.445 0.682 -5.560 593 HA LYS 108 HA LYS 108 70.503 1.711 -7.334 594 1HB LYS 108 HB2 LYS 108 73.081 2.695 -7.846 595 2HB LYS 108 HB1 LYS 108 72.792 1.472 -9.089 596 1HG LYS 108 HG2 LYS 108 70.484 3.228 -8.564 597 2HG LYS 108 HG1 LYS 108 71.891 4.065 -9.218 598 1HD LYS 108 HD2 LYS 108 71.802 1.784 -10.763 599 2HD LYS 108 HD1 LYS 108 70.091 2.134 -10.514 600 1HE LYS 108 HE2 LYS 108 70.410 4.427 -11.342 601 2HE LYS 108 HE1 LYS 108 72.150 4.131 -11.529 602 1HZ LYS 108 HZ1 LYS 108 69.890 2.922 -12.998 603 2HZ LYS 108 HZ2 LYS 108 71.359 2.079 -12.855 604 3HZ LYS 108 HZ3 LYS 108 71.319 3.598 -13.615 605 HA PRO 109 HA PRO 109 72.201 -2.412 -9.151 606 1HB PRO 109 HB2 PRO 109 74.394 -3.307 -7.524 607 2HB PRO 109 HB1 PRO 109 74.429 -2.827 -9.229 608 1HG PRO 109 HG2 PRO 109 75.562 -1.437 -7.028 609 2HG PRO 109 HG1 PRO 109 75.463 -0.879 -8.698 610 1HD PRO 109 HD2 PRO 109 73.930 0.006 -6.368 611 2HD PRO 109 HD1 PRO 109 74.041 0.737 -7.988 612 H VAL 110 HN VAL 110 73.521 -2.859 -5.878 613 HA VAL 110 HA VAL 110 72.107 -5.141 -5.119 614 HB VAL 110 HB VAL 110 73.978 -3.901 -3.947 615 1HG1 VAL 110 HG11 VAL 110 72.398 -1.748 -4.059 616 2HG1 VAL 110 HG12 VAL 110 73.600 -1.948 -2.784 617 3HG1 VAL 110 HG13 VAL 110 71.909 -2.338 -2.471 618 1HG2 VAL 110 HG21 VAL 110 72.220 -5.672 -2.940 619 2HG2 VAL 110 HG22 VAL 110 71.870 -4.305 -1.882 620 3HG2 VAL 110 HG23 VAL 110 73.506 -4.961 -1.965 621 H PHE 111 HN PHE 111 70.380 -5.007 -3.155 622 HA PHE 111 HA PHE 111 68.131 -3.336 -4.193 623 1HB PHE 111 HB2 PHE 111 68.337 -5.976 -2.739 624 2HB PHE 111 HB1 PHE 111 66.793 -5.133 -2.945 625 HD1 PHE 111 HD1 PHE 111 69.679 -6.610 -4.784 626 HD2 PHE 111 HD2 PHE 111 65.643 -5.156 -5.030 627 HE1 PHE 111 HE1 PHE 111 69.496 -7.505 -7.090 628 HE2 PHE 111 HE2 PHE 111 65.461 -6.052 -7.335 629 HZ PHE 111 HZ PHE 111 67.387 -7.226 -8.365 630 H THR 112 HN THR 112 69.546 -4.479 -1.107 631 HA THR 112 HA THR 112 67.857 -3.159 0.701 632 HB THR 112 HB THR 112 69.827 -4.722 1.135 633 HG1 THR 112 HG1 THR 112 69.746 -4.066 3.131 634 1HG2 THR 112 HG21 THR 112 71.406 -2.149 1.165 635 2HG2 THR 112 HG22 THR 112 71.434 -3.268 -0.198 636 3HG2 THR 112 HG23 THR 112 72.020 -3.787 1.385 637 H ASP 113 HN ASP 113 69.137 -1.329 2.167 638 HA ASP 113 HA ASP 113 69.267 1.041 0.361 639 1HB ASP 113 HB2 ASP 113 69.011 2.231 2.595 640 2HB ASP 113 HB1 ASP 113 67.671 1.165 2.174 641 HA PRO 114 HA PRO 114 73.665 0.973 0.789 642 1HB PRO 114 HB2 PRO 114 73.828 3.798 0.296 643 2HB PRO 114 HB1 PRO 114 74.183 2.464 -0.819 644 1HG PRO 114 HG2 PRO 114 71.929 4.239 -0.877 645 2HG PRO 114 HG1 PRO 114 72.256 2.871 -1.939 646 1HD PRO 114 HD2 PRO 114 70.252 3.068 0.139 647 2HD PRO 114 HD1 PRO 114 70.542 1.723 -0.989 648 HA PRO 115 HA PRO 115 74.118 4.322 4.248 649 1HB PRO 115 HB2 PRO 115 71.488 5.288 4.898 650 2HB PRO 115 HB1 PRO 115 72.850 6.200 4.236 651 1HG PRO 115 HG2 PRO 115 70.428 5.473 2.903 652 2HG PRO 115 HG1 PRO 115 71.830 6.308 2.217 653 1HD PRO 115 HD2 PRO 115 70.961 3.560 1.775 654 2HD PRO 115 HD1 PRO 115 72.277 4.445 0.983 655 H VAL 116 HN VAL 116 74.158 1.909 4.975 656 HA VAL 116 HA VAL 116 71.832 1.051 6.581 657 HB VAL 116 HB VAL 116 73.063 -1.014 6.708 658 1HG1 VAL 116 HG11 VAL 116 72.432 -1.305 4.558 659 2HG1 VAL 116 HG12 VAL 116 74.050 -0.774 4.097 660 3HG1 VAL 116 HG13 VAL 116 72.734 0.393 4.189 661 1HG2 VAL 116 HG21 VAL 116 75.229 -0.007 7.326 662 2HG2 VAL 116 HG22 VAL 116 75.432 0.554 5.666 663 3HG2 VAL 116 HG23 VAL 116 75.413 -1.174 6.016 664 H LYS 117 HN LYS 117 71.959 0.752 8.873 665 HA LYS 117 HA LYS 117 74.059 2.412 10.190 666 1HB LYS 117 HB2 LYS 117 71.381 2.525 10.317 667 2HB LYS 117 HB1 LYS 117 71.664 1.358 11.617 668 1HG LYS 117 HG2 LYS 117 73.571 3.176 12.225 669 2HG LYS 117 HG1 LYS 117 72.383 4.243 11.465 670 1HD LYS 117 HD2 LYS 117 71.843 4.158 13.809 671 2HD LYS 117 HD1 LYS 117 70.631 3.180 12.969 672 1HE LYS 117 HE2 LYS 117 72.815 1.448 13.556 673 2HE LYS 117 HE1 LYS 117 72.454 2.354 15.039 674 1HZ LYS 117 HZ1 LYS 117 71.039 0.308 14.593 675 2HZ LYS 117 HZ2 LYS 117 70.328 1.192 13.328 676 3HZ LYS 117 HZ3 LYS 117 70.200 1.743 14.931 677 H THR 118 HN THR 118 75.387 1.538 11.763 678 HA THR 118 HA THR 118 74.958 -0.897 13.187 679 HB THR 118 HB THR 118 75.072 -1.998 11.059 680 HG1 THR 118 HG1 THR 118 77.034 -3.154 11.277 681 1HG2 THR 118 HG21 THR 118 77.501 -0.254 10.574 682 2HG2 THR 118 HG22 THR 118 75.964 -0.201 9.710 683 3HG2 THR 118 HG23 THR 118 77.030 -1.594 9.529 684 H LYS 119 HN LYS 119 76.158 1.833 13.425 685 HA LYS 119 HA LYS 119 78.496 1.107 14.998 686 1HB LYS 119 HB2 LYS 119 78.729 1.760 12.175 687 2HB LYS 119 HB1 LYS 119 79.642 2.900 13.164 688 1HG LYS 119 HG2 LYS 119 80.345 0.609 14.396 689 2HG LYS 119 HG1 LYS 119 80.047 -0.026 12.774 690 1HD LYS 119 HD2 LYS 119 81.668 1.419 11.800 691 2HD LYS 119 HD1 LYS 119 81.752 2.425 13.246 692 1HE LYS 119 HE2 LYS 119 83.390 1.108 14.095 693 2HE LYS 119 HE1 LYS 119 82.358 -0.325 13.928 694 1HZ LYS 119 HZ1 LYS 119 82.882 -0.206 11.484 695 2HZ LYS 119 HZ2 LYS 119 84.186 -0.648 12.477 696 3HZ LYS 119 HZ3 LYS 119 84.082 0.932 11.861 697 H PHE 120 HN PHE 120 77.890 4.067 13.086 698 HA PHE 120 HA PHE 120 77.062 5.476 15.587 699 1HB PHE 120 HB2 PHE 120 79.625 5.549 14.294 700 2HB PHE 120 HB1 PHE 120 78.866 7.139 14.135 701 HD1 PHE 120 HD1 PHE 120 80.586 4.882 16.339 702 HD2 PHE 120 HD2 PHE 120 77.869 8.208 16.254 703 HE1 PHE 120 HE1 PHE 120 81.115 5.375 18.712 704 HE2 PHE 120 HE2 PHE 120 78.397 8.701 18.627 705 HZ PHE 120 HZ PHE 120 80.020 7.284 19.856 706 H GLY 121 HN GLY 121 76.026 4.719 12.680 707 1HA GLY 121 HA2 GLY 121 74.099 6.661 12.325 708 2HA GLY 121 HA1 GLY 121 75.508 7.338 11.495 709 H TYR 122 HN TYR 122 74.656 7.115 9.386 710 HA TYR 122 HA TYR 122 74.112 4.300 8.491 711 1HB TYR 122 HB2 TYR 122 73.273 6.899 7.179 712 2HB TYR 122 HB1 TYR 122 72.630 5.286 6.874 713 HD1 TYR 122 HD1 TYR 122 71.903 8.288 8.437 714 HD2 TYR 122 HD2 TYR 122 71.870 4.064 9.219 715 HE1 TYR 122 HE1 TYR 122 70.204 8.629 10.211 716 HE2 TYR 122 HE2 TYR 122 70.172 4.405 10.993 717 HH TYR 122 HH TYR 122 69.365 7.524 12.188 718 H HIS 123 HN HIS 123 75.324 3.513 6.745 719 HA HIS 123 HA HIS 123 77.126 5.426 5.326 720 1HB HIS 123 HB2 HIS 123 79.001 3.844 5.699 721 2HB HIS 123 HB1 HIS 123 78.348 4.439 7.224 722 HD1 HIS 123 HD1 HIS 123 78.409 1.371 5.029 723 HD2 HIS 123 HD2 HIS 123 77.127 2.475 8.840 724 HE1 HIS 123 HE1 HIS 123 77.814 -0.776 6.235 725 H ILE 124 HN ILE 124 77.692 4.707 3.182 726 HA ILE 124 HA ILE 124 75.805 2.733 2.050 727 HB ILE 124 HB ILE 124 77.941 4.329 0.603 728 1HG1 ILE 124 HG12 ILE 124 75.127 5.228 1.336 729 2HG1 ILE 124 HG11 ILE 124 76.610 5.858 2.065 730 1HG2 ILE 124 HG21 ILE 124 76.950 3.504 -1.232 731 2HG2 ILE 124 HG22 ILE 124 75.378 4.088 -0.691 732 3HG2 ILE 124 HG23 ILE 124 75.945 2.493 -0.194 733 1HD1 ILE 124 HD11 ILE 124 75.369 6.881 -0.205 734 2HD1 ILE 124 HD12 ILE 124 76.675 5.899 -0.872 735 3HD1 ILE 124 HD13 ILE 124 77.039 7.187 0.275 736 H ILE 125 HN ILE 125 76.408 0.622 1.986 737 HA ILE 125 HA ILE 125 79.271 -0.128 2.046 738 HB ILE 125 HB ILE 125 76.591 -1.417 2.463 739 1HG1 ILE 125 HG12 ILE 125 79.234 -1.467 3.957 740 2HG1 ILE 125 HG11 ILE 125 77.831 -0.466 4.362 741 1HG2 ILE 125 HG21 ILE 125 77.342 -3.180 1.188 742 2HG2 ILE 125 HG22 ILE 125 78.145 -3.587 2.705 743 3HG2 ILE 125 HG23 ILE 125 79.040 -2.767 1.425 744 1HD1 ILE 125 HD11 ILE 125 77.767 -3.498 4.243 745 2HD1 ILE 125 HD12 ILE 125 76.497 -2.430 4.843 746 3HD1 ILE 125 HD13 ILE 125 78.014 -2.580 5.730 747 H MET 126 HN MET 126 80.294 -1.148 0.284 748 HA MET 126 HA MET 126 78.673 -1.636 -2.151 749 1HB MET 126 HB2 MET 126 79.553 0.312 -2.955 750 2HB MET 126 HB1 MET 126 80.638 0.446 -1.571 751 1HG MET 126 HG2 MET 126 82.359 -0.695 -2.631 752 2HG MET 126 HG1 MET 126 81.267 -1.534 -3.741 753 1HE MET 126 HE1 MET 126 82.248 2.873 -3.643 754 2HE MET 126 HE2 MET 126 81.587 1.823 -2.393 755 3HE MET 126 HE3 MET 126 80.513 2.530 -3.597 756 H VAL 127 HN VAL 127 78.943 -3.874 -2.160 757 HA VAL 127 HA VAL 127 81.613 -5.064 -1.650 758 HB VAL 127 HB VAL 127 79.050 -6.406 -2.562 759 1HG1 VAL 127 HG11 VAL 127 81.168 -7.378 -0.642 760 2HG1 VAL 127 HG12 VAL 127 81.289 -7.626 -2.383 761 3HG1 VAL 127 HG13 VAL 127 79.947 -8.334 -1.484 762 1HG2 VAL 127 HG21 VAL 127 78.219 -5.216 -0.729 763 2HG2 VAL 127 HG22 VAL 127 79.767 -5.241 0.115 764 3HG2 VAL 127 HG23 VAL 127 78.782 -6.702 0.037 765 H GLU 128 HN GLU 128 83.006 -5.486 -3.429 766 HA GLU 128 HA GLU 128 81.747 -5.859 -6.072 767 1HB GLU 128 HB2 GLU 128 82.068 -3.425 -5.684 768 2HB GLU 128 HB1 GLU 128 83.796 -3.713 -5.439 769 1HG GLU 128 HG2 GLU 128 83.956 -3.346 -7.680 770 2HG GLU 128 HG1 GLU 128 83.348 -5.001 -7.826 771 H GLY 129 HN GLY 129 82.702 -7.906 -6.172 772 1HA GLY 129 HA2 GLY 129 84.591 -8.972 -7.364 773 2HA GLY 129 HA1 GLY 129 85.664 -7.925 -6.424 774 H ARG 130 HN ARG 130 83.701 -10.808 -6.355 775 HA ARG 130 HA ARG 130 84.752 -11.311 -3.620 776 1HB ARG 130 HB2 ARG 130 82.551 -12.845 -4.971 777 2HB ARG 130 HB1 ARG 130 82.826 -12.634 -3.248 778 1HG ARG 130 HG2 ARG 130 82.175 -10.305 -3.365 779 2HG ARG 130 HG1 ARG 130 82.089 -10.370 -5.126 780 1HD ARG 130 HD2 ARG 130 80.379 -12.143 -3.356 781 2HD ARG 130 HD1 ARG 130 79.838 -10.557 -3.937 782 HE ARG 130 HE ARG 130 80.934 -12.278 -6.043 783 1HH1 ARG 130 HH21 ARG 130 78.461 -13.400 -4.420 784 2HH1 ARG 130 HH22 ARG 130 77.196 -12.992 -5.532 785 1HH2 ARG 130 HH11 ARG 130 79.178 -10.854 -7.412 786 2HH2 ARG 130 HH12 ARG 130 77.603 -11.551 -7.226 787 H LYS 131 HN LYS 131 85.475 -13.569 -3.181 788 HA LYS 131 HA LYS 131 86.788 -14.749 -5.594 789 1HB LYS 131 HB2 LYS 131 87.487 -14.214 -2.821 790 2HB LYS 131 HB1 LYS 131 87.784 -15.903 -3.234 791 1HG LYS 131 HG2 LYS 131 89.601 -15.331 -4.436 792 2HG LYS 131 HG1 LYS 131 88.647 -14.207 -5.404 793 1HD LYS 131 HD2 LYS 131 90.045 -12.671 -4.422 794 2HD LYS 131 HD1 LYS 131 88.843 -12.764 -3.134 795 1HE LYS 131 HE2 LYS 131 90.581 -13.339 -1.773 796 2HE LYS 131 HE1 LYS 131 90.558 -14.913 -2.605 797 1HZ LYS 131 HZ1 LYS 131 92.109 -14.159 -4.186 798 2HZ LYS 131 HZ2 LYS 131 92.725 -13.616 -2.699 799 3HZ LYS 131 HZ3 LYS 131 91.925 -12.534 -3.736 Start of MODEL 3 1 1H GLY 28 HT1 GLY 28 96.773 -35.169 -7.510 2 2H GLY 28 HT2 GLY 28 95.368 -34.611 -6.735 3 3H GLY 28 HT3 GLY 28 96.871 -33.898 -6.391 4 1HA GLY 28 HA2 GLY 28 96.854 -33.451 -8.968 5 2HA GLY 28 HA1 GLY 28 95.113 -33.530 -8.697 6 H SER 29 HN SER 29 95.355 -31.159 -9.332 7 HA SER 29 HA SER 29 95.178 -29.501 -6.966 8 1HB SER 29 HB2 SER 29 97.513 -29.539 -6.825 9 2HB SER 29 HB1 SER 29 97.712 -29.645 -8.575 10 HG SER 29 HG SER 29 97.946 -27.511 -7.201 11 H GLY 30 HN GLY 30 94.232 -27.493 -7.496 12 1HA GLY 30 HA2 GLY 30 94.212 -26.545 -10.270 13 2HA GLY 30 HA1 GLY 30 92.653 -27.135 -9.696 14 HA PRO 31 HA PRO 31 93.158 -22.597 -8.642 15 1HB PRO 31 HB2 PRO 31 90.387 -22.348 -9.382 16 2HB PRO 31 HB1 PRO 31 91.803 -21.660 -10.198 17 1HG PRO 31 HG2 PRO 31 90.134 -23.835 -11.073 18 2HG PRO 31 HG1 PRO 31 91.533 -23.142 -11.894 19 1HD PRO 31 HD2 PRO 31 91.344 -25.704 -10.585 20 2HD PRO 31 HD1 PRO 31 92.762 -24.996 -11.392 21 H LYS 32 HN LYS 32 93.182 -22.987 -6.381 22 HA LYS 32 HA LYS 32 90.791 -24.080 -5.041 23 1HB LYS 32 HB2 LYS 32 93.592 -23.901 -4.603 24 2HB LYS 32 HB1 LYS 32 92.815 -23.022 -3.287 25 1HG LYS 32 HG2 LYS 32 91.207 -25.179 -3.354 26 2HG LYS 32 HG1 LYS 32 92.683 -25.919 -3.974 27 1HD LYS 32 HD2 LYS 32 92.923 -26.182 -1.654 28 2HD LYS 32 HD1 LYS 32 93.832 -24.703 -1.963 29 1HE LYS 32 HE2 LYS 32 91.065 -24.015 -1.561 30 2HE LYS 32 HE1 LYS 32 91.619 -25.022 -0.209 31 1HZ LYS 32 HZ1 LYS 32 93.751 -23.542 -0.485 32 2HZ LYS 32 HZ2 LYS 32 92.432 -22.992 0.434 33 3HZ LYS 32 HZ3 LYS 32 92.651 -22.440 -1.158 34 H GLY 33 HN GLY 33 89.688 -22.862 -3.332 35 1HA GLY 33 HA2 GLY 33 89.848 -20.452 -2.260 36 2HA GLY 33 HA1 GLY 33 89.596 -19.951 -3.932 37 H GLY 34 HN GLY 34 87.894 -19.893 -1.331 38 1HA GLY 34 HA1 GLY 34 85.420 -20.953 -2.634 39 2HA GLY 34 HA2 GLY 34 85.708 -21.181 -0.909 40 H GLY 35 HN GLY 35 86.154 -18.351 -3.056 41 1HA GLY 35 HA1 GLY 35 85.521 -16.110 -2.695 42 2HA GLY 35 HA2 GLY 35 83.947 -16.823 -2.315 43 H ASN 36 HN ASN 36 83.219 -16.321 -0.308 44 HA ASN 36 HA ASN 36 83.240 -15.818 2.005 45 1HB ASN 36 HB2 ASN 36 85.007 -17.843 1.558 46 2HB ASN 36 HB1 ASN 36 86.080 -16.631 2.256 47 1HD2 ASN 36 HD21 ASN 36 85.489 -19.004 3.708 48 2HD2 ASN 36 HD22 ASN 36 84.533 -18.603 5.052 49 H ALA 37 HN ALA 37 84.664 -14.087 -0.240 50 HA ALA 37 HA ALA 37 85.610 -12.000 1.653 51 1HB ALA 37 HB1 ALA 37 87.314 -12.692 -0.727 52 2HB ALA 37 HB2 ALA 37 87.455 -13.680 0.727 53 3HB ALA 37 HB3 ALA 37 87.791 -11.950 0.800 54 H VAL 38 HN VAL 38 85.401 -9.875 0.646 55 HA VAL 38 HA VAL 38 84.438 -9.778 -2.166 56 HB VAL 38 HB VAL 38 82.323 -8.842 -1.545 57 1HG1 VAL 38 HG11 VAL 38 82.576 -11.323 -1.254 58 2HG1 VAL 38 HG12 VAL 38 81.339 -10.621 -0.211 59 3HG1 VAL 38 HG13 VAL 38 82.916 -11.045 0.454 60 1HG2 VAL 38 HG21 VAL 38 82.305 -7.456 0.238 61 2HG2 VAL 38 HG22 VAL 38 83.796 -8.154 0.868 62 3HG2 VAL 38 HG23 VAL 38 82.244 -8.891 1.260 63 H LYS 39 HN LYS 39 84.639 -7.589 -3.146 64 HA LYS 39 HA LYS 39 86.506 -5.913 -1.567 65 1HB LYS 39 HB2 LYS 39 86.653 -6.503 -4.035 66 2HB LYS 39 HB1 LYS 39 85.247 -5.463 -4.282 67 1HG LYS 39 HG2 LYS 39 87.457 -4.302 -4.676 68 2HG LYS 39 HG1 LYS 39 86.468 -3.536 -3.423 69 1HD LYS 39 HD2 LYS 39 87.987 -3.998 -1.808 70 2HD LYS 39 HD1 LYS 39 88.183 -5.663 -2.368 71 1HE LYS 39 HE2 LYS 39 90.306 -4.798 -2.843 72 2HE LYS 39 HE1 LYS 39 89.478 -4.451 -4.373 73 1HZ LYS 39 HZ1 LYS 39 89.249 -2.555 -2.133 74 2HZ LYS 39 HZ2 LYS 39 89.150 -2.260 -3.803 75 3HZ LYS 39 HZ3 LYS 39 90.659 -2.538 -3.075 76 H VAL 40 HN VAL 40 85.176 -5.015 0.080 77 HA VAL 40 HA VAL 40 82.695 -3.606 -0.715 78 HB VAL 40 HB VAL 40 82.944 -5.246 1.212 79 1HG1 VAL 40 HG11 VAL 40 85.181 -4.123 1.881 80 2HG1 VAL 40 HG12 VAL 40 84.078 -4.586 3.177 81 3HG1 VAL 40 HG13 VAL 40 84.174 -2.902 2.661 82 1HG2 VAL 40 HG21 VAL 40 81.764 -2.515 1.309 83 2HG2 VAL 40 HG22 VAL 40 81.825 -3.403 2.831 84 3HG2 VAL 40 HG23 VAL 40 80.975 -4.086 1.445 85 H ARG 41 HN ARG 41 82.360 -1.435 -0.389 86 HA ARG 41 HA ARG 41 84.704 0.276 0.387 87 1HB ARG 41 HB2 ARG 41 82.495 1.028 -1.541 88 2HB ARG 41 HB1 ARG 41 84.098 1.738 -1.395 89 1HG ARG 41 HG2 ARG 41 84.929 -0.671 -2.022 90 2HG ARG 41 HG1 ARG 41 83.296 -0.870 -2.655 91 1HD ARG 41 HD2 ARG 41 83.584 0.844 -4.265 92 2HD ARG 41 HD1 ARG 41 84.983 1.529 -3.405 93 HE ARG 41 HE ARG 41 85.461 -1.235 -4.122 94 1HH1 ARG 41 HH11 ARG 41 84.411 0.721 -6.450 95 2HH1 ARG 41 HH12 ARG 41 85.923 0.982 -7.252 96 1HH2 ARG 41 HH21 ARG 41 87.825 -0.364 -4.685 97 2HH2 ARG 41 HH22 ARG 41 87.853 0.368 -6.255 98 H HIS 42 HN HIS 42 84.028 2.176 1.740 99 HA HIS 42 HA HIS 42 81.138 1.974 2.545 100 1HB HIS 42 HB2 HIS 42 81.753 1.870 4.821 101 2HB HIS 42 HB1 HIS 42 82.875 0.783 3.997 102 HD1 HIS 42 HD1 HIS 42 83.205 2.709 6.693 103 HD2 HIS 42 HD2 HIS 42 85.075 3.062 2.985 104 HE1 HIS 42 HE1 HIS 42 85.330 4.013 7.087 105 H ILE 43 HN ILE 43 80.074 3.839 2.622 106 HA ILE 43 HA ILE 43 81.588 6.418 2.875 107 HB ILE 43 HB ILE 43 79.908 5.390 0.793 108 1HG1 ILE 43 HG12 ILE 43 81.119 8.114 1.326 109 2HG1 ILE 43 HG11 ILE 43 81.824 6.801 0.378 110 1HG2 ILE 43 HG21 ILE 43 77.942 6.176 1.967 111 2HG2 ILE 43 HG22 ILE 43 78.257 7.265 0.621 112 3HG2 ILE 43 HG23 ILE 43 78.692 7.742 2.262 113 1HD1 ILE 43 HD11 ILE 43 79.670 8.719 -0.347 114 2HD1 ILE 43 HD12 ILE 43 79.474 7.063 -0.921 115 3HD1 ILE 43 HD13 ILE 43 80.911 7.985 -1.363 116 H LEU 44 HN LEU 44 81.131 7.167 4.952 117 HA LEU 44 HA LEU 44 78.365 6.705 5.994 118 1HB LEU 44 HB2 LEU 44 79.553 5.703 7.610 119 2HB LEU 44 HB1 LEU 44 81.066 6.289 6.939 120 HG LEU 44 HG LEU 44 81.258 7.969 8.483 121 1HD1 LEU 44 HD11 LEU 44 79.418 9.424 8.264 122 2HD1 LEU 44 HD12 LEU 44 79.179 8.735 9.861 123 3HD1 LEU 44 HD13 LEU 44 78.253 8.121 8.501 124 1HD2 LEU 44 HD21 LEU 44 80.698 5.628 9.479 125 2HD2 LEU 44 HD22 LEU 44 79.178 6.398 9.947 126 3HD2 LEU 44 HD23 LEU 44 80.714 7.019 10.570 127 H CYS 45 HN CYS 45 77.348 8.488 7.010 128 HA CYS 45 HA CYS 45 78.579 11.152 6.342 129 1HB CYS 45 HB2 CYS 45 75.664 10.313 6.251 130 2HB CYS 45 HB1 CYS 45 76.315 11.883 5.758 131 HG CYS 45 HG CYS 45 76.567 10.797 3.537 132 H GLU 46 HN GLU 46 76.592 9.294 8.608 133 HA GLU 46 HA GLU 46 76.219 9.676 10.920 134 1HB GLU 46 HB2 GLU 46 78.640 10.664 10.510 135 2HB GLU 46 HB1 GLU 46 77.818 12.214 10.692 136 1HG GLU 46 HG2 GLU 46 76.851 11.341 12.861 137 2HG GLU 46 HG1 GLU 46 77.908 9.940 12.694 138 H LYS 47 HN LYS 47 76.375 12.789 9.154 139 HA LYS 47 HA LYS 47 73.952 13.762 10.527 140 1HB LYS 47 HB2 LYS 47 75.677 14.932 8.315 141 2HB LYS 47 HB1 LYS 47 74.485 15.815 9.270 142 1HG LYS 47 HG2 LYS 47 75.867 14.968 11.318 143 2HG LYS 47 HG1 LYS 47 77.143 14.696 10.132 144 1HD LYS 47 HD2 LYS 47 76.227 17.224 9.478 145 2HD LYS 47 HD1 LYS 47 76.130 17.218 11.238 146 1HE LYS 47 HE2 LYS 47 78.534 16.210 11.149 147 2HE LYS 47 HE1 LYS 47 78.556 16.827 9.486 148 1HZ LYS 47 HZ1 LYS 47 77.784 18.431 11.870 149 2HZ LYS 47 HZ2 LYS 47 77.957 18.998 10.279 150 3HZ LYS 47 HZ3 LYS 47 79.320 18.481 11.152 151 H HIS 48 HN HIS 48 74.817 12.095 7.645 152 HA HIS 48 HA HIS 48 73.504 11.291 5.861 153 1HB HIS 48 HB2 HIS 48 71.210 12.379 7.515 154 2HB HIS 48 HB1 HIS 48 71.158 11.049 6.357 155 HD1 HIS 48 HD1 HIS 48 74.174 10.241 7.675 156 HD2 HIS 48 HD2 HIS 48 70.402 10.262 9.450 157 HE1 HIS 48 HE1 HIS 48 74.316 8.685 9.668 158 H GLY 49 HN GLY 49 74.106 14.395 6.452 159 1HA GLY 49 HA2 GLY 49 72.144 15.752 4.794 160 2HA GLY 49 HA1 GLY 49 73.687 16.430 5.335 161 H LYS 50 HN LYS 50 75.106 14.004 4.233 162 HA LYS 50 HA LYS 50 75.011 14.777 1.333 163 1HB LYS 50 HB2 LYS 50 77.423 14.236 1.359 164 2HB LYS 50 HB1 LYS 50 77.043 15.457 2.574 165 1HG LYS 50 HG2 LYS 50 76.837 12.648 3.490 166 2HG LYS 50 HG1 LYS 50 78.469 13.200 3.105 167 1HD LYS 50 HD2 LYS 50 77.088 15.259 4.573 168 2HD LYS 50 HD1 LYS 50 76.971 13.737 5.457 169 1HE LYS 50 HE2 LYS 50 79.072 14.232 6.210 170 2HE LYS 50 HE1 LYS 50 79.617 13.758 4.586 171 1HZ LYS 50 HZ1 LYS 50 79.243 16.018 3.832 172 2HZ LYS 50 HZ2 LYS 50 80.308 16.031 5.156 173 3HZ LYS 50 HZ3 LYS 50 78.683 16.477 5.366 174 H ILE 51 HN ILE 51 74.494 12.240 3.559 175 HA ILE 51 HA ILE 51 75.337 9.923 2.235 176 HB ILE 51 HB ILE 51 74.018 10.215 4.414 177 1HG1 ILE 51 HG12 ILE 51 72.807 8.031 4.118 178 2HG1 ILE 51 HG11 ILE 51 73.158 8.127 2.386 179 1HG2 ILE 51 HG21 ILE 51 71.664 10.134 2.508 180 2HG2 ILE 51 HG22 ILE 51 72.213 11.591 3.336 181 3HG2 ILE 51 HG23 ILE 51 71.598 10.225 4.268 182 1HD1 ILE 51 HD11 ILE 51 74.820 6.741 3.651 183 2HD1 ILE 51 HD12 ILE 51 75.267 8.180 4.568 184 3HD1 ILE 51 HD13 ILE 51 75.552 8.118 2.828 185 H MET 52 HN MET 52 72.760 12.173 1.389 186 HA MET 52 HA MET 52 71.877 10.473 -0.841 187 1HB MET 52 HB2 MET 52 69.963 11.702 -0.662 188 2HB MET 52 HB1 MET 52 70.665 12.298 0.840 189 1HG MET 52 HG2 MET 52 70.199 14.296 -0.243 190 2HG MET 52 HG1 MET 52 71.857 14.009 -0.760 191 1HE MET 52 HE1 MET 52 71.559 15.040 -4.001 192 2HE MET 52 HE2 MET 52 72.381 13.504 -3.743 193 3HE MET 52 HE3 MET 52 72.422 14.739 -2.486 194 H GLU 53 HN GLU 53 73.762 13.368 -0.265 195 HA GLU 53 HA GLU 53 74.117 14.133 -3.018 196 1HB GLU 53 HB2 GLU 53 74.851 15.051 -0.477 197 2HB GLU 53 HB1 GLU 53 76.385 14.599 -1.222 198 1HG GLU 53 HG2 GLU 53 75.652 15.918 -3.264 199 2HG GLU 53 HG1 GLU 53 74.303 16.515 -2.295 200 H ALA 54 HN ALA 54 75.424 11.788 -0.806 201 HA ALA 54 HA ALA 54 77.709 10.985 -2.440 202 1HB ALA 54 HB1 ALA 54 76.641 10.479 0.109 203 2HB ALA 54 HB2 ALA 54 78.077 9.719 -0.578 204 3HB ALA 54 HB3 ALA 54 76.504 8.936 -0.735 205 H MET 55 HN MET 55 74.292 10.240 -2.207 206 HA MET 55 HA MET 55 74.333 7.913 -3.968 207 1HB MET 55 HB2 MET 55 72.156 9.869 -3.137 208 2HB MET 55 HB1 MET 55 71.870 8.324 -3.946 209 1HG MET 55 HG2 MET 55 73.537 7.700 -1.778 210 2HG MET 55 HG1 MET 55 72.366 8.861 -1.136 211 1HE MET 55 HE1 MET 55 70.945 5.581 0.104 212 2HE MET 55 HE2 MET 55 70.573 7.288 0.347 213 3HE MET 55 HE3 MET 55 72.252 6.758 0.296 214 H GLU 56 HN GLU 56 73.512 11.367 -4.363 215 HA GLU 56 HA GLU 56 72.986 11.189 -7.203 216 1HB GLU 56 HB2 GLU 56 73.559 13.400 -5.220 217 2HB GLU 56 HB1 GLU 56 73.257 13.740 -6.923 218 1HG GLU 56 HG2 GLU 56 71.378 12.153 -5.149 219 2HG GLU 56 HG1 GLU 56 71.194 13.872 -5.494 220 H LYS 57 HN LYS 57 75.709 12.736 -5.427 221 HA LYS 57 HA LYS 57 77.414 13.379 -7.498 222 1HB LYS 57 HB2 LYS 57 77.857 12.185 -4.764 223 2HB LYS 57 HB1 LYS 57 79.231 12.578 -5.793 224 1HG LYS 57 HG2 LYS 57 77.635 14.845 -5.967 225 2HG LYS 57 HG1 LYS 57 77.478 14.364 -4.280 226 1HD LYS 57 HD2 LYS 57 79.756 14.615 -3.854 227 2HD LYS 57 HD1 LYS 57 80.201 14.376 -5.544 228 1HE LYS 57 HE2 LYS 57 80.007 16.600 -6.005 229 2HE LYS 57 HE1 LYS 57 78.485 16.734 -5.105 230 1HZ LYS 57 HZ1 LYS 57 79.591 17.000 -3.114 231 2HZ LYS 57 HZ2 LYS 57 80.632 17.830 -4.167 232 3HZ LYS 57 HZ3 LYS 57 81.010 16.252 -3.664 233 H LEU 58 HN LEU 58 77.934 10.303 -5.761 234 HA LEU 58 HA LEU 58 79.496 8.955 -7.609 235 1HB LEU 58 HB2 LEU 58 77.390 8.204 -5.622 236 2HB LEU 58 HB1 LEU 58 77.984 6.933 -6.700 237 HG LEU 58 HG LEU 58 80.349 7.777 -6.023 238 1HD1 LEU 58 HD11 LEU 58 78.693 8.849 -3.718 239 2HD1 LEU 58 HD12 LEU 58 79.530 9.842 -4.910 240 3HD1 LEU 58 HD13 LEU 58 80.453 8.823 -3.806 241 1HD2 LEU 58 HD21 LEU 58 80.442 6.108 -4.398 242 2HD2 LEU 58 HD22 LEU 58 78.963 5.670 -5.252 243 3HD2 LEU 58 HD23 LEU 58 78.872 6.540 -3.720 244 H LYS 59 HN LYS 59 76.008 9.538 -7.787 245 HA LYS 59 HA LYS 59 75.589 7.755 -10.075 246 1HB LYS 59 HB2 LYS 59 74.041 9.632 -8.351 247 2HB LYS 59 HB1 LYS 59 73.385 9.306 -9.956 248 1HG LYS 59 HG2 LYS 59 74.236 6.815 -8.912 249 2HG LYS 59 HG1 LYS 59 73.345 7.620 -7.622 250 1HD LYS 59 HD2 LYS 59 71.798 6.321 -9.010 251 2HD LYS 59 HD1 LYS 59 71.477 8.044 -9.207 252 1HE LYS 59 HE2 LYS 59 72.852 8.037 -11.290 253 2HE LYS 59 HE1 LYS 59 73.078 6.287 -11.105 254 1HZ LYS 59 HZ1 LYS 59 71.166 6.685 -12.495 255 2HZ LYS 59 HZ2 LYS 59 70.489 7.738 -11.345 256 3HZ LYS 59 HZ3 LYS 59 70.630 6.079 -11.004 257 H SER 60 HN SER 60 74.756 11.214 -9.875 258 HA SER 60 HA SER 60 74.699 11.923 -12.517 259 1HB SER 60 HB2 SER 60 76.192 13.960 -11.237 260 2HB SER 60 HB1 SER 60 74.441 13.872 -11.406 261 HG SER 60 HG SER 60 75.915 12.586 -9.357 262 H GLY 61 HN GLY 61 77.596 11.119 -10.685 263 1HA GLY 61 HA2 GLY 61 79.541 10.233 -11.902 264 2HA GLY 61 HA1 GLY 61 79.152 11.345 -13.224 265 H MET 62 HN MET 62 79.000 12.372 -9.871 266 HA MET 62 HA MET 62 80.817 14.574 -10.351 267 1HB MET 62 HB2 MET 62 78.850 13.873 -8.541 268 2HB MET 62 HB1 MET 62 80.315 13.755 -7.571 269 1HG MET 62 HG2 MET 62 80.685 15.999 -7.628 270 2HG MET 62 HG1 MET 62 80.197 16.132 -9.312 271 1HE MET 62 HE1 MET 62 77.932 14.982 -9.745 272 2HE MET 62 HE2 MET 62 76.692 16.222 -9.581 273 3HE MET 62 HE3 MET 62 76.654 14.805 -8.535 274 H ARG 63 HN ARG 63 82.110 14.226 -7.653 275 HA ARG 63 HA ARG 63 84.515 12.848 -8.577 276 1HB ARG 63 HB2 ARG 63 83.680 14.046 -5.919 277 2HB ARG 63 HB1 ARG 63 85.325 13.549 -6.340 278 1HG ARG 63 HG2 ARG 63 85.668 15.352 -7.676 279 2HG ARG 63 HG1 ARG 63 83.998 15.382 -8.252 280 1HD ARG 63 HD2 ARG 63 83.398 16.901 -6.664 281 2HD ARG 63 HD1 ARG 63 84.182 15.955 -5.378 282 HE ARG 63 HE ARG 63 86.374 16.945 -6.492 283 1HH1 ARG 63 HH11 ARG 63 83.753 18.615 -7.617 284 2HH1 ARG 63 HH12 ARG 63 84.192 20.153 -6.954 285 1HH2 ARG 63 HH21 ARG 63 86.762 18.880 -5.006 286 2HH2 ARG 63 HH22 ARG 63 85.893 20.302 -5.478 287 H PHE 64 HN PHE 64 84.983 10.715 -8.185 288 HA PHE 64 HA PHE 64 83.167 9.149 -6.443 289 1HB PHE 64 HB2 PHE 64 84.781 8.752 -8.785 290 2HB PHE 64 HB1 PHE 64 85.346 7.642 -7.537 291 HD1 PHE 64 HD1 PHE 64 82.906 7.073 -6.019 292 HD2 PHE 64 HD2 PHE 64 83.473 7.464 -10.258 293 HE1 PHE 64 HE1 PHE 64 80.935 5.622 -6.416 294 HE2 PHE 64 HE2 PHE 64 81.500 6.012 -10.655 295 HZ PHE 64 HZ PHE 64 80.231 5.092 -8.734 296 H ASN 65 HN ASN 65 86.457 10.395 -6.592 297 HA ASN 65 HA ASN 65 87.285 8.924 -4.163 298 1HB ASN 65 HB2 ASN 65 88.498 9.956 -6.473 299 2HB ASN 65 HB1 ASN 65 89.078 10.987 -5.165 300 1HD2 ASN 65 HD21 ASN 65 91.239 9.975 -5.351 301 2HD2 ASN 65 HD22 ASN 65 91.515 8.418 -4.736 302 H GLU 66 HN GLU 66 86.436 12.243 -5.140 303 HA GLU 66 HA GLU 66 87.276 13.493 -2.672 304 1HB GLU 66 HB2 GLU 66 85.085 14.350 -4.585 305 2HB GLU 66 HB1 GLU 66 86.043 15.389 -3.535 306 1HG GLU 66 HG2 GLU 66 87.599 13.689 -5.398 307 2HG GLU 66 HG1 GLU 66 86.639 14.962 -6.151 308 H VAL 67 HN VAL 67 84.068 12.466 -3.903 309 HA VAL 67 HA VAL 67 82.639 13.003 -1.501 310 HB VAL 67 HB VAL 67 81.001 11.425 -2.492 311 1HG1 VAL 67 HG11 VAL 67 82.303 12.951 -4.737 312 2HG1 VAL 67 HG12 VAL 67 81.388 13.755 -3.461 313 3HG1 VAL 67 HG13 VAL 67 80.588 12.594 -4.523 314 1HG2 VAL 67 HG21 VAL 67 82.380 9.644 -3.208 315 2HG2 VAL 67 HG22 VAL 67 83.351 10.716 -4.218 316 3HG2 VAL 67 HG23 VAL 67 81.691 10.336 -4.677 317 H ALA 68 HN ALA 68 84.189 9.993 -2.712 318 HA ALA 68 HA ALA 68 83.637 8.310 -0.511 319 1HB ALA 68 HB1 ALA 68 85.776 8.567 -2.606 320 2HB ALA 68 HB2 ALA 68 84.620 7.261 -2.354 321 3HB ALA 68 HB3 ALA 68 86.025 7.412 -1.299 322 H ALA 69 HN ALA 69 85.918 10.918 -0.963 323 HA ALA 69 HA ALA 69 87.567 10.392 1.330 324 1HB ALA 69 HB1 ALA 69 88.450 12.535 0.834 325 2HB ALA 69 HB2 ALA 69 86.916 13.111 0.187 326 3HB ALA 69 HB3 ALA 69 87.879 11.952 -0.728 327 H GLN 70 HN GLN 70 85.232 13.119 0.997 328 HA GLN 70 HA GLN 70 84.874 13.014 3.894 329 1HB GLN 70 HB2 GLN 70 84.932 14.979 1.910 330 2HB GLN 70 HB1 GLN 70 83.298 14.993 2.568 331 1HG GLN 70 HG2 GLN 70 85.790 14.899 4.263 332 2HG GLN 70 HG1 GLN 70 84.939 16.406 3.882 333 1HE2 GLN 70 HE21 GLN 70 84.409 13.168 5.483 334 2HE2 GLN 70 HE22 GLN 70 83.145 13.714 6.465 335 H TYR 71 HN TYR 71 82.681 12.866 1.050 336 HA TYR 71 HA TYR 71 80.252 12.740 2.402 337 1HB TYR 71 HB2 TYR 71 81.295 11.342 -0.060 338 2HB TYR 71 HB1 TYR 71 79.636 11.116 0.468 339 HD1 TYR 71 HD1 TYR 71 78.656 12.227 -1.459 340 HD2 TYR 71 HD2 TYR 71 81.478 14.290 1.050 341 HE1 TYR 71 HE1 TYR 71 78.000 14.384 -2.484 342 HE2 TYR 71 HE2 TYR 71 80.817 16.438 0.021 343 HH TYR 71 HH TYR 71 78.889 17.392 -1.153 344 H SER 72 HN SER 72 82.789 10.345 2.241 345 HA SER 72 HA SER 72 81.242 8.174 3.429 346 1HB SER 72 HB2 SER 72 84.220 8.673 3.171 347 2HB SER 72 HB1 SER 72 83.464 7.113 3.495 348 HG SER 72 HG SER 72 83.373 6.936 1.421 349 H GLU 73 HN GLU 73 82.500 11.046 4.675 350 HA GLU 73 HA GLU 73 83.346 11.691 6.814 351 1HB GLU 73 HB2 GLU 73 80.682 11.294 6.488 352 2HB GLU 73 HB1 GLU 73 80.997 10.257 7.881 353 1HG GLU 73 HG2 GLU 73 82.224 12.968 7.897 354 2HG GLU 73 HG1 GLU 73 80.482 12.880 8.145 355 H ASP 74 HN ASP 74 84.833 9.456 6.242 356 HA ASP 74 HA ASP 74 85.424 8.372 8.843 357 1HB ASP 74 HB2 ASP 74 84.465 6.159 8.599 358 2HB ASP 74 HB1 ASP 74 83.191 7.321 8.274 359 H LYS 75 HN LYS 75 86.048 5.671 7.437 360 HA LYS 75 HA LYS 75 88.765 6.286 6.691 361 1HB LYS 75 HB2 LYS 75 87.149 4.043 7.270 362 2HB LYS 75 HB1 LYS 75 87.790 3.766 5.653 363 1HG LYS 75 HG2 LYS 75 89.474 2.891 7.044 364 2HG LYS 75 HG1 LYS 75 90.063 4.516 6.687 365 1HD LYS 75 HD2 LYS 75 90.060 4.997 8.885 366 2HD LYS 75 HD1 LYS 75 88.326 4.687 8.949 367 1HE LYS 75 HE2 LYS 75 88.654 2.709 10.017 368 2HE LYS 75 HE1 LYS 75 89.866 2.202 8.823 369 1HZ LYS 75 HZ1 LYS 75 90.223 3.836 11.258 370 2HZ LYS 75 HZ2 LYS 75 91.302 4.006 9.957 371 3HZ LYS 75 HZ3 LYS 75 91.130 2.504 10.732 372 H ALA 76 HN ALA 76 85.890 6.725 4.996 373 HA ALA 76 HA ALA 76 85.556 7.466 2.778 374 1HB ALA 76 HB1 ALA 76 88.398 6.900 2.080 375 2HB ALA 76 HB2 ALA 76 88.095 8.120 3.316 376 3HB ALA 76 HB3 ALA 76 87.412 8.313 1.701 377 H ARG 77 HN ARG 77 85.091 6.462 0.774 378 HA ARG 77 HA ARG 77 85.658 3.521 0.681 379 1HB ARG 77 HB2 ARG 77 83.581 3.384 -0.555 380 2HB ARG 77 HB1 ARG 77 83.288 4.409 0.847 381 1HG ARG 77 HG2 ARG 77 83.363 6.395 -0.454 382 2HG ARG 77 HG1 ARG 77 84.108 5.572 -1.815 383 1HD ARG 77 HD2 ARG 77 81.495 6.121 -1.828 384 2HD ARG 77 HD1 ARG 77 82.102 4.608 -2.519 385 HE ARG 77 HE ARG 77 81.500 4.513 0.365 386 1HH1 ARG 77 HH21 ARG 77 79.650 4.813 -2.410 387 2HH1 ARG 77 HH22 ARG 77 78.762 3.341 -2.194 388 1HH2 ARG 77 HH11 ARG 77 80.708 2.250 0.463 389 2HH2 ARG 77 HH12 ARG 77 79.362 1.889 -0.565 390 H GLN 78 HN GLN 78 85.210 3.024 -1.993 391 HA GLN 78 HA GLN 78 86.459 3.006 -4.010 392 1HB GLN 78 HB2 GLN 78 85.334 5.636 -3.377 393 2HB GLN 78 HB1 GLN 78 86.713 5.740 -4.477 394 1HG GLN 78 HG2 GLN 78 84.406 5.423 -5.562 395 2HG GLN 78 HG1 GLN 78 85.679 4.319 -6.080 396 1HE2 GLN 78 HE21 GLN 78 83.846 4.180 -3.000 397 2HE2 GLN 78 HE22 GLN 78 83.137 2.669 -3.306 398 H GLY 79 HN GLY 79 87.845 6.122 -3.130 399 1HA GLY 79 HA2 GLY 79 90.534 5.261 -3.488 400 2HA GLY 79 HA1 GLY 79 90.056 6.722 -2.615 401 H GLY 80 HN GLY 80 88.308 5.047 -0.854 402 1HA GLY 80 HA1 GLY 80 90.378 4.256 1.103 403 2HA GLY 80 HA2 GLY 80 88.650 4.453 1.438 404 H ASP 81 HN ASP 81 87.395 2.890 -0.305 405 HA ASP 81 HA ASP 81 86.652 0.618 -0.281 406 1HB ASP 81 HB2 ASP 81 88.177 1.258 -2.282 407 2HB ASP 81 HB1 ASP 81 89.392 0.247 -1.486 408 H LEU 82 HN LEU 82 86.649 -0.121 1.910 409 HA LEU 82 HA LEU 82 88.659 -0.687 3.678 410 1HB LEU 82 HB2 LEU 82 86.320 -2.463 2.905 411 2HB LEU 82 HB1 LEU 82 87.192 -2.555 4.430 412 HG LEU 82 HG LEU 82 85.551 -1.150 5.154 413 1HD1 LEU 82 HD11 LEU 82 87.674 0.258 4.990 414 2HD1 LEU 82 HD12 LEU 82 86.160 1.155 5.102 415 3HD1 LEU 82 HD13 LEU 82 86.966 0.979 3.544 416 1HD2 LEU 82 HD21 LEU 82 83.886 -0.831 3.689 417 2HD2 LEU 82 HD22 LEU 82 84.986 -1.052 2.330 418 3HD2 LEU 82 HD23 LEU 82 84.779 0.546 3.045 419 H GLY 83 HN GLY 83 88.025 -2.411 0.673 420 1HA GLY 83 HA2 GLY 83 89.705 -3.683 -0.491 421 2HA GLY 83 HA1 GLY 83 90.583 -3.864 1.035 422 H TRP 84 HN TRP 84 90.471 -6.177 -0.059 423 HA TRP 84 HA TRP 84 88.160 -7.776 -0.092 424 1HB TRP 84 HB2 TRP 84 91.089 -8.166 0.388 425 2HB TRP 84 HB1 TRP 84 90.021 -9.536 0.658 426 HD1 TRP 84 HD1 TRP 84 91.800 -7.752 -1.984 427 HE1 TRP 84 HE1 TRP 84 91.045 -8.554 -4.318 428 HE3 TRP 84 HE3 TRP 84 87.653 -10.404 -0.683 429 HZ2 TRP 84 HZ2 TRP 84 88.951 -10.132 -5.473 430 HZ3 TRP 84 HZ3 TRP 84 86.298 -11.548 -2.411 431 HH2 TRP 84 HH2 TRP 84 86.931 -11.417 -4.798 432 H MET 85 HN MET 85 86.916 -8.741 1.502 433 HA MET 85 HA MET 85 87.888 -8.671 4.324 434 1HB MET 85 HB2 MET 85 85.391 -7.430 3.150 435 2HB MET 85 HB1 MET 85 85.515 -7.813 4.867 436 1HG MET 85 HG2 MET 85 87.915 -6.473 4.145 437 2HG MET 85 HG1 MET 85 86.582 -5.544 3.459 438 1HE MET 85 HE1 MET 85 88.430 -5.542 7.222 439 2HE MET 85 HE2 MET 85 88.154 -4.009 6.401 440 3HE MET 85 HE3 MET 85 88.824 -5.370 5.507 441 H THR 86 HN THR 86 87.416 -10.619 5.307 442 HA THR 86 HA THR 86 85.478 -12.414 3.911 443 HB THR 86 HB THR 86 86.841 -14.101 5.401 444 HG1 THR 86 HG1 THR 86 89.042 -13.142 5.538 445 1HG2 THR 86 HG21 THR 86 88.797 -13.508 3.529 446 2HG2 THR 86 HG22 THR 86 87.326 -12.845 2.816 447 3HG2 THR 86 HG23 THR 86 87.396 -14.547 3.268 448 H ARG 87 HN ARG 87 83.933 -13.555 5.159 449 HA ARG 87 HA ARG 87 82.606 -12.234 7.238 450 1HB ARG 87 HB2 ARG 87 82.345 -14.567 5.784 451 2HB ARG 87 HB1 ARG 87 82.570 -15.172 7.426 452 1HG ARG 87 HG2 ARG 87 80.596 -14.265 8.174 453 2HG ARG 87 HG1 ARG 87 80.710 -12.871 7.100 454 1HD ARG 87 HD2 ARG 87 78.967 -14.051 6.082 455 2HD ARG 87 HD1 ARG 87 80.354 -14.746 5.223 456 HE ARG 87 HE ARG 87 80.259 -16.392 7.353 457 1HH1 ARG 87 HH11 ARG 87 78.425 -16.127 4.617 458 2HH1 ARG 87 HH12 ARG 87 77.050 -16.997 5.210 459 1HH2 ARG 87 HH21 ARG 87 78.178 -17.070 8.489 460 2HH2 ARG 87 HH22 ARG 87 76.909 -17.529 7.403 461 H GLY 88 HN GLY 88 82.382 -13.189 9.565 462 1HA GLY 88 HA2 GLY 88 83.403 -14.029 11.558 463 2HA GLY 88 HA1 GLY 88 84.905 -14.276 10.653 464 H SER 89 HN SER 89 85.135 -11.682 9.527 465 HA SER 89 HA SER 89 85.900 -10.137 11.960 466 1HB SER 89 HB2 SER 89 87.329 -10.852 9.806 467 2HB SER 89 HB1 SER 89 86.638 -9.354 9.168 468 HG SER 89 HG SER 89 88.596 -9.708 10.998 469 H MET 90 HN MET 90 86.007 -7.723 10.077 470 HA MET 90 HA MET 90 84.595 -5.826 9.826 471 1HB MET 90 HB2 MET 90 84.057 -7.876 8.083 472 2HB MET 90 HB1 MET 90 82.460 -7.575 8.768 473 1HG MET 90 HG2 MET 90 82.939 -5.081 8.310 474 2HG MET 90 HG1 MET 90 84.255 -5.652 7.286 475 1HE MET 90 HE1 MET 90 83.772 -7.929 6.023 476 2HE MET 90 HE2 MET 90 83.856 -6.673 4.790 477 3HE MET 90 HE3 MET 90 82.587 -7.892 4.710 478 H VAL 91 HN VAL 91 81.599 -6.175 9.741 479 HA VAL 91 HA VAL 91 81.125 -6.580 12.678 480 HB VAL 91 HB VAL 91 79.591 -4.637 10.957 481 1HG1 VAL 91 HG11 VAL 91 79.389 -5.455 13.592 482 2HG1 VAL 91 HG12 VAL 91 78.725 -3.959 12.934 483 3HG1 VAL 91 HG13 VAL 91 80.307 -3.954 13.716 484 1HG2 VAL 91 HG21 VAL 91 82.401 -4.421 11.912 485 2HG2 VAL 91 HG22 VAL 91 81.375 -3.009 12.163 486 3HG2 VAL 91 HG23 VAL 91 81.619 -3.643 10.536 487 H GLY 92 HN GLY 92 79.106 -7.547 13.219 488 1HA GLY 92 HA2 GLY 92 78.088 -9.561 11.583 489 2HA GLY 92 HA1 GLY 92 77.151 -8.806 12.880 490 HA PRO 93 HA PRO 93 74.505 -6.612 10.175 491 1HB PRO 93 HB2 PRO 93 75.471 -3.917 10.485 492 2HB PRO 93 HB1 PRO 93 74.069 -4.675 11.255 493 1HG PRO 93 HG2 PRO 93 76.569 -3.956 12.466 494 2HG PRO 93 HG1 PRO 93 75.178 -4.729 13.229 495 1HD PRO 93 HD2 PRO 93 77.731 -5.908 12.575 496 2HD PRO 93 HD1 PRO 93 76.338 -6.688 13.362 497 H PHE 94 HN PHE 94 77.709 -4.994 9.830 498 HA PHE 94 HA PHE 94 77.574 -4.040 7.239 499 1HB PHE 94 HB2 PHE 94 79.535 -4.620 9.125 500 2HB PHE 94 HB1 PHE 94 80.021 -5.579 7.721 501 HD1 PHE 94 HD1 PHE 94 79.552 -2.205 9.070 502 HD2 PHE 94 HD2 PHE 94 80.467 -4.482 5.544 503 HE1 PHE 94 HE1 PHE 94 80.397 -0.152 7.964 504 HE2 PHE 94 HE2 PHE 94 81.312 -2.430 4.439 505 HZ PHE 94 HZ PHE 94 81.277 -0.264 5.648 506 H GLN 95 HN GLN 95 78.848 -7.326 7.937 507 HA GLN 95 HA GLN 95 78.696 -8.248 5.238 508 1HB GLN 95 HB2 GLN 95 78.537 -9.773 7.858 509 2HB GLN 95 HB1 GLN 95 79.027 -10.441 6.303 510 1HG GLN 95 HG2 GLN 95 81.070 -9.352 6.323 511 2HG GLN 95 HG1 GLN 95 80.470 -8.024 7.314 512 1HE2 GLN 95 HE21 GLN 95 80.788 -8.176 9.571 513 2HE2 GLN 95 HE22 GLN 95 81.421 -9.545 10.348 514 H GLU 96 HN GLU 96 76.412 -8.537 7.963 515 HA GLU 96 HA GLU 96 74.462 -10.237 7.007 516 1HB GLU 96 HB2 GLU 96 74.596 -7.807 8.674 517 2HB GLU 96 HB1 GLU 96 72.991 -8.140 8.024 518 1HG GLU 96 HG2 GLU 96 73.202 -10.492 8.876 519 2HG GLU 96 HG1 GLU 96 74.721 -10.031 9.647 520 H ALA 97 HN ALA 97 75.074 -6.913 5.920 521 HA ALA 97 HA ALA 97 72.774 -6.959 4.071 522 1HB ALA 97 HB1 ALA 97 73.351 -4.919 5.267 523 2HB ALA 97 HB2 ALA 97 73.677 -4.665 3.552 524 3HB ALA 97 HB3 ALA 97 75.006 -4.992 4.663 525 H ALA 98 HN ALA 98 76.025 -5.804 3.305 526 HA ALA 98 HA ALA 98 76.054 -6.507 0.600 527 1HB ALA 98 HB1 ALA 98 78.663 -6.862 1.759 528 2HB ALA 98 HB2 ALA 98 77.827 -5.565 2.613 529 3HB ALA 98 HB3 ALA 98 78.043 -5.476 0.864 530 H PHE 99 HN PHE 99 77.907 -8.368 3.038 531 HA PHE 99 HA PHE 99 78.566 -10.623 1.621 532 1HB PHE 99 HB2 PHE 99 78.364 -9.826 4.299 533 2HB PHE 99 HB1 PHE 99 77.454 -11.341 4.215 534 HD1 PHE 99 HD1 PHE 99 80.697 -9.893 4.464 535 HD2 PHE 99 HD2 PHE 99 78.599 -13.299 2.900 536 HE1 PHE 99 HE1 PHE 99 82.825 -11.165 4.381 537 HE2 PHE 99 HE2 PHE 99 80.726 -14.571 2.816 538 HZ PHE 99 HZ PHE 99 82.839 -13.504 3.557 539 H ALA 100 HN ALA 100 75.337 -9.805 2.789 540 HA ALA 100 HA ALA 100 74.269 -12.421 1.852 541 1HB ALA 100 HB1 ALA 100 73.753 -11.180 4.081 542 2HB ALA 100 HB2 ALA 100 72.396 -11.863 3.187 543 3HB ALA 100 HB3 ALA 100 72.736 -10.136 3.090 544 H LEU 101 HN LEU 101 74.420 -9.050 0.959 545 HA LEU 101 HA LEU 101 72.267 -9.319 -1.061 546 1HB LEU 101 HB2 LEU 101 73.837 -7.194 0.294 547 2HB LEU 101 HB1 LEU 101 73.340 -6.837 -1.366 548 HG LEU 101 HG LEU 101 71.166 -8.064 0.109 549 1HD1 LEU 101 HD11 LEU 101 72.778 -6.053 1.516 550 2HD1 LEU 101 HD12 LEU 101 71.523 -7.124 2.141 551 3HD1 LEU 101 HD13 LEU 101 71.079 -5.604 1.365 552 1HD2 LEU 101 HD21 LEU 101 70.690 -6.831 -1.862 553 2HD2 LEU 101 HD22 LEU 101 71.668 -5.460 -1.337 554 3HD2 LEU 101 HD23 LEU 101 70.127 -5.797 -0.548 555 HA PRO 102 HA PRO 102 74.755 -9.961 -4.620 556 1HB PRO 102 HB2 PRO 102 74.112 -7.510 -5.988 557 2HB PRO 102 HB1 PRO 102 73.430 -9.123 -6.252 558 1HG PRO 102 HG2 PRO 102 72.181 -6.837 -5.013 559 2HG PRO 102 HG1 PRO 102 71.482 -8.435 -5.318 560 1HD PRO 102 HD2 PRO 102 72.244 -7.308 -2.784 561 2HD PRO 102 HD1 PRO 102 71.611 -8.944 -3.099 562 H VAL 103 HN VAL 103 76.069 -8.091 -6.285 563 HA VAL 103 HA VAL 103 78.218 -7.147 -4.453 564 HB VAL 103 HB VAL 103 77.924 -7.897 -7.356 565 1HG1 VAL 103 HG11 VAL 103 79.179 -5.763 -7.345 566 2HG1 VAL 103 HG12 VAL 103 80.215 -7.119 -7.787 567 3HG1 VAL 103 HG13 VAL 103 80.302 -6.439 -6.164 568 1HG2 VAL 103 HG21 VAL 103 80.306 -8.816 -6.048 569 2HG2 VAL 103 HG22 VAL 103 78.932 -9.765 -6.614 570 3HG2 VAL 103 HG23 VAL 103 78.930 -9.100 -4.981 571 H SER 104 HN SER 104 79.328 -5.045 -5.334 572 HA SER 104 HA SER 104 79.203 -2.736 -5.775 573 1HB SER 104 HB2 SER 104 76.885 -3.834 -7.387 574 2HB SER 104 HB1 SER 104 77.350 -2.132 -7.431 575 HG SER 104 HG SER 104 78.326 -3.831 -8.965 576 H GLY 105 HN GLY 105 77.673 -0.803 -5.486 577 1HA GLY 105 HA2 GLY 105 75.314 -1.247 -3.806 578 2HA GLY 105 HA1 GLY 105 76.683 -0.530 -2.958 579 H MET 106 HN MET 106 76.937 1.671 -3.122 580 HA MET 106 HA MET 106 76.552 3.890 -3.831 581 1HB MET 106 HB2 MET 106 77.597 2.893 -5.860 582 2HB MET 106 HB1 MET 106 75.995 2.436 -6.439 583 1HG MET 106 HG2 MET 106 75.328 4.705 -6.691 584 2HG MET 106 HG1 MET 106 76.698 5.293 -5.741 585 1HE MET 106 HE1 MET 106 76.897 3.306 -9.872 586 2HE MET 106 HE2 MET 106 75.604 3.210 -8.679 587 3HE MET 106 HE3 MET 106 77.112 2.341 -8.406 588 H ASP 107 HN ASP 107 74.212 2.272 -5.977 589 HA ASP 107 HA ASP 107 71.888 2.707 -4.362 590 1HB ASP 107 HB2 ASP 107 71.073 4.710 -5.778 591 2HB ASP 107 HB1 ASP 107 72.306 5.038 -4.563 592 H LYS 108 HN LYS 108 73.250 2.587 -7.628 593 HA LYS 108 HA LYS 108 70.771 1.597 -8.822 594 1HB LYS 108 HB2 LYS 108 72.000 2.756 -10.375 595 2HB LYS 108 HB1 LYS 108 73.543 2.313 -9.640 596 1HG LYS 108 HG2 LYS 108 73.373 1.222 -11.809 597 2HG LYS 108 HG1 LYS 108 73.231 -0.013 -10.557 598 1HD LYS 108 HD2 LYS 108 71.217 -0.607 -11.366 599 2HD LYS 108 HD1 LYS 108 70.618 1.028 -11.084 600 1HE LYS 108 HE2 LYS 108 72.243 1.223 -13.382 601 2HE LYS 108 HE1 LYS 108 71.274 -0.245 -13.605 602 1HZ LYS 108 HZ1 LYS 108 69.295 0.973 -13.057 603 2HZ LYS 108 HZ2 LYS 108 70.101 1.816 -14.294 604 3HZ LYS 108 HZ3 LYS 108 70.187 2.369 -12.689 605 HA PRO 109 HA PRO 109 73.284 -2.554 -9.083 606 1HB PRO 109 HB2 PRO 109 75.390 -2.387 -7.129 607 2HB PRO 109 HB1 PRO 109 75.542 -2.596 -8.881 608 1HG PRO 109 HG2 PRO 109 76.112 -0.248 -7.299 609 2HG PRO 109 HG1 PRO 109 76.344 -0.483 -9.033 610 1HD PRO 109 HD2 PRO 109 74.379 1.160 -7.755 611 2HD PRO 109 HD1 PRO 109 74.537 0.811 -9.496 612 H VAL 110 HN VAL 110 74.339 -3.847 -6.676 613 HA VAL 110 HA VAL 110 73.227 -5.059 -4.936 614 HB VAL 110 HB VAL 110 74.575 -2.946 -4.199 615 1HG1 VAL 110 HG11 VAL 110 72.024 -1.788 -4.487 616 2HG1 VAL 110 HG12 VAL 110 73.452 -1.050 -3.773 617 3HG1 VAL 110 HG13 VAL 110 72.299 -1.908 -2.752 618 1HG2 VAL 110 HG21 VAL 110 73.247 -5.008 -2.833 619 2HG2 VAL 110 HG22 VAL 110 72.888 -3.541 -1.921 620 3HG2 VAL 110 HG23 VAL 110 74.562 -4.007 -2.217 621 H PHE 111 HN PHE 111 71.323 -3.632 -3.087 622 HA PHE 111 HA PHE 111 68.939 -3.147 -4.751 623 1HB PHE 111 HB2 PHE 111 69.499 -5.647 -3.187 624 2HB PHE 111 HB1 PHE 111 67.829 -5.082 -3.342 625 HD1 PHE 111 HD1 PHE 111 69.879 -7.401 -4.683 626 HD2 PHE 111 HD2 PHE 111 67.608 -3.993 -5.979 627 HE1 PHE 111 HE1 PHE 111 69.774 -8.342 -6.975 628 HE2 PHE 111 HE2 PHE 111 67.503 -4.934 -8.270 629 HZ PHE 111 HZ PHE 111 68.587 -7.109 -8.769 630 H THR 112 HN THR 112 69.730 -4.122 -1.400 631 HA THR 112 HA THR 112 67.730 -2.658 -0.066 632 HB THR 112 HB THR 112 69.345 -4.343 0.874 633 HG1 THR 112 HG1 THR 112 69.212 -3.459 2.837 634 1HG2 THR 112 HG21 THR 112 71.571 -3.673 1.486 635 2HG2 THR 112 HG22 THR 112 71.248 -1.999 1.041 636 3HG2 THR 112 HG23 THR 112 71.357 -3.237 -0.209 637 H ASP 113 HN ASP 113 68.816 -0.867 1.649 638 HA ASP 113 HA ASP 113 69.361 1.461 -0.096 639 1HB ASP 113 HB2 ASP 113 69.089 1.346 2.920 640 2HB ASP 113 HB1 ASP 113 68.788 2.725 1.864 641 HA PRO 114 HA PRO 114 73.713 1.059 0.513 642 1HB PRO 114 HB2 PRO 114 74.098 3.883 0.172 643 2HB PRO 114 HB1 PRO 114 74.405 2.580 -0.986 644 1HG PRO 114 HG2 PRO 114 72.284 4.518 -1.035 645 2HG PRO 114 HG1 PRO 114 72.589 3.213 -2.184 646 1HD PRO 114 HD2 PRO 114 70.475 3.394 -0.221 647 2HD PRO 114 HD1 PRO 114 70.777 2.080 -1.383 648 HA PRO 115 HA PRO 115 74.251 4.265 4.116 649 1HB PRO 115 HB2 PRO 115 71.626 5.266 4.754 650 2HB PRO 115 HB1 PRO 115 73.031 6.171 4.173 651 1HG PRO 115 HG2 PRO 115 70.627 5.562 2.743 652 2HG PRO 115 HG1 PRO 115 72.059 6.412 2.143 653 1HD PRO 115 HD2 PRO 115 71.160 3.724 1.496 654 2HD PRO 115 HD1 PRO 115 72.544 4.611 0.830 655 H VAL 116 HN VAL 116 74.267 1.864 4.780 656 HA VAL 116 HA VAL 116 71.905 1.002 6.354 657 HB VAL 116 HB VAL 116 72.978 -1.136 6.258 658 1HG1 VAL 116 HG11 VAL 116 72.463 -1.307 4.075 659 2HG1 VAL 116 HG12 VAL 116 73.995 -0.544 3.647 660 3HG1 VAL 116 HG13 VAL 116 72.563 0.447 3.929 661 1HG2 VAL 116 HG21 VAL 116 75.307 -1.402 5.501 662 2HG2 VAL 116 HG22 VAL 116 75.222 -0.371 6.931 663 3HG2 VAL 116 HG23 VAL 116 75.451 0.348 5.336 664 H LYS 117 HN LYS 117 72.085 0.529 8.611 665 HA LYS 117 HA LYS 117 74.178 2.072 10.026 666 1HB LYS 117 HB2 LYS 117 71.471 1.614 10.347 667 2HB LYS 117 HB1 LYS 117 72.188 0.556 11.572 668 1HG LYS 117 HG2 LYS 117 73.672 2.877 11.828 669 2HG LYS 117 HG1 LYS 117 72.048 3.491 11.482 670 1HD LYS 117 HD2 LYS 117 71.755 1.332 13.315 671 2HD LYS 117 HD1 LYS 117 73.054 2.364 13.931 672 1HE LYS 117 HE2 LYS 117 71.227 3.499 14.814 673 2HE LYS 117 HE1 LYS 117 71.289 4.284 13.224 674 1HZ LYS 117 HZ1 LYS 117 69.715 2.745 12.366 675 2HZ LYS 117 HZ2 LYS 117 69.074 3.304 13.837 676 3HZ LYS 117 HZ3 LYS 117 69.796 1.769 13.751 677 H THR 118 HN THR 118 75.642 1.109 11.501 678 HA THR 118 HA THR 118 75.617 -1.622 12.342 679 HB THR 118 HB THR 118 75.852 -2.151 10.000 680 HG1 THR 118 HG1 THR 118 78.066 -2.964 10.013 681 1HG2 THR 118 HG21 THR 118 77.066 0.346 9.840 682 2HG2 THR 118 HG22 THR 118 76.911 -0.814 8.521 683 3HG2 THR 118 HG23 THR 118 78.380 -0.778 9.497 684 H LYS 119 HN LYS 119 77.508 1.236 11.497 685 HA LYS 119 HA LYS 119 79.510 0.510 13.606 686 1HB LYS 119 HB2 LYS 119 79.733 1.325 10.934 687 2HB LYS 119 HB1 LYS 119 80.152 2.761 11.870 688 1HG LYS 119 HG2 LYS 119 81.855 1.556 13.088 689 2HG LYS 119 HG1 LYS 119 81.338 0.020 12.386 690 1HD LYS 119 HD2 LYS 119 82.326 0.461 10.352 691 2HD LYS 119 HD1 LYS 119 82.089 2.203 10.494 692 1HE LYS 119 HE2 LYS 119 84.415 2.002 10.808 693 2HE LYS 119 HE1 LYS 119 83.827 1.968 12.482 694 1HZ LYS 119 HZ1 LYS 119 84.995 0.022 12.466 695 2HZ LYS 119 HZ2 LYS 119 84.794 -0.227 10.797 696 3HZ LYS 119 HZ3 LYS 119 83.522 -0.572 11.869 697 H PHE 120 HN PHE 120 77.938 3.425 12.218 698 HA PHE 120 HA PHE 120 77.086 4.400 14.818 699 1HB PHE 120 HB2 PHE 120 79.704 4.635 14.562 700 2HB PHE 120 HB1 PHE 120 79.280 6.027 13.554 701 HD1 PHE 120 HD1 PHE 120 78.215 7.996 14.505 702 HD2 PHE 120 HD2 PHE 120 79.134 4.586 16.950 703 HE1 PHE 120 HE1 PHE 120 77.810 9.348 16.543 704 HE2 PHE 120 HE2 PHE 120 78.728 5.940 18.989 705 HZ PHE 120 HZ PHE 120 78.067 8.321 18.786 706 H GLY 121 HN GLY 121 75.473 4.169 12.713 707 1HA GLY 121 HA2 GLY 121 73.920 6.116 12.116 708 2HA GLY 121 HA1 GLY 121 75.368 6.872 11.435 709 H TYR 122 HN TYR 122 73.910 6.816 9.438 710 HA TYR 122 HA TYR 122 73.646 4.157 8.159 711 1HB TYR 122 HB2 TYR 122 72.931 6.968 7.257 712 2HB TYR 122 HB1 TYR 122 72.420 5.477 6.468 713 HD1 TYR 122 HD1 TYR 122 70.635 7.698 7.719 714 HD2 TYR 122 HD2 TYR 122 72.120 3.947 9.197 715 HE1 TYR 122 HE1 TYR 122 68.703 7.542 9.265 716 HE2 TYR 122 HE2 TYR 122 70.188 3.792 10.742 717 HH TYR 122 HH TYR 122 67.665 6.312 10.788 718 H HIS 123 HN HIS 123 75.100 3.415 6.643 719 HA HIS 123 HA HIS 123 76.979 5.392 5.392 720 1HB HIS 123 HB2 HIS 123 77.974 2.674 6.138 721 2HB HIS 123 HB1 HIS 123 78.832 4.211 6.128 722 HD1 HIS 123 HD1 HIS 123 77.762 5.958 8.097 723 HD2 HIS 123 HD2 HIS 123 77.455 1.846 8.707 724 HE1 HIS 123 HE1 HIS 123 77.356 5.629 10.575 725 H ILE 124 HN ILE 124 77.535 4.861 3.218 726 HA ILE 124 HA ILE 124 75.814 2.819 1.946 727 HB ILE 124 HB ILE 124 77.793 4.784 0.756 728 1HG1 ILE 124 HG12 ILE 124 74.830 5.042 1.382 729 2HG1 ILE 124 HG11 ILE 124 76.140 6.030 2.036 730 1HG2 ILE 124 HG21 ILE 124 76.155 2.695 -0.346 731 2HG2 ILE 124 HG22 ILE 124 77.249 3.794 -1.186 732 3HG2 ILE 124 HG23 ILE 124 75.569 4.257 -0.923 733 1HD1 ILE 124 HD11 ILE 124 74.737 6.252 -0.535 734 2HD1 ILE 124 HD12 ILE 124 76.493 6.271 -0.703 735 3HD1 ILE 124 HD13 ILE 124 75.693 7.458 0.327 736 H ILE 125 HN ILE 125 76.586 0.904 1.074 737 HA ILE 125 HA ILE 125 79.529 0.398 1.326 738 HB ILE 125 HB ILE 125 77.050 -1.113 2.059 739 1HG1 ILE 125 HG12 ILE 125 79.708 -1.305 3.425 740 2HG1 ILE 125 HG11 ILE 125 78.801 0.210 3.554 741 1HG2 ILE 125 HG21 ILE 125 79.657 -2.369 1.180 742 2HG2 ILE 125 HG22 ILE 125 78.032 -2.718 0.587 743 3HG2 ILE 125 HG23 ILE 125 78.498 -3.198 2.220 744 1HD1 ILE 125 HD11 ILE 125 77.194 -0.725 4.872 745 2HD1 ILE 125 HD12 ILE 125 78.427 -1.942 5.202 746 3HD1 ILE 125 HD13 ILE 125 77.199 -2.243 3.972 747 H MET 126 HN MET 126 80.495 -0.839 -0.354 748 HA MET 126 HA MET 126 78.792 -1.584 -2.693 749 1HB MET 126 HB2 MET 126 81.123 0.323 -2.542 750 2HB MET 126 HB1 MET 126 80.746 -0.515 -4.053 751 1HG MET 126 HG2 MET 126 78.290 0.341 -3.508 752 2HG MET 126 HG1 MET 126 79.173 1.564 -2.582 753 1HE MET 126 HE1 MET 126 80.965 2.759 -3.237 754 2HE MET 126 HE2 MET 126 79.982 3.952 -4.082 755 3HE MET 126 HE3 MET 126 81.429 3.307 -4.854 756 H VAL 127 HN VAL 127 79.233 -3.765 -2.873 757 HA VAL 127 HA VAL 127 81.878 -4.837 -2.092 758 HB VAL 127 HB VAL 127 79.222 -5.974 -2.992 759 1HG1 VAL 127 HG11 VAL 127 80.515 -7.696 -3.783 760 2HG1 VAL 127 HG12 VAL 127 80.545 -8.140 -2.075 761 3HG1 VAL 127 HG13 VAL 127 81.898 -7.253 -2.780 762 1HG2 VAL 127 HG21 VAL 127 79.530 -7.009 -0.612 763 2HG2 VAL 127 HG22 VAL 127 79.055 -5.316 -0.746 764 3HG2 VAL 127 HG23 VAL 127 80.732 -5.737 -0.399 765 H GLU 128 HN GLU 128 83.305 -5.891 -3.606 766 HA GLU 128 HA GLU 128 82.527 -5.866 -6.463 767 1HB GLU 128 HB2 GLU 128 83.977 -3.792 -5.198 768 2HB GLU 128 HB1 GLU 128 85.147 -4.695 -6.171 769 1HG GLU 128 HG2 GLU 128 84.006 -4.271 -8.171 770 2HG GLU 128 HG1 GLU 128 82.473 -3.961 -7.343 771 H GLY 129 HN GLY 129 82.792 -8.159 -6.279 772 1HA GLY 129 HA2 GLY 129 84.231 -9.920 -7.101 773 2HA GLY 129 HA1 GLY 129 85.616 -9.010 -6.479 774 H ARG 130 HN ARG 130 83.143 -11.310 -5.724 775 HA ARG 130 HA ARG 130 83.767 -11.256 -2.873 776 1HB ARG 130 HB2 ARG 130 82.053 -12.991 -4.607 777 2HB ARG 130 HB1 ARG 130 82.073 -13.095 -2.853 778 1HG ARG 130 HG2 ARG 130 80.940 -11.106 -2.591 779 2HG ARG 130 HG1 ARG 130 81.634 -10.400 -4.050 780 1HD ARG 130 HD2 ARG 130 79.875 -11.091 -5.318 781 2HD ARG 130 HD1 ARG 130 79.924 -12.721 -4.621 782 HE ARG 130 HE ARG 130 78.576 -10.369 -3.344 783 1HH1 ARG 130 HH11 ARG 130 79.669 -12.889 -1.802 784 2HH1 ARG 130 HH12 ARG 130 78.180 -13.744 -1.571 785 1HH2 ARG 130 HH21 ARG 130 76.421 -11.835 -3.871 786 2HH2 ARG 130 HH22 ARG 130 76.341 -13.146 -2.743 787 H LYS 131 HN LYS 131 85.435 -12.342 -5.383 788 HA LYS 131 HA LYS 131 87.174 -13.935 -5.623 789 1HB LYS 131 HB2 LYS 131 86.840 -13.299 -2.855 790 2HB LYS 131 HB1 LYS 131 87.161 -15.029 -2.975 791 1HG LYS 131 HG2 LYS 131 89.162 -14.595 -4.317 792 2HG LYS 131 HG1 LYS 131 88.823 -12.864 -4.301 793 1HD LYS 131 HD2 LYS 131 89.107 -12.788 -1.882 794 2HD LYS 131 HD1 LYS 131 89.307 -14.540 -1.818 795 1HE LYS 131 HE2 LYS 131 91.140 -13.074 -3.661 796 2HE LYS 131 HE1 LYS 131 91.423 -12.865 -1.915 797 1HZ LYS 131 HZ1 LYS 131 92.442 -14.909 -3.086 798 2HZ LYS 131 HZ2 LYS 131 90.864 -15.537 -3.056 799 3HZ LYS 131 HZ3 LYS 131 91.653 -15.142 -1.603 Start of MODEL 4 1 1H GLY 28 HT1 GLY 28 70.866 -20.145 -8.137 2 2H GLY 28 HT2 GLY 28 71.789 -19.043 -7.231 3 3H GLY 28 HT3 GLY 28 70.392 -19.741 -6.561 4 1HA GLY 28 HA2 GLY 28 71.647 -21.321 -5.681 5 2HA GLY 28 HA1 GLY 28 71.969 -21.869 -7.327 6 H SER 29 HN SER 29 74.084 -21.847 -7.919 7 HA SER 29 HA SER 29 76.410 -21.426 -7.786 8 1HB SER 29 HB2 SER 29 75.077 -18.743 -7.350 9 2HB SER 29 HB1 SER 29 76.818 -18.907 -7.580 10 HG SER 29 HG SER 29 76.527 -19.405 -9.615 11 H GLY 30 HN GLY 30 76.715 -22.680 -5.791 12 1HA GLY 30 HA2 GLY 30 78.208 -22.169 -3.798 13 2HA GLY 30 HA1 GLY 30 76.999 -20.964 -3.356 14 HA PRO 31 HA PRO 31 76.089 -25.472 -1.853 15 1HB PRO 31 HB2 PRO 31 77.018 -24.771 0.781 16 2HB PRO 31 HB1 PRO 31 77.660 -26.010 -0.313 17 1HG PRO 31 HG2 PRO 31 78.848 -23.489 0.399 18 2HG PRO 31 HG1 PRO 31 79.489 -24.723 -0.688 19 1HD PRO 31 HD2 PRO 31 78.407 -22.138 -1.384 20 2HD PRO 31 HD1 PRO 31 79.055 -23.380 -2.479 21 H LYS 32 HN LYS 32 76.112 -22.688 0.418 22 HA LYS 32 HA LYS 32 73.126 -22.942 0.604 23 1HB LYS 32 HB2 LYS 32 75.271 -23.107 2.583 24 2HB LYS 32 HB1 LYS 32 74.067 -21.893 3.013 25 1HG LYS 32 HG2 LYS 32 72.439 -23.909 2.208 26 2HG LYS 32 HG1 LYS 32 73.801 -24.842 2.829 27 1HD LYS 32 HD2 LYS 32 72.521 -24.548 4.760 28 2HD LYS 32 HD1 LYS 32 73.638 -23.188 4.867 29 1HE LYS 32 HE2 LYS 32 71.661 -22.018 5.155 30 2HE LYS 32 HE1 LYS 32 71.673 -22.046 3.380 31 1HZ LYS 32 HZ1 LYS 32 70.359 -24.010 3.370 32 2HZ LYS 32 HZ2 LYS 32 69.590 -22.932 4.435 33 3HZ LYS 32 HZ3 LYS 32 70.517 -24.218 5.046 34 H GLY 33 HN GLY 33 75.163 -21.079 -0.869 35 1HA GLY 33 HA2 GLY 33 74.852 -18.838 -1.605 36 2HA GLY 33 HA1 GLY 33 73.659 -18.613 -0.325 37 H GLY 34 HN GLY 34 75.698 -16.710 -0.849 38 1HA GLY 34 HA2 GLY 34 76.738 -15.437 1.019 39 2HA GLY 34 HA1 GLY 34 77.322 -16.977 1.648 40 H GLY 35 HN GLY 35 79.530 -16.766 1.473 41 1HA GLY 35 HA2 GLY 35 80.965 -17.266 -0.815 42 2HA GLY 35 HA1 GLY 35 80.762 -15.508 -0.864 43 H ASN 36 HN ASN 36 83.162 -15.478 -0.622 44 HA ASN 36 HA ASN 36 83.975 -15.839 2.245 45 1HB ASN 36 HB2 ASN 36 85.062 -16.783 -0.301 46 2HB ASN 36 HB1 ASN 36 86.268 -15.937 0.669 47 1HD2 ASN 36 HD21 ASN 36 84.233 -18.809 0.510 48 2HD2 ASN 36 HD22 ASN 36 84.885 -19.575 1.877 49 H ALA 37 HN ALA 37 85.459 -14.287 -0.593 50 HA ALA 37 HA ALA 37 85.800 -11.808 1.025 51 1HB ALA 37 HB1 ALA 37 87.561 -13.409 -0.422 52 2HB ALA 37 HB2 ALA 37 87.887 -11.767 0.132 53 3HB ALA 37 HB3 ALA 37 87.267 -12.042 -1.496 54 H VAL 38 HN VAL 38 85.243 -9.801 0.051 55 HA VAL 38 HA VAL 38 83.880 -9.811 -2.595 56 HB VAL 38 HB VAL 38 81.831 -8.993 -1.674 57 1HG1 VAL 38 HG11 VAL 38 82.538 -11.462 -1.114 58 2HG1 VAL 38 HG12 VAL 38 81.103 -10.778 -0.358 59 3HG1 VAL 38 HG13 VAL 38 82.617 -10.864 0.540 60 1HG2 VAL 38 HG21 VAL 38 82.138 -7.405 -0.074 61 2HG2 VAL 38 HG22 VAL 38 83.608 -8.168 0.531 62 3HG2 VAL 38 HG23 VAL 38 82.029 -8.757 1.053 63 H LYS 39 HN LYS 39 83.928 -7.548 -3.571 64 HA LYS 39 HA LYS 39 85.979 -5.905 -2.184 65 1HB LYS 39 HB2 LYS 39 85.833 -6.433 -4.659 66 2HB LYS 39 HB1 LYS 39 84.402 -5.406 -4.714 67 1HG LYS 39 HG2 LYS 39 86.590 -4.247 -5.332 68 2HG LYS 39 HG1 LYS 39 85.682 -3.471 -4.025 69 1HD LYS 39 HD2 LYS 39 87.268 -3.972 -2.465 70 2HD LYS 39 HD1 LYS 39 87.564 -5.577 -3.145 71 1HE LYS 39 HE2 LYS 39 89.558 -4.120 -3.408 72 2HE LYS 39 HE1 LYS 39 88.871 -4.529 -4.993 73 1HZ LYS 39 HZ1 LYS 39 88.309 -2.071 -3.412 74 2HZ LYS 39 HZ2 LYS 39 87.567 -2.471 -4.887 75 3HZ LYS 39 HZ3 LYS 39 89.234 -2.147 -4.831 76 H VAL 40 HN VAL 40 84.739 -5.175 -0.324 77 HA VAL 40 HA VAL 40 82.267 -3.621 -0.842 78 HB VAL 40 HB VAL 40 82.650 -5.416 0.965 79 1HG1 VAL 40 HG11 VAL 40 84.811 -4.636 1.780 80 2HG1 VAL 40 HG12 VAL 40 83.623 -4.511 3.077 81 3HG1 VAL 40 HG13 VAL 40 84.120 -3.067 2.193 82 1HG2 VAL 40 HG21 VAL 40 80.927 -4.483 2.158 83 2HG2 VAL 40 HG22 VAL 40 80.917 -3.354 0.802 84 3HG2 VAL 40 HG23 VAL 40 81.737 -2.924 2.304 85 H ARG 41 HN ARG 41 82.037 -1.453 -0.307 86 HA ARG 41 HA ARG 41 84.531 0.060 0.395 87 1HB ARG 41 HB2 ARG 41 82.342 0.480 -1.630 88 2HB ARG 41 HB1 ARG 41 83.203 1.877 -0.985 89 1HG ARG 41 HG2 ARG 41 84.275 1.057 -3.056 90 2HG ARG 41 HG1 ARG 41 85.350 0.871 -1.670 91 1HD ARG 41 HD2 ARG 41 85.171 -1.443 -1.670 92 2HD ARG 41 HD1 ARG 41 83.536 -1.419 -2.368 93 HE ARG 41 HE ARG 41 85.969 -1.526 -3.890 94 1HH1 ARG 41 HH11 ARG 41 82.968 -1.913 -4.688 95 2HH1 ARG 41 HH12 ARG 41 82.850 -0.744 -5.959 96 1HH2 ARG 41 HH21 ARG 41 85.815 0.850 -5.127 97 2HH2 ARG 41 HH22 ARG 41 84.464 0.818 -6.209 98 H HIS 42 HN HIS 42 84.148 1.840 1.899 99 HA HIS 42 HA HIS 42 81.449 1.702 3.204 100 1HB HIS 42 HB2 HIS 42 84.229 2.151 4.315 101 2HB HIS 42 HB1 HIS 42 82.743 2.303 5.265 102 HD1 HIS 42 HD1 HIS 42 82.545 0.240 6.650 103 HD2 HIS 42 HD2 HIS 42 83.828 -0.639 2.783 104 HE1 HIS 42 HE1 HIS 42 82.689 -2.283 6.499 105 H ILE 43 HN ILE 43 80.317 3.536 2.919 106 HA ILE 43 HA ILE 43 81.763 6.151 3.005 107 HB ILE 43 HB ILE 43 79.707 5.067 1.095 108 1HG1 ILE 43 HG12 ILE 43 82.281 6.656 0.826 109 2HG1 ILE 43 HG11 ILE 43 82.044 4.948 0.426 110 1HG2 ILE 43 HG21 ILE 43 79.292 7.378 0.304 111 2HG2 ILE 43 HG22 ILE 43 80.261 8.001 1.640 112 3HG2 ILE 43 HG23 ILE 43 78.744 7.162 1.968 113 1HD1 ILE 43 HD11 ILE 43 81.802 5.909 -1.674 114 2HD1 ILE 43 HD12 ILE 43 81.098 7.392 -1.030 115 3HD1 ILE 43 HD13 ILE 43 80.127 5.923 -1.126 116 H LEU 44 HN LEU 44 81.148 6.855 5.058 117 HA LEU 44 HA LEU 44 78.244 6.717 5.787 118 1HB LEU 44 HB2 LEU 44 79.248 5.703 7.583 119 2HB LEU 44 HB1 LEU 44 80.844 6.271 7.094 120 HG LEU 44 HG LEU 44 80.046 8.576 8.023 121 1HD1 LEU 44 HD11 LEU 44 78.299 6.791 9.716 122 2HD1 LEU 44 HD12 LEU 44 77.659 7.583 8.275 123 3HD1 LEU 44 HD13 LEU 44 78.290 8.552 9.607 124 1HD2 LEU 44 HD21 LEU 44 80.987 6.155 9.463 125 2HD2 LEU 44 HD22 LEU 44 80.459 7.516 10.453 126 3HD2 LEU 44 HD23 LEU 44 81.762 7.731 9.280 127 H CYS 45 HN CYS 45 77.215 8.722 6.193 128 HA CYS 45 HA CYS 45 78.860 11.156 5.659 129 1HB CYS 45 HB2 CYS 45 75.870 10.629 5.686 130 2HB CYS 45 HB1 CYS 45 76.625 12.164 5.229 131 HG CYS 45 HG CYS 45 76.981 9.506 3.612 132 H GLU 46 HN GLU 46 77.298 9.481 8.216 133 HA GLU 46 HA GLU 46 77.153 10.005 10.524 134 1HB GLU 46 HB2 GLU 46 79.367 11.218 9.706 135 2HB GLU 46 HB1 GLU 46 78.397 12.675 9.924 136 1HG GLU 46 HG2 GLU 46 77.871 11.196 12.221 137 2HG GLU 46 HG1 GLU 46 79.589 10.920 11.939 138 H LYS 47 HN LYS 47 76.756 12.986 8.596 139 HA LYS 47 HA LYS 47 74.331 13.696 10.153 140 1HB LYS 47 HB2 LYS 47 75.769 15.144 7.903 141 2HB LYS 47 HB1 LYS 47 74.617 15.845 9.041 142 1HG LYS 47 HG2 LYS 47 76.201 15.198 10.903 143 2HG LYS 47 HG1 LYS 47 77.374 14.753 9.665 144 1HD LYS 47 HD2 LYS 47 76.242 17.387 9.161 145 2HD LYS 47 HD1 LYS 47 77.000 17.303 10.752 146 1HE LYS 47 HE2 LYS 47 78.492 16.086 8.461 147 2HE LYS 47 HE1 LYS 47 78.445 17.856 8.566 148 1HZ LYS 47 HZ1 LYS 47 79.317 15.936 10.662 149 2HZ LYS 47 HZ2 LYS 47 79.020 17.580 10.974 150 3HZ LYS 47 HZ3 LYS 47 80.258 17.125 9.903 151 H HIS 48 HN HIS 48 75.272 12.191 7.215 152 HA HIS 48 HA HIS 48 73.998 11.281 5.458 153 1HB HIS 48 HB2 HIS 48 71.647 12.128 7.169 154 2HB HIS 48 HB1 HIS 48 71.704 10.805 6.005 155 HD1 HIS 48 HD1 HIS 48 74.813 10.296 7.260 156 HD2 HIS 48 HD2 HIS 48 71.091 9.935 9.101 157 HE1 HIS 48 HE1 HIS 48 75.151 8.767 9.253 158 H GLY 49 HN GLY 49 74.289 14.435 6.089 159 1HA GLY 49 HA2 GLY 49 72.179 15.578 4.443 160 2HA GLY 49 HA1 GLY 49 73.630 16.425 5.002 161 H LYS 50 HN LYS 50 75.032 13.855 3.804 162 HA LYS 50 HA LYS 50 75.061 14.825 0.966 163 1HB LYS 50 HB2 LYS 50 77.520 14.009 1.164 164 2HB LYS 50 HB1 LYS 50 77.094 15.531 1.945 165 1HG LYS 50 HG2 LYS 50 76.853 12.967 3.489 166 2HG LYS 50 HG1 LYS 50 78.439 13.713 3.292 167 1HD LYS 50 HD2 LYS 50 76.595 15.780 3.968 168 2HD LYS 50 HD1 LYS 50 76.338 14.451 5.099 169 1HE LYS 50 HE2 LYS 50 79.114 15.485 4.450 170 2HE LYS 50 HE1 LYS 50 78.137 16.151 5.778 171 1HZ LYS 50 HZ1 LYS 50 79.133 13.391 5.409 172 2HZ LYS 50 HZ2 LYS 50 77.765 13.691 6.370 173 3HZ LYS 50 HZ3 LYS 50 79.261 14.388 6.774 174 H ILE 51 HN ILE 51 74.570 12.181 3.082 175 HA ILE 51 HA ILE 51 75.494 9.949 1.672 176 HB ILE 51 HB ILE 51 74.179 10.066 3.848 177 1HG1 ILE 51 HG12 ILE 51 72.754 7.943 3.147 178 2HG1 ILE 51 HG11 ILE 51 73.663 8.107 1.636 179 1HG2 ILE 51 HG21 ILE 51 71.818 10.224 3.815 180 2HG2 ILE 51 HG22 ILE 51 71.741 9.956 2.074 181 3HG2 ILE 51 HG23 ILE 51 72.349 11.487 2.704 182 1HD1 ILE 51 HD11 ILE 51 74.862 6.617 3.173 183 2HD1 ILE 51 HD12 ILE 51 74.850 7.864 4.421 184 3HD1 ILE 51 HD13 ILE 51 75.780 8.105 2.943 185 H MET 52 HN MET 52 72.913 12.186 0.843 186 HA MET 52 HA MET 52 72.085 10.511 -1.436 187 1HB MET 52 HB2 MET 52 70.991 13.245 -1.256 188 2HB MET 52 HB1 MET 52 70.146 11.715 -1.358 189 1HG MET 52 HG2 MET 52 69.551 12.009 0.780 190 2HG MET 52 HG1 MET 52 71.217 11.691 1.224 191 1HE MET 52 HE1 MET 52 72.335 14.133 -0.546 192 2HE MET 52 HE2 MET 52 73.123 13.984 1.020 193 3HE MET 52 HE3 MET 52 72.465 15.535 0.515 194 H GLU 53 HN GLU 53 73.966 13.350 -0.724 195 HA GLU 53 HA GLU 53 74.273 14.235 -3.471 196 1HB GLU 53 HB2 GLU 53 75.033 15.033 -0.839 197 2HB GLU 53 HB1 GLU 53 76.526 14.827 -1.754 198 1HG GLU 53 HG2 GLU 53 75.884 16.417 -3.377 199 2HG GLU 53 HG1 GLU 53 74.184 16.330 -2.913 200 H ALA 54 HN ALA 54 75.618 11.909 -1.268 201 HA ALA 54 HA ALA 54 77.944 11.179 -2.889 202 1HB ALA 54 HB1 ALA 54 77.492 10.807 -0.371 203 2HB ALA 54 HB2 ALA 54 78.153 9.428 -1.253 204 3HB ALA 54 HB3 ALA 54 76.431 9.490 -0.872 205 H MET 55 HN MET 55 74.568 10.264 -2.571 206 HA MET 55 HA MET 55 74.656 7.956 -4.344 207 1HB MET 55 HB2 MET 55 72.460 9.836 -3.395 208 2HB MET 55 HB1 MET 55 72.160 8.339 -4.287 209 1HG MET 55 HG2 MET 55 73.942 7.832 -2.064 210 2HG MET 55 HG1 MET 55 72.466 8.629 -1.497 211 1HE MET 55 HE1 MET 55 71.974 6.905 -0.119 212 2HE MET 55 HE2 MET 55 71.102 5.429 -0.526 213 3HE MET 55 HE3 MET 55 70.349 6.996 -0.811 214 H GLU 56 HN GLU 56 73.797 11.395 -4.685 215 HA GLU 56 HA GLU 56 73.209 11.213 -7.534 216 1HB GLU 56 HB2 GLU 56 73.629 13.423 -5.512 217 2HB GLU 56 HB1 GLU 56 73.299 13.769 -7.210 218 1HG GLU 56 HG2 GLU 56 71.514 11.812 -5.834 219 2HG GLU 56 HG1 GLU 56 71.327 13.515 -5.415 220 H LYS 57 HN LYS 57 75.810 12.953 -5.744 221 HA LYS 57 HA LYS 57 77.474 13.700 -7.825 222 1HB LYS 57 HB2 LYS 57 78.140 12.461 -5.134 223 2HB LYS 57 HB1 LYS 57 79.337 13.257 -6.153 224 1HG LYS 57 HG2 LYS 57 76.798 14.715 -5.512 225 2HG LYS 57 HG1 LYS 57 78.056 14.621 -4.279 226 1HD LYS 57 HD2 LYS 57 78.921 15.352 -7.036 227 2HD LYS 57 HD1 LYS 57 78.012 16.567 -6.137 228 1HE LYS 57 HE2 LYS 57 79.774 15.720 -4.216 229 2HE LYS 57 HE1 LYS 57 80.760 15.566 -5.685 230 1HZ LYS 57 HZ1 LYS 57 81.001 17.791 -5.298 231 2HZ LYS 57 HZ2 LYS 57 79.498 17.944 -4.523 232 3HZ LYS 57 HZ3 LYS 57 79.576 17.845 -6.216 233 H LEU 58 HN LEU 58 77.973 10.626 -6.058 234 HA LEU 58 HA LEU 58 79.729 9.323 -7.752 235 1HB LEU 58 HB2 LEU 58 77.267 8.329 -6.274 236 2HB LEU 58 HB1 LEU 58 78.486 7.249 -6.961 237 HG LEU 58 HG LEU 58 79.000 9.404 -4.887 238 1HD1 LEU 58 HD11 LEU 58 77.806 7.055 -4.385 239 2HD1 LEU 58 HD12 LEU 58 78.982 7.757 -3.273 240 3HD1 LEU 58 HD13 LEU 58 79.479 6.498 -4.404 241 1HD2 LEU 58 HD21 LEU 58 80.807 7.373 -6.226 242 2HD2 LEU 58 HD22 LEU 58 81.260 8.307 -4.800 243 3HD2 LEU 58 HD23 LEU 58 80.928 9.130 -6.326 244 H LYS 59 HN LYS 59 76.210 9.668 -8.147 245 HA LYS 59 HA LYS 59 76.051 8.092 -10.589 246 1HB LYS 59 HB2 LYS 59 74.346 9.611 -8.757 247 2HB LYS 59 HB1 LYS 59 73.844 9.778 -10.440 248 1HG LYS 59 HG2 LYS 59 74.573 7.040 -9.842 249 2HG LYS 59 HG1 LYS 59 73.319 7.609 -8.741 250 1HD LYS 59 HD2 LYS 59 73.180 7.944 -11.751 251 2HD LYS 59 HD1 LYS 59 72.445 6.592 -10.890 252 1HE LYS 59 HE2 LYS 59 71.830 9.522 -10.350 253 2HE LYS 59 HE1 LYS 59 70.798 8.417 -11.279 254 1HZ LYS 59 HZ1 LYS 59 71.449 8.396 -8.412 255 2HZ LYS 59 HZ2 LYS 59 71.173 6.909 -9.186 256 3HZ LYS 59 HZ3 LYS 59 69.963 8.103 -9.177 257 H SER 60 HN SER 60 75.210 11.532 -10.145 258 HA SER 60 HA SER 60 75.208 12.487 -12.700 259 1HB SER 60 HB2 SER 60 76.852 14.188 -10.984 260 2HB SER 60 HB1 SER 60 75.217 14.461 -11.588 261 HG SER 60 HG SER 60 76.017 12.971 -9.320 262 H GLY 61 HN GLY 61 78.067 11.448 -10.925 263 1HA GLY 61 HA2 GLY 61 79.991 10.596 -12.187 264 2HA GLY 61 HA1 GLY 61 79.639 11.799 -13.436 265 H MET 62 HN MET 62 79.686 12.409 -9.925 266 HA MET 62 HA MET 62 81.685 14.541 -10.404 267 1HB MET 62 HB2 MET 62 79.423 14.269 -8.846 268 2HB MET 62 HB1 MET 62 80.715 14.009 -7.674 269 1HG MET 62 HG2 MET 62 80.485 16.339 -7.629 270 2HG MET 62 HG1 MET 62 81.790 16.125 -8.794 271 1HE MET 62 HE1 MET 62 77.356 16.846 -9.783 272 2HE MET 62 HE2 MET 62 78.068 17.080 -8.188 273 3HE MET 62 HE3 MET 62 78.000 15.464 -8.886 274 H ARG 63 HN ARG 63 82.553 14.213 -7.535 275 HA ARG 63 HA ARG 63 84.842 12.463 -8.054 276 1HB ARG 63 HB2 ARG 63 83.843 14.034 -5.667 277 2HB ARG 63 HB1 ARG 63 85.402 13.204 -5.723 278 1HG ARG 63 HG2 ARG 63 86.332 14.807 -6.999 279 2HG ARG 63 HG1 ARG 63 84.905 14.952 -8.030 280 1HD ARG 63 HD2 ARG 63 83.958 16.602 -6.714 281 2HD ARG 63 HD1 ARG 63 84.636 15.932 -5.212 282 HE ARG 63 HE ARG 63 86.900 16.734 -6.486 283 1HH1 ARG 63 HH21 ARG 63 83.984 18.245 -5.508 284 2HH1 ARG 63 HH22 ARG 63 84.551 19.854 -5.811 285 1HH2 ARG 63 HH11 ARG 63 87.586 18.821 -7.131 286 2HH2 ARG 63 HH12 ARG 63 86.590 20.180 -6.729 287 H PHE 64 HN PHE 64 85.094 10.367 -7.259 288 HA PHE 64 HA PHE 64 82.815 9.184 -5.797 289 1HB PHE 64 HB2 PHE 64 84.295 8.260 -7.824 290 2HB PHE 64 HB1 PHE 64 85.337 7.728 -6.505 291 HD1 PHE 64 HD1 PHE 64 83.501 7.021 -4.374 292 HD2 PHE 64 HD2 PHE 64 83.112 6.393 -8.606 293 HE1 PHE 64 HE1 PHE 64 81.986 5.103 -3.950 294 HE2 PHE 64 HE2 PHE 64 81.598 4.474 -8.181 295 HZ PHE 64 HZ PHE 64 81.034 3.830 -5.853 296 H ASN 65 HN ASN 65 86.270 9.921 -5.444 297 HA ASN 65 HA ASN 65 86.289 8.905 -2.673 298 1HB ASN 65 HB2 ASN 65 88.674 9.335 -2.836 299 2HB ASN 65 HB1 ASN 65 88.127 8.503 -4.289 300 1HD2 ASN 65 HD21 ASN 65 88.909 9.415 -6.172 301 2HD2 ASN 65 HD22 ASN 65 89.301 11.054 -6.381 302 H GLU 66 HN GLU 66 86.454 12.099 -4.330 303 HA GLU 66 HA GLU 66 87.113 13.650 -2.027 304 1HB GLU 66 HB2 GLU 66 85.136 14.355 -4.218 305 2HB GLU 66 HB1 GLU 66 86.064 15.484 -3.241 306 1HG GLU 66 HG2 GLU 66 87.169 13.520 -5.271 307 2HG GLU 66 HG1 GLU 66 87.165 15.276 -5.391 308 H VAL 67 HN VAL 67 83.899 12.815 -3.370 309 HA VAL 67 HA VAL 67 82.283 13.674 -1.229 310 HB VAL 67 HB VAL 67 80.829 11.750 -1.995 311 1HG1 VAL 67 HG11 VAL 67 82.067 13.482 -4.122 312 2HG1 VAL 67 HG12 VAL 67 80.663 13.882 -3.130 313 3HG1 VAL 67 HG13 VAL 67 80.560 12.584 -4.325 314 1HG2 VAL 67 HG21 VAL 67 81.750 10.656 -4.154 315 2HG2 VAL 67 HG22 VAL 67 82.265 10.034 -2.585 316 3HG2 VAL 67 HG23 VAL 67 83.325 11.105 -3.499 317 H ALA 68 HN ALA 68 83.955 10.593 -1.813 318 HA ALA 68 HA ALA 68 83.297 9.184 0.495 319 1HB ALA 68 HB1 ALA 68 85.188 7.861 -0.027 320 2HB ALA 68 HB2 ALA 68 86.079 9.236 -0.666 321 3HB ALA 68 HB3 ALA 68 84.725 8.564 -1.577 322 H ALA 69 HN ALA 69 85.911 11.574 0.006 323 HA ALA 69 HA ALA 69 87.263 11.539 2.416 324 1HB ALA 69 HB1 ALA 69 86.287 14.217 1.632 325 2HB ALA 69 HB2 ALA 69 86.950 13.275 0.295 326 3HB ALA 69 HB3 ALA 69 87.941 13.611 1.714 327 H GLN 70 HN GLN 70 84.361 13.604 1.927 328 HA GLN 70 HA GLN 70 83.873 13.488 4.826 329 1HB GLN 70 HB2 GLN 70 83.508 15.354 2.777 330 2HB GLN 70 HB1 GLN 70 81.885 14.855 3.248 331 1HG GLN 70 HG2 GLN 70 84.019 15.488 5.254 332 2HG GLN 70 HG1 GLN 70 82.936 16.743 4.632 333 1HE2 GLN 70 HE21 GLN 70 82.553 13.323 5.953 334 2HE2 GLN 70 HE22 GLN 70 81.190 13.713 6.876 335 H TYR 71 HN TYR 71 81.811 13.170 1.959 336 HA TYR 71 HA TYR 71 79.540 12.100 3.030 337 1HB TYR 71 HB2 TYR 71 80.951 11.247 0.476 338 2HB TYR 71 HB1 TYR 71 79.250 10.972 0.827 339 HD1 TYR 71 HD1 TYR 71 79.278 12.340 -1.484 340 HD2 TYR 71 HD2 TYR 71 80.155 14.043 2.364 341 HE1 TYR 71 HE1 TYR 71 78.717 14.588 -2.348 342 HE2 TYR 71 HE2 TYR 71 79.594 16.285 1.493 343 HH TYR 71 HH TYR 71 78.328 17.305 -0.279 344 H SER 72 HN SER 72 82.627 10.418 2.695 345 HA SER 72 HA SER 72 81.408 7.859 3.568 346 1HB SER 72 HB2 SER 72 83.366 6.923 2.817 347 2HB SER 72 HB1 SER 72 83.538 8.459 1.992 348 HG SER 72 HG SER 72 84.697 9.211 3.824 349 H GLU 73 HN GLU 73 83.107 6.823 5.359 350 HA GLU 73 HA GLU 73 82.667 8.407 7.780 351 1HB GLU 73 HB2 GLU 73 83.952 6.331 8.747 352 2HB GLU 73 HB1 GLU 73 82.324 6.102 8.109 353 1HG GLU 73 HG2 GLU 73 84.128 4.415 7.377 354 2HG GLU 73 HG1 GLU 73 83.132 5.121 6.107 355 H ASP 74 HN ASP 74 84.165 10.032 6.479 356 HA ASP 74 HA ASP 74 86.163 11.290 6.671 357 1HB ASP 74 HB2 ASP 74 86.018 10.448 9.041 358 2HB ASP 74 HB1 ASP 74 87.001 9.067 8.563 359 H LYS 75 HN LYS 75 87.185 7.845 6.915 360 HA LYS 75 HA LYS 75 89.432 8.062 5.194 361 1HB LYS 75 HB2 LYS 75 88.243 6.148 6.731 362 2HB LYS 75 HB1 LYS 75 87.817 5.567 5.122 363 1HG LYS 75 HG2 LYS 75 90.624 6.246 6.056 364 2HG LYS 75 HG1 LYS 75 89.970 4.615 5.894 365 1HD LYS 75 HD2 LYS 75 89.395 5.584 3.435 366 2HD LYS 75 HD1 LYS 75 90.844 6.523 3.793 367 1HE LYS 75 HE2 LYS 75 92.059 4.698 3.194 368 2HE LYS 75 HE1 LYS 75 91.423 3.885 4.636 369 1HZ LYS 75 HZ1 LYS 75 89.660 4.119 2.311 370 2HZ LYS 75 HZ2 LYS 75 89.777 2.872 3.457 371 3HZ LYS 75 HZ3 LYS 75 90.923 2.992 2.208 372 H ALA 76 HN ALA 76 89.442 8.593 3.021 373 HA ALA 76 HA ALA 76 86.906 8.363 1.494 374 1HB ALA 76 HB1 ALA 76 87.730 10.426 1.018 375 2HB ALA 76 HB2 ALA 76 88.744 9.568 -0.139 376 3HB ALA 76 HB3 ALA 76 89.377 9.974 1.457 377 H ARG 77 HN ARG 77 90.010 8.209 -0.127 378 HA ARG 77 HA ARG 77 90.795 6.606 -1.693 379 1HB ARG 77 HB2 ARG 77 89.857 5.110 0.748 380 2HB ARG 77 HB1 ARG 77 90.488 4.216 -0.633 381 1HG ARG 77 HG2 ARG 77 92.098 6.552 0.240 382 2HG ARG 77 HG1 ARG 77 92.063 5.183 1.353 383 1HD ARG 77 HD2 ARG 77 93.503 4.045 0.024 384 2HD ARG 77 HD1 ARG 77 92.398 4.219 -1.355 385 HE ARG 77 HE ARG 77 93.818 6.690 -0.724 386 1HH1 ARG 77 HH11 ARG 77 93.103 4.542 -3.145 387 2HH1 ARG 77 HH12 ARG 77 94.619 4.669 -3.974 388 1HH2 ARG 77 HH21 ARG 77 96.149 6.489 -1.450 389 2HH2 ARG 77 HH22 ARG 77 96.343 5.769 -3.014 390 H GLN 78 HN GLN 78 89.195 7.072 -3.336 391 HA GLN 78 HA GLN 78 87.450 6.508 -4.823 392 1HB GLN 78 HB2 GLN 78 88.382 4.325 -4.964 393 2HB GLN 78 HB1 GLN 78 87.925 3.937 -3.304 394 1HG GLN 78 HG2 GLN 78 85.620 4.693 -4.967 395 2HG GLN 78 HG1 GLN 78 86.465 3.260 -5.570 396 1HE2 GLN 78 HE21 GLN 78 83.995 4.129 -3.504 397 2HE2 GLN 78 HE22 GLN 78 84.056 2.826 -2.415 398 H GLY 79 HN GLY 79 86.447 4.565 -2.029 399 1HA GLY 79 HA2 GLY 79 84.501 6.493 -1.100 400 2HA GLY 79 HA1 GLY 79 83.745 5.197 -2.023 401 H GLY 80 HN GLY 80 86.511 5.189 0.226 402 1HA GLY 80 HA2 GLY 80 86.719 4.105 2.320 403 2HA GLY 80 HA1 GLY 80 85.011 3.670 2.226 404 H ASP 81 HN ASP 81 87.583 3.028 -0.150 405 HA ASP 81 HA ASP 81 86.740 0.259 -0.430 406 1HB ASP 81 HB2 ASP 81 88.049 2.125 -1.943 407 2HB ASP 81 HB1 ASP 81 89.401 1.115 -1.408 408 H LEU 82 HN LEU 82 87.052 -0.322 1.948 409 HA LEU 82 HA LEU 82 89.551 -0.308 3.280 410 1HB LEU 82 HB2 LEU 82 87.103 -2.081 3.305 411 2HB LEU 82 HB1 LEU 82 88.452 -2.376 4.401 412 HG LEU 82 HG LEU 82 86.893 -1.002 5.581 413 1HD1 LEU 82 HD11 LEU 82 88.624 1.234 4.771 414 2HD1 LEU 82 HD12 LEU 82 89.497 -0.248 5.159 415 3HD1 LEU 82 HD13 LEU 82 88.427 0.483 6.355 416 1HD2 LEU 82 HD21 LEU 82 86.980 1.085 3.429 417 2HD2 LEU 82 HD22 LEU 82 85.815 0.900 4.739 418 3HD2 LEU 82 HD23 LEU 82 85.797 -0.224 3.379 419 H GLY 83 HN GLY 83 88.477 -2.118 0.549 420 1HA GLY 83 HA2 GLY 83 90.064 -3.339 -0.838 421 2HA GLY 83 HA1 GLY 83 91.003 -3.694 0.621 422 H TRP 84 HN TRP 84 90.476 -5.857 -0.859 423 HA TRP 84 HA TRP 84 88.124 -7.293 -0.789 424 1HB TRP 84 HB2 TRP 84 91.026 -7.896 -0.443 425 2HB TRP 84 HB1 TRP 84 89.898 -9.210 -0.137 426 HD1 TRP 84 HD1 TRP 84 91.587 -7.414 -2.851 427 HE1 TRP 84 HE1 TRP 84 90.667 -8.147 -5.148 428 HE3 TRP 84 HE3 TRP 84 87.479 -9.995 -1.335 429 HZ2 TRP 84 HZ2 TRP 84 88.461 -9.654 -6.194 430 HZ3 TRP 84 HZ3 TRP 84 85.989 -11.076 -2.983 431 HH2 TRP 84 HH2 TRP 84 86.466 -10.909 -5.413 432 H MET 85 HN MET 85 86.965 -8.522 0.819 433 HA MET 85 HA MET 85 87.994 -8.311 3.625 434 1HB MET 85 HB2 MET 85 86.165 -6.563 2.562 435 2HB MET 85 HB1 MET 85 85.115 -7.793 3.268 436 1HG MET 85 HG2 MET 85 85.467 -6.317 5.063 437 2HG MET 85 HG1 MET 85 86.660 -7.582 5.355 438 1HE MET 85 HE1 MET 85 86.090 -4.639 6.132 439 2HE MET 85 HE2 MET 85 87.412 -3.515 5.830 440 3HE MET 85 HE3 MET 85 87.662 -4.890 6.902 441 H THR 86 HN THR 86 87.607 -10.148 4.778 442 HA THR 86 HA THR 86 85.710 -12.164 3.621 443 HB THR 86 HB THR 86 87.429 -13.651 5.044 444 HG1 THR 86 HG1 THR 86 89.169 -12.615 5.547 445 1HG2 THR 86 HG21 THR 86 88.363 -12.531 2.409 446 2HG2 THR 86 HG22 THR 86 86.925 -13.547 2.505 447 3HG2 THR 86 HG23 THR 86 88.491 -14.184 3.009 448 H ARG 87 HN ARG 87 84.399 -13.308 5.152 449 HA ARG 87 HA ARG 87 83.479 -11.897 7.435 450 1HB ARG 87 HB2 ARG 87 82.978 -14.317 6.012 451 2HB ARG 87 HB1 ARG 87 83.094 -14.728 7.723 452 1HG ARG 87 HG2 ARG 87 81.609 -12.338 7.627 453 2HG ARG 87 HG1 ARG 87 80.970 -13.338 6.323 454 1HD ARG 87 HD2 ARG 87 81.417 -14.435 9.114 455 2HD ARG 87 HD1 ARG 87 79.882 -13.699 8.614 456 HE ARG 87 HE ARG 87 79.719 -15.431 6.853 457 1HH1 ARG 87 HH21 ARG 87 80.744 -16.414 9.794 458 2HH1 ARG 87 HH22 ARG 87 81.601 -17.825 9.269 459 1HH2 ARG 87 HH11 ARG 87 81.452 -16.988 5.907 460 2HH2 ARG 87 HH12 ARG 87 82.003 -18.149 7.068 461 H GLY 88 HN GLY 88 83.769 -12.413 9.721 462 1HA GLY 88 HA2 GLY 88 84.933 -13.631 11.500 463 2HA GLY 88 HA1 GLY 88 86.238 -13.967 10.353 464 H SER 89 HN SER 89 85.966 -11.062 9.408 465 HA SER 89 HA SER 89 87.321 -9.763 11.750 466 1HB SER 89 HB2 SER 89 88.630 -10.718 9.618 467 2HB SER 89 HB1 SER 89 88.138 -9.161 8.935 468 HG SER 89 HG SER 89 89.644 -9.642 11.285 469 H MET 90 HN MET 90 84.620 -9.641 9.955 470 HA MET 90 HA MET 90 84.635 -6.669 9.600 471 1HB MET 90 HB2 MET 90 83.860 -8.804 7.985 472 2HB MET 90 HB1 MET 90 82.333 -8.181 8.609 473 1HG MET 90 HG2 MET 90 83.542 -5.845 8.005 474 2HG MET 90 HG1 MET 90 84.320 -6.884 6.811 475 1HE MET 90 HE1 MET 90 83.638 -7.899 5.194 476 2HE MET 90 HE2 MET 90 82.392 -7.250 4.132 477 3HE MET 90 HE3 MET 90 82.062 -8.695 5.083 478 H VAL 91 HN VAL 91 81.651 -6.725 9.581 479 HA VAL 91 HA VAL 91 81.220 -6.902 12.545 480 HB VAL 91 HB VAL 91 79.740 -5.179 10.545 481 1HG1 VAL 91 HG11 VAL 91 79.452 -5.706 13.311 482 2HG1 VAL 91 HG12 VAL 91 78.624 -4.467 12.368 483 3HG1 VAL 91 HG13 VAL 91 80.139 -4.087 13.186 484 1HG2 VAL 91 HG21 VAL 91 81.821 -4.253 10.213 485 2HG2 VAL 91 HG22 VAL 91 82.449 -4.860 11.746 486 3HG2 VAL 91 HG23 VAL 91 81.415 -3.431 11.720 487 H GLY 92 HN GLY 92 79.003 -7.513 13.196 488 1HA GLY 92 HA2 GLY 92 78.000 -9.780 11.738 489 2HA GLY 92 HA1 GLY 92 77.202 -9.017 13.119 490 HA PRO 93 HA PRO 93 74.214 -6.930 10.694 491 1HB PRO 93 HB2 PRO 93 75.113 -4.210 10.980 492 2HB PRO 93 HB1 PRO 93 73.814 -5.031 11.861 493 1HG PRO 93 HG2 PRO 93 76.417 -4.265 12.834 494 2HG PRO 93 HG1 PRO 93 75.106 -5.042 13.724 495 1HD PRO 93 HD2 PRO 93 77.591 -6.217 12.887 496 2HD PRO 93 HD1 PRO 93 76.239 -7.021 13.719 497 H PHE 94 HN PHE 94 77.274 -5.116 10.161 498 HA PHE 94 HA PHE 94 76.832 -4.266 7.523 499 1HB PHE 94 HB2 PHE 94 78.746 -3.778 9.137 500 2HB PHE 94 HB1 PHE 94 79.449 -5.322 8.630 501 HD1 PHE 94 HD1 PHE 94 79.347 -1.855 7.959 502 HD2 PHE 94 HD2 PHE 94 79.552 -5.671 5.991 503 HE1 PHE 94 HE1 PHE 94 80.301 -0.769 5.944 504 HE2 PHE 94 HE2 PHE 94 80.504 -4.582 3.978 505 HZ PHE 94 HZ PHE 94 80.879 -2.131 3.954 506 H GLN 95 HN GLN 95 78.520 -7.275 8.514 507 HA GLN 95 HA GLN 95 78.771 -8.365 5.884 508 1HB GLN 95 HB2 GLN 95 80.116 -9.241 7.623 509 2HB GLN 95 HB1 GLN 95 78.736 -9.447 8.701 510 1HG GLN 95 HG2 GLN 95 78.324 -10.952 6.266 511 2HG GLN 95 HG1 GLN 95 79.870 -11.390 6.995 512 1HE2 GLN 95 HE21 GLN 95 77.326 -12.995 6.924 513 2HE2 GLN 95 HE22 GLN 95 76.941 -13.306 8.548 514 H GLU 96 HN GLU 96 76.311 -8.939 8.420 515 HA GLU 96 HA GLU 96 74.712 -10.876 7.250 516 1HB GLU 96 HB2 GLU 96 74.426 -8.630 9.105 517 2HB GLU 96 HB1 GLU 96 72.917 -9.012 8.277 518 1HG GLU 96 HG2 GLU 96 74.324 -11.421 9.128 519 2HG GLU 96 HG1 GLU 96 73.964 -10.356 10.487 520 H ALA 97 HN ALA 97 74.951 -7.464 6.316 521 HA ALA 97 HA ALA 97 72.738 -7.723 4.374 522 1HB ALA 97 HB1 ALA 97 72.711 -5.620 5.318 523 2HB ALA 97 HB2 ALA 97 73.784 -5.277 3.961 524 3HB ALA 97 HB3 ALA 97 74.458 -5.596 5.559 525 H ALA 98 HN ALA 98 75.775 -6.048 3.784 526 HA ALA 98 HA ALA 98 76.046 -6.570 1.072 527 1HB ALA 98 HB1 ALA 98 77.922 -5.383 1.484 528 2HB ALA 98 HB2 ALA 98 78.610 -6.718 2.410 529 3HB ALA 98 HB3 ALA 98 77.572 -5.535 3.206 530 H PHE 99 HN PHE 99 78.044 -8.366 3.434 531 HA PHE 99 HA PHE 99 78.983 -10.417 1.864 532 1HB PHE 99 HB2 PHE 99 78.532 -9.871 4.632 533 2HB PHE 99 HB1 PHE 99 78.085 -11.557 4.330 534 HD1 PHE 99 HD1 PHE 99 80.754 -9.133 3.265 535 HD2 PHE 99 HD2 PHE 99 79.786 -13.126 4.517 536 HE1 PHE 99 HE1 PHE 99 83.153 -9.751 3.152 537 HE2 PHE 99 HE2 PHE 99 82.184 -13.744 4.403 538 HZ PHE 99 HZ PHE 99 83.866 -12.056 3.721 539 H ALA 100 HN ALA 100 75.689 -10.109 3.104 540 HA ALA 100 HA ALA 100 74.976 -12.735 1.875 541 1HB ALA 100 HB1 ALA 100 72.827 -11.446 3.270 542 2HB ALA 100 HB2 ALA 100 74.290 -11.296 4.243 543 3HB ALA 100 HB3 ALA 100 73.722 -12.889 3.743 544 H LEU 101 HN LEU 101 75.181 -9.642 0.823 545 HA LEU 101 HA LEU 101 72.621 -9.804 -0.727 546 1HB LEU 101 HB2 LEU 101 74.243 -7.589 0.487 547 2HB LEU 101 HB1 LEU 101 73.219 -7.246 -0.912 548 HG LEU 101 HG LEU 101 72.133 -8.740 1.470 549 1HD1 LEU 101 HD11 LEU 101 71.314 -6.004 1.515 550 2HD1 LEU 101 HD12 LEU 101 73.077 -6.041 1.469 551 3HD1 LEU 101 HD13 LEU 101 72.210 -6.891 2.748 552 1HD2 LEU 101 HD21 LEU 101 70.008 -7.970 0.614 553 2HD2 LEU 101 HD22 LEU 101 70.913 -8.648 -0.740 554 3HD2 LEU 101 HD23 LEU 101 70.805 -6.900 -0.538 555 HA PRO 102 HA PRO 102 74.746 -9.951 -4.567 556 1HB PRO 102 HB2 PRO 102 73.419 -7.697 -5.753 557 2HB PRO 102 HB1 PRO 102 73.028 -9.413 -5.942 558 1HG PRO 102 HG2 PRO 102 71.554 -7.408 -4.504 559 2HG PRO 102 HG1 PRO 102 71.163 -9.123 -4.683 560 1HD PRO 102 HD2 PRO 102 72.122 -7.750 -2.328 561 2HD PRO 102 HD1 PRO 102 71.693 -9.471 -2.498 562 H VAL 103 HN VAL 103 76.395 -8.877 -5.837 563 HA VAL 103 HA VAL 103 77.846 -6.742 -4.464 564 HB VAL 103 HB VAL 103 78.124 -8.501 -6.877 565 1HG1 VAL 103 HG11 VAL 103 80.227 -7.211 -7.488 566 2HG1 VAL 103 HG12 VAL 103 79.627 -5.904 -6.467 567 3HG1 VAL 103 HG13 VAL 103 78.714 -6.401 -7.890 568 1HG2 VAL 103 HG21 VAL 103 78.981 -9.034 -4.551 569 2HG2 VAL 103 HG22 VAL 103 80.120 -7.701 -4.743 570 3HG2 VAL 103 HG23 VAL 103 80.205 -9.095 -5.820 571 H SER 104 HN SER 104 78.220 -4.573 -5.457 572 HA SER 104 HA SER 104 77.074 -3.597 -7.842 573 1HB SER 104 HB2 SER 104 75.152 -4.341 -5.803 574 2HB SER 104 HB1 SER 104 75.024 -2.618 -6.163 575 HG SER 104 HG SER 104 75.344 -4.148 -8.400 576 H GLY 105 HN GLY 105 76.336 -2.321 -4.597 577 1HA GLY 105 HA2 GLY 105 76.963 -0.325 -3.558 578 2HA GLY 105 HA1 GLY 105 78.528 -0.572 -4.324 579 H MET 106 HN MET 106 77.391 1.976 -3.955 580 HA MET 106 HA MET 106 77.379 3.968 -5.162 581 1HB MET 106 HB2 MET 106 78.638 2.157 -6.707 582 2HB MET 106 HB1 MET 106 77.283 2.545 -7.747 583 1HG MET 106 HG2 MET 106 78.552 4.892 -6.485 584 2HG MET 106 HG1 MET 106 79.616 4.004 -7.583 585 1HE MET 106 HE1 MET 106 76.378 5.389 -6.825 586 2HE MET 106 HE2 MET 106 75.564 5.824 -8.322 587 3HE MET 106 HE3 MET 106 76.800 6.883 -7.670 588 H ASP 107 HN ASP 107 75.877 3.535 -8.023 589 HA ASP 107 HA ASP 107 73.318 4.512 -7.013 590 1HB ASP 107 HB2 ASP 107 72.810 4.343 -9.575 591 2HB ASP 107 HB1 ASP 107 73.981 5.523 -9.012 592 H LYS 108 HN LYS 108 74.480 1.396 -8.154 593 HA LYS 108 HA LYS 108 71.669 0.373 -7.954 594 1HB LYS 108 HB2 LYS 108 72.704 -1.444 -9.481 595 2HB LYS 108 HB1 LYS 108 72.416 0.147 -10.193 596 1HG LYS 108 HG2 LYS 108 74.746 0.751 -9.900 597 2HG LYS 108 HG1 LYS 108 75.061 -0.720 -8.980 598 1HD LYS 108 HD2 LYS 108 73.983 -0.860 -11.793 599 2HD LYS 108 HD1 LYS 108 75.713 -0.682 -11.500 600 1HE LYS 108 HE2 LYS 108 75.864 -2.902 -11.074 601 2HE LYS 108 HE1 LYS 108 74.688 -2.733 -9.757 602 1HZ LYS 108 HZ1 LYS 108 73.961 -4.195 -11.653 603 2HZ LYS 108 HZ2 LYS 108 73.924 -2.804 -12.627 604 3HZ LYS 108 HZ3 LYS 108 72.898 -2.927 -11.279 605 HA PRO 109 HA PRO 109 74.787 -1.485 -4.784 606 1HB PRO 109 HB2 PRO 109 72.917 -0.731 -2.739 607 2HB PRO 109 HB1 PRO 109 74.578 -0.162 -2.969 608 1HG PRO 109 HG2 PRO 109 72.099 1.240 -3.498 609 2HG PRO 109 HG1 PRO 109 73.753 1.855 -3.596 610 1HD PRO 109 HD2 PRO 109 72.008 1.327 -5.780 611 2HD PRO 109 HD1 PRO 109 73.746 1.711 -5.857 612 H VAL 110 HN VAL 110 73.798 -2.916 -2.841 613 HA VAL 110 HA VAL 110 72.660 -5.251 -3.758 614 HB VAL 110 HB VAL 110 71.819 -5.431 -1.369 615 1HG1 VAL 110 HG11 VAL 110 74.176 -5.927 -2.074 616 2HG1 VAL 110 HG12 VAL 110 73.988 -5.425 -0.394 617 3HG1 VAL 110 HG13 VAL 110 74.594 -4.282 -1.592 618 1HG2 VAL 110 HG21 VAL 110 72.556 -3.490 0.088 619 2HG2 VAL 110 HG22 VAL 110 71.172 -3.166 -0.953 620 3HG2 VAL 110 HG23 VAL 110 72.763 -2.559 -1.392 621 H PHE 111 HN PHE 111 70.418 -5.950 -2.568 622 HA PHE 111 HA PHE 111 68.278 -4.658 -4.067 623 1HB PHE 111 HB2 PHE 111 68.783 -7.038 -2.402 624 2HB PHE 111 HB1 PHE 111 67.154 -6.376 -2.214 625 HD1 PHE 111 HD1 PHE 111 65.554 -7.286 -3.645 626 HD2 PHE 111 HD2 PHE 111 69.609 -6.901 -5.011 627 HE1 PHE 111 HE1 PHE 111 64.913 -8.277 -5.827 628 HE2 PHE 111 HE2 PHE 111 68.967 -7.893 -7.194 629 HZ PHE 111 HZ PHE 111 66.620 -8.581 -7.601 630 H THR 112 HN THR 112 69.761 -4.320 -0.941 631 HA THR 112 HA THR 112 67.375 -2.951 0.204 632 HB THR 112 HB THR 112 68.835 -4.529 1.506 633 HG1 THR 112 HG1 THR 112 67.850 -3.254 2.878 634 1HG2 THR 112 HG21 THR 112 70.859 -2.470 0.746 635 2HG2 THR 112 HG22 THR 112 71.031 -4.221 0.878 636 3HG2 THR 112 HG23 THR 112 70.995 -3.225 2.334 637 H ASP 113 HN ASP 113 69.101 -1.076 1.744 638 HA ASP 113 HA ASP 113 69.499 0.943 -0.431 639 1HB ASP 113 HB2 ASP 113 69.204 1.403 2.547 640 2HB ASP 113 HB1 ASP 113 68.936 2.560 1.243 641 HA PRO 114 HA PRO 114 73.826 0.882 0.251 642 1HB PRO 114 HB2 PRO 114 74.106 3.704 -0.204 643 2HB PRO 114 HB1 PRO 114 74.447 2.372 -1.322 644 1HG PRO 114 HG2 PRO 114 72.267 4.228 -1.434 645 2HG PRO 114 HG1 PRO 114 72.583 2.867 -2.511 646 1HD PRO 114 HD2 PRO 114 70.517 3.109 -0.487 647 2HD PRO 114 HD1 PRO 114 70.787 1.772 -1.627 648 HA PRO 115 HA PRO 115 74.281 4.169 3.776 649 1HB PRO 115 HB2 PRO 115 71.691 5.300 4.302 650 2HB PRO 115 HB1 PRO 115 73.135 6.124 3.701 651 1HG PRO 115 HG2 PRO 115 70.734 5.562 2.265 652 2HG PRO 115 HG1 PRO 115 72.223 6.282 1.632 653 1HD PRO 115 HD2 PRO 115 71.171 3.592 1.192 654 2HD PRO 115 HD1 PRO 115 72.554 4.387 0.422 655 H VAL 116 HN VAL 116 74.239 1.900 4.734 656 HA VAL 116 HA VAL 116 71.723 1.222 6.171 657 HB VAL 116 HB VAL 116 72.682 -0.956 6.306 658 1HG1 VAL 116 HG11 VAL 116 72.578 0.461 3.813 659 2HG1 VAL 116 HG12 VAL 116 72.230 -1.240 4.121 660 3HG1 VAL 116 HG13 VAL 116 73.876 -0.731 3.746 661 1HG2 VAL 116 HG21 VAL 116 75.293 0.246 5.381 662 2HG2 VAL 116 HG22 VAL 116 75.010 -1.439 5.818 663 3HG2 VAL 116 HG23 VAL 116 74.923 -0.181 7.053 664 H LYS 117 HN LYS 117 71.748 0.911 8.464 665 HA LYS 117 HA LYS 117 73.905 2.401 9.875 666 1HB LYS 117 HB2 LYS 117 71.221 2.543 9.992 667 2HB LYS 117 HB1 LYS 117 71.489 1.323 11.246 668 1HG LYS 117 HG2 LYS 117 73.346 3.606 11.390 669 2HG LYS 117 HG1 LYS 117 71.651 4.048 11.640 670 1HD LYS 117 HD2 LYS 117 72.533 1.588 13.036 671 2HD LYS 117 HD1 LYS 117 73.274 3.088 13.611 672 1HE LYS 117 HE2 LYS 117 71.351 3.225 14.872 673 2HE LYS 117 HE1 LYS 117 70.654 3.862 13.370 674 1HZ LYS 117 HZ1 LYS 117 70.817 0.968 14.040 675 2HZ LYS 117 HZ2 LYS 117 70.004 1.668 12.724 676 3HZ LYS 117 HZ3 LYS 117 69.435 1.914 14.305 677 H THR 118 HN THR 118 75.208 1.407 11.441 678 HA THR 118 HA THR 118 74.636 -1.192 12.581 679 HB THR 118 HB THR 118 75.075 -1.889 10.282 680 HG1 THR 118 HG1 THR 118 76.904 -3.210 10.704 681 1HG2 THR 118 HG21 THR 118 76.440 0.221 9.794 682 2HG2 THR 118 HG22 THR 118 77.039 -1.277 9.080 683 3HG2 THR 118 HG23 THR 118 77.808 -0.620 10.525 684 H LYS 119 HN LYS 119 77.146 1.153 11.649 685 HA LYS 119 HA LYS 119 78.729 0.407 14.063 686 1HB LYS 119 HB2 LYS 119 79.662 0.584 11.687 687 2HB LYS 119 HB1 LYS 119 79.430 2.326 11.831 688 1HG LYS 119 HG2 LYS 119 81.680 1.946 12.507 689 2HG LYS 119 HG1 LYS 119 80.779 2.161 14.012 690 1HD LYS 119 HD2 LYS 119 80.493 -0.504 13.714 691 2HD LYS 119 HD1 LYS 119 82.035 -0.292 12.884 692 1HE LYS 119 HE2 LYS 119 82.976 0.825 14.861 693 2HE LYS 119 HE1 LYS 119 81.417 0.688 15.696 694 1HZ LYS 119 HZ1 LYS 119 83.168 -1.163 16.036 695 2HZ LYS 119 HZ2 LYS 119 82.695 -1.687 14.491 696 3HZ LYS 119 HZ3 LYS 119 81.558 -1.613 15.751 697 H PHE 120 HN PHE 120 76.952 3.115 12.611 698 HA PHE 120 HA PHE 120 76.526 4.392 15.157 699 1HB PHE 120 HB2 PHE 120 79.042 4.667 14.631 700 2HB PHE 120 HB1 PHE 120 78.522 5.811 13.386 701 HD1 PHE 120 HD1 PHE 120 77.891 5.026 17.005 702 HD2 PHE 120 HD2 PHE 120 78.276 8.050 13.979 703 HE1 PHE 120 HE1 PHE 120 77.619 6.787 18.730 704 HE2 PHE 120 HE2 PHE 120 78.006 9.811 15.704 705 HZ PHE 120 HZ PHE 120 77.677 9.179 18.079 706 H GLY 121 HN GLY 121 76.615 4.633 11.634 707 1HA GLY 121 HA2 GLY 121 74.112 6.187 11.713 708 2HA GLY 121 HA1 GLY 121 75.489 7.005 10.964 709 H TYR 122 HN TYR 122 74.029 6.896 9.008 710 HA TYR 122 HA TYR 122 73.732 4.226 7.767 711 1HB TYR 122 HB2 TYR 122 73.025 7.056 6.922 712 2HB TYR 122 HB1 TYR 122 72.600 5.613 6.003 713 HD1 TYR 122 HD1 TYR 122 71.727 3.669 7.908 714 HD2 TYR 122 HD2 TYR 122 71.150 7.923 7.977 715 HE1 TYR 122 HE1 TYR 122 69.704 3.373 9.316 716 HE2 TYR 122 HE2 TYR 122 69.134 7.630 9.386 717 HH TYR 122 HH TYR 122 67.438 5.067 9.655 718 H HIS 123 HN HIS 123 75.323 3.414 6.451 719 HA HIS 123 HA HIS 123 77.138 5.385 5.093 720 1HB HIS 123 HB2 HIS 123 78.911 3.629 5.417 721 2HB HIS 123 HB1 HIS 123 78.292 4.282 6.930 722 HD1 HIS 123 HD1 HIS 123 78.281 1.184 4.821 723 HD2 HIS 123 HD2 HIS 123 76.773 2.456 8.492 724 HE1 HIS 123 HE1 HIS 123 77.496 -0.893 6.036 725 H ILE 124 HN ILE 124 77.772 4.768 2.923 726 HA ILE 124 HA ILE 124 75.825 2.953 1.638 727 HB ILE 124 HB ILE 124 78.071 4.549 0.378 728 1HG1 ILE 124 HG12 ILE 124 75.316 5.418 1.299 729 2HG1 ILE 124 HG11 ILE 124 76.874 6.155 1.697 730 1HG2 ILE 124 HG21 ILE 124 77.171 3.846 -1.552 731 2HG2 ILE 124 HG22 ILE 124 75.581 4.431 -1.065 732 3HG2 ILE 124 HG23 ILE 124 76.096 2.801 -0.625 733 1HD1 ILE 124 HD11 ILE 124 77.060 6.477 -0.913 734 2HD1 ILE 124 HD12 ILE 124 76.083 7.600 0.033 735 3HD1 ILE 124 HD13 ILE 124 75.307 6.300 -0.870 736 H ILE 125 HN ILE 125 76.347 0.819 1.659 737 HA ILE 125 HA ILE 125 79.170 -0.049 1.656 738 HB ILE 125 HB ILE 125 76.440 -1.245 2.069 739 1HG1 ILE 125 HG12 ILE 125 79.056 -1.213 3.600 740 2HG1 ILE 125 HG11 ILE 125 77.563 -0.363 4.018 741 1HG2 ILE 125 HG21 ILE 125 77.578 -3.499 2.231 742 2HG2 ILE 125 HG22 ILE 125 78.977 -2.775 1.440 743 3HG2 ILE 125 HG23 ILE 125 77.435 -2.866 0.591 744 1HD1 ILE 125 HD11 ILE 125 76.424 -2.418 4.494 745 2HD1 ILE 125 HD12 ILE 125 77.989 -2.531 5.298 746 3HD1 ILE 125 HD13 ILE 125 77.717 -3.381 3.779 747 H MET 126 HN MET 126 80.190 -0.557 -0.225 748 HA MET 126 HA MET 126 78.514 -1.229 -2.594 749 1HB MET 126 HB2 MET 126 79.377 0.745 -3.353 750 2HB MET 126 HB1 MET 126 80.548 0.808 -2.033 751 1HG MET 126 HG2 MET 126 82.143 -0.451 -3.222 752 2HG MET 126 HG1 MET 126 80.941 -1.070 -4.362 753 1HE MET 126 HE1 MET 126 82.393 3.193 -3.888 754 2HE MET 126 HE2 MET 126 81.713 2.085 -2.694 755 3HE MET 126 HE3 MET 126 80.635 3.021 -3.731 756 H VAL 127 HN VAL 127 78.769 -3.461 -2.642 757 HA VAL 127 HA VAL 127 81.414 -4.677 -2.117 758 HB VAL 127 HB VAL 127 78.769 -5.894 -2.977 759 1HG1 VAL 127 HG11 VAL 127 80.527 -7.423 -1.213 760 2HG1 VAL 127 HG12 VAL 127 81.305 -7.020 -2.743 761 3HG1 VAL 127 HG13 VAL 127 79.779 -7.903 -2.737 762 1HG2 VAL 127 HG21 VAL 127 78.217 -4.809 -0.974 763 2HG2 VAL 127 HG22 VAL 127 79.829 -5.036 -0.296 764 3HG2 VAL 127 HG23 VAL 127 78.720 -6.402 -0.411 765 H GLU 128 HN GLU 128 82.611 -5.780 -3.803 766 HA GLU 128 HA GLU 128 81.492 -5.623 -6.533 767 1HB GLU 128 HB2 GLU 128 83.146 -3.640 -5.427 768 2HB GLU 128 HB1 GLU 128 84.193 -4.571 -6.508 769 1HG GLU 128 HG2 GLU 128 81.951 -4.358 -8.042 770 2HG GLU 128 HG1 GLU 128 81.874 -2.837 -7.143 771 H GLY 129 HN GLY 129 81.641 -7.883 -6.481 772 1HA GLY 129 HA2 GLY 129 82.708 -9.786 -7.420 773 2HA GLY 129 HA1 GLY 129 84.247 -8.927 -7.298 774 H ARG 130 HN ARG 130 82.878 -11.603 -6.269 775 HA ARG 130 HA ARG 130 84.444 -11.565 -3.759 776 1HB ARG 130 HB2 ARG 130 82.402 -12.865 -2.769 777 2HB ARG 130 HB1 ARG 130 82.297 -11.112 -2.906 778 1HG ARG 130 HG2 ARG 130 80.242 -12.109 -3.768 779 2HG ARG 130 HG1 ARG 130 81.144 -11.395 -5.105 780 1HD ARG 130 HD2 ARG 130 81.509 -13.429 -6.086 781 2HD ARG 130 HD1 ARG 130 81.828 -14.219 -4.531 782 HE ARG 130 HE ARG 130 79.489 -14.650 -4.318 783 1HH1 ARG 130 HH11 ARG 130 78.736 -11.794 -5.178 784 2HH1 ARG 130 HH12 ARG 130 77.790 -12.124 -6.592 785 1HH2 ARG 130 HH21 ARG 130 78.899 -15.396 -6.892 786 2HH2 ARG 130 HH22 ARG 130 77.882 -14.164 -7.561 787 H LYS 131 HN LYS 131 84.207 -14.047 -2.851 788 HA LYS 131 HA LYS 131 84.684 -15.827 -5.223 789 1HB LYS 131 HB2 LYS 131 86.116 -15.389 -2.616 790 2HB LYS 131 HB1 LYS 131 86.230 -16.959 -3.411 791 1HG LYS 131 HG2 LYS 131 87.741 -16.137 -4.863 792 2HG LYS 131 HG1 LYS 131 86.597 -14.897 -5.377 793 1HD LYS 131 HD2 LYS 131 87.408 -13.328 -3.849 794 2HD LYS 131 HD1 LYS 131 88.068 -14.564 -2.779 795 1HE LYS 131 HE2 LYS 131 89.862 -15.050 -4.367 796 2HE LYS 131 HE1 LYS 131 89.159 -13.917 -5.545 797 1HZ LYS 131 HZ1 LYS 131 89.232 -12.362 -3.417 798 2HZ LYS 131 HZ2 LYS 131 90.556 -12.492 -4.473 799 3HZ LYS 131 HZ3 LYS 131 90.537 -13.370 -3.019 Start of MODEL 5 1 1H GLY 28 HT1 GLY 28 90.835 -16.498 8.738 2 2H GLY 28 HT2 GLY 28 89.425 -15.660 9.177 3 3H GLY 28 HT3 GLY 28 89.770 -15.948 7.539 4 1HA GLY 28 HA2 GLY 28 89.483 -18.221 9.381 5 2HA GLY 28 HA1 GLY 28 88.044 -17.425 8.743 6 H SER 29 HN SER 29 91.032 -17.555 6.915 7 HA SER 29 HA SER 29 89.655 -18.945 4.722 8 1HB SER 29 HB2 SER 29 91.683 -18.381 3.513 9 2HB SER 29 HB1 SER 29 91.244 -16.995 4.510 10 HG SER 29 HG SER 29 93.154 -17.191 5.321 11 H GLY 30 HN GLY 30 89.339 -21.102 5.541 12 1HA GLY 30 HA2 GLY 30 91.630 -22.622 6.557 13 2HA GLY 30 HA1 GLY 30 90.003 -23.251 6.295 14 HA PRO 31 HA PRO 31 93.092 -24.577 2.925 15 1HB PRO 31 HB2 PRO 31 92.354 -27.288 3.558 16 2HB PRO 31 HB1 PRO 31 93.940 -26.516 3.739 17 1HG PRO 31 HG2 PRO 31 92.085 -27.268 5.809 18 2HG PRO 31 HG1 PRO 31 93.675 -26.524 5.990 19 1HD PRO 31 HD2 PRO 31 91.102 -25.305 6.423 20 2HD PRO 31 HD1 PRO 31 92.703 -24.542 6.562 21 H LYS 32 HN LYS 32 89.863 -25.595 3.957 22 HA LYS 32 HA LYS 32 89.014 -25.611 1.089 23 1HB LYS 32 HB2 LYS 32 89.529 -27.913 2.088 24 2HB LYS 32 HB1 LYS 32 88.147 -27.651 3.152 25 1HG LYS 32 HG2 LYS 32 86.638 -27.498 1.290 26 2HG LYS 32 HG1 LYS 32 87.971 -27.434 0.137 27 1HD LYS 32 HD2 LYS 32 87.761 -29.678 -0.040 28 2HD LYS 32 HD1 LYS 32 88.442 -29.773 1.584 29 1HE LYS 32 HE2 LYS 32 85.819 -29.175 2.141 30 2HE LYS 32 HE1 LYS 32 85.656 -30.190 0.695 31 1HZ LYS 32 HZ1 LYS 32 86.839 -31.918 1.680 32 2HZ LYS 32 HZ2 LYS 32 85.884 -31.349 2.965 33 3HZ LYS 32 HZ3 LYS 32 87.524 -30.919 2.866 34 H GLY 33 HN GLY 33 86.946 -24.735 0.785 35 1HA GLY 33 HA2 GLY 33 84.839 -23.835 1.372 36 2HA GLY 33 HA1 GLY 33 85.093 -24.411 3.019 37 H GLY 34 HN GLY 34 86.531 -21.999 0.789 38 1HA GLY 34 HA1 GLY 34 86.694 -20.145 3.132 39 2HA GLY 34 HA2 GLY 34 87.867 -20.142 1.815 40 H GLY 35 HN GLY 35 87.535 -18.193 0.805 41 1HA GLY 35 HA1 GLY 35 86.397 -16.837 -0.797 42 2HA GLY 35 HA2 GLY 35 84.923 -17.771 -0.498 43 H ASN 36 HN ASN 36 83.453 -16.229 0.130 44 HA ASN 36 HA ASN 36 82.436 -14.603 1.513 45 1HB ASN 36 HB2 ASN 36 84.734 -15.284 3.366 46 2HB ASN 36 HB1 ASN 36 83.136 -14.693 3.820 47 1HD2 ASN 36 HD21 ASN 36 84.084 -17.138 4.905 48 2HD2 ASN 36 HD22 ASN 36 83.183 -18.420 4.252 49 H ALA 37 HN ALA 37 85.125 -14.110 -0.135 50 HA ALA 37 HA ALA 37 85.966 -11.571 1.168 51 1HB ALA 37 HB1 ALA 37 87.972 -11.959 0.109 52 2HB ALA 37 HB2 ALA 37 87.193 -12.566 -1.351 53 3HB ALA 37 HB3 ALA 37 87.364 -13.613 0.057 54 H VAL 38 HN VAL 38 85.522 -9.595 0.201 55 HA VAL 38 HA VAL 38 84.440 -9.481 -2.566 56 HB VAL 38 HB VAL 38 82.344 -8.595 -1.866 57 1HG1 VAL 38 HG11 VAL 38 83.037 -10.698 0.196 58 2HG1 VAL 38 HG12 VAL 38 82.610 -11.048 -1.480 59 3HG1 VAL 38 HG13 VAL 38 81.426 -10.305 -0.405 60 1HG2 VAL 38 HG21 VAL 38 83.047 -7.007 -0.205 61 2HG2 VAL 38 HG22 VAL 38 83.658 -8.290 0.841 62 3HG2 VAL 38 HG23 VAL 38 81.922 -8.107 0.590 63 H LYS 39 HN LYS 39 84.681 -7.227 -3.501 64 HA LYS 39 HA LYS 39 86.611 -5.638 -1.881 65 1HB LYS 39 HB2 LYS 39 86.686 -6.183 -4.383 66 2HB LYS 39 HB1 LYS 39 85.359 -5.037 -4.563 67 1HG LYS 39 HG2 LYS 39 87.677 -4.053 -4.930 68 2HG LYS 39 HG1 LYS 39 86.717 -3.232 -3.691 69 1HD LYS 39 HD2 LYS 39 88.115 -3.876 -2.015 70 2HD LYS 39 HD1 LYS 39 88.303 -5.504 -2.681 71 1HE LYS 39 HE2 LYS 39 90.402 -3.969 -2.678 72 2HE LYS 39 HE1 LYS 39 90.012 -4.797 -4.197 73 1HZ LYS 39 HZ1 LYS 39 89.359 -2.885 -5.167 74 2HZ LYS 39 HZ2 LYS 39 90.301 -2.133 -3.970 75 3HZ LYS 39 HZ3 LYS 39 88.623 -2.288 -3.761 76 H VAL 40 HN VAL 40 85.233 -4.858 -0.187 77 HA VAL 40 HA VAL 40 82.837 -3.282 -0.947 78 HB VAL 40 HB VAL 40 82.740 -5.015 0.794 79 1HG1 VAL 40 HG11 VAL 40 84.448 -5.273 2.233 80 2HG1 VAL 40 HG12 VAL 40 84.146 -3.667 2.895 81 3HG1 VAL 40 HG13 VAL 40 85.243 -3.866 1.528 82 1HG2 VAL 40 HG21 VAL 40 81.143 -3.676 1.643 83 2HG2 VAL 40 HG22 VAL 40 82.025 -2.233 1.140 84 3HG2 VAL 40 HG23 VAL 40 82.366 -2.977 2.704 85 H ARG 41 HN ARG 41 82.827 -1.085 -0.937 86 HA ARG 41 HA ARG 41 85.181 0.382 0.178 87 1HB ARG 41 HB2 ARG 41 82.905 1.417 -1.538 88 2HB ARG 41 HB1 ARG 41 84.496 2.140 -1.317 89 1HG ARG 41 HG2 ARG 41 85.019 -0.459 -2.222 90 2HG ARG 41 HG1 ARG 41 83.659 0.090 -3.201 91 1HD ARG 41 HD2 ARG 41 84.917 2.170 -3.753 92 2HD ARG 41 HD1 ARG 41 86.299 1.554 -2.820 93 HE ARG 41 HE ARG 41 85.974 -0.529 -4.435 94 1HH1 ARG 41 HH11 ARG 41 84.046 0.890 -6.207 95 2HH1 ARG 41 HH12 ARG 41 85.082 1.564 -7.421 96 1HH2 ARG 41 HH21 ARG 41 87.974 1.166 -5.551 97 2HH2 ARG 41 HH22 ARG 41 87.306 1.719 -7.050 98 H HIS 42 HN HIS 42 84.747 2.106 1.745 99 HA HIS 42 HA HIS 42 82.031 1.859 2.996 100 1HB HIS 42 HB2 HIS 42 84.703 2.543 4.244 101 2HB HIS 42 HB1 HIS 42 83.189 2.220 5.106 102 HD1 HIS 42 HD1 HIS 42 83.318 -0.072 6.087 103 HD2 HIS 42 HD2 HIS 42 85.047 0.066 2.296 104 HE1 HIS 42 HE1 HIS 42 84.018 -2.443 5.530 105 H ILE 43 HN ILE 43 80.907 3.672 3.498 106 HA ILE 43 HA ILE 43 82.169 6.357 3.397 107 HB ILE 43 HB ILE 43 79.984 5.308 1.586 108 1HG1 ILE 43 HG12 ILE 43 82.583 6.774 1.031 109 2HG1 ILE 43 HG11 ILE 43 82.320 5.037 0.813 110 1HG2 ILE 43 HG21 ILE 43 79.430 7.544 2.676 111 2HG2 ILE 43 HG22 ILE 43 79.483 7.548 0.913 112 3HG2 ILE 43 HG23 ILE 43 80.837 8.197 1.838 113 1HD1 ILE 43 HD11 ILE 43 81.679 7.190 -0.990 114 2HD1 ILE 43 HD12 ILE 43 80.194 6.366 -0.521 115 3HD1 ILE 43 HD13 ILE 43 81.515 5.455 -1.250 116 H LEU 44 HN LEU 44 81.454 7.155 5.410 117 HA LEU 44 HA LEU 44 78.637 6.468 6.183 118 1HB LEU 44 HB2 LEU 44 79.805 5.573 7.931 119 2HB LEU 44 HB1 LEU 44 81.273 6.453 7.500 120 HG LEU 44 HG LEU 44 80.455 8.459 8.603 121 1HD1 LEU 44 HD11 LEU 44 78.270 8.806 9.104 122 2HD1 LEU 44 HD12 LEU 44 78.131 7.240 9.904 123 3HD1 LEU 44 HD13 LEU 44 77.937 7.357 8.158 124 1HD2 LEU 44 HD21 LEU 44 80.874 5.929 9.944 125 2HD2 LEU 44 HD22 LEU 44 79.770 6.937 10.880 126 3HD2 LEU 44 HD23 LEU 44 81.370 7.545 10.450 127 H CYS 45 HN CYS 45 77.267 8.157 6.633 128 HA CYS 45 HA CYS 45 78.335 10.937 6.334 129 1HB CYS 45 HB2 CYS 45 75.930 11.432 5.837 130 2HB CYS 45 HB1 CYS 45 76.606 10.214 4.745 131 HG CYS 45 HG CYS 45 74.889 8.639 5.570 132 H GLU 46 HN GLU 46 78.646 11.917 8.322 133 HA GLU 46 HA GLU 46 77.364 10.924 10.743 134 1HB GLU 46 HB2 GLU 46 79.661 11.933 10.549 135 2HB GLU 46 HB1 GLU 46 78.901 13.491 10.226 136 1HG GLU 46 HG2 GLU 46 79.358 13.473 12.571 137 2HG GLU 46 HG1 GLU 46 77.628 13.160 12.423 138 H LYS 47 HN LYS 47 76.811 13.587 8.493 139 HA LYS 47 HA LYS 47 74.576 14.594 10.201 140 1HB LYS 47 HB2 LYS 47 74.683 16.473 8.457 141 2HB LYS 47 HB1 LYS 47 76.102 16.297 9.487 142 1HG LYS 47 HG2 LYS 47 76.156 14.664 7.027 143 2HG LYS 47 HG1 LYS 47 76.193 16.405 6.754 144 1HD LYS 47 HD2 LYS 47 78.011 15.017 8.738 145 2HD LYS 47 HD1 LYS 47 78.468 15.299 7.059 146 1HE LYS 47 HE2 LYS 47 77.410 17.636 8.599 147 2HE LYS 47 HE1 LYS 47 79.058 17.087 8.960 148 1HZ LYS 47 HZ1 LYS 47 79.181 18.598 7.128 149 2HZ LYS 47 HZ2 LYS 47 77.933 17.798 6.298 150 3HZ LYS 47 HZ3 LYS 47 79.439 17.041 6.511 151 H HIS 48 HN HIS 48 75.144 12.481 7.657 152 HA HIS 48 HA HIS 48 73.719 11.398 6.130 153 1HB HIS 48 HB2 HIS 48 71.762 12.679 8.055 154 2HB HIS 48 HB1 HIS 48 71.284 11.522 6.816 155 HD1 HIS 48 HD1 HIS 48 74.605 10.817 8.202 156 HD2 HIS 48 HD2 HIS 48 70.679 9.793 9.145 157 HE1 HIS 48 HE1 HIS 48 74.749 8.857 9.796 158 H GLY 49 HN GLY 49 74.335 14.519 6.048 159 1HA GLY 49 HA2 GLY 49 72.157 15.406 4.263 160 2HA GLY 49 HA1 GLY 49 73.539 16.384 4.781 161 H LYS 50 HN LYS 50 75.619 14.599 4.108 162 HA LYS 50 HA LYS 50 75.693 14.961 1.183 163 1HB LYS 50 HB2 LYS 50 77.777 13.638 2.918 164 2HB LYS 50 HB1 LYS 50 78.015 14.594 1.455 165 1HG LYS 50 HG2 LYS 50 78.408 16.357 2.810 166 2HG LYS 50 HG1 LYS 50 76.688 16.327 3.200 167 1HD LYS 50 HD2 LYS 50 77.732 16.176 5.312 168 2HD LYS 50 HD1 LYS 50 77.330 14.501 4.928 169 1HE LYS 50 HE2 LYS 50 79.691 14.769 5.763 170 2HE LYS 50 HE1 LYS 50 79.625 14.115 4.111 171 1HZ LYS 50 HZ1 LYS 50 79.545 17.012 4.323 172 2HZ LYS 50 HZ2 LYS 50 80.402 16.028 3.234 173 3HZ LYS 50 HZ3 LYS 50 81.015 16.309 4.794 174 H ILE 51 HN ILE 51 74.894 12.458 3.402 175 HA ILE 51 HA ILE 51 75.724 10.106 2.152 176 HB ILE 51 HB ILE 51 74.311 10.429 4.236 177 1HG1 ILE 51 HG12 ILE 51 73.039 8.332 3.923 178 2HG1 ILE 51 HG11 ILE 51 73.288 8.448 2.175 179 1HG2 ILE 51 HG21 ILE 51 72.662 11.946 3.055 180 2HG2 ILE 51 HG22 ILE 51 71.926 10.665 4.021 181 3HG2 ILE 51 HG23 ILE 51 72.014 10.509 2.265 182 1HD1 ILE 51 HD11 ILE 51 75.410 7.665 2.324 183 2HD1 ILE 51 HD12 ILE 51 74.969 7.143 3.950 184 3HD1 ILE 51 HD13 ILE 51 75.778 8.692 3.710 185 H MET 52 HN MET 52 73.053 12.261 1.229 186 HA MET 52 HA MET 52 72.342 10.610 -1.082 187 1HB MET 52 HB2 MET 52 71.237 12.718 0.488 188 2HB MET 52 HB1 MET 52 71.339 13.307 -1.171 189 1HG MET 52 HG2 MET 52 70.356 10.535 -0.913 190 2HG MET 52 HG1 MET 52 69.291 11.760 -0.221 191 1HE MET 52 HE1 MET 52 71.715 11.085 -2.873 192 2HE MET 52 HE2 MET 52 71.657 12.741 -3.468 193 3HE MET 52 HE3 MET 52 70.955 11.442 -4.428 194 H GLU 53 HN GLU 53 74.017 13.651 -0.459 195 HA GLU 53 HA GLU 53 74.584 14.390 -3.147 196 1HB GLU 53 HB2 GLU 53 75.199 15.236 -0.543 197 2HB GLU 53 HB1 GLU 53 76.767 14.838 -1.245 198 1HG GLU 53 HG2 GLU 53 76.289 16.288 -3.168 199 2HG GLU 53 HG1 GLU 53 74.687 16.641 -2.521 200 H ALA 54 HN ALA 54 75.819 11.996 -0.932 201 HA ALA 54 HA ALA 54 78.091 11.234 -2.662 202 1HB ALA 54 HB1 ALA 54 78.003 11.103 -0.122 203 2HB ALA 54 HB2 ALA 54 78.465 9.594 -0.909 204 3HB ALA 54 HB3 ALA 54 76.823 9.804 -0.300 205 H MET 55 HN MET 55 74.767 10.340 -2.017 206 HA MET 55 HA MET 55 74.830 7.817 -3.488 207 1HB MET 55 HB2 MET 55 73.173 9.021 -1.690 208 2HB MET 55 HB1 MET 55 72.307 9.358 -3.195 209 1HG MET 55 HG2 MET 55 72.392 6.948 -3.768 210 2HG MET 55 HG1 MET 55 73.210 6.623 -2.234 211 1HE MET 55 HE1 MET 55 70.922 6.581 0.413 212 2HE MET 55 HE2 MET 55 71.479 8.236 0.176 213 3HE MET 55 HE3 MET 55 72.555 6.890 -0.192 214 H GLU 56 HN GLU 56 73.690 11.132 -4.222 215 HA GLU 56 HA GLU 56 72.889 10.558 -6.937 216 1HB GLU 56 HB2 GLU 56 72.801 12.667 -5.073 217 2HB GLU 56 HB1 GLU 56 73.729 13.295 -6.434 218 1HG GLU 56 HG2 GLU 56 71.304 11.745 -7.147 219 2HG GLU 56 HG1 GLU 56 71.012 13.291 -6.352 220 H LYS 57 HN LYS 57 75.728 12.362 -5.672 221 HA LYS 57 HA LYS 57 77.176 12.794 -7.988 222 1HB LYS 57 HB2 LYS 57 77.899 12.029 -5.175 223 2HB LYS 57 HB1 LYS 57 79.176 12.248 -6.372 224 1HG LYS 57 HG2 LYS 57 77.766 14.466 -6.893 225 2HG LYS 57 HG1 LYS 57 77.304 14.260 -5.204 226 1HD LYS 57 HD2 LYS 57 79.558 14.373 -4.467 227 2HD LYS 57 HD1 LYS 57 80.181 14.136 -6.098 228 1HE LYS 57 HE2 LYS 57 80.422 16.454 -5.883 229 2HE LYS 57 HE1 LYS 57 78.786 16.372 -6.564 230 1HZ LYS 57 HZ1 LYS 57 78.345 17.551 -4.675 231 2HZ LYS 57 HZ2 LYS 57 79.640 16.877 -3.806 232 3HZ LYS 57 HZ3 LYS 57 78.209 15.988 -4.030 233 H LEU 58 HN LEU 58 77.929 9.946 -5.948 234 HA LEU 58 HA LEU 58 79.380 8.399 -7.693 235 1HB LEU 58 HB2 LEU 58 77.576 8.021 -5.424 236 2HB LEU 58 HB1 LEU 58 77.603 6.607 -6.487 237 HG LEU 58 HG LEU 58 80.258 7.241 -6.367 238 1HD1 LEU 58 HD11 LEU 58 80.803 7.682 -4.013 239 2HD1 LEU 58 HD12 LEU 58 79.085 7.804 -3.631 240 3HD1 LEU 58 HD13 LEU 58 79.842 9.000 -4.683 241 1HD2 LEU 58 HD21 LEU 58 78.903 5.057 -5.919 242 2HD2 LEU 58 HD22 LEU 58 78.993 5.539 -4.224 243 3HD2 LEU 58 HD23 LEU 58 80.473 5.240 -5.138 244 H LYS 59 HN LYS 59 75.888 8.971 -7.795 245 HA LYS 59 HA LYS 59 75.432 7.005 -9.931 246 1HB LYS 59 HB2 LYS 59 73.887 8.945 -8.272 247 2HB LYS 59 HB1 LYS 59 73.180 8.472 -9.818 248 1HG LYS 59 HG2 LYS 59 74.278 6.194 -8.351 249 2HG LYS 59 HG1 LYS 59 73.015 7.029 -7.448 250 1HD LYS 59 HD2 LYS 59 72.769 6.071 -10.317 251 2HD LYS 59 HD1 LYS 59 72.074 5.260 -8.914 252 1HE LYS 59 HE2 LYS 59 70.954 7.586 -8.439 253 2HE LYS 59 HE1 LYS 59 71.291 7.894 -10.153 254 1HZ LYS 59 HZ1 LYS 59 69.851 6.303 -10.807 255 2HZ LYS 59 HZ2 LYS 59 69.151 6.535 -9.277 256 3HZ LYS 59 HZ3 LYS 59 70.242 5.257 -9.531 257 H SER 60 HN SER 60 74.669 10.503 -9.834 258 HA SER 60 HA SER 60 74.425 11.053 -12.524 259 1HB SER 60 HB2 SER 60 76.058 13.096 -11.332 260 2HB SER 60 HB1 SER 60 74.317 13.115 -11.610 261 HG SER 60 HG SER 60 75.679 12.009 -9.385 262 H GLY 61 HN GLY 61 77.480 10.696 -10.733 263 1HA GLY 61 HA2 GLY 61 79.304 9.548 -12.057 264 2HA GLY 61 HA1 GLY 61 78.899 10.666 -13.368 265 H MET 62 HN MET 62 78.946 11.644 -9.983 266 HA MET 62 HA MET 62 80.944 13.712 -10.614 267 1HB MET 62 HB2 MET 62 78.820 13.213 -8.746 268 2HB MET 62 HB1 MET 62 80.293 13.563 -7.845 269 1HG MET 62 HG2 MET 62 79.320 15.691 -8.243 270 2HG MET 62 HG1 MET 62 80.594 15.551 -9.454 271 1HE MET 62 HE1 MET 62 77.143 15.427 -8.409 272 2HE MET 62 HE2 MET 62 76.702 14.044 -9.406 273 3HE MET 62 HE3 MET 62 76.116 15.650 -9.831 274 H ARG 63 HN ARG 63 82.406 13.907 -8.292 275 HA ARG 63 HA ARG 63 84.518 12.051 -8.594 276 1HB ARG 63 HB2 ARG 63 83.571 13.656 -6.204 277 2HB ARG 63 HB1 ARG 63 85.153 12.874 -6.321 278 1HG ARG 63 HG2 ARG 63 85.967 14.441 -7.717 279 2HG ARG 63 HG1 ARG 63 84.452 14.581 -8.618 280 1HD ARG 63 HD2 ARG 63 83.622 16.232 -7.226 281 2HD ARG 63 HD1 ARG 63 84.435 15.569 -5.789 282 HE ARG 63 HE ARG 63 86.564 16.374 -7.297 283 1HH1 ARG 63 HH21 ARG 63 84.997 18.253 -8.897 284 2HH1 ARG 63 HH22 ARG 63 85.003 19.700 -7.943 285 1HH2 ARG 63 HH11 ARG 63 85.964 18.091 -5.026 286 2HH2 ARG 63 HH12 ARG 63 85.550 19.608 -5.753 287 H PHE 64 HN PHE 64 84.713 9.943 -7.919 288 HA PHE 64 HA PHE 64 82.581 8.791 -6.231 289 1HB PHE 64 HB2 PHE 64 82.947 7.220 -7.817 290 2HB PHE 64 HB1 PHE 64 84.428 8.009 -8.337 291 HD1 PHE 64 HD1 PHE 64 82.981 5.452 -6.112 292 HD2 PHE 64 HD2 PHE 64 86.592 7.310 -7.510 293 HE1 PHE 64 HE1 PHE 64 84.312 3.572 -5.187 294 HE2 PHE 64 HE2 PHE 64 87.922 5.439 -6.573 295 HZ PHE 64 HZ PHE 64 86.781 3.566 -5.417 296 H ASN 65 HN ASN 65 86.057 9.507 -6.182 297 HA ASN 65 HA ASN 65 86.349 8.367 -3.471 298 1HB ASN 65 HB2 ASN 65 88.746 9.227 -3.884 299 2HB ASN 65 HB1 ASN 65 88.167 7.955 -4.955 300 1HD2 ASN 65 HD21 ASN 65 88.043 8.426 -7.176 301 2HD2 ASN 65 HD22 ASN 65 88.382 9.951 -7.842 302 H GLU 66 HN GLU 66 86.154 11.582 -5.019 303 HA GLU 66 HA GLU 66 87.011 13.052 -2.689 304 1HB GLU 66 HB2 GLU 66 85.047 13.937 -4.816 305 2HB GLU 66 HB1 GLU 66 86.088 14.961 -3.840 306 1HG GLU 66 HG2 GLU 66 87.019 12.946 -5.908 307 2HG GLU 66 HG1 GLU 66 87.064 14.701 -6.067 308 H VAL 67 HN VAL 67 83.780 12.046 -3.875 309 HA VAL 67 HA VAL 67 82.278 13.200 -1.772 310 HB VAL 67 HB VAL 67 80.739 11.209 -2.270 311 1HG1 VAL 67 HG11 VAL 67 81.501 13.457 -3.846 312 2HG1 VAL 67 HG12 VAL 67 79.909 12.724 -3.662 313 3HG1 VAL 67 HG13 VAL 67 81.012 12.136 -4.906 314 1HG2 VAL 67 HG21 VAL 67 83.127 10.450 -3.815 315 2HG2 VAL 67 HG22 VAL 67 81.582 10.277 -4.647 316 3HG2 VAL 67 HG23 VAL 67 81.857 9.448 -3.123 317 H ALA 68 HN ALA 68 83.356 9.778 -2.083 318 HA ALA 68 HA ALA 68 82.851 8.968 0.540 319 1HB ALA 68 HB1 ALA 68 84.867 8.306 -1.577 320 2HB ALA 68 HB2 ALA 68 83.527 7.329 -0.996 321 3HB ALA 68 HB3 ALA 68 84.983 7.503 -0.013 322 H ALA 69 HN ALA 69 85.509 10.929 -0.778 323 HA ALA 69 HA ALA 69 87.351 10.991 1.311 324 1HB ALA 69 HB1 ALA 69 88.018 12.996 0.362 325 2HB ALA 69 HB2 ALA 69 86.368 13.603 0.245 326 3HB ALA 69 HB3 ALA 69 86.960 12.426 -0.927 327 H GLN 70 HN GLN 70 84.748 13.458 1.151 328 HA GLN 70 HA GLN 70 84.784 13.471 4.081 329 1HB GLN 70 HB2 GLN 70 84.447 15.387 2.111 330 2HB GLN 70 HB1 GLN 70 82.836 15.186 2.807 331 1HG GLN 70 HG2 GLN 70 85.364 15.468 4.414 332 2HG GLN 70 HG1 GLN 70 84.275 16.826 4.075 333 1HE2 GLN 70 HE21 GLN 70 84.203 13.477 5.606 334 2HE2 GLN 70 HE22 GLN 70 82.957 13.867 6.681 335 H TYR 71 HN TYR 71 82.476 12.937 1.444 336 HA TYR 71 HA TYR 71 80.144 12.554 2.898 337 1HB TYR 71 HB2 TYR 71 81.171 11.022 0.478 338 2HB TYR 71 HB1 TYR 71 79.494 11.057 1.008 339 HD1 TYR 71 HD1 TYR 71 79.292 11.921 -1.458 340 HD2 TYR 71 HD2 TYR 71 81.059 14.208 1.721 341 HE1 TYR 71 HE1 TYR 71 78.912 14.004 -2.741 342 HE2 TYR 71 HE2 TYR 71 80.679 16.280 0.437 343 HH TYR 71 HH TYR 71 78.615 16.613 -1.953 344 H SER 72 HN SER 72 82.950 10.401 2.662 345 HA SER 72 HA SER 72 81.592 8.127 3.904 346 1HB SER 72 HB2 SER 72 83.658 7.983 2.502 347 2HB SER 72 HB1 SER 72 84.536 8.851 3.762 348 HG SER 72 HG SER 72 84.174 6.288 3.613 349 H GLU 73 HN GLU 73 82.668 11.134 5.055 350 HA GLU 73 HA GLU 73 83.327 11.935 7.185 351 1HB GLU 73 HB2 GLU 73 80.728 11.300 6.823 352 2HB GLU 73 HB1 GLU 73 81.090 10.305 8.238 353 1HG GLU 73 HG2 GLU 73 81.820 13.234 8.041 354 2HG GLU 73 HG1 GLU 73 80.295 12.680 8.734 355 H ASP 74 HN ASP 74 84.913 9.721 6.602 356 HA ASP 74 HA ASP 74 86.015 8.940 9.054 357 1HB ASP 74 HB2 ASP 74 84.001 7.893 9.740 358 2HB ASP 74 HB1 ASP 74 83.707 7.215 8.140 359 H LYS 75 HN LYS 75 85.120 6.271 6.961 360 HA LYS 75 HA LYS 75 87.743 5.425 6.383 361 1HB LYS 75 HB2 LYS 75 85.183 5.167 4.771 362 2HB LYS 75 HB1 LYS 75 86.612 4.153 4.561 363 1HG LYS 75 HG2 LYS 75 84.948 4.403 7.083 364 2HG LYS 75 HG1 LYS 75 84.991 3.012 6.005 365 1HD LYS 75 HD2 LYS 75 87.551 3.015 6.462 366 2HD LYS 75 HD1 LYS 75 87.150 4.034 7.845 367 1HE LYS 75 HE2 LYS 75 85.419 2.213 8.460 368 2HE LYS 75 HE1 LYS 75 86.286 1.184 7.305 369 1HZ LYS 75 HZ1 LYS 75 87.106 1.228 9.726 370 2HZ LYS 75 HZ2 LYS 75 87.735 2.760 9.347 371 3HZ LYS 75 HZ3 LYS 75 88.263 1.387 8.496 372 H ALA 76 HN ALA 76 85.974 8.071 5.058 373 HA ALA 76 HA ALA 76 86.771 9.815 3.671 374 1HB ALA 76 HB1 ALA 76 89.052 8.449 4.430 375 2HB ALA 76 HB2 ALA 76 89.000 9.971 3.543 376 3HB ALA 76 HB3 ALA 76 89.134 8.443 2.664 377 H ARG 77 HN ARG 77 88.292 9.437 1.297 378 HA ARG 77 HA ARG 77 86.329 8.992 -0.649 379 1HB ARG 77 HB2 ARG 77 88.303 8.887 -2.149 380 2HB ARG 77 HB1 ARG 77 88.440 10.184 -0.965 381 1HG ARG 77 HG2 ARG 77 89.794 8.653 0.480 382 2HG ARG 77 HG1 ARG 77 89.731 7.443 -0.802 383 1HD ARG 77 HD2 ARG 77 90.782 9.143 -2.353 384 2HD ARG 77 HD1 ARG 77 91.011 10.195 -0.942 385 HE ARG 77 HE ARG 77 91.995 7.652 -0.211 386 1HH1 ARG 77 HH21 ARG 77 92.806 10.505 -1.887 387 2HH1 ARG 77 HH22 ARG 77 94.405 9.987 -2.304 388 1HH2 ARG 77 HH11 ARG 77 93.987 6.789 -1.031 389 2HH2 ARG 77 HH12 ARG 77 95.074 7.882 -1.821 390 H GLN 78 HN GLN 78 85.996 7.173 -2.121 391 HA GLN 78 HA GLN 78 85.972 4.576 -0.995 392 1HB GLN 78 HB2 GLN 78 86.167 5.596 -3.847 393 2HB GLN 78 HB1 GLN 78 85.828 3.911 -3.448 394 1HG GLN 78 HG2 GLN 78 84.100 6.347 -3.044 395 2HG GLN 78 HG1 GLN 78 83.669 4.777 -3.715 396 1HE2 GLN 78 HE21 GLN 78 82.648 3.332 -2.308 397 2HE2 GLN 78 HE22 GLN 78 82.602 3.494 -0.621 398 H GLY 79 HN GLY 79 88.438 6.573 -2.385 399 1HA GLY 79 HA2 GLY 79 90.459 4.844 -3.172 400 2HA GLY 79 HA1 GLY 79 90.748 6.339 -2.257 401 H GLY 80 HN GLY 80 89.080 5.497 -0.053 402 1HA GLY 80 HA1 GLY 80 90.962 4.300 1.688 403 2HA GLY 80 HA2 GLY 80 89.214 4.392 1.980 404 H ASP 81 HN ASP 81 88.144 2.908 0.010 405 HA ASP 81 HA ASP 81 87.502 0.589 -0.115 406 1HB ASP 81 HB2 ASP 81 88.829 1.452 -2.091 407 2HB ASP 81 HB1 ASP 81 90.253 0.680 -1.381 408 H LEU 82 HN LEU 82 87.661 -0.182 2.127 409 HA LEU 82 HA LEU 82 89.840 -0.933 3.630 410 1HB LEU 82 HB2 LEU 82 87.086 -1.911 3.166 411 2HB LEU 82 HB1 LEU 82 88.156 -3.069 3.955 412 HG LEU 82 HG LEU 82 88.816 -0.970 5.421 413 1HD1 LEU 82 HD11 LEU 82 86.013 -0.163 5.283 414 2HD1 LEU 82 HD12 LEU 82 86.887 0.176 3.790 415 3HD1 LEU 82 HD13 LEU 82 87.465 0.836 5.318 416 1HD2 LEU 82 HD21 LEU 82 86.610 -2.940 5.592 417 2HD2 LEU 82 HD22 LEU 82 86.485 -1.573 6.701 418 3HD2 LEU 82 HD23 LEU 82 87.911 -2.609 6.736 419 H GLY 83 HN GLY 83 88.736 -2.422 0.645 420 1HA GLY 83 HA2 GLY 83 90.153 -3.735 -0.788 421 2HA GLY 83 HA1 GLY 83 91.205 -4.060 0.597 422 H TRP 84 HN TRP 84 90.599 -6.240 -0.818 423 HA TRP 84 HA TRP 84 88.297 -7.719 -0.581 424 1HB TRP 84 HB2 TRP 84 91.223 -8.308 -0.314 425 2HB TRP 84 HB1 TRP 84 90.082 -9.618 -0.048 426 HD1 TRP 84 HD1 TRP 84 91.719 -7.653 -2.697 427 HE1 TRP 84 HE1 TRP 84 90.822 -8.332 -5.021 428 HE3 TRP 84 HE3 TRP 84 87.732 -10.480 -1.282 429 HZ2 TRP 84 HZ2 TRP 84 88.682 -9.888 -6.125 430 HZ3 TRP 84 HZ3 TRP 84 86.284 -11.554 -2.977 431 HH2 TRP 84 HH2 TRP 84 86.746 -11.264 -5.395 432 H MET 85 HN MET 85 87.057 -8.519 1.102 433 HA MET 85 HA MET 85 88.278 -8.610 3.836 434 1HB MET 85 HB2 MET 85 86.410 -6.723 2.787 435 2HB MET 85 HB1 MET 85 85.550 -7.727 3.954 436 1HG MET 85 HG2 MET 85 86.536 -5.852 5.140 437 2HG MET 85 HG1 MET 85 87.419 -7.313 5.584 438 1HE MET 85 HE1 MET 85 90.344 -4.932 5.691 439 2HE MET 85 HE2 MET 85 89.795 -6.514 6.240 440 3HE MET 85 HE3 MET 85 88.758 -5.107 6.455 441 H THR 86 HN THR 86 87.717 -10.465 4.918 442 HA THR 86 HA THR 86 85.740 -12.288 3.639 443 HB THR 86 HB THR 86 86.899 -13.733 5.593 444 HG1 THR 86 HG1 THR 86 88.311 -12.470 6.510 445 1HG2 THR 86 HG21 THR 86 87.060 -14.345 3.275 446 2HG2 THR 86 HG22 THR 86 88.707 -14.267 3.901 447 3HG2 THR 86 HG23 THR 86 88.073 -12.948 2.917 448 H ARG 87 HN ARG 87 83.936 -13.073 4.806 449 HA ARG 87 HA ARG 87 82.591 -11.434 6.635 450 1HB ARG 87 HB2 ARG 87 81.766 -13.429 5.304 451 2HB ARG 87 HB1 ARG 87 82.496 -14.463 6.532 452 1HG ARG 87 HG2 ARG 87 80.792 -12.309 7.611 453 2HG ARG 87 HG1 ARG 87 79.929 -13.506 6.645 454 1HD ARG 87 HD2 ARG 87 80.195 -15.125 8.232 455 2HD ARG 87 HD1 ARG 87 81.888 -14.677 8.519 456 HE ARG 87 HE ARG 87 79.964 -12.683 9.473 457 1HH1 ARG 87 HH21 ARG 87 82.636 -13.166 10.729 458 2HH1 ARG 87 HH22 ARG 87 82.208 -13.992 12.191 459 1HH2 ARG 87 HH11 ARG 87 79.006 -14.781 11.123 460 2HH2 ARG 87 HH12 ARG 87 80.154 -14.905 12.414 461 H GLY 88 HN GLY 88 85.025 -13.923 7.277 462 1HA GLY 88 HA2 GLY 88 84.740 -14.401 9.992 463 2HA GLY 88 HA1 GLY 88 86.325 -14.242 9.221 464 H SER 89 HN SER 89 86.088 -11.490 8.466 465 HA SER 89 HA SER 89 85.929 -10.144 11.144 466 1HB SER 89 HB2 SER 89 88.247 -10.596 10.557 467 2HB SER 89 HB1 SER 89 88.004 -9.923 8.939 468 HG SER 89 HG SER 89 88.252 -8.640 11.400 469 H MET 90 HN MET 90 83.787 -9.365 10.445 470 HA MET 90 HA MET 90 83.976 -6.875 8.883 471 1HB MET 90 HB2 MET 90 83.520 -9.208 7.526 472 2HB MET 90 HB1 MET 90 81.870 -8.702 7.889 473 1HG MET 90 HG2 MET 90 83.641 -6.533 6.950 474 2HG MET 90 HG1 MET 90 83.325 -7.792 5.755 475 1HE MET 90 HE1 MET 90 80.502 -6.833 4.123 476 2HE MET 90 HE2 MET 90 82.231 -7.160 4.215 477 3HE MET 90 HE3 MET 90 81.650 -5.498 4.284 478 H VAL 91 HN VAL 91 83.271 -7.490 11.625 479 HA VAL 91 HA VAL 91 81.609 -6.905 13.199 480 HB VAL 91 HB VAL 91 80.092 -5.637 10.927 481 1HG1 VAL 91 HG11 VAL 91 80.326 -5.382 13.826 482 2HG1 VAL 91 HG12 VAL 91 79.068 -4.778 12.749 483 3HG1 VAL 91 HG13 VAL 91 80.534 -3.833 13.010 484 1HG2 VAL 91 HG21 VAL 91 82.905 -5.104 11.714 485 2HG2 VAL 91 HG22 VAL 91 81.869 -3.685 11.567 486 3HG2 VAL 91 HG23 VAL 91 82.079 -4.769 10.192 487 H GLY 92 HN GLY 92 78.732 -6.547 12.229 488 1HA GLY 92 HA2 GLY 92 78.121 -9.439 11.754 489 2HA GLY 92 HA1 GLY 92 77.186 -8.457 12.891 490 HA PRO 93 HA PRO 93 74.423 -7.157 9.756 491 1HB PRO 93 HB2 PRO 93 74.649 -4.338 10.291 492 2HB PRO 93 HB1 PRO 93 73.384 -5.453 10.832 493 1HG PRO 93 HG2 PRO 93 75.463 -4.238 12.404 494 2HG PRO 93 HG1 PRO 93 74.199 -5.345 12.945 495 1HD PRO 93 HD2 PRO 93 77.018 -5.886 12.648 496 2HD PRO 93 HD1 PRO 93 75.744 -7.005 13.187 497 H PHE 94 HN PHE 94 77.397 -5.222 10.039 498 HA PHE 94 HA PHE 94 77.497 -3.871 7.608 499 1HB PHE 94 HB2 PHE 94 79.185 -4.424 9.687 500 2HB PHE 94 HB1 PHE 94 79.953 -5.342 8.383 501 HD1 PHE 94 HD1 PHE 94 78.009 -2.147 8.227 502 HD2 PHE 94 HD2 PHE 94 81.825 -4.062 7.751 503 HE1 PHE 94 HE1 PHE 94 78.948 -0.047 7.301 504 HE2 PHE 94 HE2 PHE 94 82.763 -1.962 6.827 505 HZ PHE 94 HZ PHE 94 81.325 0.046 6.600 506 H GLN 95 HN GLN 95 78.282 -7.298 8.207 507 HA GLN 95 HA GLN 95 78.834 -7.786 5.353 508 1HB GLN 95 HB2 GLN 95 80.198 -8.978 6.870 509 2HB GLN 95 HB1 GLN 95 78.840 -9.358 7.928 510 1HG GLN 95 HG2 GLN 95 78.439 -10.393 5.230 511 2HG GLN 95 HG1 GLN 95 79.910 -11.029 5.968 512 1HE2 GLN 95 HE21 GLN 95 76.906 -12.045 5.542 513 2HE2 GLN 95 HE22 GLN 95 76.566 -12.765 7.041 514 H GLU 96 HN GLU 96 76.420 -8.873 7.770 515 HA GLU 96 HA GLU 96 74.779 -10.560 6.375 516 1HB GLU 96 HB2 GLU 96 74.545 -8.609 8.501 517 2HB GLU 96 HB1 GLU 96 73.047 -8.678 7.574 518 1HG GLU 96 HG2 GLU 96 73.187 -11.216 7.783 519 2HG GLU 96 HG1 GLU 96 74.469 -10.955 8.964 520 H ALA 97 HN ALA 97 75.070 -7.074 5.822 521 HA ALA 97 HA ALA 97 72.848 -6.968 3.921 522 1HB ALA 97 HB1 ALA 97 73.290 -4.983 5.114 523 2HB ALA 97 HB2 ALA 97 74.014 -4.663 3.538 524 3HB ALA 97 HB3 ALA 97 75.033 -5.138 4.897 525 H ALA 98 HN ALA 98 76.215 -5.987 3.363 526 HA ALA 98 HA ALA 98 76.321 -6.212 0.604 527 1HB ALA 98 HB1 ALA 98 78.429 -5.618 1.144 528 2HB ALA 98 HB2 ALA 98 78.752 -7.256 1.713 529 3HB ALA 98 HB3 ALA 98 78.109 -6.048 2.824 530 H PHE 99 HN PHE 99 76.765 -8.861 2.962 531 HA PHE 99 HA PHE 99 77.377 -10.877 0.981 532 1HB PHE 99 HB2 PHE 99 76.663 -10.713 3.878 533 2HB PHE 99 HB1 PHE 99 76.521 -12.290 3.087 534 HD1 PHE 99 HD1 PHE 99 78.383 -13.623 3.484 535 HD2 PHE 99 HD2 PHE 99 78.931 -9.417 2.806 536 HE1 PHE 99 HE1 PHE 99 80.841 -13.921 3.624 537 HE2 PHE 99 HE2 PHE 99 81.389 -9.715 2.946 538 HZ PHE 99 HZ PHE 99 82.344 -11.966 3.355 539 H ALA 100 HN ALA 100 74.485 -10.679 3.062 540 HA ALA 100 HA ALA 100 72.813 -12.439 1.710 541 1HB ALA 100 HB1 ALA 100 72.371 -11.202 3.840 542 2HB ALA 100 HB2 ALA 100 71.001 -11.143 2.733 543 3HB ALA 100 HB3 ALA 100 72.065 -9.745 2.897 544 H LEU 101 HN LEU 101 73.437 -9.026 0.919 545 HA LEU 101 HA LEU 101 71.680 -9.184 -1.463 546 1HB LEU 101 HB2 LEU 101 73.299 -7.011 -0.096 547 2HB LEU 101 HB1 LEU 101 72.321 -6.735 -1.541 548 HG LEU 101 HG LEU 101 70.854 -8.161 0.551 549 1HD1 LEU 101 HD11 LEU 101 70.716 -5.608 1.597 550 2HD1 LEU 101 HD12 LEU 101 72.437 -5.791 1.262 551 3HD1 LEU 101 HD13 LEU 101 71.614 -6.947 2.310 552 1HD2 LEU 101 HD21 LEU 101 69.158 -7.097 -0.492 553 2HD2 LEU 101 HD22 LEU 101 70.356 -6.484 -1.632 554 3HD2 LEU 101 HD23 LEU 101 69.903 -5.521 -0.226 555 HA PRO 102 HA PRO 102 74.841 -9.833 -4.459 556 1HB PRO 102 HB2 PRO 102 74.241 -7.510 -6.047 557 2HB PRO 102 HB1 PRO 102 73.745 -9.186 -6.334 558 1HG PRO 102 HG2 PRO 102 72.122 -6.971 -5.450 559 2HG PRO 102 HG1 PRO 102 71.616 -8.634 -5.782 560 1HD PRO 102 HD2 PRO 102 71.837 -7.343 -3.222 561 2HD PRO 102 HD1 PRO 102 71.394 -9.038 -3.548 562 H VAL 103 HN VAL 103 76.844 -8.752 -5.422 563 HA VAL 103 HA VAL 103 78.310 -7.285 -3.515 564 HB VAL 103 HB VAL 103 79.772 -6.982 -5.584 565 1HG1 VAL 103 HG11 VAL 103 78.922 -9.830 -5.367 566 2HG1 VAL 103 HG12 VAL 103 79.568 -9.027 -3.936 567 3HG1 VAL 103 HG13 VAL 103 80.552 -9.157 -5.394 568 1HG2 VAL 103 HG21 VAL 103 77.617 -7.126 -7.066 569 2HG2 VAL 103 HG22 VAL 103 77.912 -8.862 -6.952 570 3HG2 VAL 103 HG23 VAL 103 79.138 -7.805 -7.649 571 H SER 104 HN SER 104 79.485 -5.187 -4.982 572 HA SER 104 HA SER 104 79.180 -2.880 -5.404 573 1HB SER 104 HB2 SER 104 76.703 -4.179 -6.566 574 2HB SER 104 HB1 SER 104 77.055 -2.457 -6.771 575 HG SER 104 HG SER 104 78.965 -2.999 -7.795 576 H GLY 105 HN GLY 105 77.645 -0.993 -4.846 577 1HA GLY 105 HA2 GLY 105 75.685 -1.627 -2.721 578 2HA GLY 105 HA1 GLY 105 77.061 -0.630 -2.257 579 H MET 106 HN MET 106 77.096 1.525 -2.860 580 HA MET 106 HA MET 106 75.911 3.558 -3.175 581 1HB MET 106 HB2 MET 106 76.115 3.994 -5.517 582 2HB MET 106 HB1 MET 106 77.397 2.871 -5.093 583 1HG MET 106 HG2 MET 106 76.545 1.228 -6.397 584 2HG MET 106 HG1 MET 106 74.892 1.549 -5.867 585 1HE MET 106 HE1 MET 106 77.601 1.865 -8.252 586 2HE MET 106 HE2 MET 106 77.752 3.587 -7.905 587 3HE MET 106 HE3 MET 106 77.156 3.062 -9.478 588 H ASP 107 HN ASP 107 74.099 3.521 -5.749 589 HA ASP 107 HA ASP 107 71.678 2.311 -4.466 590 1HB ASP 107 HB2 ASP 107 70.473 4.397 -4.963 591 2HB ASP 107 HB1 ASP 107 71.881 4.735 -3.959 592 H LYS 108 HN LYS 108 72.145 0.647 -6.210 593 HA LYS 108 HA LYS 108 70.414 0.906 -8.422 594 1HB LYS 108 HB2 LYS 108 72.768 2.412 -8.684 595 2HB LYS 108 HB1 LYS 108 73.006 0.993 -9.708 596 1HG LYS 108 HG2 LYS 108 70.662 1.448 -10.633 597 2HG LYS 108 HG1 LYS 108 70.762 3.014 -9.829 598 1HD LYS 108 HD2 LYS 108 71.928 3.804 -11.586 599 2HD LYS 108 HD1 LYS 108 73.211 2.652 -11.218 600 1HE LYS 108 HE2 LYS 108 72.600 2.111 -13.449 601 2HE LYS 108 HE1 LYS 108 71.690 0.932 -12.485 602 1HZ LYS 108 HZ1 LYS 108 70.669 3.592 -13.345 603 2HZ LYS 108 HZ2 LYS 108 69.799 2.414 -12.485 604 3HZ LYS 108 HZ3 LYS 108 70.269 2.123 -14.090 605 HA PRO 109 HA PRO 109 73.344 -2.860 -9.204 606 1HB PRO 109 HB2 PRO 109 75.221 -3.008 -7.029 607 2HB PRO 109 HB1 PRO 109 75.562 -2.756 -8.749 608 1HG PRO 109 HG2 PRO 109 75.818 -0.857 -6.635 609 2HG PRO 109 HG1 PRO 109 76.052 -0.579 -8.362 610 1HD PRO 109 HD2 PRO 109 73.847 0.286 -6.664 611 2HD PRO 109 HD1 PRO 109 74.188 0.720 -8.356 612 H VAL 110 HN VAL 110 73.920 -2.644 -5.704 613 HA VAL 110 HA VAL 110 72.701 -5.113 -5.039 614 HB VAL 110 HB VAL 110 74.289 -3.464 -3.776 615 1HG1 VAL 110 HG11 VAL 110 71.558 -2.485 -2.896 616 2HG1 VAL 110 HG12 VAL 110 72.787 -1.541 -3.738 617 3HG1 VAL 110 HG13 VAL 110 73.074 -2.089 -2.087 618 1HG2 VAL 110 HG21 VAL 110 72.773 -5.646 -3.002 619 2HG2 VAL 110 HG22 VAL 110 72.390 -4.440 -1.774 620 3HG2 VAL 110 HG23 VAL 110 74.066 -4.911 -2.055 621 H PHE 111 HN PHE 111 70.840 -4.595 -3.014 622 HA PHE 111 HA PHE 111 68.547 -3.417 -4.547 623 1HB PHE 111 HB2 PHE 111 68.923 -5.869 -2.855 624 2HB PHE 111 HB1 PHE 111 67.316 -5.135 -2.955 625 HD1 PHE 111 HD1 PHE 111 70.034 -6.745 -4.884 626 HD2 PHE 111 HD2 PHE 111 66.038 -5.176 -5.008 627 HE1 PHE 111 HE1 PHE 111 69.686 -7.807 -7.098 628 HE2 PHE 111 HE2 PHE 111 65.690 -6.239 -7.222 629 HZ PHE 111 HZ PHE 111 67.514 -7.554 -8.267 630 H THR 112 HN THR 112 70.113 -3.737 -1.390 631 HA THR 112 HA THR 112 68.074 -2.252 0.065 632 HB THR 112 HB THR 112 69.533 -3.850 1.172 633 HG1 THR 112 HG1 THR 112 70.613 -1.471 2.105 634 1HG2 THR 112 HG21 THR 112 72.040 -2.721 1.345 635 2HG2 THR 112 HG22 THR 112 71.591 -2.382 -0.327 636 3HG2 THR 112 HG23 THR 112 71.604 -4.044 0.261 637 H ASP 113 HN ASP 113 69.157 -0.294 1.426 638 HA ASP 113 HA ASP 113 69.841 1.752 -0.610 639 1HB ASP 113 HB2 ASP 113 69.364 2.051 2.369 640 2HB ASP 113 HB1 ASP 113 69.195 3.292 1.128 641 HA PRO 114 HA PRO 114 74.144 1.602 0.227 642 1HB PRO 114 HB2 PRO 114 74.460 4.448 0.085 643 2HB PRO 114 HB1 PRO 114 74.827 3.242 -1.152 644 1HG PRO 114 HG2 PRO 114 72.587 5.093 -1.053 645 2HG PRO 114 HG1 PRO 114 73.074 4.017 -2.364 646 1HD PRO 114 HD2 PRO 114 70.795 3.722 -0.682 647 2HD PRO 114 HD1 PRO 114 71.422 2.519 -1.834 648 HA PRO 115 HA PRO 115 74.399 4.649 4.026 649 1HB PRO 115 HB2 PRO 115 71.701 5.484 4.568 650 2HB PRO 115 HB1 PRO 115 73.082 6.492 4.119 651 1HG PRO 115 HG2 PRO 115 70.791 5.749 2.509 652 2HG PRO 115 HG1 PRO 115 72.108 6.861 2.104 653 1HD PRO 115 HD2 PRO 115 71.659 4.256 1.010 654 2HD PRO 115 HD1 PRO 115 73.056 5.314 0.740 655 H VAL 116 HN VAL 116 74.491 2.222 4.598 656 HA VAL 116 HA VAL 116 72.030 1.115 5.803 657 HB VAL 116 HB VAL 116 73.282 -0.909 5.845 658 1HG1 VAL 116 HG11 VAL 116 73.500 -1.130 3.605 659 2HG1 VAL 116 HG12 VAL 116 74.766 0.096 3.530 660 3HG1 VAL 116 HG13 VAL 116 73.070 0.578 3.524 661 1HG2 VAL 116 HG21 VAL 116 75.690 -1.029 5.738 662 2HG2 VAL 116 HG22 VAL 116 75.268 0.130 6.997 663 3HG2 VAL 116 HG23 VAL 116 75.809 0.702 5.419 664 H LYS 117 HN LYS 117 71.876 0.637 8.068 665 HA LYS 117 HA LYS 117 73.694 2.294 9.755 666 1HB LYS 117 HB2 LYS 117 71.069 2.403 9.577 667 2HB LYS 117 HB1 LYS 117 71.138 1.019 10.677 668 1HG LYS 117 HG2 LYS 117 71.697 2.336 12.425 669 2HG LYS 117 HG1 LYS 117 72.974 3.133 11.493 670 1HD LYS 117 HD2 LYS 117 71.657 4.919 11.025 671 2HD LYS 117 HD1 LYS 117 70.268 3.894 10.636 672 1HE LYS 117 HE2 LYS 117 71.086 4.128 13.515 673 2HE LYS 117 HE1 LYS 117 70.202 5.475 12.774 674 1HZ LYS 117 HZ1 LYS 117 69.325 2.700 12.303 675 2HZ LYS 117 HZ2 LYS 117 68.414 4.133 12.259 676 3HZ LYS 117 HZ3 LYS 117 68.889 3.472 13.750 677 H THR 118 HN THR 118 74.958 1.352 11.314 678 HA THR 118 HA THR 118 74.657 -1.601 11.751 679 HB THR 118 HB THR 118 77.111 -1.645 11.865 680 HG1 THR 118 HG1 THR 118 77.158 1.055 11.108 681 1HG2 THR 118 HG21 THR 118 76.308 -1.946 9.651 682 2HG2 THR 118 HG22 THR 118 77.586 -0.738 9.511 683 3HG2 THR 118 HG23 THR 118 75.895 -0.240 9.486 684 H LYS 119 HN LYS 119 75.425 1.558 13.141 685 HA LYS 119 HA LYS 119 74.382 0.972 15.721 686 1HB LYS 119 HB2 LYS 119 76.728 -0.404 15.210 687 2HB LYS 119 HB1 LYS 119 77.299 1.012 16.091 688 1HG LYS 119 HG2 LYS 119 76.009 0.507 17.990 689 2HG LYS 119 HG1 LYS 119 74.916 -0.543 17.081 690 1HD LYS 119 HD2 LYS 119 77.821 -1.273 17.226 691 2HD LYS 119 HD1 LYS 119 76.802 -1.580 18.632 692 1HE LYS 119 HE2 LYS 119 75.381 -3.054 17.418 693 2HE LYS 119 HE1 LYS 119 75.987 -2.475 15.854 694 1HZ LYS 119 HZ1 LYS 119 78.145 -3.361 16.355 695 2HZ LYS 119 HZ2 LYS 119 77.008 -4.604 16.578 696 3HZ LYS 119 HZ3 LYS 119 77.666 -3.800 17.922 697 H PHE 120 HN PHE 120 76.676 2.786 13.762 698 HA PHE 120 HA PHE 120 76.636 5.061 15.682 699 1HB PHE 120 HB2 PHE 120 78.492 3.886 13.893 700 2HB PHE 120 HB1 PHE 120 78.118 5.488 13.238 701 HD1 PHE 120 HD1 PHE 120 79.386 3.653 16.198 702 HD2 PHE 120 HD2 PHE 120 78.759 7.502 14.399 703 HE1 PHE 120 HE1 PHE 120 80.817 4.697 17.933 704 HE2 PHE 120 HE2 PHE 120 80.189 8.547 16.134 705 HZ PHE 120 HZ PHE 120 81.220 7.144 17.900 706 H GLY 121 HN GLY 121 76.121 4.547 12.161 707 1HA GLY 121 HA2 GLY 121 73.738 6.198 12.145 708 2HA GLY 121 HA1 GLY 121 75.132 7.065 11.483 709 H TYR 122 HN TYR 122 74.429 7.078 9.319 710 HA TYR 122 HA TYR 122 73.803 4.462 8.037 711 1HB TYR 122 HB2 TYR 122 73.366 7.373 7.472 712 2HB TYR 122 HB1 TYR 122 73.364 6.246 6.115 713 HD1 TYR 122 HD1 TYR 122 72.206 3.821 7.252 714 HD2 TYR 122 HD2 TYR 122 71.124 7.926 7.891 715 HE1 TYR 122 HE1 TYR 122 69.900 3.121 7.838 716 HE2 TYR 122 HE2 TYR 122 68.817 7.229 8.477 717 HH TYR 122 HH TYR 122 67.944 3.804 8.727 718 H HIS 123 HN HIS 123 75.059 3.689 6.275 719 HA HIS 123 HA HIS 123 77.455 5.245 5.449 720 1HB HIS 123 HB2 HIS 123 77.954 2.409 6.199 721 2HB HIS 123 HB1 HIS 123 78.981 3.822 6.428 722 HD1 HIS 123 HD1 HIS 123 78.037 5.529 8.401 723 HD2 HIS 123 HD2 HIS 123 76.722 1.579 8.536 724 HE1 HIS 123 HE1 HIS 123 77.179 5.143 10.748 725 H ILE 124 HN ILE 124 78.037 4.749 3.301 726 HA ILE 124 HA ILE 124 76.237 2.891 1.856 727 HB ILE 124 HB ILE 124 78.493 4.621 0.801 728 1HG1 ILE 124 HG12 ILE 124 75.579 5.332 1.282 729 2HG1 ILE 124 HG11 ILE 124 76.977 6.043 2.101 730 1HG2 ILE 124 HG21 ILE 124 76.331 4.501 -0.981 731 2HG2 ILE 124 HG22 ILE 124 76.508 2.859 -0.365 732 3HG2 ILE 124 HG23 ILE 124 77.873 3.662 -1.138 733 1HD1 ILE 124 HD11 ILE 124 77.402 7.442 0.369 734 2HD1 ILE 124 HD12 ILE 124 75.792 7.027 -0.220 735 3HD1 ILE 124 HD13 ILE 124 77.205 6.157 -0.823 736 H ILE 125 HN ILE 125 76.854 0.813 1.430 737 HA ILE 125 HA ILE 125 79.768 0.127 1.565 738 HB ILE 125 HB ILE 125 77.206 -1.276 2.341 739 1HG1 ILE 125 HG12 ILE 125 79.781 -0.943 3.898 740 2HG1 ILE 125 HG11 ILE 125 78.494 0.272 3.928 741 1HG2 ILE 125 HG21 ILE 125 78.095 -3.243 1.764 742 2HG2 ILE 125 HG22 ILE 125 79.394 -2.952 2.922 743 3HG2 ILE 125 HG23 ILE 125 79.584 -2.460 1.239 744 1HD1 ILE 125 HD11 ILE 125 76.994 -1.892 4.414 745 2HD1 ILE 125 HD12 ILE 125 77.814 -1.026 5.715 746 3HD1 ILE 125 HD13 ILE 125 78.523 -2.499 5.052 747 H MET 126 HN MET 126 80.451 -0.114 -0.580 748 HA MET 126 HA MET 126 78.599 -1.597 -2.419 749 1HB MET 126 HB2 MET 126 80.033 -0.409 -4.196 750 2HB MET 126 HB1 MET 126 78.939 0.606 -3.250 751 1HG MET 126 HG2 MET 126 80.725 1.377 -1.852 752 2HG MET 126 HG1 MET 126 81.838 0.161 -2.499 753 1HE MET 126 HE1 MET 126 80.230 3.243 -2.465 754 2HE MET 126 HE2 MET 126 79.618 3.456 -4.105 755 3HE MET 126 HE3 MET 126 81.094 4.285 -3.605 756 H VAL 127 HN VAL 127 79.256 -3.611 -2.840 757 HA VAL 127 HA VAL 127 82.004 -4.484 -2.205 758 HB VAL 127 HB VAL 127 79.366 -5.743 -2.956 759 1HG1 VAL 127 HG11 VAL 127 80.886 -7.144 -4.119 760 2HG1 VAL 127 HG12 VAL 127 80.627 -7.951 -2.574 761 3HG1 VAL 127 HG13 VAL 127 82.100 -7.017 -2.849 762 1HG2 VAL 127 HG21 VAL 127 79.411 -5.277 -0.661 763 2HG2 VAL 127 HG22 VAL 127 81.141 -5.599 -0.532 764 3HG2 VAL 127 HG23 VAL 127 80.007 -6.938 -0.711 765 H GLU 128 HN GLU 128 83.415 -5.444 -3.807 766 HA GLU 128 HA GLU 128 82.527 -5.256 -6.630 767 1HB GLU 128 HB2 GLU 128 84.066 -3.308 -5.283 768 2HB GLU 128 HB1 GLU 128 85.192 -4.179 -6.334 769 1HG GLU 128 HG2 GLU 128 82.831 -3.805 -7.848 770 2HG GLU 128 HG1 GLU 128 83.158 -2.256 -7.056 771 H GLY 129 HN GLY 129 82.700 -7.517 -6.611 772 1HA GLY 129 HA2 GLY 129 83.905 -9.356 -7.534 773 2HA GLY 129 HA1 GLY 129 85.408 -8.505 -7.158 774 H ARG 130 HN ARG 130 83.532 -11.094 -6.300 775 HA ARG 130 HA ARG 130 84.605 -11.037 -3.526 776 1HB ARG 130 HB2 ARG 130 82.844 -12.998 -3.353 777 2HB ARG 130 HB1 ARG 130 82.314 -11.322 -3.308 778 1HG ARG 130 HG2 ARG 130 81.422 -11.408 -5.448 779 2HG ARG 130 HG1 ARG 130 82.554 -12.652 -5.978 780 1HD ARG 130 HD2 ARG 130 80.293 -13.615 -5.754 781 2HD ARG 130 HD1 ARG 130 81.356 -14.301 -4.510 782 HE ARG 130 HE ARG 130 80.268 -11.968 -3.384 783 1HH1 ARG 130 HH11 ARG 130 79.873 -14.840 -2.399 784 2HH1 ARG 130 HH12 ARG 130 78.145 -14.955 -2.413 785 1HH2 ARG 130 HH21 ARG 130 77.710 -12.147 -4.400 786 2HH2 ARG 130 HH22 ARG 130 76.919 -13.430 -3.546 787 H LYS 131 HN LYS 131 85.258 -13.240 -2.688 788 HA LYS 131 HA LYS 131 86.566 -15.205 -2.884 789 1HB LYS 131 HB2 LYS 131 85.705 -15.225 -5.780 790 2HB LYS 131 HB1 LYS 131 86.001 -16.600 -4.718 791 1HG LYS 131 HG2 LYS 131 83.666 -14.679 -4.666 792 2HG LYS 131 HG1 LYS 131 83.629 -16.424 -4.884 793 1HD LYS 131 HD2 LYS 131 84.567 -16.661 -2.556 794 2HD LYS 131 HD1 LYS 131 84.371 -14.919 -2.359 795 1HE LYS 131 HE2 LYS 131 82.268 -15.419 -1.625 796 2HE LYS 131 HE1 LYS 131 81.889 -15.739 -3.334 797 1HZ LYS 131 HZ1 LYS 131 81.432 -17.773 -2.384 798 2HZ LYS 131 HZ2 LYS 131 82.642 -17.627 -1.199 799 3HZ LYS 131 HZ3 LYS 131 83.060 -17.993 -2.805 Start of MODEL 6 1 1H GLY 28 HT1 GLY 28 89.786 -15.711 15.822 2 2H GLY 28 HT2 GLY 28 90.216 -14.244 16.566 3 3H GLY 28 HT3 GLY 28 91.134 -15.645 16.849 4 1HA GLY 28 HA2 GLY 28 91.300 -13.753 14.703 5 2HA GLY 28 HA1 GLY 28 92.485 -14.941 15.247 6 H SER 29 HN SER 29 90.437 -14.148 12.727 7 HA SER 29 HA SER 29 90.145 -16.984 11.823 8 1HB SER 29 HB2 SER 29 88.107 -15.661 11.909 9 2HB SER 29 HB1 SER 29 88.867 -14.360 10.993 10 HG SER 29 HG SER 29 89.067 -15.808 9.246 11 H GLY 30 HN GLY 30 91.772 -17.641 10.469 12 1HA GLY 30 HA2 GLY 30 92.866 -15.629 8.543 13 2HA GLY 30 HA1 GLY 30 93.905 -16.807 9.345 14 HA PRO 31 HA PRO 31 93.351 -19.643 6.060 15 1HB PRO 31 HB2 PRO 31 92.986 -21.917 7.787 16 2HB PRO 31 HB1 PRO 31 94.459 -21.410 6.939 17 1HG PRO 31 HG2 PRO 31 93.896 -21.263 9.757 18 2HG PRO 31 HG1 PRO 31 95.366 -20.769 8.915 19 1HD PRO 31 HD2 PRO 31 93.357 -19.076 10.107 20 2HD PRO 31 HD1 PRO 31 94.834 -18.577 9.248 21 H LYS 32 HN LYS 32 91.640 -20.677 4.938 22 HA LYS 32 HA LYS 32 89.245 -21.687 6.174 23 1HB LYS 32 HB2 LYS 32 89.449 -18.955 6.288 24 2HB LYS 32 HB1 LYS 32 88.563 -19.171 4.778 25 1HG LYS 32 HG2 LYS 32 87.027 -20.755 6.073 26 2HG LYS 32 HG1 LYS 32 87.798 -20.147 7.539 27 1HD LYS 32 HD2 LYS 32 87.223 -17.807 6.268 28 2HD LYS 32 HD1 LYS 32 85.882 -18.813 5.719 29 1HE LYS 32 HE2 LYS 32 85.083 -17.886 7.755 30 2HE LYS 32 HE1 LYS 32 85.675 -19.485 8.245 31 1HZ LYS 32 HZ1 LYS 32 87.251 -16.959 8.304 32 2HZ LYS 32 HZ2 LYS 32 87.816 -18.491 8.771 33 3HZ LYS 32 HZ3 LYS 32 86.588 -17.728 9.662 34 H GLY 33 HN GLY 33 87.601 -22.245 4.500 35 1HA GLY 33 HA2 GLY 33 88.908 -22.812 1.917 36 2HA GLY 33 HA1 GLY 33 87.358 -23.457 2.456 37 H GLY 34 HN GLY 34 88.211 -21.971 -0.066 38 1HA GLY 34 HA1 GLY 34 86.917 -20.632 -1.538 39 2HA GLY 34 HA2 GLY 34 85.835 -20.256 -0.197 40 H GLY 35 HN GLY 35 85.900 -17.987 -0.678 41 1HA GLY 35 HA1 GLY 35 88.460 -16.692 0.160 42 2HA GLY 35 HA2 GLY 35 87.577 -16.098 -1.251 43 H ASN 36 HN ASN 36 84.939 -16.304 -0.286 44 HA ASN 36 HA ASN 36 83.385 -15.032 0.967 45 1HB ASN 36 HB2 ASN 36 85.633 -15.643 2.888 46 2HB ASN 36 HB1 ASN 36 84.177 -14.797 3.411 47 1HD2 ASN 36 HD21 ASN 36 85.322 -17.729 3.772 48 2HD2 ASN 36 HD22 ASN 36 83.958 -18.693 3.472 49 H ALA 37 HN ALA 37 85.902 -13.729 -0.394 50 HA ALA 37 HA ALA 37 85.955 -11.170 1.129 51 1HB ALA 37 HB1 ALA 37 87.843 -12.788 -0.275 52 2HB ALA 37 HB2 ALA 37 88.141 -11.264 0.562 53 3HB ALA 37 HB3 ALA 37 87.704 -11.261 -1.147 54 H VAL 38 HN VAL 38 85.445 -9.219 0.044 55 HA VAL 38 HA VAL 38 84.408 -9.307 -2.740 56 HB VAL 38 HB VAL 38 82.195 -8.793 -2.138 57 1HG1 VAL 38 HG11 VAL 38 82.943 -11.056 -1.183 58 2HG1 VAL 38 HG12 VAL 38 81.465 -10.369 -0.516 59 3HG1 VAL 38 HG13 VAL 38 82.976 -10.256 0.387 60 1HG2 VAL 38 HG21 VAL 38 83.413 -7.670 0.380 61 2HG2 VAL 38 HG22 VAL 38 81.682 -7.998 0.281 62 3HG2 VAL 38 HG23 VAL 38 82.427 -6.849 -0.829 63 H LYS 39 HN LYS 39 84.462 -7.032 -3.699 64 HA LYS 39 HA LYS 39 86.210 -5.315 -2.023 65 1HB LYS 39 HB2 LYS 39 86.415 -5.820 -4.518 66 2HB LYS 39 HB1 LYS 39 85.001 -4.790 -4.742 67 1HG LYS 39 HG2 LYS 39 87.261 -3.624 -5.016 68 2HG LYS 39 HG1 LYS 39 86.168 -2.875 -3.843 69 1HD LYS 39 HD2 LYS 39 87.505 -3.405 -2.075 70 2HD LYS 39 HD1 LYS 39 87.908 -4.995 -2.737 71 1HE LYS 39 HE2 LYS 39 89.971 -3.963 -2.987 72 2HE LYS 39 HE1 LYS 39 89.229 -3.453 -4.518 73 1HZ LYS 39 HZ1 LYS 39 89.046 -1.952 -1.952 74 2HZ LYS 39 HZ2 LYS 39 88.439 -1.452 -3.459 75 3HZ LYS 39 HZ3 LYS 39 90.116 -1.566 -3.211 76 H VAL 40 HN VAL 40 84.704 -4.684 -0.359 77 HA VAL 40 HA VAL 40 82.256 -3.233 -1.191 78 HB VAL 40 HB VAL 40 82.406 -5.035 0.609 79 1HG1 VAL 40 HG11 VAL 40 83.291 -2.959 2.533 80 2HG1 VAL 40 HG12 VAL 40 84.549 -3.626 1.492 81 3HG1 VAL 40 HG13 VAL 40 83.601 -4.695 2.528 82 1HG2 VAL 40 HG21 VAL 40 80.859 -3.829 2.111 83 2HG2 VAL 40 HG22 VAL 40 80.494 -3.486 0.420 84 3HG2 VAL 40 HG23 VAL 40 81.360 -2.298 1.393 85 H ARG 41 HN ARG 41 81.908 -1.067 -0.749 86 HA ARG 41 HA ARG 41 84.205 0.493 0.385 87 1HB ARG 41 HB2 ARG 41 82.285 1.294 -1.826 88 2HB ARG 41 HB1 ARG 41 83.722 2.176 -1.312 89 1HG ARG 41 HG2 ARG 41 85.182 0.583 -2.239 90 2HG ARG 41 HG1 ARG 41 83.951 -0.679 -2.247 91 1HD ARG 41 HD2 ARG 41 83.108 -0.005 -4.267 92 2HD ARG 41 HD1 ARG 41 83.299 1.718 -3.876 93 HE ARG 41 HE ARG 41 85.890 0.975 -4.118 94 1HH1 ARG 41 HH21 ARG 41 83.226 1.194 -6.191 95 2HH1 ARG 41 HH22 ARG 41 84.048 0.573 -7.583 96 1HH2 ARG 41 HH11 ARG 41 86.926 -0.265 -5.839 97 2HH2 ARG 41 HH12 ARG 41 86.143 -0.254 -7.384 98 H HIS 42 HN HIS 42 83.443 1.152 2.380 99 HA HIS 42 HA HIS 42 80.560 1.622 2.804 100 1HB HIS 42 HB2 HIS 42 82.978 1.817 4.626 101 2HB HIS 42 HB1 HIS 42 81.289 1.786 5.148 102 HD1 HIS 42 HD1 HIS 42 80.056 -0.452 3.649 103 HD2 HIS 42 HD2 HIS 42 83.965 -0.716 5.076 104 HE1 HIS 42 HE1 HIS 42 80.600 -2.923 3.800 105 H ILE 43 HN ILE 43 79.649 3.625 2.654 106 HA ILE 43 HA ILE 43 81.434 6.006 2.984 107 HB ILE 43 HB ILE 43 79.356 5.250 0.966 108 1HG1 ILE 43 HG12 ILE 43 81.849 6.924 0.662 109 2HG1 ILE 43 HG11 ILE 43 81.902 5.155 0.659 110 1HG2 ILE 43 HG21 ILE 43 78.369 7.287 1.701 111 2HG2 ILE 43 HG22 ILE 43 79.338 7.728 0.295 112 3HG2 ILE 43 HG23 ILE 43 79.942 8.054 1.920 113 1HD1 ILE 43 HD11 ILE 43 79.811 6.226 -1.090 114 2HD1 ILE 43 HD12 ILE 43 81.073 5.047 -1.446 115 3HD1 ILE 43 HD13 ILE 43 81.422 6.772 -1.555 116 H LEU 44 HN LEU 44 80.853 6.807 5.017 117 HA LEU 44 HA LEU 44 78.074 6.712 6.012 118 1HB LEU 44 HB2 LEU 44 80.719 7.758 7.048 119 2HB LEU 44 HB1 LEU 44 79.209 7.952 7.943 120 HG LEU 44 HG LEU 44 80.469 5.363 7.095 121 1HD1 LEU 44 HD11 LEU 44 79.949 6.457 9.873 122 2HD1 LEU 44 HD12 LEU 44 81.494 6.655 9.039 123 3HD1 LEU 44 HD13 LEU 44 80.913 5.040 9.449 124 1HD2 LEU 44 HD21 LEU 44 77.902 5.988 8.582 125 2HD2 LEU 44 HD22 LEU 44 78.619 4.379 8.505 126 3HD2 LEU 44 HD23 LEU 44 78.051 5.161 7.035 127 H CYS 45 HN CYS 45 76.714 8.351 5.385 128 HA CYS 45 HA CYS 45 77.389 10.811 4.192 129 1HB CYS 45 HB2 CYS 45 75.165 11.513 5.215 130 2HB CYS 45 HB1 CYS 45 75.123 9.979 4.333 131 HG CYS 45 HG CYS 45 75.716 9.502 7.267 132 H GLU 46 HN GLU 46 77.765 9.711 7.478 133 HA GLU 46 HA GLU 46 78.865 10.692 9.307 134 1HB GLU 46 HB2 GLU 46 80.231 11.542 7.263 135 2HB GLU 46 HB1 GLU 46 79.372 13.063 7.506 136 1HG GLU 46 HG2 GLU 46 81.348 13.311 8.785 137 2HG GLU 46 HG1 GLU 46 80.121 12.871 9.973 138 H LYS 47 HN LYS 47 77.220 13.237 7.417 139 HA LYS 47 HA LYS 47 75.970 14.219 9.951 140 1HB LYS 47 HB2 LYS 47 76.310 15.550 7.245 141 2HB LYS 47 HB1 LYS 47 75.793 16.334 8.738 142 1HG LYS 47 HG2 LYS 47 78.060 15.423 9.686 143 2HG LYS 47 HG1 LYS 47 78.515 15.294 7.988 144 1HD LYS 47 HD2 LYS 47 77.426 17.792 8.029 145 2HD LYS 47 HD1 LYS 47 78.102 17.705 9.656 146 1HE LYS 47 HE2 LYS 47 80.050 16.600 7.897 147 2HE LYS 47 HE1 LYS 47 79.500 18.125 7.180 148 1HZ LYS 47 HZ1 LYS 47 79.843 19.236 9.263 149 2HZ LYS 47 HZ2 LYS 47 81.277 18.410 8.875 150 3HZ LYS 47 HZ3 LYS 47 80.219 17.780 10.046 151 H HIS 48 HN HIS 48 75.255 12.197 7.455 152 HA HIS 48 HA HIS 48 73.234 11.447 6.506 153 1HB HIS 48 HB2 HIS 48 72.335 12.927 8.987 154 2HB HIS 48 HB1 HIS 48 71.268 11.896 8.031 155 HD1 HIS 48 HD1 HIS 48 74.836 11.488 9.377 156 HD2 HIS 48 HD2 HIS 48 71.251 9.372 9.142 157 HE1 HIS 48 HE1 HIS 48 75.283 9.214 10.406 158 H GLY 49 HN GLY 49 74.318 14.361 6.108 159 1HA GLY 49 HA2 GLY 49 71.826 15.487 4.898 160 2HA GLY 49 HA1 GLY 49 73.208 16.469 5.411 161 H LYS 50 HN LYS 50 74.661 13.856 4.230 162 HA LYS 50 HA LYS 50 74.708 14.816 1.394 163 1HB LYS 50 HB2 LYS 50 77.157 13.995 1.598 164 2HB LYS 50 HB1 LYS 50 76.745 15.504 2.406 165 1HG LYS 50 HG2 LYS 50 76.404 12.964 3.947 166 2HG LYS 50 HG1 LYS 50 78.049 13.537 3.676 167 1HD LYS 50 HD2 LYS 50 75.787 15.026 5.037 168 2HD LYS 50 HD1 LYS 50 77.296 14.481 5.761 169 1HE LYS 50 HE2 LYS 50 78.122 16.545 5.282 170 2HE LYS 50 HE1 LYS 50 78.102 16.050 3.574 171 1HZ LYS 50 HZ1 LYS 50 75.607 16.611 3.737 172 2HZ LYS 50 HZ2 LYS 50 76.710 17.897 3.602 173 3HZ LYS 50 HZ3 LYS 50 76.036 17.505 5.112 174 H ILE 51 HN ILE 51 74.018 12.281 3.505 175 HA ILE 51 HA ILE 51 74.928 9.944 2.293 176 HB ILE 51 HB ILE 51 73.345 10.302 4.295 177 1HG1 ILE 51 HG12 ILE 51 72.143 8.132 3.861 178 2HG1 ILE 51 HG11 ILE 51 72.774 8.179 2.209 179 1HG2 ILE 51 HG21 ILE 51 70.966 10.287 3.838 180 2HG2 ILE 51 HG22 ILE 51 71.264 10.197 2.101 181 3HG2 ILE 51 HG23 ILE 51 71.696 11.656 2.997 182 1HD1 ILE 51 HD11 ILE 51 74.239 6.805 3.617 183 2HD1 ILE 51 HD12 ILE 51 74.428 8.139 4.755 184 3HD1 ILE 51 HD13 ILE 51 75.087 8.271 3.125 185 H MET 52 HN MET 52 72.602 12.291 1.097 186 HA MET 52 HA MET 52 71.938 10.586 -1.216 187 1HB MET 52 HB2 MET 52 70.990 13.357 -1.319 188 2HB MET 52 HB1 MET 52 70.067 11.870 -1.373 189 1HG MET 52 HG2 MET 52 69.274 12.421 0.646 190 2HG MET 52 HG1 MET 52 70.850 12.023 1.294 191 1HE MET 52 HE1 MET 52 72.941 14.063 1.053 192 2HE MET 52 HE2 MET 52 72.514 15.680 0.508 193 3HE MET 52 HE3 MET 52 72.315 14.315 -0.578 194 H GLU 53 HN GLU 53 73.897 13.325 -0.361 195 HA GLU 53 HA GLU 53 74.556 14.114 -3.072 196 1HB GLU 53 HB2 GLU 53 75.084 14.932 -0.382 197 2HB GLU 53 HB1 GLU 53 76.645 14.629 -1.142 198 1HG GLU 53 HG2 GLU 53 76.040 16.108 -3.007 199 2HG GLU 53 HG1 GLU 53 74.449 16.377 -2.295 200 H ALA 54 HN ALA 54 75.512 11.792 -0.672 201 HA ALA 54 HA ALA 54 77.948 10.885 -2.032 202 1HB ALA 54 HB1 ALA 54 77.179 10.665 0.451 203 2HB ALA 54 HB2 ALA 54 77.954 9.262 -0.284 204 3HB ALA 54 HB3 ALA 54 76.199 9.315 -0.122 205 H MET 55 HN MET 55 74.516 10.166 -2.024 206 HA MET 55 HA MET 55 74.605 7.732 -3.593 207 1HB MET 55 HB2 MET 55 72.532 9.859 -2.978 208 2HB MET 55 HB1 MET 55 72.155 8.429 -3.949 209 1HG MET 55 HG2 MET 55 73.555 7.610 -1.572 210 2HG MET 55 HG1 MET 55 72.189 8.643 -1.121 211 1HE MET 55 HE1 MET 55 70.190 7.137 -0.255 212 2HE MET 55 HE2 MET 55 71.761 6.445 0.140 213 3HE MET 55 HE3 MET 55 70.465 5.398 -0.436 214 H GLU 56 HN GLU 56 74.052 11.172 -4.383 215 HA GLU 56 HA GLU 56 73.715 10.717 -7.228 216 1HB GLU 56 HB2 GLU 56 73.858 12.947 -5.286 217 2HB GLU 56 HB1 GLU 56 74.329 13.360 -6.935 218 1HG GLU 56 HG2 GLU 56 72.209 12.428 -7.779 219 2HG GLU 56 HG1 GLU 56 71.742 11.993 -6.134 220 H LYS 57 HN LYS 57 76.298 12.563 -5.550 221 HA LYS 57 HA LYS 57 78.150 12.912 -7.523 222 1HB LYS 57 HB2 LYS 57 78.097 12.811 -4.717 223 2HB LYS 57 HB1 LYS 57 79.445 11.786 -5.183 224 1HG LYS 57 HG2 LYS 57 80.674 13.566 -5.835 225 2HG LYS 57 HG1 LYS 57 79.329 14.244 -6.750 226 1HD LYS 57 HD2 LYS 57 78.381 14.854 -4.387 227 2HD LYS 57 HD1 LYS 57 80.054 14.656 -3.866 228 1HE LYS 57 HE2 LYS 57 80.582 16.202 -5.939 229 2HE LYS 57 HE1 LYS 57 78.890 16.696 -5.739 230 1HZ LYS 57 HZ1 LYS 57 80.917 16.599 -3.562 231 2HZ LYS 57 HZ2 LYS 57 79.309 17.125 -3.410 232 3HZ LYS 57 HZ3 LYS 57 80.413 18.017 -4.346 233 H LEU 58 HN LEU 58 78.092 9.933 -5.529 234 HA LEU 58 HA LEU 58 79.996 8.462 -7.032 235 1HB LEU 58 HB2 LEU 58 77.796 7.942 -5.095 236 2HB LEU 58 HB1 LEU 58 78.411 6.545 -5.993 237 HG LEU 58 HG LEU 58 80.758 7.639 -5.317 238 1HD1 LEU 58 HD11 LEU 58 79.549 9.540 -4.163 239 2HD1 LEU 58 HD12 LEU 58 80.697 8.673 -3.141 240 3HD1 LEU 58 HD13 LEU 58 78.968 8.364 -2.985 241 1HD2 LEU 58 HD21 LEU 58 80.945 5.780 -4.019 242 2HD2 LEU 58 HD22 LEU 58 79.309 5.426 -4.573 243 3HD2 LEU 58 HD23 LEU 58 79.561 6.227 -3.022 244 H LYS 59 HN LYS 59 76.496 8.903 -7.610 245 HA LYS 59 HA LYS 59 76.506 6.823 -9.703 246 1HB LYS 59 HB2 LYS 59 74.477 6.738 -8.682 247 2HB LYS 59 HB1 LYS 59 74.631 8.367 -8.050 248 1HG LYS 59 HG2 LYS 59 73.601 9.318 -9.851 249 2HG LYS 59 HG1 LYS 59 74.147 8.073 -10.976 250 1HD LYS 59 HD2 LYS 59 72.567 6.467 -9.919 251 2HD LYS 59 HD1 LYS 59 71.984 7.759 -8.871 252 1HE LYS 59 HE2 LYS 59 70.912 8.873 -10.623 253 2HE LYS 59 HE1 LYS 59 71.990 8.183 -11.852 254 1HZ LYS 59 HZ1 LYS 59 70.354 6.374 -10.211 255 2HZ LYS 59 HZ2 LYS 59 70.911 6.174 -11.804 256 3HZ LYS 59 HZ3 LYS 59 69.598 7.204 -11.483 257 H SER 60 HN SER 60 75.225 10.139 -9.737 258 HA SER 60 HA SER 60 75.050 10.758 -12.367 259 1HB SER 60 HB2 SER 60 76.578 12.627 -10.570 260 2HB SER 60 HB1 SER 60 75.273 12.997 -11.698 261 HG SER 60 HG SER 60 75.144 11.778 -9.164 262 H GLY 61 HN GLY 61 78.106 10.399 -10.620 263 1HA GLY 61 HA2 GLY 61 80.022 9.523 -11.929 264 2HA GLY 61 HA1 GLY 61 79.497 10.562 -13.261 265 H MET 62 HN MET 62 79.710 11.456 -9.816 266 HA MET 62 HA MET 62 81.488 13.707 -10.596 267 1HB MET 62 HB2 MET 62 79.279 13.575 -9.064 268 2HB MET 62 HB1 MET 62 80.493 13.249 -7.831 269 1HG MET 62 HG2 MET 62 80.654 15.518 -7.710 270 2HG MET 62 HG1 MET 62 81.646 15.343 -9.157 271 1HE MET 62 HE1 MET 62 77.700 14.534 -9.287 272 2HE MET 62 HE2 MET 62 77.151 16.182 -8.993 273 3HE MET 62 HE3 MET 62 78.170 15.374 -7.803 274 H ARG 63 HN ARG 63 82.367 13.705 -7.688 275 HA ARG 63 HA ARG 63 84.817 12.171 -8.071 276 1HB ARG 63 HB2 ARG 63 83.617 13.690 -5.740 277 2HB ARG 63 HB1 ARG 63 85.261 13.034 -5.772 278 1HG ARG 63 HG2 ARG 63 86.004 14.600 -7.257 279 2HG ARG 63 HG1 ARG 63 84.438 14.754 -8.058 280 1HD ARG 63 HD2 ARG 63 83.716 16.382 -6.606 281 2HD ARG 63 HD1 ARG 63 84.488 15.606 -5.204 282 HE ARG 63 HE ARG 63 86.570 16.691 -5.822 283 1HH1 ARG 63 HH21 ARG 63 84.857 16.630 -8.683 284 2HH1 ARG 63 HH22 ARG 63 85.230 18.254 -9.158 285 1HH2 ARG 63 HH11 ARG 63 86.674 19.091 -6.118 286 2HH2 ARG 63 HH12 ARG 63 86.259 19.648 -7.706 287 H PHE 64 HN PHE 64 85.075 10.057 -7.480 288 HA PHE 64 HA PHE 64 82.999 8.726 -5.858 289 1HB PHE 64 HB2 PHE 64 84.992 8.092 -7.856 290 2HB PHE 64 HB1 PHE 64 85.249 7.071 -6.445 291 HD1 PHE 64 HD1 PHE 64 83.913 6.787 -9.464 292 HD2 PHE 64 HD2 PHE 64 82.548 6.666 -5.393 293 HE1 PHE 64 HE1 PHE 64 81.995 5.374 -10.150 294 HE2 PHE 64 HE2 PHE 64 80.629 5.251 -6.080 295 HZ PHE 64 HZ PHE 64 80.353 4.606 -8.458 296 H ASN 65 HN ASN 65 86.398 9.706 -5.728 297 HA ASN 65 HA ASN 65 86.744 8.613 -3.022 298 1HB ASN 65 HB2 ASN 65 88.999 8.994 -3.427 299 2HB ASN 65 HB1 ASN 65 88.347 8.619 -5.018 300 1HD2 ASN 65 HD21 ASN 65 88.573 10.184 -6.645 301 2HD2 ASN 65 HD22 ASN 65 89.155 11.757 -6.384 302 H GLU 66 HN GLU 66 86.485 11.877 -4.522 303 HA GLU 66 HA GLU 66 87.217 13.360 -2.183 304 1HB GLU 66 HB2 GLU 66 85.133 14.067 -4.277 305 2HB GLU 66 HB1 GLU 66 86.020 15.196 -3.263 306 1HG GLU 66 HG2 GLU 66 87.453 13.297 -5.124 307 2HG GLU 66 HG1 GLU 66 86.893 14.876 -5.662 308 H VAL 67 HN VAL 67 83.970 12.452 -3.406 309 HA VAL 67 HA VAL 67 82.433 13.175 -1.163 310 HB VAL 67 HB VAL 67 81.022 11.196 -1.908 311 1HG1 VAL 67 HG11 VAL 67 80.310 12.939 -3.181 312 2HG1 VAL 67 HG12 VAL 67 81.150 12.074 -4.476 313 3HG1 VAL 67 HG13 VAL 67 81.957 13.394 -3.628 314 1HG2 VAL 67 HG21 VAL 67 83.480 10.713 -3.537 315 2HG2 VAL 67 HG22 VAL 67 81.902 10.160 -4.099 316 3HG2 VAL 67 HG23 VAL 67 82.549 9.577 -2.565 317 H ALA 68 HN ALA 68 84.246 10.212 -1.893 318 HA ALA 68 HA ALA 68 83.823 8.628 0.352 319 1HB ALA 68 HB1 ALA 68 85.398 8.565 -1.823 320 2HB ALA 68 HB2 ALA 68 85.678 7.506 -0.445 321 3HB ALA 68 HB3 ALA 68 86.613 8.986 -0.622 322 H ALA 69 HN ALA 69 86.183 11.257 -0.073 323 HA ALA 69 HA ALA 69 87.536 11.246 2.341 324 1HB ALA 69 HB1 ALA 69 86.487 13.890 1.557 325 2HB ALA 69 HB2 ALA 69 87.147 12.966 0.208 326 3HB ALA 69 HB3 ALA 69 88.156 13.322 1.608 327 H GLN 70 HN GLN 70 84.638 13.320 1.869 328 HA GLN 70 HA GLN 70 84.129 13.126 4.759 329 1HB GLN 70 HB2 GLN 70 83.797 15.037 2.730 330 2HB GLN 70 HB1 GLN 70 82.177 14.598 3.259 331 1HG GLN 70 HG2 GLN 70 84.405 15.116 5.200 332 2HG GLN 70 HG1 GLN 70 83.378 16.433 4.612 333 1HE2 GLN 70 HE21 GLN 70 82.816 13.032 5.907 334 2HE2 GLN 70 HE22 GLN 70 81.515 13.498 6.883 335 H TYR 71 HN TYR 71 82.018 12.974 1.916 336 HA TYR 71 HA TYR 71 79.714 11.966 2.905 337 1HB TYR 71 HB2 TYR 71 81.167 11.025 0.420 338 2HB TYR 71 HB1 TYR 71 79.464 10.747 0.737 339 HD1 TYR 71 HD1 TYR 71 79.439 12.028 -1.577 340 HD2 TYR 71 HD2 TYR 71 80.408 13.873 2.184 341 HE1 TYR 71 HE1 TYR 71 78.872 14.244 -2.517 342 HE2 TYR 71 HE2 TYR 71 79.841 16.084 1.240 343 HH TYR 71 HH TYR 71 78.794 17.131 -0.488 344 H SER 72 HN SER 72 82.728 10.137 2.720 345 HA SER 72 HA SER 72 81.320 7.668 3.506 346 1HB SER 72 HB2 SER 72 83.146 6.664 2.620 347 2HB SER 72 HB1 SER 72 83.576 8.266 2.039 348 HG SER 72 HG SER 72 84.629 6.789 4.110 349 H GLU 73 HN GLU 73 82.761 6.422 5.279 350 HA GLU 73 HA GLU 73 82.347 7.745 7.809 351 1HB GLU 73 HB2 GLU 73 83.432 5.631 8.637 352 2HB GLU 73 HB1 GLU 73 82.111 5.338 7.504 353 1HG GLU 73 HG2 GLU 73 83.547 4.719 5.775 354 2HG GLU 73 HG1 GLU 73 84.907 5.614 6.455 355 H ASP 74 HN ASP 74 83.819 9.510 6.685 356 HA ASP 74 HA ASP 74 85.781 10.803 7.072 357 1HB ASP 74 HB2 ASP 74 85.563 9.670 9.335 358 2HB ASP 74 HB1 ASP 74 86.669 8.432 8.747 359 H LYS 75 HN LYS 75 86.495 7.292 6.643 360 HA LYS 75 HA LYS 75 88.989 7.520 5.339 361 1HB LYS 75 HB2 LYS 75 86.777 5.604 5.631 362 2HB LYS 75 HB1 LYS 75 87.661 5.405 4.119 363 1HG LYS 75 HG2 LYS 75 88.911 5.503 6.882 364 2HG LYS 75 HG1 LYS 75 88.659 4.038 5.928 365 1HD LYS 75 HD2 LYS 75 89.986 5.418 4.088 366 2HD LYS 75 HD1 LYS 75 90.604 6.280 5.497 367 1HE LYS 75 HE2 LYS 75 90.665 3.254 5.210 368 2HE LYS 75 HE1 LYS 75 92.038 4.318 4.850 369 1HZ LYS 75 HZ1 LYS 75 90.605 4.667 7.389 370 2HZ LYS 75 HZ2 LYS 75 92.241 4.948 7.029 371 3HZ LYS 75 HZ3 LYS 75 91.679 3.362 7.257 372 H ALA 76 HN ALA 76 88.724 6.477 2.756 373 HA ALA 76 HA ALA 76 86.766 7.921 1.176 374 1HB ALA 76 HB1 ALA 76 88.469 9.631 2.143 375 2HB ALA 76 HB2 ALA 76 88.081 9.726 0.425 376 3HB ALA 76 HB3 ALA 76 89.584 8.965 0.949 377 H ARG 77 HN ARG 77 89.079 8.290 -0.903 378 HA ARG 77 HA ARG 77 90.081 6.979 -2.605 379 1HB ARG 77 HB2 ARG 77 90.219 5.484 -0.157 380 2HB ARG 77 HB1 ARG 77 89.832 4.368 -1.466 381 1HG ARG 77 HG2 ARG 77 92.025 6.410 -1.784 382 2HG ARG 77 HG1 ARG 77 92.336 4.867 -0.987 383 1HD ARG 77 HD2 ARG 77 92.049 3.649 -2.943 384 2HD ARG 77 HD1 ARG 77 90.907 4.823 -3.625 385 HE ARG 77 HE ARG 77 93.745 5.650 -3.241 386 1HH1 ARG 77 HH21 ARG 77 92.364 3.807 -5.551 387 2HH1 ARG 77 HH22 ARG 77 92.486 4.946 -6.848 388 1HH2 ARG 77 HH11 ARG 77 93.348 7.600 -4.787 389 2HH2 ARG 77 HH12 ARG 77 93.043 7.095 -6.416 390 H GLN 78 HN GLN 78 88.549 7.015 -4.228 391 HA GLN 78 HA GLN 78 86.844 6.240 -5.652 392 1HB GLN 78 HB2 GLN 78 87.673 4.079 -5.614 393 2HB GLN 78 HB1 GLN 78 87.460 3.922 -3.872 394 1HG GLN 78 HG2 GLN 78 85.012 4.274 -5.563 395 2HG GLN 78 HG1 GLN 78 85.807 2.695 -5.566 396 1HE2 GLN 78 HE21 GLN 78 83.438 4.447 -3.973 397 2HE2 GLN 78 HE22 GLN 78 83.445 3.627 -2.486 398 H GLY 79 HN GLY 79 86.176 5.898 -2.151 399 1HA GLY 79 HA2 GLY 79 83.954 7.457 -1.990 400 2HA GLY 79 HA1 GLY 79 83.306 5.935 -2.587 401 H GLY 80 HN GLY 80 84.725 4.047 -1.256 402 1HA GLY 80 HA2 GLY 80 85.075 4.642 1.556 403 2HA GLY 80 HA1 GLY 80 83.545 3.821 1.255 404 H ASP 81 HN ASP 81 86.189 3.070 -0.886 405 HA ASP 81 HA ASP 81 86.111 0.277 -0.326 406 1HB ASP 81 HB2 ASP 81 88.368 0.390 -1.547 407 2HB ASP 81 HB1 ASP 81 86.988 1.092 -2.402 408 H LEU 82 HN LEU 82 86.236 0.212 2.064 409 HA LEU 82 HA LEU 82 88.594 1.185 3.439 410 1HB LEU 82 HB2 LEU 82 86.946 0.996 4.987 411 2HB LEU 82 HB1 LEU 82 86.007 -0.062 3.943 412 HG LEU 82 HG LEU 82 87.621 -1.923 4.654 413 1HD1 LEU 82 HD11 LEU 82 89.346 -1.318 5.987 414 2HD1 LEU 82 HD12 LEU 82 88.184 -0.857 7.230 415 3HD1 LEU 82 HD13 LEU 82 88.737 0.338 6.054 416 1HD2 LEU 82 HD21 LEU 82 86.409 -2.159 6.890 417 2HD2 LEU 82 HD22 LEU 82 85.378 -1.956 5.474 418 3HD2 LEU 82 HD23 LEU 82 85.679 -0.590 6.549 419 H GLY 83 HN GLY 83 88.200 -1.325 1.281 420 1HA GLY 83 HA2 GLY 83 90.290 -2.627 0.811 421 2HA GLY 83 HA1 GLY 83 90.419 -2.880 2.558 422 H TRP 84 HN TRP 84 90.300 -4.977 0.575 423 HA TRP 84 HA TRP 84 87.935 -6.259 -0.007 424 1HB TRP 84 HB2 TRP 84 90.648 -7.063 0.920 425 2HB TRP 84 HB1 TRP 84 89.424 -8.323 0.923 426 HD1 TRP 84 HD1 TRP 84 91.734 -6.522 -1.274 427 HE1 TRP 84 HE1 TRP 84 91.328 -7.142 -3.746 428 HE3 TRP 84 HE3 TRP 84 87.286 -8.962 -0.827 429 HZ2 TRP 84 HZ2 TRP 84 89.364 -8.505 -5.320 430 HZ3 TRP 84 HZ3 TRP 84 86.168 -9.917 -2.822 431 HH2 TRP 84 HH2 TRP 84 87.199 -9.692 -5.065 432 H MET 85 HN MET 85 86.645 -7.920 1.239 433 HA MET 85 HA MET 85 86.850 -7.670 4.202 434 1HB MET 85 HB2 MET 85 84.823 -6.476 2.412 435 2HB MET 85 HB1 MET 85 84.168 -7.314 3.820 436 1HG MET 85 HG2 MET 85 86.348 -5.205 3.930 437 2HG MET 85 HG1 MET 85 84.645 -4.902 4.272 438 1HE MET 85 HE1 MET 85 87.318 -4.474 5.939 439 2HE MET 85 HE2 MET 85 88.038 -6.056 5.652 440 3HE MET 85 HE3 MET 85 87.589 -5.585 7.288 441 H THR 86 HN THR 86 86.356 -9.588 5.181 442 HA THR 86 HA THR 86 84.545 -11.509 3.832 443 HB THR 86 HB THR 86 86.700 -12.122 2.990 444 HG1 THR 86 HG1 THR 86 86.642 -14.178 3.616 445 1HG2 THR 86 HG21 THR 86 87.532 -11.967 5.882 446 2HG2 THR 86 HG22 THR 86 88.137 -10.976 4.553 447 3HG2 THR 86 HG23 THR 86 88.536 -12.693 4.627 448 H ARG 87 HN ARG 87 83.707 -13.019 5.191 449 HA ARG 87 HA ARG 87 82.897 -12.369 7.757 450 1HB ARG 87 HB2 ARG 87 82.833 -14.591 6.026 451 2HB ARG 87 HB1 ARG 87 83.448 -15.213 7.559 452 1HG ARG 87 HG2 ARG 87 81.109 -13.352 7.644 453 2HG ARG 87 HG1 ARG 87 80.826 -15.006 7.101 454 1HD ARG 87 HD2 ARG 87 82.515 -15.152 9.400 455 2HD ARG 87 HD1 ARG 87 81.162 -14.072 9.792 456 HE ARG 87 HE ARG 87 79.702 -15.928 9.570 457 1HH1 ARG 87 HH21 ARG 87 81.793 -17.822 10.355 458 2HH1 ARG 87 HH22 ARG 87 81.880 -18.907 9.007 459 1HH2 ARG 87 HH11 ARG 87 80.222 -16.768 6.839 460 2HH2 ARG 87 HH12 ARG 87 80.990 -18.310 7.018 461 H GLY 88 HN GLY 88 83.620 -13.132 9.903 462 1HA GLY 88 HA2 GLY 88 85.295 -14.024 11.399 463 2HA GLY 88 HA1 GLY 88 86.463 -13.978 10.070 464 H SER 89 HN SER 89 85.580 -11.201 9.348 465 HA SER 89 HA SER 89 86.890 -9.747 11.627 466 1HB SER 89 HB2 SER 89 87.230 -9.686 8.636 467 2HB SER 89 HB1 SER 89 87.633 -8.253 9.593 468 HG SER 89 HG SER 89 89.461 -9.475 9.492 469 H MET 90 HN MET 90 84.536 -9.575 8.967 470 HA MET 90 HA MET 90 83.596 -6.945 9.240 471 1HB MET 90 HB2 MET 90 82.492 -9.597 8.425 472 2HB MET 90 HB1 MET 90 81.340 -8.281 8.651 473 1HG MET 90 HG2 MET 90 82.253 -7.006 6.930 474 2HG MET 90 HG1 MET 90 83.835 -7.775 7.061 475 1HE MET 90 HE1 MET 90 81.903 -7.979 3.698 476 2HE MET 90 HE2 MET 90 81.633 -6.914 5.075 477 3HE MET 90 HE3 MET 90 80.426 -8.128 4.661 478 H VAL 91 HN VAL 91 81.094 -6.721 10.102 479 HA VAL 91 HA VAL 91 81.259 -7.355 13.019 480 HB VAL 91 HB VAL 91 79.301 -5.455 11.746 481 1HG1 VAL 91 HG11 VAL 91 80.507 -4.340 14.003 482 2HG1 VAL 91 HG12 VAL 91 80.377 -6.056 14.389 483 3HG1 VAL 91 HG13 VAL 91 78.935 -5.139 13.951 484 1HG2 VAL 91 HG21 VAL 91 81.146 -4.556 10.668 485 2HG2 VAL 91 HG22 VAL 91 82.277 -5.156 11.880 486 3HG2 VAL 91 HG23 VAL 91 81.281 -3.743 12.228 487 H GLY 92 HN GLY 92 78.290 -6.701 13.125 488 1HA GLY 92 HA2 GLY 92 77.357 -9.456 12.650 489 2HA GLY 92 HA1 GLY 92 76.456 -8.181 13.484 490 HA PRO 93 HA PRO 93 74.076 -7.340 9.912 491 1HB PRO 93 HB2 PRO 93 74.445 -4.487 9.988 492 2HB PRO 93 HB1 PRO 93 73.065 -5.425 10.580 493 1HG PRO 93 HG2 PRO 93 75.052 -4.058 12.129 494 2HG PRO 93 HG1 PRO 93 73.702 -5.029 12.718 495 1HD PRO 93 HD2 PRO 93 76.522 -5.692 12.733 496 2HD PRO 93 HD1 PRO 93 75.167 -6.641 13.388 497 H PHE 94 HN PHE 94 77.176 -5.630 10.147 498 HA PHE 94 HA PHE 94 77.614 -4.605 7.627 499 1HB PHE 94 HB2 PHE 94 79.105 -5.321 9.853 500 2HB PHE 94 HB1 PHE 94 79.827 -6.296 8.563 501 HD1 PHE 94 HD1 PHE 94 81.729 -5.269 7.698 502 HD2 PHE 94 HD2 PHE 94 78.323 -2.854 8.704 503 HE1 PHE 94 HE1 PHE 94 82.898 -3.260 6.832 504 HE2 PHE 94 HE2 PHE 94 79.491 -0.845 7.839 505 HZ PHE 94 HZ PHE 94 81.779 -1.048 6.903 506 H GLN 95 HN GLN 95 78.603 -7.965 8.419 507 HA GLN 95 HA GLN 95 78.889 -8.745 5.664 508 1HB GLN 95 HB2 GLN 95 80.074 -9.861 7.448 509 2HB GLN 95 HB1 GLN 95 78.565 -10.252 8.274 510 1HG GLN 95 HG2 GLN 95 78.274 -11.276 5.668 511 2HG GLN 95 HG1 GLN 95 79.914 -11.703 6.157 512 1HE2 GLN 95 HE21 GLN 95 76.722 -11.530 7.857 513 2HE2 GLN 95 HE22 GLN 95 76.860 -13.065 8.570 514 H GLU 96 HN GLU 96 76.203 -8.954 7.969 515 HA GLU 96 HA GLU 96 74.509 -10.774 6.636 516 1HB GLU 96 HB2 GLU 96 74.092 -8.320 8.338 517 2HB GLU 96 HB1 GLU 96 72.716 -9.249 7.748 518 1HG GLU 96 HG2 GLU 96 74.494 -11.176 8.728 519 2HG GLU 96 HG1 GLU 96 74.566 -9.869 9.909 520 H ALA 97 HN ALA 97 75.073 -7.322 5.981 521 HA ALA 97 HA ALA 97 72.988 -7.266 3.893 522 1HB ALA 97 HB1 ALA 97 73.043 -5.193 4.851 523 2HB ALA 97 HB2 ALA 97 74.390 -4.912 3.748 524 3HB ALA 97 HB3 ALA 97 74.701 -5.400 5.414 525 H ALA 98 HN ALA 98 76.196 -5.847 3.605 526 HA ALA 98 HA ALA 98 76.683 -6.079 0.932 527 1HB ALA 98 HB1 ALA 98 78.936 -7.003 2.607 528 2HB ALA 98 HB2 ALA 98 78.138 -5.540 3.184 529 3HB ALA 98 HB3 ALA 98 78.822 -5.589 1.559 530 H PHE 99 HN PHE 99 77.775 -8.676 3.166 531 HA PHE 99 HA PHE 99 78.485 -10.564 1.198 532 1HB PHE 99 HB2 PHE 99 78.358 -10.371 3.964 533 2HB PHE 99 HB1 PHE 99 77.254 -11.704 3.597 534 HD1 PHE 99 HD1 PHE 99 78.229 -13.816 3.599 535 HD2 PHE 99 HD2 PHE 99 80.561 -10.440 2.328 536 HE1 PHE 99 HE1 PHE 99 80.169 -15.307 3.197 537 HE2 PHE 99 HE2 PHE 99 82.501 -11.931 1.927 538 HZ PHE 99 HZ PHE 99 82.307 -14.364 2.361 539 H ALA 100 HN ALA 100 75.410 -10.514 3.027 540 HA ALA 100 HA ALA 100 74.122 -12.537 1.469 541 1HB ALA 100 HB1 ALA 100 72.720 -10.247 2.845 542 2HB ALA 100 HB2 ALA 100 73.587 -11.464 3.780 543 3HB ALA 100 HB3 ALA 100 72.231 -11.939 2.756 544 H LEU 101 HN LEU 101 73.748 -8.971 1.339 545 HA LEU 101 HA LEU 101 71.993 -8.904 -0.904 546 1HB LEU 101 HB2 LEU 101 73.935 -7.033 0.430 547 2HB LEU 101 HB1 LEU 101 73.120 -6.531 -1.057 548 HG LEU 101 HG LEU 101 71.971 -5.941 1.180 549 1HD1 LEU 101 HD11 LEU 101 69.738 -6.391 0.219 550 2HD1 LEU 101 HD12 LEU 101 70.461 -7.522 -0.924 551 3HD1 LEU 101 HD13 LEU 101 70.855 -5.805 -1.013 552 1HD2 LEU 101 HD21 LEU 101 70.564 -7.758 2.112 553 2HD2 LEU 101 HD22 LEU 101 72.283 -8.120 2.270 554 3HD2 LEU 101 HD23 LEU 101 71.330 -8.902 1.008 555 HA PRO 102 HA PRO 102 74.421 -9.704 -4.469 556 1HB PRO 102 HB2 PRO 102 73.672 -7.294 -5.851 557 2HB PRO 102 HB1 PRO 102 73.002 -8.921 -6.053 558 1HG PRO 102 HG2 PRO 102 71.773 -6.628 -4.807 559 2HG PRO 102 HG1 PRO 102 71.085 -8.239 -5.047 560 1HD PRO 102 HD2 PRO 102 71.948 -7.048 -2.576 561 2HD PRO 102 HD1 PRO 102 71.311 -8.695 -2.827 562 H VAL 103 HN VAL 103 76.212 -8.738 -5.834 563 HA VAL 103 HA VAL 103 78.130 -7.302 -4.232 564 HB VAL 103 HB VAL 103 77.838 -8.365 -7.016 565 1HG1 VAL 103 HG11 VAL 103 79.927 -7.384 -7.768 566 2HG1 VAL 103 HG12 VAL 103 80.139 -6.554 -6.228 567 3HG1 VAL 103 HG13 VAL 103 78.832 -6.080 -7.314 568 1HG2 VAL 103 HG21 VAL 103 79.529 -8.783 -4.597 569 2HG2 VAL 103 HG22 VAL 103 80.273 -9.121 -6.161 570 3HG2 VAL 103 HG23 VAL 103 78.803 -9.969 -5.680 571 H SER 104 HN SER 104 79.191 -5.228 -5.303 572 HA SER 104 HA SER 104 78.970 -2.941 -5.834 573 1HB SER 104 HB2 SER 104 76.724 -4.245 -7.388 574 2HB SER 104 HB1 SER 104 77.063 -2.514 -7.507 575 HG SER 104 HG SER 104 78.190 -3.659 -9.099 576 H GLY 105 HN GLY 105 77.455 -1.040 -5.511 577 1HA GLY 105 HA2 GLY 105 75.013 -1.465 -3.979 578 2HA GLY 105 HA1 GLY 105 76.351 -0.891 -2.987 579 H MET 106 HN MET 106 76.951 1.270 -3.137 580 HA MET 106 HA MET 106 76.677 3.560 -3.650 581 1HB MET 106 HB2 MET 106 77.714 2.769 -5.714 582 2HB MET 106 HB1 MET 106 76.148 2.225 -6.326 583 1HG MET 106 HG2 MET 106 75.412 4.699 -5.971 584 2HG MET 106 HG1 MET 106 77.147 5.042 -5.929 585 1HE MET 106 HE1 MET 106 74.736 2.624 -8.295 586 2HE MET 106 HE2 MET 106 74.410 4.012 -9.329 587 3HE MET 106 HE3 MET 106 74.109 4.122 -7.596 588 H ASP 107 HN ASP 107 74.330 2.539 -6.076 589 HA ASP 107 HA ASP 107 71.956 2.800 -4.477 590 1HB ASP 107 HB2 ASP 107 72.950 5.116 -4.342 591 2HB ASP 107 HB1 ASP 107 72.751 5.246 -6.089 592 H LYS 108 HN LYS 108 72.339 0.912 -6.307 593 HA LYS 108 HA LYS 108 70.257 1.212 -8.214 594 1HB LYS 108 HB2 LYS 108 72.711 2.521 -8.833 595 2HB LYS 108 HB1 LYS 108 72.532 1.157 -9.941 596 1HG LYS 108 HG2 LYS 108 70.112 2.826 -9.442 597 2HG LYS 108 HG1 LYS 108 71.391 3.546 -10.420 598 1HD LYS 108 HD2 LYS 108 71.201 1.930 -12.096 599 2HD LYS 108 HD1 LYS 108 70.470 0.748 -11.011 600 1HE LYS 108 HE2 LYS 108 68.385 1.473 -11.543 601 2HE LYS 108 HE1 LYS 108 68.831 3.153 -11.191 602 1HZ LYS 108 HZ1 LYS 108 70.150 2.986 -13.368 603 2HZ LYS 108 HZ2 LYS 108 68.462 3.148 -13.483 604 3HZ LYS 108 HZ3 LYS 108 69.190 1.629 -13.703 605 HA PRO 109 HA PRO 109 72.963 -2.631 -9.488 606 1HB PRO 109 HB2 PRO 109 75.016 -2.891 -7.483 607 2HB PRO 109 HB1 PRO 109 75.209 -2.650 -9.226 608 1HG PRO 109 HG2 PRO 109 75.651 -0.749 -7.098 609 2HG PRO 109 HG1 PRO 109 75.915 -0.534 -8.829 610 1HD PRO 109 HD2 PRO 109 73.866 0.654 -7.226 611 2HD PRO 109 HD1 PRO 109 74.059 0.775 -8.993 612 H VAL 110 HN VAL 110 73.875 -2.645 -6.044 613 HA VAL 110 HA VAL 110 72.534 -5.032 -5.387 614 HB VAL 110 HB VAL 110 74.097 -3.062 -4.156 615 1HG1 VAL 110 HG11 VAL 110 71.760 -2.153 -3.409 616 2HG1 VAL 110 HG12 VAL 110 73.034 -2.323 -2.202 617 3HG1 VAL 110 HG13 VAL 110 71.763 -3.538 -2.318 618 1HG2 VAL 110 HG21 VAL 110 74.462 -4.733 -2.500 619 2HG2 VAL 110 HG22 VAL 110 74.101 -5.608 -3.988 620 3HG2 VAL 110 HG23 VAL 110 72.861 -5.429 -2.746 621 H PHE 111 HN PHE 111 70.721 -4.672 -3.361 622 HA PHE 111 HA PHE 111 68.499 -3.155 -4.686 623 1HB PHE 111 HB2 PHE 111 68.734 -5.878 -3.461 624 2HB PHE 111 HB1 PHE 111 67.169 -5.054 -3.396 625 HD1 PHE 111 HD1 PHE 111 69.822 -6.323 -5.666 626 HD2 PHE 111 HD2 PHE 111 65.842 -4.736 -5.371 627 HE1 PHE 111 HE1 PHE 111 69.408 -6.923 -8.037 628 HE2 PHE 111 HE2 PHE 111 65.427 -5.336 -7.741 629 HZ PHE 111 HZ PHE 111 67.209 -6.430 -9.075 630 H THR 112 HN THR 112 69.697 -4.322 -1.524 631 HA THR 112 HA THR 112 67.833 -3.039 0.154 632 HB THR 112 HB THR 112 69.585 -4.630 0.870 633 HG1 THR 112 HG1 THR 112 68.640 -3.017 2.312 634 1HG2 THR 112 HG21 THR 112 71.309 -2.528 -0.255 635 2HG2 THR 112 HG22 THR 112 71.631 -4.249 -0.039 636 3HG2 THR 112 HG23 THR 112 71.847 -3.134 1.312 637 H ASP 113 HN ASP 113 68.984 -1.204 1.746 638 HA ASP 113 HA ASP 113 69.252 1.157 -0.049 639 1HB ASP 113 HB2 ASP 113 68.873 2.353 2.175 640 2HB ASP 113 HB1 ASP 113 67.549 1.320 1.637 641 HA PRO 114 HA PRO 114 73.639 1.097 0.586 642 1HB PRO 114 HB2 PRO 114 73.794 3.924 0.117 643 2HB PRO 114 HB1 PRO 114 74.204 2.601 -0.983 644 1HG PRO 114 HG2 PRO 114 71.894 4.339 -1.062 645 2HG PRO 114 HG1 PRO 114 72.379 3.101 -2.222 646 1HD PRO 114 HD2 PRO 114 70.178 2.987 -0.401 647 2HD PRO 114 HD1 PRO 114 70.770 1.676 -1.450 648 HA PRO 115 HA PRO 115 73.876 4.605 3.980 649 1HB PRO 115 HB2 PRO 115 71.155 5.307 4.586 650 2HB PRO 115 HB1 PRO 115 72.436 6.339 3.944 651 1HG PRO 115 HG2 PRO 115 70.126 5.275 2.568 652 2HG PRO 115 HG1 PRO 115 71.351 6.398 1.956 653 1HD PRO 115 HD2 PRO 115 71.005 3.645 1.230 654 2HD PRO 115 HD1 PRO 115 72.310 4.737 0.724 655 H VAL 116 HN VAL 116 73.982 2.052 4.559 656 HA VAL 116 HA VAL 116 71.798 1.222 6.365 657 HB VAL 116 HB VAL 116 73.036 -0.870 6.392 658 1HG1 VAL 116 HG11 VAL 116 73.358 0.085 3.564 659 2HG1 VAL 116 HG12 VAL 116 71.748 0.014 4.279 660 3HG1 VAL 116 HG13 VAL 116 72.720 -1.451 4.148 661 1HG2 VAL 116 HG21 VAL 116 75.250 -1.044 5.990 662 2HG2 VAL 116 HG22 VAL 116 75.259 0.703 6.213 663 3HG2 VAL 116 HG23 VAL 116 75.172 0.024 4.589 664 H LYS 117 HN LYS 117 72.156 0.867 8.616 665 HA LYS 117 HA LYS 117 74.494 2.368 9.729 666 1HB LYS 117 HB2 LYS 117 72.044 3.112 9.986 667 2HB LYS 117 HB1 LYS 117 71.876 1.748 11.100 668 1HG LYS 117 HG2 LYS 117 73.884 2.672 12.356 669 2HG LYS 117 HG1 LYS 117 73.742 4.124 11.355 670 1HD LYS 117 HD2 LYS 117 71.355 4.336 12.122 671 2HD LYS 117 HD1 LYS 117 71.646 2.992 13.237 672 1HE LYS 117 HE2 LYS 117 73.562 5.301 13.289 673 2HE LYS 117 HE1 LYS 117 71.973 5.506 14.051 674 1HZ LYS 117 HZ1 LYS 117 73.004 4.445 15.755 675 2HZ LYS 117 HZ2 LYS 117 74.158 3.703 14.754 676 3HZ LYS 117 HZ3 LYS 117 72.590 3.059 14.871 677 H THR 118 HN THR 118 75.673 1.428 11.430 678 HA THR 118 HA THR 118 75.016 -0.837 12.974 679 HB THR 118 HB THR 118 74.779 -2.167 11.035 680 HG1 THR 118 HG1 THR 118 77.091 -3.153 10.925 681 1HG2 THR 118 HG21 THR 118 77.039 -0.485 9.996 682 2HG2 THR 118 HG22 THR 118 75.476 -0.827 9.255 683 3HG2 THR 118 HG23 THR 118 76.730 -2.067 9.281 684 H LYS 119 HN LYS 119 77.479 1.000 11.275 685 HA LYS 119 HA LYS 119 79.530 0.169 13.283 686 1HB LYS 119 HB2 LYS 119 80.107 -0.104 10.931 687 2HB LYS 119 HB1 LYS 119 79.668 1.570 10.596 688 1HG LYS 119 HG2 LYS 119 81.615 2.387 11.457 689 2HG LYS 119 HG1 LYS 119 81.641 1.207 12.770 690 1HD LYS 119 HD2 LYS 119 82.188 0.407 9.909 691 2HD LYS 119 HD1 LYS 119 83.472 0.989 10.969 692 1HE LYS 119 HE2 LYS 119 82.090 -0.905 12.516 693 2HE LYS 119 HE1 LYS 119 82.211 -1.633 10.903 694 1HZ LYS 119 HZ1 LYS 119 84.434 -0.397 12.452 695 2HZ LYS 119 HZ2 LYS 119 84.568 -0.999 10.869 696 3HZ LYS 119 HZ3 LYS 119 84.230 -2.055 12.156 697 H PHE 120 HN PHE 120 79.056 3.209 11.465 698 HA PHE 120 HA PHE 120 78.750 4.708 14.015 699 1HB PHE 120 HB2 PHE 120 81.213 4.279 13.285 700 2HB PHE 120 HB1 PHE 120 80.881 5.465 12.014 701 HD1 PHE 120 HD1 PHE 120 80.726 4.959 15.718 702 HD2 PHE 120 HD2 PHE 120 80.947 7.775 12.483 703 HE1 PHE 120 HE1 PHE 120 81.075 6.798 17.344 704 HE2 PHE 120 HE2 PHE 120 81.296 9.616 14.108 705 HZ PHE 120 HZ PHE 120 81.360 9.127 16.539 706 H GLY 121 HN GLY 121 76.711 4.483 12.212 707 1HA GLY 121 HA2 GLY 121 75.423 6.617 11.613 708 2HA GLY 121 HA1 GLY 121 76.829 7.010 10.612 709 H TYR 122 HN TYR 122 75.445 7.005 8.717 710 HA TYR 122 HA TYR 122 74.342 4.334 7.927 711 1HB TYR 122 HB2 TYR 122 73.909 7.206 7.092 712 2HB TYR 122 HB1 TYR 122 73.311 5.873 6.108 713 HD1 TYR 122 HD1 TYR 122 71.068 5.385 6.451 714 HD2 TYR 122 HD2 TYR 122 73.458 6.670 9.778 715 HE1 TYR 122 HE1 TYR 122 69.102 5.163 7.945 716 HE2 TYR 122 HE2 TYR 122 71.493 6.447 11.275 717 HH TYR 122 HH TYR 122 69.266 4.976 11.177 718 H HIS 123 HN HIS 123 76.054 3.191 6.937 719 HA HIS 123 HA HIS 123 77.798 4.719 5.065 720 1HB HIS 123 HB2 HIS 123 79.243 2.703 5.226 721 2HB HIS 123 HB1 HIS 123 78.894 3.394 6.803 722 HD1 HIS 123 HD1 HIS 123 78.645 0.296 4.885 723 HD2 HIS 123 HD2 HIS 123 76.773 1.906 8.244 724 HE1 HIS 123 HE1 HIS 123 77.533 -1.638 6.084 725 H ILE 124 HN ILE 124 77.901 4.235 2.884 726 HA ILE 124 HA ILE 124 75.702 2.590 1.779 727 HB ILE 124 HB ILE 124 77.859 4.321 0.516 728 1HG1 ILE 124 HG12 ILE 124 74.960 4.874 1.232 729 2HG1 ILE 124 HG11 ILE 124 76.389 5.667 1.910 730 1HG2 ILE 124 HG21 ILE 124 75.475 4.041 -1.057 731 2HG2 ILE 124 HG22 ILE 124 76.080 2.436 -0.643 732 3HG2 ILE 124 HG23 ILE 124 77.127 3.586 -1.475 733 1HD1 ILE 124 HD11 ILE 124 75.013 6.139 -0.664 734 2HD1 ILE 124 HD12 ILE 124 76.772 6.069 -0.775 735 3HD1 ILE 124 HD13 ILE 124 76.002 7.235 0.300 736 H ILE 125 HN ILE 125 76.141 0.429 1.562 737 HA ILE 125 HA ILE 125 78.923 -0.509 1.374 738 HB ILE 125 HB ILE 125 76.178 -1.707 1.730 739 1HG1 ILE 125 HG12 ILE 125 78.695 -1.874 3.415 740 2HG1 ILE 125 HG11 ILE 125 77.425 -0.664 3.654 741 1HG2 ILE 125 HG21 ILE 125 77.016 -3.475 0.536 742 2HG2 ILE 125 HG22 ILE 125 77.750 -3.848 2.095 743 3HG2 ILE 125 HG23 ILE 125 78.693 -3.029 0.850 744 1HD1 ILE 125 HD11 ILE 125 76.289 -3.330 3.448 745 2HD1 ILE 125 HD12 ILE 125 76.130 -2.152 4.749 746 3HD1 ILE 125 HD13 ILE 125 77.498 -3.264 4.731 747 H MET 126 HN MET 126 79.821 -0.517 -0.615 748 HA MET 126 HA MET 126 78.171 -1.505 -2.910 749 1HB MET 126 HB2 MET 126 78.702 0.435 -3.957 750 2HB MET 126 HB1 MET 126 79.466 0.984 -2.463 751 1HG MET 126 HG2 MET 126 81.607 0.172 -3.147 752 2HG MET 126 HG1 MET 126 80.907 -0.735 -4.496 753 1HE MET 126 HE1 MET 126 81.787 3.576 -3.828 754 2HE MET 126 HE2 MET 126 81.098 2.402 -2.704 755 3HE MET 126 HE3 MET 126 80.031 3.393 -3.695 756 H VAL 127 HN VAL 127 78.864 -3.601 -3.169 757 HA VAL 127 HA VAL 127 81.639 -4.369 -2.528 758 HB VAL 127 HB VAL 127 79.182 -5.866 -3.485 759 1HG1 VAL 127 HG11 VAL 127 80.993 -7.236 -4.126 760 2HG1 VAL 127 HG12 VAL 127 80.565 -7.840 -2.525 761 3HG1 VAL 127 HG13 VAL 127 81.955 -6.771 -2.723 762 1HG2 VAL 127 HG21 VAL 127 79.039 -4.831 -1.221 763 2HG2 VAL 127 HG22 VAL 127 80.499 -5.705 -0.756 764 3HG2 VAL 127 HG23 VAL 127 79.029 -6.594 -1.154 765 H GLU 128 HN GLU 128 83.097 -5.278 -4.075 766 HA GLU 128 HA GLU 128 82.293 -5.168 -6.925 767 1HB GLU 128 HB2 GLU 128 83.631 -3.097 -5.598 768 2HB GLU 128 HB1 GLU 128 84.902 -3.952 -6.486 769 1HG GLU 128 HG2 GLU 128 83.274 -3.877 -8.496 770 2HG GLU 128 HG1 GLU 128 82.395 -2.653 -7.569 771 H GLY 129 HN GLY 129 82.576 -7.421 -6.853 772 1HA GLY 129 HA2 GLY 129 83.893 -9.227 -7.669 773 2HA GLY 129 HA1 GLY 129 85.338 -8.284 -7.296 774 H ARG 130 HN ARG 130 83.564 -10.930 -6.388 775 HA ARG 130 HA ARG 130 84.991 -11.004 -3.782 776 1HB ARG 130 HB2 ARG 130 82.923 -10.514 -2.941 777 2HB ARG 130 HB1 ARG 130 82.077 -11.087 -4.369 778 1HG ARG 130 HG2 ARG 130 83.430 -13.023 -2.495 779 2HG ARG 130 HG1 ARG 130 81.815 -12.416 -2.143 780 1HD ARG 130 HD2 ARG 130 81.416 -13.103 -4.709 781 2HD ARG 130 HD1 ARG 130 82.709 -14.253 -4.321 782 HE ARG 130 HE ARG 130 81.150 -14.583 -2.156 783 1HH1 ARG 130 HH11 ARG 130 80.923 -16.042 -4.977 784 2HH1 ARG 130 HH12 ARG 130 79.197 -16.152 -5.077 785 1HH2 ARG 130 HH21 ARG 130 78.639 -13.920 -2.482 786 2HH2 ARG 130 HH22 ARG 130 77.904 -14.951 -3.664 787 H LYS 131 HN LYS 131 85.186 -13.277 -2.978 788 HA LYS 131 HA LYS 131 84.540 -15.516 -4.717 789 1HB LYS 131 HB2 LYS 131 87.063 -15.929 -5.167 790 2HB LYS 131 HB1 LYS 131 86.260 -14.684 -6.120 791 1HG LYS 131 HG2 LYS 131 88.352 -13.770 -5.322 792 2HG LYS 131 HG1 LYS 131 87.049 -12.989 -4.430 793 1HD LYS 131 HD2 LYS 131 87.713 -13.891 -2.457 794 2HD LYS 131 HD1 LYS 131 87.996 -15.473 -3.181 795 1HE LYS 131 HE2 LYS 131 90.218 -15.049 -3.045 796 2HE LYS 131 HE1 LYS 131 89.986 -13.760 -4.251 797 1HZ LYS 131 HZ1 LYS 131 90.854 -12.753 -2.283 798 2HZ LYS 131 HZ2 LYS 131 89.722 -13.545 -1.294 799 3HZ LYS 131 HZ3 LYS 131 89.214 -12.333 -2.371 Start of MODEL 7 1 1H GLY 28 HT1 GLY 28 87.801 -22.430 -10.438 2 2H GLY 28 HT2 GLY 28 88.074 -22.760 -8.794 3 3H GLY 28 HT3 GLY 28 88.946 -21.527 -9.572 4 1HA GLY 28 HA2 GLY 28 86.261 -20.938 -9.951 5 2HA GLY 28 HA1 GLY 28 86.462 -21.367 -8.252 6 H SER 29 HN SER 29 88.436 -20.301 -7.182 7 HA SER 29 HA SER 29 88.387 -17.417 -7.852 8 1HB SER 29 HB2 SER 29 89.725 -17.408 -5.640 9 2HB SER 29 HB1 SER 29 88.052 -17.959 -5.559 10 HG SER 29 HG SER 29 89.668 -19.325 -4.509 11 H GLY 30 HN GLY 30 90.301 -20.101 -8.611 12 1HA GLY 30 HA2 GLY 30 92.218 -19.928 -10.079 13 2HA GLY 30 HA1 GLY 30 92.519 -18.310 -9.445 14 HA PRO 31 HA PRO 31 95.519 -21.260 -7.463 15 1HB PRO 31 HB2 PRO 31 97.342 -19.032 -7.461 16 2HB PRO 31 HB1 PRO 31 97.441 -20.525 -8.412 17 1HG PRO 31 HG2 PRO 31 96.801 -17.875 -9.332 18 2HG PRO 31 HG1 PRO 31 96.912 -19.358 -10.282 19 1HD PRO 31 HD2 PRO 31 94.533 -17.894 -9.565 20 2HD PRO 31 HD1 PRO 31 94.644 -19.400 -10.506 21 H LYS 32 HN LYS 32 97.276 -19.833 -5.667 22 HA LYS 32 HA LYS 32 97.229 -19.077 -3.424 23 1HB LYS 32 HB2 LYS 32 96.682 -17.081 -4.962 24 2HB LYS 32 HB1 LYS 32 95.006 -17.310 -4.466 25 1HG LYS 32 HG2 LYS 32 95.466 -16.776 -2.224 26 2HG LYS 32 HG1 LYS 32 97.190 -17.104 -2.402 27 1HD LYS 32 HD2 LYS 32 97.617 -14.996 -3.113 28 2HD LYS 32 HD1 LYS 32 96.240 -15.006 -4.215 29 1HE LYS 32 HE2 LYS 32 95.307 -14.953 -1.471 30 2HE LYS 32 HE1 LYS 32 96.422 -13.608 -1.772 31 1HZ LYS 32 HZ1 LYS 32 94.195 -13.007 -2.480 32 2HZ LYS 32 HZ2 LYS 32 94.100 -14.387 -3.466 33 3HZ LYS 32 HZ3 LYS 32 95.203 -13.149 -3.837 34 H GLY 33 HN GLY 33 95.511 -18.527 -1.573 35 1HA GLY 33 HA2 GLY 33 93.147 -20.325 -1.856 36 2HA GLY 33 HA1 GLY 33 94.217 -20.493 -0.465 37 H GLY 34 HN GLY 34 91.930 -18.319 -2.064 38 1HA GLY 34 HA1 GLY 34 91.331 -17.128 0.582 39 2HA GLY 34 HA2 GLY 34 91.809 -16.023 -0.707 40 H GLY 35 HN GLY 35 89.847 -14.992 -1.075 41 1HA GLY 35 HA1 GLY 35 87.869 -14.935 -2.469 42 2HA GLY 35 HA2 GLY 35 87.708 -16.685 -2.260 43 H ASN 36 HN ASN 36 85.434 -16.187 -1.642 44 HA ASN 36 HA ASN 36 83.754 -15.853 -0.004 45 1HB ASN 36 HB2 ASN 36 85.754 -17.409 0.952 46 2HB ASN 36 HB1 ASN 36 85.806 -16.092 2.123 47 1HD2 ASN 36 HD21 ASN 36 82.927 -15.488 1.988 48 2HD2 ASN 36 HD22 ASN 36 82.118 -16.777 2.740 49 H ALA 37 HN ALA 37 85.544 -13.525 -0.867 50 HA ALA 37 HA ALA 37 84.779 -11.701 1.367 51 1HB ALA 37 HB1 ALA 37 87.452 -12.488 0.424 52 2HB ALA 37 HB2 ALA 37 86.982 -11.723 1.943 53 3HB ALA 37 HB3 ALA 37 87.226 -10.740 0.499 54 H VAL 38 HN VAL 38 83.710 -9.963 0.521 55 HA VAL 38 HA VAL 38 83.858 -9.448 -2.408 56 HB VAL 38 HB VAL 38 81.726 -8.443 -2.098 57 1HG1 VAL 38 HG11 VAL 38 82.270 -11.004 -0.996 58 2HG1 VAL 38 HG12 VAL 38 80.746 -10.415 -1.657 59 3HG1 VAL 38 HG13 VAL 38 81.093 -10.223 0.060 60 1HG2 VAL 38 HG21 VAL 38 80.858 -7.776 0.095 61 2HG2 VAL 38 HG22 VAL 38 82.410 -6.991 -0.195 62 3HG2 VAL 38 HG23 VAL 38 82.316 -8.389 0.876 63 H LYS 39 HN LYS 39 84.373 -7.210 -3.234 64 HA LYS 39 HA LYS 39 86.088 -5.751 -1.301 65 1HB LYS 39 HB2 LYS 39 86.077 -6.376 -3.971 66 2HB LYS 39 HB1 LYS 39 85.544 -4.697 -4.001 67 1HG LYS 39 HG2 LYS 39 87.968 -5.619 -2.423 68 2HG LYS 39 HG1 LYS 39 88.081 -5.079 -4.104 69 1HD LYS 39 HD2 LYS 39 87.103 -2.905 -3.476 70 2HD LYS 39 HD1 LYS 39 86.970 -3.446 -1.795 71 1HE LYS 39 HE2 LYS 39 89.016 -2.226 -1.839 72 2HE LYS 39 HE1 LYS 39 89.539 -3.914 -1.997 73 1HZ LYS 39 HZ1 LYS 39 88.806 -2.356 -4.392 74 2HZ LYS 39 HZ2 LYS 39 89.837 -3.701 -4.265 75 3HZ LYS 39 HZ3 LYS 39 90.354 -2.177 -3.722 76 H VAL 40 HN VAL 40 84.475 -4.870 0.148 77 HA VAL 40 HA VAL 40 82.354 -3.154 -0.990 78 HB VAL 40 HB VAL 40 82.099 -4.920 0.838 79 1HG1 VAL 40 HG11 VAL 40 83.442 -2.712 2.426 80 2HG1 VAL 40 HG12 VAL 40 84.090 -4.327 2.137 81 3HG1 VAL 40 HG13 VAL 40 82.647 -4.120 3.128 82 1HG2 VAL 40 HG21 VAL 40 80.187 -3.825 1.316 83 2HG2 VAL 40 HG22 VAL 40 80.825 -2.460 0.400 84 3HG2 VAL 40 HG23 VAL 40 81.065 -2.540 2.146 85 H ARG 41 HN ARG 41 82.089 -0.968 -0.465 86 HA ARG 41 HA ARG 41 84.520 0.427 0.604 87 1HB ARG 41 HB2 ARG 41 82.413 1.171 -1.449 88 2HB ARG 41 HB1 ARG 41 83.605 2.318 -0.839 89 1HG ARG 41 HG2 ARG 41 85.365 0.568 -1.530 90 2HG ARG 41 HG1 ARG 41 84.070 -0.197 -2.446 91 1HD ARG 41 HD2 ARG 41 83.939 2.575 -3.053 92 2HD ARG 41 HD1 ARG 41 85.649 2.103 -3.171 93 HE ARG 41 HE ARG 41 83.595 0.345 -4.429 94 1HH1 ARG 41 HH21 ARG 41 86.735 0.460 -4.662 95 2HH1 ARG 41 HH22 ARG 41 86.874 1.004 -6.300 96 1HH2 ARG 41 HH11 ARG 41 83.547 1.945 -6.550 97 2HH2 ARG 41 HH12 ARG 41 85.070 1.844 -7.369 98 H HIS 42 HN HIS 42 84.104 2.163 2.112 99 HA HIS 42 HA HIS 42 81.347 2.135 3.310 100 1HB HIS 42 HB2 HIS 42 82.614 2.648 5.444 101 2HB HIS 42 HB1 HIS 42 82.907 1.048 4.753 102 HD1 HIS 42 HD1 HIS 42 85.224 1.355 6.241 103 HD2 HIS 42 HD2 HIS 42 84.910 3.682 2.804 104 HE1 HIS 42 HE1 HIS 42 87.572 2.086 5.647 105 H ILE 43 HN ILE 43 80.292 4.070 3.116 106 HA ILE 43 HA ILE 43 81.901 6.598 3.390 107 HB ILE 43 HB ILE 43 80.627 5.725 1.107 108 1HG1 ILE 43 HG12 ILE 43 81.152 8.546 2.070 109 2HG1 ILE 43 HG11 ILE 43 82.200 7.537 1.066 110 1HG2 ILE 43 HG21 ILE 43 78.762 7.742 2.376 111 2HG2 ILE 43 HG22 ILE 43 78.404 6.021 2.251 112 3HG2 ILE 43 HG23 ILE 43 78.591 6.988 0.792 113 1HD1 ILE 43 HD11 ILE 43 81.229 8.799 -0.594 114 2HD1 ILE 43 HD12 ILE 43 79.736 9.038 0.313 115 3HD1 ILE 43 HD13 ILE 43 80.037 7.502 -0.499 116 H LEU 44 HN LEU 44 81.277 7.621 5.333 117 HA LEU 44 HA LEU 44 78.511 7.018 6.351 118 1HB LEU 44 HB2 LEU 44 80.925 8.283 7.720 119 2HB LEU 44 HB1 LEU 44 79.389 7.888 8.495 120 HG LEU 44 HG LEU 44 81.658 6.178 7.896 121 1HD1 LEU 44 HD11 LEU 44 80.378 6.738 10.098 122 2HD1 LEU 44 HD12 LEU 44 80.918 5.079 9.839 123 3HD1 LEU 44 HD13 LEU 44 79.232 5.517 9.545 124 1HD2 LEU 44 HD21 LEU 44 80.412 5.190 6.152 125 2HD2 LEU 44 HD22 LEU 44 78.895 5.380 7.035 126 3HD2 LEU 44 HD23 LEU 44 80.075 4.176 7.556 127 H CYS 45 HN CYS 45 77.199 8.669 7.037 128 HA CYS 45 HA CYS 45 78.009 11.466 6.383 129 1HB CYS 45 HB2 CYS 45 75.475 10.032 5.525 130 2HB CYS 45 HB1 CYS 45 75.790 11.759 5.284 131 HG CYS 45 HG CYS 45 77.881 11.019 3.779 132 H GLU 46 HN GLU 46 78.185 11.094 8.885 133 HA GLU 46 HA GLU 46 76.190 10.628 10.706 134 1HB GLU 46 HB2 GLU 46 78.586 12.182 10.535 135 2HB GLU 46 HB1 GLU 46 77.388 13.131 11.414 136 1HG GLU 46 HG2 GLU 46 78.309 11.860 13.139 137 2HG GLU 46 HG1 GLU 46 76.941 10.852 12.665 138 H LYS 47 HN LYS 47 76.273 13.330 8.436 139 HA LYS 47 HA LYS 47 73.883 14.572 9.712 140 1HB LYS 47 HB2 LYS 47 75.486 15.443 7.289 141 2HB LYS 47 HB1 LYS 47 74.421 16.439 8.279 142 1HG LYS 47 HG2 LYS 47 75.944 15.987 10.235 143 2HG LYS 47 HG1 LYS 47 77.053 15.191 9.118 144 1HD LYS 47 HD2 LYS 47 76.767 17.456 7.758 145 2HD LYS 47 HD1 LYS 47 76.345 18.092 9.348 146 1HE LYS 47 HE2 LYS 47 78.641 16.456 9.721 147 2HE LYS 47 HE1 LYS 47 78.963 17.486 8.313 148 1HZ LYS 47 HZ1 LYS 47 77.756 18.497 10.832 149 2HZ LYS 47 HZ2 LYS 47 78.365 19.411 9.536 150 3HZ LYS 47 HZ3 LYS 47 79.425 18.539 10.537 151 H HIS 48 HN HIS 48 74.870 12.634 7.004 152 HA HIS 48 HA HIS 48 73.641 11.547 5.332 153 1HB HIS 48 HB2 HIS 48 71.356 12.417 7.125 154 2HB HIS 48 HB1 HIS 48 71.280 11.146 5.903 155 HD1 HIS 48 HD1 HIS 48 73.864 9.662 6.339 156 HD2 HIS 48 HD2 HIS 48 71.530 11.003 9.517 157 HE1 HIS 48 HE1 HIS 48 74.584 8.315 8.359 158 H GLY 49 HN GLY 49 73.825 14.738 5.632 159 1HA GLY 49 HA2 GLY 49 71.685 15.606 3.840 160 2HA GLY 49 HA1 GLY 49 73.075 16.582 4.351 161 H LYS 50 HN LYS 50 74.782 14.149 3.578 162 HA LYS 50 HA LYS 50 74.866 14.681 0.628 163 1HB LYS 50 HB2 LYS 50 77.271 14.443 0.846 164 2HB LYS 50 HB1 LYS 50 76.727 15.560 2.097 165 1HG LYS 50 HG2 LYS 50 76.743 12.700 2.874 166 2HG LYS 50 HG1 LYS 50 78.326 13.425 2.598 167 1HD LYS 50 HD2 LYS 50 76.362 15.000 4.198 168 2HD LYS 50 HD1 LYS 50 77.087 13.590 4.970 169 1HE LYS 50 HE2 LYS 50 79.215 14.514 4.963 170 2HE LYS 50 HE1 LYS 50 78.902 15.473 3.499 171 1HZ LYS 50 HZ1 LYS 50 77.161 16.643 4.939 172 2HZ LYS 50 HZ2 LYS 50 78.791 17.024 5.227 173 3HZ LYS 50 HZ3 LYS 50 77.967 15.962 6.267 174 H ILE 51 HN ILE 51 74.482 12.310 3.095 175 HA ILE 51 HA ILE 51 75.529 9.972 1.992 176 HB ILE 51 HB ILE 51 74.253 10.251 4.143 177 1HG1 ILE 51 HG12 ILE 51 73.006 8.053 3.938 178 2HG1 ILE 51 HG11 ILE 51 73.395 8.079 2.213 179 1HG2 ILE 51 HG21 ILE 51 72.345 11.447 2.690 180 2HG2 ILE 51 HG22 ILE 51 71.980 10.621 4.206 181 3HG2 ILE 51 HG23 ILE 51 71.700 9.805 2.667 182 1HD1 ILE 51 HD11 ILE 51 75.016 6.782 3.730 183 2HD1 ILE 51 HD12 ILE 51 75.525 8.354 4.344 184 3HD1 ILE 51 HD13 ILE 51 75.738 7.964 2.637 185 H MET 52 HN MET 52 72.778 11.885 0.918 186 HA MET 52 HA MET 52 72.051 9.889 -1.125 187 1HB MET 52 HB2 MET 52 70.046 10.929 -0.864 188 2HB MET 52 HB1 MET 52 70.796 12.024 0.292 189 1HG MET 52 HG2 MET 52 69.810 13.388 -1.427 190 2HG MET 52 HG1 MET 52 71.555 13.426 -1.681 191 1HE MET 52 HE1 MET 52 71.347 13.576 -5.082 192 2HE MET 52 HE2 MET 52 72.570 12.474 -4.452 193 3HE MET 52 HE3 MET 52 72.096 13.885 -3.509 194 H GLU 53 HN GLU 53 73.509 13.076 -0.875 195 HA GLU 53 HA GLU 53 73.943 13.615 -3.632 196 1HB GLU 53 HB2 GLU 53 74.503 14.772 -1.163 197 2HB GLU 53 HB1 GLU 53 76.104 14.366 -1.781 198 1HG GLU 53 HG2 GLU 53 75.528 15.522 -3.913 199 2HG GLU 53 HG1 GLU 53 73.978 15.987 -3.210 200 H ALA 54 HN ALA 54 75.406 11.549 -1.239 201 HA ALA 54 HA ALA 54 77.800 10.854 -2.732 202 1HB ALA 54 HB1 ALA 54 77.125 10.510 -0.224 203 2HB ALA 54 HB2 ALA 54 78.050 9.235 -1.015 204 3HB ALA 54 HB3 ALA 54 76.308 9.060 -0.809 205 H MET 55 HN MET 55 74.443 9.845 -2.688 206 HA MET 55 HA MET 55 74.773 7.412 -4.248 207 1HB MET 55 HB2 MET 55 72.387 9.267 -3.946 208 2HB MET 55 HB1 MET 55 72.341 7.563 -4.413 209 1HG MET 55 HG2 MET 55 73.385 6.984 -2.215 210 2HG MET 55 HG1 MET 55 73.259 8.686 -1.758 211 1HE MET 55 HE1 MET 55 72.082 6.118 -0.261 212 2HE MET 55 HE2 MET 55 71.712 5.314 -1.784 213 3HE MET 55 HE3 MET 55 70.414 5.674 -0.649 214 H GLU 56 HN GLU 56 73.753 10.737 -5.103 215 HA GLU 56 HA GLU 56 73.542 10.206 -7.934 216 1HB GLU 56 HB2 GLU 56 73.561 12.543 -6.071 217 2HB GLU 56 HB1 GLU 56 73.813 12.870 -7.786 218 1HG GLU 56 HG2 GLU 56 71.692 11.011 -7.662 219 2HG GLU 56 HG1 GLU 56 71.360 12.204 -6.406 220 H LYS 57 HN LYS 57 75.956 12.183 -6.152 221 HA LYS 57 HA LYS 57 77.803 12.703 -8.131 222 1HB LYS 57 HB2 LYS 57 77.889 12.113 -5.220 223 2HB LYS 57 HB1 LYS 57 79.439 12.067 -6.059 224 1HG LYS 57 HG2 LYS 57 78.301 14.346 -7.097 225 2HG LYS 57 HG1 LYS 57 77.711 14.368 -5.435 226 1HD LYS 57 HD2 LYS 57 79.898 14.376 -4.537 227 2HD LYS 57 HD1 LYS 57 80.614 13.832 -6.054 228 1HE LYS 57 HE2 LYS 57 80.752 15.959 -6.865 229 2HE LYS 57 HE1 LYS 57 79.128 16.373 -6.284 230 1HZ LYS 57 HZ1 LYS 57 80.612 17.594 -4.935 231 2HZ LYS 57 HZ2 LYS 57 81.662 16.272 -4.740 232 3HZ LYS 57 HZ3 LYS 57 80.141 16.272 -3.981 233 H LEU 58 HN LEU 58 78.381 9.918 -5.969 234 HA LEU 58 HA LEU 58 80.228 8.517 -7.480 235 1HB LEU 58 HB2 LEU 58 77.981 7.769 -5.637 236 2HB LEU 58 HB1 LEU 58 78.901 6.480 -6.424 237 HG LEU 58 HG LEU 58 81.004 7.555 -5.578 238 1HD1 LEU 58 HD11 LEU 58 80.267 9.823 -5.259 239 2HD1 LEU 58 HD12 LEU 58 80.683 9.180 -3.671 240 3HD1 LEU 58 HD13 LEU 58 78.995 9.311 -4.153 241 1HD2 LEU 58 HD21 LEU 58 78.913 6.737 -3.541 242 2HD2 LEU 58 HD22 LEU 58 80.635 6.876 -3.189 243 3HD2 LEU 58 HD23 LEU 58 80.068 5.679 -4.352 244 H LYS 59 HN LYS 59 76.721 8.680 -8.036 245 HA LYS 59 HA LYS 59 76.761 6.601 -10.103 246 1HB LYS 59 HB2 LYS 59 74.839 8.377 -8.720 247 2HB LYS 59 HB1 LYS 59 74.399 7.947 -10.372 248 1HG LYS 59 HG2 LYS 59 75.387 5.599 -9.063 249 2HG LYS 59 HG1 LYS 59 74.170 6.341 -8.026 250 1HD LYS 59 HD2 LYS 59 73.724 5.912 -10.986 251 2HD LYS 59 HD1 LYS 59 73.304 4.690 -9.786 252 1HE LYS 59 HE2 LYS 59 71.780 6.242 -8.672 253 2HE LYS 59 HE1 LYS 59 72.278 7.554 -9.759 254 1HZ LYS 59 HZ1 LYS 59 70.744 5.110 -10.367 255 2HZ LYS 59 HZ2 LYS 59 71.690 5.824 -11.585 256 3HZ LYS 59 HZ3 LYS 59 70.440 6.708 -10.849 257 H SER 60 HN SER 60 75.614 9.977 -10.365 258 HA SER 60 HA SER 60 75.706 10.363 -13.080 259 1HB SER 60 HB2 SER 60 76.988 12.592 -11.722 260 2HB SER 60 HB1 SER 60 75.365 12.495 -12.403 261 HG SER 60 HG SER 60 76.235 11.645 -9.847 262 H GLY 61 HN GLY 61 78.510 10.323 -10.904 263 1HA GLY 61 HA2 GLY 61 80.609 9.367 -11.866 264 2HA GLY 61 HA1 GLY 61 80.252 10.285 -13.337 265 H MET 62 HN MET 62 79.839 11.548 -10.049 266 HA MET 62 HA MET 62 81.515 13.857 -10.702 267 1HB MET 62 HB2 MET 62 79.456 13.118 -8.887 268 2HB MET 62 HB1 MET 62 80.849 13.569 -7.905 269 1HG MET 62 HG2 MET 62 79.617 15.590 -8.304 270 2HG MET 62 HG1 MET 62 81.036 15.658 -9.351 271 1HE MET 62 HE1 MET 62 77.314 14.138 -9.390 272 2HE MET 62 HE2 MET 62 76.644 15.416 -10.402 273 3HE MET 62 HE3 MET 62 77.448 15.830 -8.890 274 H ARG 63 HN ARG 63 82.645 14.049 -7.967 275 HA ARG 63 HA ARG 63 85.146 12.668 -8.426 276 1HB ARG 63 HB2 ARG 63 83.929 14.070 -6.029 277 2HB ARG 63 HB1 ARG 63 85.617 13.550 -6.134 278 1HG ARG 63 HG2 ARG 63 86.180 15.205 -7.580 279 2HG ARG 63 HG1 ARG 63 84.615 15.177 -8.399 280 1HD ARG 63 HD2 ARG 63 83.813 16.848 -7.077 281 2HD ARG 63 HD1 ARG 63 84.373 16.028 -5.601 282 HE ARG 63 HE ARG 63 86.600 17.099 -7.123 283 1HH1 ARG 63 HH11 ARG 63 85.048 17.248 -4.201 284 2HH1 ARG 63 HH12 ARG 63 85.384 18.917 -3.884 285 1HH2 ARG 63 HH21 ARG 63 86.598 19.552 -7.070 286 2HH2 ARG 63 HH22 ARG 63 86.262 20.223 -5.509 287 H PHE 64 HN PHE 64 85.572 10.548 -7.888 288 HA PHE 64 HA PHE 64 83.664 9.087 -6.163 289 1HB PHE 64 HB2 PHE 64 85.830 8.512 -8.123 290 2HB PHE 64 HB1 PHE 64 85.635 7.327 -6.833 291 HD1 PHE 64 HD1 PHE 64 84.784 7.768 -10.071 292 HD2 PHE 64 HD2 PHE 64 82.840 7.176 -6.287 293 HE1 PHE 64 HE1 PHE 64 82.807 6.825 -11.235 294 HE2 PHE 64 HE2 PHE 64 80.863 6.233 -7.450 295 HZ PHE 64 HZ PHE 64 80.846 6.058 -9.923 296 H ASN 65 HN ASN 65 86.966 10.343 -6.162 297 HA ASN 65 HA ASN 65 87.551 9.116 -3.533 298 1HB ASN 65 HB2 ASN 65 89.127 9.381 -5.567 299 2HB ASN 65 HB1 ASN 65 89.238 11.074 -5.094 300 1HD2 ASN 65 HD21 ASN 65 90.501 7.946 -4.477 301 2HD2 ASN 65 HD22 ASN 65 91.362 8.323 -3.064 302 H GLU 66 HN GLU 66 86.755 12.307 -4.887 303 HA GLU 66 HA GLU 66 87.438 13.793 -2.497 304 1HB GLU 66 HB2 GLU 66 85.328 14.467 -4.565 305 2HB GLU 66 HB1 GLU 66 86.239 15.590 -3.567 306 1HG GLU 66 HG2 GLU 66 87.437 13.793 -5.699 307 2HG GLU 66 HG1 GLU 66 87.139 15.520 -5.868 308 H VAL 67 HN VAL 67 84.308 12.595 -3.804 309 HA VAL 67 HA VAL 67 82.726 13.309 -1.574 310 HB VAL 67 HB VAL 67 81.297 11.384 -2.362 311 1HG1 VAL 67 HG11 VAL 67 82.393 13.015 -4.640 312 2HG1 VAL 67 HG12 VAL 67 81.274 13.653 -3.433 313 3HG1 VAL 67 HG13 VAL 67 80.769 12.337 -4.499 314 1HG2 VAL 67 HG21 VAL 67 82.224 10.413 -4.602 315 2HG2 VAL 67 HG22 VAL 67 82.729 9.716 -3.063 316 3HG2 VAL 67 HG23 VAL 67 83.788 10.845 -3.910 317 H ALA 68 HN ALA 68 84.356 10.165 -2.270 318 HA ALA 68 HA ALA 68 83.834 8.823 0.131 319 1HB ALA 68 HB1 ALA 68 85.346 8.415 -2.102 320 2HB ALA 68 HB2 ALA 68 85.467 7.406 -0.662 321 3HB ALA 68 HB3 ALA 68 86.615 8.720 -0.916 322 H ALA 69 HN ALA 69 86.134 11.368 -0.627 323 HA ALA 69 HA ALA 69 87.654 11.388 1.743 324 1HB ALA 69 HB1 ALA 69 88.444 13.307 0.804 325 2HB ALA 69 HB2 ALA 69 86.834 14.017 0.694 326 3HB ALA 69 HB3 ALA 69 87.392 12.901 -0.552 327 H GLN 70 HN GLN 70 85.063 13.832 1.185 328 HA GLN 70 HA GLN 70 84.588 13.692 4.083 329 1HB GLN 70 HB2 GLN 70 84.218 15.685 1.991 330 2HB GLN 70 HB1 GLN 70 82.867 15.608 3.114 331 1HG GLN 70 HG2 GLN 70 85.755 16.214 3.725 332 2HG GLN 70 HG1 GLN 70 84.315 17.134 4.173 333 1HE2 GLN 70 HE21 GLN 70 82.981 14.416 5.074 334 2HE2 GLN 70 HE22 GLN 70 83.714 14.070 6.565 335 H TYR 71 HN TYR 71 82.646 13.184 1.136 336 HA TYR 71 HA TYR 71 80.101 13.073 2.188 337 1HB TYR 71 HB2 TYR 71 81.514 11.334 0.169 338 2HB TYR 71 HB1 TYR 71 79.816 11.088 0.540 339 HD1 TYR 71 HD1 TYR 71 78.925 11.788 -1.572 340 HD2 TYR 71 HD2 TYR 71 81.501 14.449 0.650 341 HE1 TYR 71 HE1 TYR 71 78.275 13.669 -3.048 342 HE2 TYR 71 HE2 TYR 71 80.840 16.305 -0.837 343 HH TYR 71 HH TYR 71 78.851 16.875 -2.299 344 H SER 72 HN SER 72 82.768 10.942 2.748 345 HA SER 72 HA SER 72 81.145 9.200 4.526 346 1HB SER 72 HB2 SER 72 82.826 8.337 2.846 347 2HB SER 72 HB1 SER 72 84.077 9.147 3.779 348 HG SER 72 HG SER 72 83.554 6.822 4.234 349 H GLU 73 HN GLU 73 80.856 10.417 6.441 350 HA GLU 73 HA GLU 73 82.739 12.313 7.486 351 1HB GLU 73 HB2 GLU 73 80.203 10.985 8.263 352 2HB GLU 73 HB1 GLU 73 81.174 11.612 9.603 353 1HG GLU 73 HG2 GLU 73 79.507 13.260 8.605 354 2HG GLU 73 HG1 GLU 73 81.177 13.826 8.671 355 H ASP 74 HN ASP 74 84.379 10.266 7.015 356 HA ASP 74 HA ASP 74 85.907 9.782 9.267 357 1HB ASP 74 HB2 ASP 74 85.064 7.389 9.862 358 2HB ASP 74 HB1 ASP 74 84.150 8.763 10.476 359 H LYS 75 HN LYS 75 85.223 6.625 8.182 360 HA LYS 75 HA LYS 75 87.661 6.069 6.993 361 1HB LYS 75 HB2 LYS 75 84.893 5.025 6.886 362 2HB LYS 75 HB1 LYS 75 85.919 4.523 5.546 363 1HG LYS 75 HG2 LYS 75 86.181 2.878 7.271 364 2HG LYS 75 HG1 LYS 75 87.657 3.845 7.257 365 1HD LYS 75 HD2 LYS 75 87.138 4.892 9.262 366 2HD LYS 75 HD1 LYS 75 85.400 4.676 9.043 367 1HE LYS 75 HE2 LYS 75 85.427 2.612 10.027 368 2HE LYS 75 HE1 LYS 75 86.929 2.148 9.201 369 1HZ LYS 75 HZ1 LYS 75 86.744 4.089 11.455 370 2HZ LYS 75 HZ2 LYS 75 88.170 3.561 10.697 371 3HZ LYS 75 HZ3 LYS 75 87.242 2.475 11.616 372 H ALA 76 HN ALA 76 85.104 5.867 4.634 373 HA ALA 76 HA ALA 76 85.406 8.177 3.106 374 1HB ALA 76 HB1 ALA 76 87.725 6.376 3.080 375 2HB ALA 76 HB2 ALA 76 87.618 8.069 2.604 376 3HB ALA 76 HB3 ALA 76 87.155 6.804 1.467 377 H ARG 77 HN ARG 77 86.234 5.219 1.440 378 HA ARG 77 HA ARG 77 84.174 3.602 1.008 379 1HB ARG 77 HB2 ARG 77 82.556 5.449 1.048 380 2HB ARG 77 HB1 ARG 77 83.372 6.222 -0.313 381 1HG ARG 77 HG2 ARG 77 81.597 5.076 -1.344 382 2HG ARG 77 HG1 ARG 77 82.923 3.923 -1.504 383 1HD ARG 77 HD2 ARG 77 81.515 2.440 -0.476 384 2HD ARG 77 HD1 ARG 77 81.865 3.335 1.009 385 HE ARG 77 HE ARG 77 79.677 4.197 0.862 386 1HH1 ARG 77 HH21 ARG 77 78.712 2.062 -0.892 387 2HH1 ARG 77 HH22 ARG 77 78.166 2.914 -2.297 388 1HH2 ARG 77 HH11 ARG 77 79.887 5.826 -1.527 389 2HH2 ARG 77 HH12 ARG 77 78.829 5.046 -2.656 390 H GLN 78 HN GLN 78 84.744 5.963 -1.583 391 HA GLN 78 HA GLN 78 85.581 4.009 -3.496 392 1HB GLN 78 HB2 GLN 78 85.836 6.993 -3.169 393 2HB GLN 78 HB1 GLN 78 86.542 6.178 -4.569 394 1HG GLN 78 HG2 GLN 78 84.230 7.034 -5.006 395 2HG GLN 78 HG1 GLN 78 84.358 5.286 -5.198 396 1HE2 GLN 78 HE21 GLN 78 83.525 7.724 -2.666 397 2HE2 GLN 78 HE22 GLN 78 82.339 6.761 -1.926 398 H GLY 79 HN GLY 79 87.834 6.623 -2.909 399 1HA GLY 79 HA2 GLY 79 90.145 4.993 -3.090 400 2HA GLY 79 HA1 GLY 79 90.118 6.615 -2.391 401 H GLY 80 HN GLY 80 87.931 5.513 -0.515 402 1HA GLY 80 HA1 GLY 80 89.825 4.537 1.541 403 2HA GLY 80 HA2 GLY 80 88.182 5.106 1.839 404 H ASP 81 HN ASP 81 88.071 3.128 -0.827 405 HA ASP 81 HA ASP 81 86.390 1.164 -0.117 406 1HB ASP 81 HB2 ASP 81 87.716 1.435 -2.254 407 2HB ASP 81 HB1 ASP 81 89.044 0.574 -1.466 408 H LEU 82 HN LEU 82 86.240 0.081 1.815 409 HA LEU 82 HA LEU 82 88.049 -0.403 3.807 410 1HB LEU 82 HB2 LEU 82 85.648 -1.682 2.744 411 2HB LEU 82 HB1 LEU 82 86.682 -2.815 3.617 412 HG LEU 82 HG LEU 82 86.690 -0.453 5.148 413 1HD1 LEU 82 HD11 LEU 82 84.729 0.235 3.797 414 2HD1 LEU 82 HD12 LEU 82 84.328 0.007 5.500 415 3HD1 LEU 82 HD13 LEU 82 83.886 -1.224 4.314 416 1HD2 LEU 82 HD21 LEU 82 85.938 -3.250 5.366 417 2HD2 LEU 82 HD22 LEU 82 84.833 -2.232 6.290 418 3HD2 LEU 82 HD23 LEU 82 86.567 -2.170 6.610 419 H GLY 83 HN GLY 83 87.608 -2.535 0.963 420 1HA GLY 83 HA2 GLY 83 89.699 -3.400 -0.124 421 2HA GLY 83 HA1 GLY 83 90.332 -3.650 1.510 422 H TRP 84 HN TRP 84 89.939 -5.677 -0.588 423 HA TRP 84 HA TRP 84 87.727 -7.314 -0.491 424 1HB TRP 84 HB2 TRP 84 90.690 -7.765 -0.522 425 2HB TRP 84 HB1 TRP 84 89.636 -9.162 -0.429 426 HD1 TRP 84 HD1 TRP 84 90.696 -6.384 -2.694 427 HE1 TRP 84 HE1 TRP 84 89.773 -6.789 -5.072 428 HE3 TRP 84 HE3 TRP 84 87.637 -10.339 -1.755 429 HZ2 TRP 84 HZ2 TRP 84 87.964 -8.579 -6.391 430 HZ3 TRP 84 HZ3 TRP 84 86.328 -11.383 -3.583 431 HH2 TRP 84 HH2 TRP 84 86.479 -10.509 -5.890 432 H MET 85 HN MET 85 86.523 -7.985 1.250 433 HA MET 85 HA MET 85 87.990 -8.754 3.755 434 1HB MET 85 HB2 MET 85 86.278 -6.603 3.327 435 2HB MET 85 HB1 MET 85 85.237 -7.814 4.076 436 1HG MET 85 HG2 MET 85 86.278 -6.464 5.822 437 2HG MET 85 HG1 MET 85 86.937 -8.099 5.884 438 1HE MET 85 HE1 MET 85 87.774 -5.804 7.215 439 2HE MET 85 HE2 MET 85 88.621 -4.514 6.366 440 3HE MET 85 HE3 MET 85 89.541 -5.808 7.128 441 H THR 86 HN THR 86 87.414 -10.729 4.592 442 HA THR 86 HA THR 86 85.393 -12.335 3.115 443 HB THR 86 HB THR 86 86.578 -14.012 4.894 444 HG1 THR 86 HG1 THR 86 88.627 -12.190 4.264 445 1HG2 THR 86 HG21 THR 86 87.561 -14.862 3.030 446 2HG2 THR 86 HG22 THR 86 88.342 -13.333 2.629 447 3HG2 THR 86 HG23 THR 86 86.656 -13.603 2.194 448 H ARG 87 HN ARG 87 83.651 -13.374 4.242 449 HA ARG 87 HA ARG 87 82.256 -11.977 6.216 450 1HB ARG 87 HB2 ARG 87 81.543 -13.942 4.762 451 2HB ARG 87 HB1 ARG 87 82.342 -14.994 5.931 452 1HG ARG 87 HG2 ARG 87 80.915 -13.952 7.728 453 2HG ARG 87 HG1 ARG 87 80.032 -13.103 6.460 454 1HD ARG 87 HD2 ARG 87 78.722 -15.039 6.752 455 2HD ARG 87 HD1 ARG 87 79.792 -15.533 5.427 456 HE ARG 87 HE ARG 87 80.758 -17.071 6.937 457 1HH1 ARG 87 HH21 ARG 87 78.349 -16.485 8.784 458 2HH1 ARG 87 HH22 ARG 87 79.171 -16.167 10.276 459 1HH2 ARG 87 HH11 ARG 87 82.276 -15.758 8.786 460 2HH2 ARG 87 HH12 ARG 87 81.394 -15.757 10.277 461 H GLY 88 HN GLY 88 81.905 -12.585 8.540 462 1HA GLY 88 HA2 GLY 88 82.653 -13.371 10.660 463 2HA GLY 88 HA1 GLY 88 84.061 -14.091 9.863 464 H SER 89 HN SER 89 85.276 -12.030 8.617 465 HA SER 89 HA SER 89 86.150 -10.327 10.890 466 1HB SER 89 HB2 SER 89 87.596 -11.755 9.241 467 2HB SER 89 HB1 SER 89 87.336 -10.410 8.120 468 HG SER 89 HG SER 89 89.078 -9.757 9.177 469 H MET 90 HN MET 90 83.612 -9.593 9.938 470 HA MET 90 HA MET 90 84.179 -6.875 8.921 471 1HB MET 90 HB2 MET 90 83.412 -9.057 7.253 472 2HB MET 90 HB1 MET 90 82.030 -7.966 7.360 473 1HG MET 90 HG2 MET 90 84.258 -6.282 7.082 474 2HG MET 90 HG1 MET 90 84.546 -7.605 5.952 475 1HE MET 90 HE1 MET 90 81.299 -7.832 3.966 476 2HE MET 90 HE2 MET 90 82.369 -8.737 5.032 477 3HE MET 90 HE3 MET 90 83.030 -7.927 3.614 478 H VAL 91 HN VAL 91 83.328 -7.023 11.367 479 HA VAL 91 HA VAL 91 81.571 -6.515 12.862 480 HB VAL 91 HB VAL 91 79.999 -5.669 10.434 481 1HG1 VAL 91 HG11 VAL 91 80.552 -4.014 12.872 482 2HG1 VAL 91 HG12 VAL 91 79.429 -5.367 13.004 483 3HG1 VAL 91 HG13 VAL 91 79.109 -4.064 11.859 484 1HG2 VAL 91 HG21 VAL 91 82.485 -4.308 11.524 485 2HG2 VAL 91 HG22 VAL 91 81.371 -3.588 10.361 486 3HG2 VAL 91 HG23 VAL 91 82.305 -5.017 9.919 487 H GLY 92 HN GLY 92 78.694 -6.573 11.746 488 1HA GLY 92 HA2 GLY 92 78.407 -9.551 11.654 489 2HA GLY 92 HA1 GLY 92 77.331 -8.539 12.629 490 HA PRO 93 HA PRO 93 74.548 -8.184 9.268 491 1HB PRO 93 HB2 PRO 93 74.051 -5.386 9.711 492 2HB PRO 93 HB1 PRO 93 73.058 -6.764 10.213 493 1HG PRO 93 HG2 PRO 93 74.670 -5.050 11.865 494 2HG PRO 93 HG1 PRO 93 73.676 -6.420 12.366 495 1HD PRO 93 HD2 PRO 93 76.556 -6.267 12.267 496 2HD PRO 93 HD1 PRO 93 75.553 -7.650 12.763 497 H PHE 94 HN PHE 94 77.088 -5.753 9.626 498 HA PHE 94 HA PHE 94 76.937 -4.422 7.144 499 1HB PHE 94 HB2 PHE 94 78.430 -4.026 9.181 500 2HB PHE 94 HB1 PHE 94 79.472 -5.310 8.550 501 HD1 PHE 94 HD1 PHE 94 80.149 -5.065 6.008 502 HD2 PHE 94 HD2 PHE 94 78.802 -1.829 8.490 503 HE1 PHE 94 HE1 PHE 94 81.219 -3.439 4.470 504 HE2 PHE 94 HE2 PHE 94 79.871 -0.204 6.952 505 HZ PHE 94 HZ PHE 94 81.081 -1.009 4.943 506 H GLN 95 HN GLN 95 78.277 -7.616 7.925 507 HA GLN 95 HA GLN 95 79.327 -7.963 5.189 508 1HB GLN 95 HB2 GLN 95 80.504 -9.707 6.144 509 2HB GLN 95 HB1 GLN 95 80.188 -8.754 7.590 510 1HG GLN 95 HG2 GLN 95 78.131 -10.133 7.982 511 2HG GLN 95 HG1 GLN 95 78.600 -11.141 6.615 512 1HE2 GLN 95 HE21 GLN 95 78.675 -12.873 8.419 513 2HE2 GLN 95 HE22 GLN 95 80.120 -13.024 9.295 514 H GLU 96 HN GLU 96 76.605 -9.114 7.159 515 HA GLU 96 HA GLU 96 75.729 -11.111 5.248 516 1HB GLU 96 HB2 GLU 96 74.006 -11.454 6.808 517 2HB GLU 96 HB1 GLU 96 75.296 -10.796 7.811 518 1HG GLU 96 HG2 GLU 96 73.492 -9.482 8.475 519 2HG GLU 96 HG1 GLU 96 74.188 -8.482 7.200 520 H ALA 97 HN ALA 97 75.079 -7.675 5.708 521 HA ALA 97 HA ALA 97 72.840 -7.688 3.783 522 1HB ALA 97 HB1 ALA 97 73.329 -5.089 4.352 523 2HB ALA 97 HB2 ALA 97 74.134 -5.844 5.726 524 3HB ALA 97 HB3 ALA 97 72.421 -6.144 5.434 525 H ALA 98 HN ALA 98 76.256 -6.810 3.861 526 HA ALA 98 HA ALA 98 76.039 -5.669 1.109 527 1HB ALA 98 HB1 ALA 98 77.645 -4.245 1.834 528 2HB ALA 98 HB2 ALA 98 78.614 -5.559 2.502 529 3HB ALA 98 HB3 ALA 98 77.293 -4.869 3.446 530 H PHE 99 HN PHE 99 78.077 -7.964 2.980 531 HA PHE 99 HA PHE 99 79.428 -8.888 0.562 532 1HB PHE 99 HB2 PHE 99 80.825 -8.994 2.380 533 2HB PHE 99 HB1 PHE 99 79.494 -9.269 3.510 534 HD1 PHE 99 HD1 PHE 99 78.383 -11.537 3.539 535 HD2 PHE 99 HD2 PHE 99 82.112 -10.787 1.566 536 HE1 PHE 99 HE1 PHE 99 78.873 -13.976 3.542 537 HE2 PHE 99 HE2 PHE 99 82.608 -13.214 1.563 538 HZ PHE 99 HZ PHE 99 80.994 -14.811 2.553 539 H ALA 100 HN ALA 100 76.548 -9.777 2.303 540 HA ALA 100 HA ALA 100 76.462 -12.502 1.144 541 1HB ALA 100 HB1 ALA 100 75.493 -11.238 3.425 542 2HB ALA 100 HB2 ALA 100 75.018 -12.842 2.866 543 3HB ALA 100 HB3 ALA 100 74.053 -11.432 2.426 544 H LEU 101 HN LEU 101 74.727 -9.407 0.893 545 HA LEU 101 HA LEU 101 72.884 -10.274 -1.173 546 1HB LEU 101 HB2 LEU 101 73.790 -7.739 0.157 547 2HB LEU 101 HB1 LEU 101 72.816 -7.612 -1.311 548 HG LEU 101 HG LEU 101 72.014 -9.330 1.054 549 1HD1 LEU 101 HD11 LEU 101 71.752 -6.409 0.581 550 2HD1 LEU 101 HD12 LEU 101 71.791 -7.303 2.102 551 3HD1 LEU 101 HD13 LEU 101 70.304 -7.239 1.155 552 1HD2 LEU 101 HD21 LEU 101 70.891 -9.968 -0.967 553 2HD2 LEU 101 HD22 LEU 101 70.606 -8.286 -1.413 554 3HD2 LEU 101 HD23 LEU 101 69.746 -8.994 -0.047 555 HA PRO 102 HA PRO 102 75.095 -9.785 -4.950 556 1HB PRO 102 HB2 PRO 102 73.723 -7.440 -5.918 557 2HB PRO 102 HB1 PRO 102 73.478 -9.128 -6.398 558 1HG PRO 102 HG2 PRO 102 71.813 -7.452 -4.685 559 2HG PRO 102 HG1 PRO 102 71.458 -9.052 -5.354 560 1HD PRO 102 HD2 PRO 102 71.989 -8.473 -2.645 561 2HD PRO 102 HD1 PRO 102 72.007 -10.094 -3.383 562 H VAL 103 HN VAL 103 76.981 -8.660 -5.599 563 HA VAL 103 HA VAL 103 78.244 -6.882 -3.861 564 HB VAL 103 HB VAL 103 79.662 -6.572 -5.943 565 1HG1 VAL 103 HG11 VAL 103 79.499 -9.400 -6.031 566 2HG1 VAL 103 HG12 VAL 103 79.125 -8.899 -4.381 567 3HG1 VAL 103 HG13 VAL 103 80.648 -8.416 -5.127 568 1HG2 VAL 103 HG21 VAL 103 78.789 -7.013 -7.956 569 2HG2 VAL 103 HG22 VAL 103 77.257 -7.411 -7.176 570 3HG2 VAL 103 HG23 VAL 103 78.462 -8.671 -7.452 571 H SER 104 HN SER 104 79.161 -4.787 -5.537 572 HA SER 104 HA SER 104 78.610 -2.572 -6.146 573 1HB SER 104 HB2 SER 104 76.184 -4.168 -7.009 574 2HB SER 104 HB1 SER 104 76.383 -2.454 -7.388 575 HG SER 104 HG SER 104 78.607 -3.343 -8.110 576 H GLY 105 HN GLY 105 77.149 -0.746 -5.556 577 1HA GLY 105 HA2 GLY 105 75.002 -1.105 -3.656 578 2HA GLY 105 HA1 GLY 105 76.487 -0.611 -2.846 579 H MET 106 HN MET 106 76.953 1.564 -2.821 580 HA MET 106 HA MET 106 76.764 3.861 -3.299 581 1HB MET 106 HB2 MET 106 77.557 2.977 -5.482 582 2HB MET 106 HB1 MET 106 75.880 2.735 -5.976 583 1HG MET 106 HG2 MET 106 75.429 5.103 -5.868 584 2HG MET 106 HG1 MET 106 77.002 5.418 -5.121 585 1HE MET 106 HE1 MET 106 75.391 3.433 -7.796 586 2HE MET 106 HE2 MET 106 76.946 2.652 -8.075 587 3HE MET 106 HE3 MET 106 76.277 3.729 -9.299 588 H ASP 107 HN ASP 107 74.101 2.798 -5.435 589 HA ASP 107 HA ASP 107 71.994 3.351 -3.533 590 1HB ASP 107 HB2 ASP 107 71.402 5.570 -4.224 591 2HB ASP 107 HB1 ASP 107 73.141 5.595 -3.931 592 H LYS 108 HN LYS 108 72.206 1.249 -5.316 593 HA LYS 108 HA LYS 108 69.748 1.398 -6.775 594 1HB LYS 108 HB2 LYS 108 72.074 2.533 -7.999 595 2HB LYS 108 HB1 LYS 108 71.611 1.087 -8.902 596 1HG LYS 108 HG2 LYS 108 69.436 2.962 -8.084 597 2HG LYS 108 HG1 LYS 108 70.492 3.460 -9.406 598 1HD LYS 108 HD2 LYS 108 69.713 0.680 -9.702 599 2HD LYS 108 HD1 LYS 108 68.292 1.716 -9.575 600 1HE LYS 108 HE2 LYS 108 68.608 2.284 -11.750 601 2HE LYS 108 HE1 LYS 108 70.120 3.078 -11.270 602 1HZ LYS 108 HZ1 LYS 108 70.791 1.422 -12.761 603 2HZ LYS 108 HZ2 LYS 108 69.698 0.278 -12.140 604 3HZ LYS 108 HZ3 LYS 108 71.069 0.723 -11.240 605 HA PRO 109 HA PRO 109 72.098 -2.658 -8.093 606 1HB PRO 109 HB2 PRO 109 74.544 -2.712 -6.577 607 2HB PRO 109 HB1 PRO 109 74.351 -2.692 -8.337 608 1HG PRO 109 HG2 PRO 109 75.227 -0.554 -6.596 609 2HG PRO 109 HG1 PRO 109 75.146 -0.570 -8.359 610 1HD PRO 109 HD2 PRO 109 73.467 0.892 -6.575 611 2HD PRO 109 HD1 PRO 109 73.282 0.728 -8.338 612 H VAL 110 HN VAL 110 73.595 -4.233 -6.109 613 HA VAL 110 HA VAL 110 72.914 -5.626 -4.302 614 HB VAL 110 HB VAL 110 74.165 -3.493 -3.543 615 1HG1 VAL 110 HG11 VAL 110 72.722 -2.101 -1.970 616 2HG1 VAL 110 HG12 VAL 110 71.324 -2.825 -2.761 617 3HG1 VAL 110 HG13 VAL 110 72.458 -1.847 -3.693 618 1HG2 VAL 110 HG21 VAL 110 72.700 -4.270 -1.156 619 2HG2 VAL 110 HG22 VAL 110 74.381 -4.584 -1.588 620 3HG2 VAL 110 HG23 VAL 110 73.109 -5.671 -2.146 621 H PHE 111 HN PHE 111 71.096 -4.913 -2.135 622 HA PHE 111 HA PHE 111 68.506 -4.629 -3.611 623 1HB PHE 111 HB2 PHE 111 69.656 -6.857 -2.114 624 2HB PHE 111 HB1 PHE 111 68.058 -6.402 -1.510 625 HD1 PHE 111 HD1 PHE 111 69.867 -6.964 -4.753 626 HD2 PHE 111 HD2 PHE 111 66.172 -7.259 -2.582 627 HE1 PHE 111 HE1 PHE 111 68.813 -8.086 -6.697 628 HE2 PHE 111 HE2 PHE 111 65.119 -8.380 -4.527 629 HZ PHE 111 HZ PHE 111 66.440 -8.794 -6.585 630 H THR 112 HN THR 112 70.309 -4.175 -0.606 631 HA THR 112 HA THR 112 67.953 -2.886 0.676 632 HB THR 112 HB THR 112 69.200 -4.425 2.034 633 HG1 THR 112 HG1 THR 112 70.206 -1.909 2.790 634 1HG2 THR 112 HG21 THR 112 71.451 -3.305 0.582 635 2HG2 THR 112 HG22 THR 112 71.360 -4.809 1.496 636 3HG2 THR 112 HG23 THR 112 71.763 -3.303 2.318 637 H ASP 113 HN ASP 113 68.646 -0.860 2.024 638 HA ASP 113 HA ASP 113 69.582 1.177 0.138 639 1HB ASP 113 HB2 ASP 113 69.077 2.670 2.069 640 2HB ASP 113 HB1 ASP 113 67.748 1.556 1.751 641 HA PRO 114 HA PRO 114 73.823 0.740 1.202 642 1HB PRO 114 HB2 PRO 114 74.394 3.484 0.649 643 2HB PRO 114 HB1 PRO 114 74.707 2.068 -0.361 644 1HG PRO 114 HG2 PRO 114 72.718 4.099 -0.766 645 2HG PRO 114 HG1 PRO 114 73.025 2.670 -1.755 646 1HD PRO 114 HD2 PRO 114 70.793 3.161 0.028 647 2HD PRO 114 HD1 PRO 114 71.076 1.746 -1.011 648 HA PRO 115 HA PRO 115 74.378 4.291 4.487 649 1HB PRO 115 HB2 PRO 115 71.803 5.531 4.831 650 2HB PRO 115 HB1 PRO 115 73.306 6.262 4.257 651 1HG PRO 115 HG2 PRO 115 70.949 5.650 2.737 652 2HG PRO 115 HG1 PRO 115 72.461 6.364 2.156 653 1HD PRO 115 HD2 PRO 115 71.452 3.697 1.681 654 2HD PRO 115 HD1 PRO 115 72.949 4.421 1.077 655 H VAL 116 HN VAL 116 74.054 1.875 5.270 656 HA VAL 116 HA VAL 116 71.611 1.529 6.920 657 HB VAL 116 HB VAL 116 72.340 -0.751 7.018 658 1HG1 VAL 116 HG11 VAL 116 72.149 0.695 4.516 659 2HG1 VAL 116 HG12 VAL 116 71.502 -0.894 4.927 660 3HG1 VAL 116 HG13 VAL 116 73.158 -0.741 4.337 661 1HG2 VAL 116 HG21 VAL 116 74.729 -0.218 7.437 662 2HG2 VAL 116 HG22 VAL 116 74.909 0.139 5.717 663 3HG2 VAL 116 HG23 VAL 116 74.501 -1.498 6.242 664 H LYS 117 HN LYS 117 71.772 1.169 9.201 665 HA LYS 117 HA LYS 117 74.091 2.488 10.449 666 1HB LYS 117 HB2 LYS 117 71.360 2.379 10.868 667 2HB LYS 117 HB1 LYS 117 72.014 1.385 12.181 668 1HG LYS 117 HG2 LYS 117 73.634 3.758 11.800 669 2HG LYS 117 HG1 LYS 117 71.941 4.204 12.065 670 1HD LYS 117 HD2 LYS 117 72.393 2.157 13.907 671 2HD LYS 117 HD1 LYS 117 73.887 3.106 13.950 672 1HE LYS 117 HE2 LYS 117 72.846 4.884 14.936 673 2HE LYS 117 HE1 LYS 117 71.420 4.739 13.891 674 1HZ LYS 117 HZ1 LYS 117 71.125 4.122 16.333 675 2HZ LYS 117 HZ2 LYS 117 72.046 2.737 15.987 676 3HZ LYS 117 HZ3 LYS 117 70.569 2.999 15.191 677 H THR 118 HN THR 118 75.605 1.492 11.702 678 HA THR 118 HA THR 118 75.237 -1.308 12.596 679 HB THR 118 HB THR 118 77.198 -2.071 11.380 680 HG1 THR 118 HG1 THR 118 78.236 -0.536 9.964 681 1HG2 THR 118 HG21 THR 118 74.994 -1.925 10.160 682 2HG2 THR 118 HG22 THR 118 76.411 -1.895 9.109 683 3HG2 THR 118 HG23 THR 118 75.549 -0.399 9.471 684 H LYS 119 HN LYS 119 75.290 0.245 14.565 685 HA LYS 119 HA LYS 119 76.446 0.945 16.496 686 1HB LYS 119 HB2 LYS 119 78.737 -0.508 15.133 687 2HB LYS 119 HB1 LYS 119 78.623 -0.118 16.848 688 1HG LYS 119 HG2 LYS 119 77.584 -2.095 17.147 689 2HG LYS 119 HG1 LYS 119 76.219 -1.441 16.237 690 1HD LYS 119 HD2 LYS 119 77.753 -2.108 14.160 691 2HD LYS 119 HD1 LYS 119 78.418 -3.253 15.326 692 1HE LYS 119 HE2 LYS 119 76.089 -4.053 15.805 693 2HE LYS 119 HE1 LYS 119 75.500 -2.984 14.516 694 1HZ LYS 119 HZ1 LYS 119 76.089 -5.343 13.838 695 2HZ LYS 119 HZ2 LYS 119 77.713 -4.914 14.096 696 3HZ LYS 119 HZ3 LYS 119 76.792 -4.103 12.919 697 H PHE 120 HN PHE 120 76.400 2.648 14.046 698 HA PHE 120 HA PHE 120 78.467 4.565 14.882 699 1HB PHE 120 HB2 PHE 120 78.840 2.684 12.710 700 2HB PHE 120 HB1 PHE 120 78.826 4.336 12.083 701 HD1 PHE 120 HD1 PHE 120 81.132 2.090 12.691 702 HD2 PHE 120 HD2 PHE 120 79.913 5.837 14.404 703 HE1 PHE 120 HE1 PHE 120 83.430 2.444 13.554 704 HE2 PHE 120 HE2 PHE 120 82.210 6.190 15.268 705 HZ PHE 120 HZ PHE 120 83.968 4.493 14.843 706 H GLY 121 HN GLY 121 77.008 4.220 11.692 707 1HA GLY 121 HA2 GLY 121 74.779 6.020 12.204 708 2HA GLY 121 HA1 GLY 121 76.097 6.804 11.319 709 H TYR 122 HN TYR 122 74.464 6.878 9.489 710 HA TYR 122 HA TYR 122 73.840 4.257 8.251 711 1HB TYR 122 HB2 TYR 122 73.334 7.081 7.260 712 2HB TYR 122 HB1 TYR 122 72.529 5.614 6.717 713 HD1 TYR 122 HD1 TYR 122 72.079 4.225 9.310 714 HD2 TYR 122 HD2 TYR 122 71.592 8.351 8.225 715 HE1 TYR 122 HE1 TYR 122 70.372 4.492 11.090 716 HE2 TYR 122 HE2 TYR 122 69.890 8.620 10.008 717 HH TYR 122 HH TYR 122 69.165 5.989 12.268 718 H HIS 123 HN HIS 123 75.555 3.350 7.183 719 HA HIS 123 HA HIS 123 77.407 5.169 5.684 720 1HB HIS 123 HB2 HIS 123 78.997 3.357 5.943 721 2HB HIS 123 HB1 HIS 123 78.235 3.646 7.505 722 HD1 HIS 123 HD1 HIS 123 78.218 1.208 4.624 723 HD2 HIS 123 HD2 HIS 123 76.751 1.501 8.519 724 HE1 HIS 123 HE1 HIS 123 77.412 -1.105 5.262 725 H ILE 124 HN ILE 124 77.794 4.760 3.446 726 HA ILE 124 HA ILE 124 75.703 3.139 2.112 727 HB ILE 124 HB ILE 124 77.963 4.813 0.957 728 1HG1 ILE 124 HG12 ILE 124 75.098 5.553 1.639 729 2HG1 ILE 124 HG11 ILE 124 76.560 6.223 2.376 730 1HG2 ILE 124 HG21 ILE 124 76.330 3.013 -0.307 731 2HG2 ILE 124 HG22 ILE 124 77.093 4.398 -1.087 732 3HG2 ILE 124 HG23 ILE 124 75.434 4.520 -0.507 733 1HD1 ILE 124 HD11 ILE 124 75.210 7.163 0.062 734 2HD1 ILE 124 HD12 ILE 124 76.728 6.460 -0.496 735 3HD1 ILE 124 HD13 ILE 124 76.743 7.740 0.717 736 H ILE 125 HN ILE 125 76.113 1.067 1.577 737 HA ILE 125 HA ILE 125 78.926 0.107 1.637 738 HB ILE 125 HB ILE 125 76.934 -1.966 1.301 739 1HG1 ILE 125 HG12 ILE 125 76.434 -0.003 3.570 740 2HG1 ILE 125 HG11 ILE 125 75.301 -0.441 2.283 741 1HG2 ILE 125 HG21 ILE 125 78.539 -1.249 3.752 742 2HG2 ILE 125 HG22 ILE 125 79.246 -2.027 2.335 743 3HG2 ILE 125 HG23 ILE 125 77.978 -2.845 3.254 744 1HD1 ILE 125 HD11 ILE 125 74.576 -2.162 3.536 745 2HD1 ILE 125 HD12 ILE 125 75.754 -1.774 4.787 746 3HD1 ILE 125 HD13 ILE 125 76.191 -2.865 3.475 747 H MET 126 HN MET 126 79.931 -0.278 -0.227 748 HA MET 126 HA MET 126 78.301 -0.967 -2.643 749 1HB MET 126 HB2 MET 126 79.028 1.038 -3.435 750 2HB MET 126 HB1 MET 126 80.108 1.250 -2.053 751 1HG MET 126 HG2 MET 126 81.888 0.112 -3.128 752 2HG MET 126 HG1 MET 126 80.815 -0.584 -4.351 753 1HE MET 126 HE1 MET 126 79.863 2.865 -3.310 754 2HE MET 126 HE2 MET 126 80.969 3.976 -4.112 755 3HE MET 126 HE3 MET 126 81.551 2.965 -2.791 756 H VAL 127 HN VAL 127 78.766 -3.138 -2.875 757 HA VAL 127 HA VAL 127 81.412 -4.195 -2.116 758 HB VAL 127 HB VAL 127 78.776 -5.312 -3.063 759 1HG1 VAL 127 HG11 VAL 127 80.342 -6.798 -4.047 760 2HG1 VAL 127 HG12 VAL 127 79.906 -7.562 -2.517 761 3HG1 VAL 127 HG13 VAL 127 81.433 -6.688 -2.668 762 1HG2 VAL 127 HG21 VAL 127 79.608 -4.506 -0.593 763 2HG2 VAL 127 HG22 VAL 127 80.092 -6.202 -0.566 764 3HG2 VAL 127 HG23 VAL 127 78.408 -5.771 -0.859 765 H GLU 128 HN GLU 128 82.886 -5.133 -3.595 766 HA GLU 128 HA GLU 128 82.212 -5.042 -6.473 767 1HB GLU 128 HB2 GLU 128 83.010 -2.806 -5.924 768 2HB GLU 128 HB1 GLU 128 84.444 -3.484 -5.138 769 1HG GLU 128 HG2 GLU 128 85.488 -3.906 -7.124 770 2HG GLU 128 HG1 GLU 128 83.984 -4.380 -7.927 771 H GLY 129 HN GLY 129 82.556 -7.335 -6.364 772 1HA GLY 129 HA2 GLY 129 84.087 -8.978 -7.249 773 2HA GLY 129 HA1 GLY 129 85.408 -8.065 -6.516 774 H ARG 130 HN ARG 130 83.416 -10.760 -6.190 775 HA ARG 130 HA ARG 130 84.453 -11.165 -3.422 776 1HB ARG 130 HB2 ARG 130 82.187 -12.245 -2.968 777 2HB ARG 130 HB1 ARG 130 82.194 -10.494 -3.143 778 1HG ARG 130 HG2 ARG 130 81.220 -10.571 -5.275 779 2HG ARG 130 HG1 ARG 130 81.731 -12.237 -5.549 780 1HD ARG 130 HD2 ARG 130 80.062 -12.223 -3.227 781 2HD ARG 130 HD1 ARG 130 79.225 -11.323 -4.505 782 HE ARG 130 HE ARG 130 80.483 -13.955 -5.151 783 1HH1 ARG 130 HH21 ARG 130 78.584 -12.071 -6.810 784 2HH1 ARG 130 HH22 ARG 130 77.147 -13.038 -6.798 785 1HH2 ARG 130 HH11 ARG 130 78.266 -15.143 -4.281 786 2HH2 ARG 130 HH12 ARG 130 76.967 -14.777 -5.367 787 H LYS 131 HN LYS 131 83.763 -13.657 -2.884 788 HA LYS 131 HA LYS 131 84.198 -15.379 -5.270 789 1HB LYS 131 HB2 LYS 131 86.051 -14.988 -2.915 790 2HB LYS 131 HB1 LYS 131 86.101 -16.461 -3.884 791 1HG LYS 131 HG2 LYS 131 87.489 -15.330 -5.267 792 2HG LYS 131 HG1 LYS 131 86.061 -14.434 -5.786 793 1HD LYS 131 HD2 LYS 131 87.024 -12.567 -4.973 794 2HD LYS 131 HD1 LYS 131 86.847 -13.248 -3.356 795 1HE LYS 131 HE2 LYS 131 89.073 -14.584 -4.225 796 2HE LYS 131 HE1 LYS 131 89.271 -13.015 -5.042 797 1HZ LYS 131 HZ1 LYS 131 90.043 -12.412 -3.009 798 2HZ LYS 131 HZ2 LYS 131 89.198 -13.636 -2.189 799 3HZ LYS 131 HZ3 LYS 131 88.393 -12.219 -2.667 Start of MODEL 8 1 1H GLY 28 HT1 GLY 28 83.878 -26.023 5.067 2 2H GLY 28 HT2 GLY 28 85.051 -24.899 4.570 3 3H GLY 28 HT3 GLY 28 83.757 -25.293 3.541 4 1HA GLY 28 HA2 GLY 28 82.541 -23.668 4.386 5 2HA GLY 28 HA1 GLY 28 82.688 -24.415 5.977 6 H SER 29 HN SER 29 83.419 -21.663 4.220 7 HA SER 29 HA SER 29 84.720 -19.761 4.744 8 1HB SER 29 HB2 SER 29 83.863 -21.049 7.131 9 2HB SER 29 HB1 SER 29 85.531 -20.538 7.394 10 HG SER 29 HG SER 29 83.861 -18.938 7.856 11 H GLY 30 HN GLY 30 86.304 -20.874 3.177 12 1HA GLY 30 HA2 GLY 30 88.483 -22.459 4.035 13 2HA GLY 30 HA1 GLY 30 88.533 -21.378 2.642 14 HA PRO 31 HA PRO 31 90.988 -19.865 6.520 15 1HB PRO 31 HB2 PRO 31 93.443 -20.648 5.235 16 2HB PRO 31 HB1 PRO 31 92.771 -21.243 6.765 17 1HG PRO 31 HG2 PRO 31 92.945 -22.630 4.253 18 2HG PRO 31 HG1 PRO 31 92.270 -23.219 5.774 19 1HD PRO 31 HD2 PRO 31 90.847 -22.470 3.374 20 2HD PRO 31 HD1 PRO 31 90.168 -23.071 4.905 21 H LYS 32 HN LYS 32 93.473 -18.690 5.731 22 HA LYS 32 HA LYS 32 92.733 -16.257 4.558 23 1HB LYS 32 HB2 LYS 32 94.996 -17.437 5.585 24 2HB LYS 32 HB1 LYS 32 95.438 -17.228 3.891 25 1HG LYS 32 HG2 LYS 32 94.138 -14.955 5.362 26 2HG LYS 32 HG1 LYS 32 95.856 -15.270 5.608 27 1HD LYS 32 HD2 LYS 32 94.690 -15.083 2.831 28 2HD LYS 32 HD1 LYS 32 95.188 -13.636 3.708 29 1HE LYS 32 HE2 LYS 32 97.095 -15.956 3.542 30 2HE LYS 32 HE1 LYS 32 96.932 -14.864 2.153 31 1HZ LYS 32 HZ1 LYS 32 98.589 -14.019 3.699 32 2HZ LYS 32 HZ2 LYS 32 97.463 -14.059 4.971 33 3HZ LYS 32 HZ3 LYS 32 97.244 -12.986 3.673 34 H GLY 33 HN GLY 33 92.244 -15.656 2.476 35 1HA GLY 33 HA2 GLY 33 91.955 -15.798 0.152 36 2HA GLY 33 HA1 GLY 33 93.464 -16.710 0.131 37 H GLY 34 HN GLY 34 90.111 -17.268 1.282 38 1HA GLY 34 HA1 GLY 34 90.081 -19.773 -0.324 39 2HA GLY 34 HA2 GLY 34 89.709 -19.868 1.397 40 H GLY 35 HN GLY 35 88.793 -17.346 -0.948 41 1HA GLY 35 HA1 GLY 35 86.651 -16.778 -1.776 42 2HA GLY 35 HA2 GLY 35 86.019 -18.262 -1.048 43 H ASN 36 HN ASN 36 84.212 -16.780 -0.364 44 HA ASN 36 HA ASN 36 83.110 -15.645 1.402 45 1HB ASN 36 HB2 ASN 36 85.321 -17.132 2.452 46 2HB ASN 36 HB1 ASN 36 85.218 -15.606 3.328 47 1HD2 ASN 36 HD21 ASN 36 82.609 -17.654 1.910 48 2HD2 ASN 36 HD22 ASN 36 81.764 -17.846 3.370 49 H ALA 37 HN ALA 37 85.290 -14.371 -0.465 50 HA ALA 37 HA ALA 37 85.736 -11.880 1.135 51 1HB ALA 37 HB1 ALA 37 87.635 -13.387 0.135 52 2HB ALA 37 HB2 ALA 37 87.745 -11.639 -0.070 53 3HB ALA 37 HB3 ALA 37 87.176 -12.648 -1.399 54 H VAL 38 HN VAL 38 85.241 -9.891 0.105 55 HA VAL 38 HA VAL 38 83.948 -9.896 -2.570 56 HB VAL 38 HB VAL 38 81.848 -9.153 -1.743 57 1HG1 VAL 38 HG11 VAL 38 82.691 -10.939 0.540 58 2HG1 VAL 38 HG12 VAL 38 82.497 -11.568 -1.094 59 3HG1 VAL 38 HG13 VAL 38 81.122 -10.850 -0.260 60 1HG2 VAL 38 HG21 VAL 38 82.010 -8.833 1.014 61 2HG2 VAL 38 HG22 VAL 38 81.928 -7.535 -0.177 62 3HG2 VAL 38 HG23 VAL 38 83.494 -8.088 0.421 63 H LYS 39 HN LYS 39 84.016 -7.622 -3.524 64 HA LYS 39 HA LYS 39 86.091 -6.026 -2.129 65 1HB LYS 39 HB2 LYS 39 85.930 -6.535 -4.599 66 2HB LYS 39 HB1 LYS 39 84.512 -5.490 -4.650 67 1HG LYS 39 HG2 LYS 39 86.618 -4.291 -5.293 68 2HG LYS 39 HG1 LYS 39 85.852 -3.590 -3.858 69 1HD LYS 39 HD2 LYS 39 87.622 -4.112 -2.549 70 2HD LYS 39 HD1 LYS 39 87.695 -5.760 -3.186 71 1HE LYS 39 HE2 LYS 39 88.804 -3.294 -4.584 72 2HE LYS 39 HE1 LYS 39 89.769 -4.521 -3.742 73 1HZ LYS 39 HZ1 LYS 39 87.883 -5.718 -5.514 74 2HZ LYS 39 HZ2 LYS 39 89.571 -5.901 -5.467 75 3HZ LYS 39 HZ3 LYS 39 88.877 -4.632 -6.356 76 H VAL 40 HN VAL 40 85.079 -5.065 -0.317 77 HA VAL 40 HA VAL 40 82.507 -3.651 -0.652 78 HB VAL 40 HB VAL 40 84.259 -3.845 1.800 79 1HG1 VAL 40 HG11 VAL 40 81.818 -2.600 1.289 80 2HG1 VAL 40 HG12 VAL 40 82.461 -3.006 2.880 81 3HG1 VAL 40 HG13 VAL 40 81.364 -4.119 2.063 82 1HG2 VAL 40 HG21 VAL 40 83.124 -5.990 0.292 83 2HG2 VAL 40 HG22 VAL 40 82.215 -5.832 1.794 84 3HG2 VAL 40 HG23 VAL 40 83.962 -6.070 1.841 85 H ARG 41 HN ARG 41 82.195 -1.499 -0.247 86 HA ARG 41 HA ARG 41 84.524 0.322 0.141 87 1HB ARG 41 HB2 ARG 41 82.535 0.180 -2.127 88 2HB ARG 41 HB1 ARG 41 83.242 1.733 -1.683 89 1HG ARG 41 HG2 ARG 41 85.209 1.196 -2.660 90 2HG ARG 41 HG1 ARG 41 85.257 -0.368 -1.845 91 1HD ARG 41 HD2 ARG 41 84.487 -1.454 -3.692 92 2HD ARG 41 HD1 ARG 41 83.221 -0.236 -3.967 93 HE ARG 41 HE ARG 41 85.592 1.085 -4.582 94 1HH1 ARG 41 HH21 ARG 41 85.471 -2.146 -5.265 95 2HH1 ARG 41 HH22 ARG 41 85.503 -1.989 -6.990 96 1HH2 ARG 41 HH11 ARG 41 85.015 1.445 -6.949 97 2HH2 ARG 41 HH12 ARG 41 85.244 0.045 -7.944 98 H HIS 42 HN HIS 42 83.759 2.312 1.301 99 HA HIS 42 HA HIS 42 80.858 2.177 2.053 100 1HB HIS 42 HB2 HIS 42 81.740 2.474 4.451 101 2HB HIS 42 HB1 HIS 42 81.965 0.890 3.698 102 HD1 HIS 42 HD1 HIS 42 83.813 3.856 4.953 103 HD2 HIS 42 HD2 HIS 42 84.676 0.404 2.793 104 HE1 HIS 42 HE1 HIS 42 86.339 3.639 4.927 105 H ILE 43 HN ILE 43 79.884 4.088 2.374 106 HA ILE 43 HA ILE 43 81.520 6.564 2.755 107 HB ILE 43 HB ILE 43 80.143 5.812 0.447 108 1HG1 ILE 43 HG12 ILE 43 80.725 8.631 1.400 109 2HG1 ILE 43 HG11 ILE 43 81.915 7.533 0.689 110 1HG2 ILE 43 HG21 ILE 43 77.969 6.192 1.558 111 2HG2 ILE 43 HG22 ILE 43 78.239 7.366 0.271 112 3HG2 ILE 43 HG23 ILE 43 78.461 7.837 1.955 113 1HD1 ILE 43 HD11 ILE 43 80.107 9.258 -0.671 114 2HD1 ILE 43 HD12 ILE 43 79.600 7.599 -1.002 115 3HD1 ILE 43 HD13 ILE 43 81.246 8.112 -1.378 116 H LEU 44 HN LEU 44 80.958 7.241 4.857 117 HA LEU 44 HA LEU 44 78.193 6.642 5.793 118 1HB LEU 44 HB2 LEU 44 79.697 5.672 7.230 119 2HB LEU 44 HB1 LEU 44 80.985 6.799 6.805 120 HG LEU 44 HG LEU 44 80.520 8.188 8.509 121 1HD1 LEU 44 HD11 LEU 44 77.650 7.553 8.010 122 2HD1 LEU 44 HD12 LEU 44 78.414 9.125 8.274 123 3HD1 LEU 44 HD13 LEU 44 78.102 8.054 9.630 124 1HD2 LEU 44 HD21 LEU 44 80.417 5.597 9.174 125 2HD2 LEU 44 HD22 LEU 44 78.813 6.103 9.714 126 3HD2 LEU 44 HD23 LEU 44 80.255 6.875 10.383 127 H CYS 45 HN CYS 45 76.988 8.332 6.735 128 HA CYS 45 HA CYS 45 77.987 11.125 6.245 129 1HB CYS 45 HB2 CYS 45 75.155 10.110 5.859 130 2HB CYS 45 HB1 CYS 45 75.815 11.674 5.354 131 HG CYS 45 HG CYS 45 77.417 10.238 3.701 132 H GLU 46 HN GLU 46 78.238 11.935 8.322 133 HA GLU 46 HA GLU 46 76.855 10.995 10.643 134 1HB GLU 46 HB2 GLU 46 79.037 12.290 10.446 135 2HB GLU 46 HB1 GLU 46 78.064 13.734 10.170 136 1HG GLU 46 HG2 GLU 46 78.690 13.499 12.559 137 2HG GLU 46 HG1 GLU 46 76.943 13.413 12.335 138 H LYS 47 HN LYS 47 76.132 13.562 8.318 139 HA LYS 47 HA LYS 47 73.722 14.345 9.896 140 1HB LYS 47 HB2 LYS 47 74.844 15.571 7.362 141 2HB LYS 47 HB1 LYS 47 73.793 16.333 8.555 142 1HG LYS 47 HG2 LYS 47 75.637 16.044 10.250 143 2HG LYS 47 HG1 LYS 47 76.681 15.497 8.938 144 1HD LYS 47 HD2 LYS 47 76.331 17.638 7.763 145 2HD LYS 47 HD1 LYS 47 75.280 18.186 9.069 146 1HE LYS 47 HE2 LYS 47 77.402 17.563 10.567 147 2HE LYS 47 HE1 LYS 47 78.258 17.863 9.042 148 1HZ LYS 47 HZ1 LYS 47 76.373 19.680 10.450 149 2HZ LYS 47 HZ2 LYS 47 76.902 19.941 8.858 150 3HZ LYS 47 HZ3 LYS 47 78.017 19.952 10.139 151 H HIS 48 HN HIS 48 74.521 12.106 7.599 152 HA HIS 48 HA HIS 48 73.265 10.873 6.035 153 1HB HIS 48 HB2 HIS 48 71.207 12.198 7.802 154 2HB HIS 48 HB1 HIS 48 70.735 11.089 6.516 155 HD1 HIS 48 HD1 HIS 48 73.869 10.657 8.580 156 HD2 HIS 48 HD2 HIS 48 70.103 8.911 8.206 157 HE1 HIS 48 HE1 HIS 48 73.931 8.535 9.956 158 H GLY 49 HN GLY 49 73.846 13.961 5.738 159 1HA GLY 49 HA2 GLY 49 71.835 14.590 3.645 160 2HA GLY 49 HA1 GLY 49 73.010 15.732 4.320 161 H LYS 50 HN LYS 50 75.263 13.923 4.131 162 HA LYS 50 HA LYS 50 76.018 14.386 1.347 163 1HB LYS 50 HB2 LYS 50 77.455 12.722 3.429 164 2HB LYS 50 HB1 LYS 50 78.162 13.660 2.114 165 1HG LYS 50 HG2 LYS 50 78.455 15.291 3.659 166 2HG LYS 50 HG1 LYS 50 76.719 15.562 3.512 167 1HD LYS 50 HD2 LYS 50 76.709 15.137 5.753 168 2HD LYS 50 HD1 LYS 50 76.767 13.450 5.243 169 1HE LYS 50 HE2 LYS 50 78.592 13.540 6.716 170 2HE LYS 50 HE1 LYS 50 79.391 13.912 5.172 171 1HZ LYS 50 HZ1 LYS 50 79.274 16.205 5.599 172 2HZ LYS 50 HZ2 LYS 50 79.772 15.535 7.078 173 3HZ LYS 50 HZ3 LYS 50 78.157 16.014 6.861 174 H ILE 51 HN ILE 51 74.549 11.789 3.119 175 HA ILE 51 HA ILE 51 75.423 9.526 1.671 176 HB ILE 51 HB ILE 51 73.793 9.822 3.688 177 1HG1 ILE 51 HG12 ILE 51 72.619 7.665 3.060 178 2HG1 ILE 51 HG11 ILE 51 73.359 7.815 1.459 179 1HG2 ILE 51 HG21 ILE 51 71.854 9.959 1.358 180 2HG2 ILE 51 HG22 ILE 51 72.150 11.239 2.536 181 3HG2 ILE 51 HG23 ILE 51 71.400 9.727 3.047 182 1HD1 ILE 51 HD11 ILE 51 74.836 7.656 4.108 183 2HD1 ILE 51 HD12 ILE 51 75.602 7.883 2.536 184 3HD1 ILE 51 HD13 ILE 51 74.746 6.382 2.891 185 H MET 52 HN MET 52 72.827 11.859 0.919 186 HA MET 52 HA MET 52 72.189 10.687 -1.637 187 1HB MET 52 HB2 MET 52 71.015 12.395 0.101 188 2HB MET 52 HB1 MET 52 71.708 13.561 -1.024 189 1HG MET 52 HG2 MET 52 69.826 11.291 -1.661 190 2HG MET 52 HG1 MET 52 69.489 13.015 -1.793 191 1HE MET 52 HE1 MET 52 71.356 14.460 -4.397 192 2HE MET 52 HE2 MET 52 72.766 13.764 -3.602 193 3HE MET 52 HE3 MET 52 71.434 14.391 -2.633 194 H GLU 53 HN GLU 53 74.095 13.471 -0.570 195 HA GLU 53 HA GLU 53 74.946 14.408 -3.109 196 1HB GLU 53 HB2 GLU 53 75.437 14.939 -0.401 197 2HB GLU 53 HB1 GLU 53 77.005 14.415 -1.015 198 1HG GLU 53 HG2 GLU 53 76.542 16.042 -2.987 199 2HG GLU 53 HG1 GLU 53 75.307 16.732 -1.931 200 H ALA 54 HN ALA 54 75.778 11.705 -1.086 201 HA ALA 54 HA ALA 54 78.121 10.887 -2.660 202 1HB ALA 54 HB1 ALA 54 78.127 9.041 -1.114 203 2HB ALA 54 HB2 ALA 54 76.419 9.268 -0.739 204 3HB ALA 54 HB3 ALA 54 77.609 10.443 -0.178 205 H MET 55 HN MET 55 74.667 10.249 -2.465 206 HA MET 55 HA MET 55 74.670 7.993 -4.312 207 1HB MET 55 HB2 MET 55 72.569 9.943 -3.310 208 2HB MET 55 HB1 MET 55 72.192 8.528 -4.302 209 1HG MET 55 HG2 MET 55 73.896 7.681 -2.163 210 2HG MET 55 HG1 MET 55 72.582 8.643 -1.472 211 1HE MET 55 HE1 MET 55 71.096 7.097 -0.290 212 2HE MET 55 HE2 MET 55 72.504 6.040 -0.364 213 3HE MET 55 HE3 MET 55 70.904 5.389 -0.713 214 H GLU 56 HN GLU 56 73.667 11.417 -4.658 215 HA GLU 56 HA GLU 56 73.245 11.280 -7.501 216 1HB GLU 56 HB2 GLU 56 72.920 13.072 -5.349 217 2HB GLU 56 HB1 GLU 56 73.949 13.906 -6.512 218 1HG GLU 56 HG2 GLU 56 72.292 13.278 -8.306 219 2HG GLU 56 HG1 GLU 56 71.233 12.665 -7.034 220 H LYS 57 HN LYS 57 75.788 13.163 -5.800 221 HA LYS 57 HA LYS 57 77.432 13.810 -7.898 222 1HB LYS 57 HB2 LYS 57 78.313 12.708 -5.210 223 2HB LYS 57 HB1 LYS 57 79.280 13.732 -6.263 224 1HG LYS 57 HG2 LYS 57 76.611 14.836 -5.714 225 2HG LYS 57 HG1 LYS 57 77.587 14.653 -4.263 226 1HD LYS 57 HD2 LYS 57 78.252 16.230 -6.753 227 2HD LYS 57 HD1 LYS 57 78.066 16.833 -5.110 228 1HE LYS 57 HE2 LYS 57 80.044 14.883 -4.863 229 2HE LYS 57 HE1 LYS 57 80.439 15.703 -6.386 230 1HZ LYS 57 HZ1 LYS 57 81.302 16.817 -4.315 231 2HZ LYS 57 HZ2 LYS 57 79.688 17.151 -3.902 232 3HZ LYS 57 HZ3 LYS 57 80.359 17.804 -5.320 233 H LEU 58 HN LEU 58 77.952 10.769 -6.030 234 HA LEU 58 HA LEU 58 79.861 9.563 -7.648 235 1HB LEU 58 HB2 LEU 58 77.484 8.586 -6.083 236 2HB LEU 58 HB1 LEU 58 78.488 7.428 -6.962 237 HG LEU 58 HG LEU 58 80.455 8.112 -5.753 238 1HD1 LEU 58 HD11 LEU 58 79.981 10.520 -5.623 239 2HD1 LEU 58 HD12 LEU 58 80.410 9.871 -4.042 240 3HD1 LEU 58 HD13 LEU 58 78.728 10.209 -4.424 241 1HD2 LEU 58 HD21 LEU 58 78.396 6.770 -4.607 242 2HD2 LEU 58 HD22 LEU 58 78.581 8.094 -3.459 243 3HD2 LEU 58 HD23 LEU 58 79.941 7.033 -3.803 244 H LYS 59 HN LYS 59 76.373 9.872 -8.241 245 HA LYS 59 HA LYS 59 76.472 8.257 -10.704 246 1HB LYS 59 HB2 LYS 59 74.496 9.638 -8.975 247 2HB LYS 59 HB1 LYS 59 74.064 9.530 -10.681 248 1HG LYS 59 HG2 LYS 59 75.165 7.023 -9.689 249 2HG LYS 59 HG1 LYS 59 73.747 7.524 -8.770 250 1HD LYS 59 HD2 LYS 59 73.636 7.738 -11.751 251 2HD LYS 59 HD1 LYS 59 73.503 6.134 -11.032 252 1HE LYS 59 HE2 LYS 59 71.436 6.578 -10.126 253 2HE LYS 59 HE1 LYS 59 71.847 8.268 -9.774 254 1HZ LYS 59 HZ1 LYS 59 71.790 7.455 -12.581 255 2HZ LYS 59 HZ2 LYS 59 71.328 8.928 -11.872 256 3HZ LYS 59 HZ3 LYS 59 70.289 7.585 -11.803 257 H SER 60 HN SER 60 75.429 11.615 -10.051 258 HA SER 60 HA SER 60 75.236 12.745 -12.513 259 1HB SER 60 HB2 SER 60 76.979 14.361 -10.814 260 2HB SER 60 HB1 SER 60 75.299 14.639 -11.271 261 HG SER 60 HG SER 60 76.288 12.995 -9.188 262 H GLY 61 HN GLY 61 78.389 12.201 -10.885 263 1HA GLY 61 HA2 GLY 61 80.069 11.269 -12.655 264 2HA GLY 61 HA1 GLY 61 79.715 12.783 -13.495 265 H MET 62 HN MET 62 79.680 13.231 -10.105 266 HA MET 62 HA MET 62 81.911 15.015 -10.118 267 1HB MET 62 HB2 MET 62 80.767 13.446 -7.791 268 2HB MET 62 HB1 MET 62 81.596 15.000 -7.712 269 1HG MET 62 HG2 MET 62 79.197 14.803 -9.478 270 2HG MET 62 HG1 MET 62 78.937 14.835 -7.739 271 1HE MET 62 HE1 MET 62 77.758 16.497 -9.565 272 2HE MET 62 HE2 MET 62 78.172 18.213 -9.563 273 3HE MET 62 HE3 MET 62 77.594 17.450 -8.081 274 H ARG 63 HN ARG 63 83.098 13.821 -7.604 275 HA ARG 63 HA ARG 63 85.004 11.975 -8.967 276 1HB ARG 63 HB2 ARG 63 85.383 13.264 -6.280 277 2HB ARG 63 HB1 ARG 63 86.596 12.808 -7.475 278 1HG ARG 63 HG2 ARG 63 86.586 15.059 -7.819 279 2HG ARG 63 HG1 ARG 63 85.302 14.612 -8.940 280 1HD ARG 63 HD2 ARG 63 83.719 15.690 -7.697 281 2HD ARG 63 HD1 ARG 63 84.342 15.018 -6.174 282 HE ARG 63 HE ARG 63 85.678 16.970 -5.956 283 1HH1 ARG 63 HH11 ARG 63 83.649 18.322 -7.771 284 2HH1 ARG 63 HH12 ARG 63 84.681 19.035 -8.964 285 1HH2 ARG 63 HH21 ARG 63 87.433 17.101 -8.120 286 2HH2 ARG 63 HH22 ARG 63 86.825 18.343 -9.163 287 H PHE 64 HN PHE 64 85.711 10.113 -7.798 288 HA PHE 64 HA PHE 64 83.655 8.938 -6.026 289 1HB PHE 64 HB2 PHE 64 86.167 7.928 -7.411 290 2HB PHE 64 HB1 PHE 64 85.158 6.915 -6.381 291 HD1 PHE 64 HD1 PHE 64 82.448 7.973 -7.075 292 HD2 PHE 64 HD2 PHE 64 85.817 7.016 -9.561 293 HE1 PHE 64 HE1 PHE 64 80.921 7.554 -8.986 294 HE2 PHE 64 HE2 PHE 64 84.292 6.596 -11.471 295 HZ PHE 64 HZ PHE 64 81.844 6.865 -11.184 296 H ASN 65 HN ASN 65 86.935 10.221 -5.991 297 HA ASN 65 HA ASN 65 87.463 9.223 -3.263 298 1HB ASN 65 HB2 ASN 65 88.938 9.889 -5.547 299 2HB ASN 65 HB1 ASN 65 89.338 11.150 -4.382 300 1HD2 ASN 65 HD21 ASN 65 89.823 10.204 -2.056 301 2HD2 ASN 65 HD22 ASN 65 90.748 8.783 -2.013 302 H GLU 66 HN GLU 66 86.764 12.356 -4.845 303 HA GLU 66 HA GLU 66 87.287 14.001 -2.554 304 1HB GLU 66 HB2 GLU 66 85.257 14.300 -4.788 305 2HB GLU 66 HB1 GLU 66 85.832 15.603 -3.754 306 1HG GLU 66 HG2 GLU 66 87.636 13.929 -5.526 307 2HG GLU 66 HG1 GLU 66 86.991 15.506 -5.984 308 H VAL 67 HN VAL 67 84.140 12.887 -3.847 309 HA VAL 67 HA VAL 67 82.588 13.493 -1.575 310 HB VAL 67 HB VAL 67 81.123 11.660 -2.513 311 1HG1 VAL 67 HG11 VAL 67 80.483 12.929 -4.330 312 2HG1 VAL 67 HG12 VAL 67 82.152 13.185 -4.846 313 3HG1 VAL 67 HG13 VAL 67 81.504 14.094 -3.483 314 1HG2 VAL 67 HG21 VAL 67 83.613 11.179 -4.074 315 2HG2 VAL 67 HG22 VAL 67 82.040 10.811 -4.782 316 3HG2 VAL 67 HG23 VAL 67 82.543 10.020 -3.290 317 H ALA 68 HN ALA 68 84.191 10.407 -2.470 318 HA ALA 68 HA ALA 68 83.598 8.853 -0.219 319 1HB ALA 68 HB1 ALA 68 86.002 7.951 -0.733 320 2HB ALA 68 HB2 ALA 68 85.991 9.132 -2.042 321 3HB ALA 68 HB3 ALA 68 84.786 7.844 -2.005 322 H ALA 69 HN ALA 69 85.796 11.542 -0.631 323 HA ALA 69 HA ALA 69 87.341 11.249 1.737 324 1HB ALA 69 HB1 ALA 69 86.445 13.927 0.714 325 2HB ALA 69 HB2 ALA 69 87.401 12.894 -0.346 326 3HB ALA 69 HB3 ALA 69 88.054 13.407 1.209 327 H GLN 70 HN GLN 70 84.743 13.724 1.368 328 HA GLN 70 HA GLN 70 84.240 13.365 4.253 329 1HB GLN 70 HB2 GLN 70 83.872 15.489 2.288 330 2HB GLN 70 HB1 GLN 70 82.487 15.306 3.354 331 1HG GLN 70 HG2 GLN 70 85.337 15.943 4.088 332 2HG GLN 70 HG1 GLN 70 83.861 16.806 4.536 333 1HE2 GLN 70 HE21 GLN 70 82.571 14.011 5.227 334 2HE2 GLN 70 HE22 GLN 70 83.255 13.609 6.726 335 H TYR 71 HN TYR 71 82.362 13.177 1.239 336 HA TYR 71 HA TYR 71 79.822 12.788 2.271 337 1HB TYR 71 HB2 TYR 71 81.229 11.373 -0.015 338 2HB TYR 71 HB1 TYR 71 79.491 11.317 0.247 339 HD1 TYR 71 HD1 TYR 71 79.390 12.344 -2.086 340 HD2 TYR 71 HD2 TYR 71 81.044 14.458 1.287 341 HE1 TYR 71 HE1 TYR 71 79.116 14.496 -3.277 342 HE2 TYR 71 HE2 TYR 71 80.761 16.589 0.084 343 HH TYR 71 HH TYR 71 79.771 17.582 -1.687 344 H SER 72 HN SER 72 82.561 10.627 2.395 345 HA SER 72 HA SER 72 81.017 8.349 3.425 346 1HB SER 72 HB2 SER 72 83.035 8.144 1.989 347 2HB SER 72 HB1 SER 72 83.991 8.918 3.250 348 HG SER 72 HG SER 72 83.412 6.371 3.015 349 H GLU 73 HN GLU 73 82.401 11.177 4.725 350 HA GLU 73 HA GLU 73 83.281 11.742 6.836 351 1HB GLU 73 HB2 GLU 73 81.379 12.232 8.076 352 2HB GLU 73 HB1 GLU 73 80.722 12.012 6.457 353 1HG GLU 73 HG2 GLU 73 79.269 10.635 7.519 354 2HG GLU 73 HG1 GLU 73 80.580 9.477 7.374 355 H ASP 74 HN ASP 74 84.884 10.198 7.044 356 HA ASP 74 HA ASP 74 86.067 8.826 8.630 357 1HB ASP 74 HB2 ASP 74 83.874 9.171 10.027 358 2HB ASP 74 HB1 ASP 74 83.445 7.572 9.422 359 H LYS 75 HN LYS 75 87.123 7.371 7.364 360 HA LYS 75 HA LYS 75 87.513 5.366 6.165 361 1HB LYS 75 HB2 LYS 75 85.285 4.948 7.895 362 2HB LYS 75 HB1 LYS 75 84.890 4.202 6.350 363 1HG LYS 75 HG2 LYS 75 87.287 3.204 6.464 364 2HG LYS 75 HG1 LYS 75 87.214 3.621 8.175 365 1HD LYS 75 HD2 LYS 75 84.951 2.381 8.192 366 2HD LYS 75 HD1 LYS 75 85.445 1.718 6.636 367 1HE LYS 75 HE2 LYS 75 86.255 0.096 8.143 368 2HE LYS 75 HE1 LYS 75 87.679 1.135 7.937 369 1HZ LYS 75 HZ1 LYS 75 87.033 2.397 9.865 370 2HZ LYS 75 HZ2 LYS 75 87.098 0.756 10.299 371 3HZ LYS 75 HZ3 LYS 75 85.598 1.507 10.031 372 H ALA 76 HN ALA 76 87.469 6.986 4.342 373 HA ALA 76 HA ALA 76 85.395 7.808 2.734 374 1HB ALA 76 HB1 ALA 76 87.101 7.625 0.884 375 2HB ALA 76 HB2 ALA 76 88.119 6.716 2.001 376 3HB ALA 76 HB3 ALA 76 87.701 8.393 2.354 377 H ARG 77 HN ARG 77 84.962 6.934 0.414 378 HA ARG 77 HA ARG 77 83.813 4.227 0.656 379 1HB ARG 77 HB2 ARG 77 82.962 6.549 -0.418 380 2HB ARG 77 HB1 ARG 77 83.701 5.844 -1.849 381 1HG ARG 77 HG2 ARG 77 82.373 3.735 -1.363 382 2HG ARG 77 HG1 ARG 77 81.493 4.669 -0.152 383 1HD ARG 77 HD2 ARG 77 80.257 4.722 -2.284 384 2HD ARG 77 HD1 ARG 77 80.909 6.335 -1.952 385 HE ARG 77 HE ARG 77 82.938 5.039 -3.355 386 1HH1 ARG 77 HH11 ARG 77 79.762 4.426 -4.153 387 2HH1 ARG 77 HH12 ARG 77 79.833 5.113 -5.742 388 1HH2 ARG 77 HH21 ARG 77 82.975 6.507 -5.286 389 2HH2 ARG 77 HH22 ARG 77 81.652 6.293 -6.382 390 H GLN 78 HN GLN 78 85.438 5.703 -2.173 391 HA GLN 78 HA GLN 78 86.613 3.111 -2.885 392 1HB GLN 78 HB2 GLN 78 87.061 5.864 -4.083 393 2HB GLN 78 HB1 GLN 78 87.290 4.302 -4.878 394 1HG GLN 78 HG2 GLN 78 84.662 5.521 -3.976 395 2HG GLN 78 HG1 GLN 78 85.184 5.225 -5.632 396 1HE2 GLN 78 HE21 GLN 78 83.953 3.657 -2.703 397 2HE2 GLN 78 HE22 GLN 78 83.656 2.156 -3.434 398 H GLY 79 HN GLY 79 87.836 6.358 -2.016 399 1HA GLY 79 HA2 GLY 79 90.592 5.520 -1.850 400 2HA GLY 79 HA1 GLY 79 89.931 7.019 -1.190 401 H GLY 80 HN GLY 80 87.900 4.892 0.082 402 1HA GLY 80 HA1 GLY 80 89.646 4.274 2.430 403 2HA GLY 80 HA2 GLY 80 87.970 4.801 2.600 404 H ASP 81 HN ASP 81 87.691 3.022 -0.036 405 HA ASP 81 HA ASP 81 86.229 0.900 0.905 406 1HB ASP 81 HB2 ASP 81 86.989 -0.259 -1.173 407 2HB ASP 81 HB1 ASP 81 86.611 1.443 -1.458 408 H LEU 82 HN LEU 82 86.860 -0.282 2.745 409 HA LEU 82 HA LEU 82 89.376 -0.959 3.671 410 1HB LEU 82 HB2 LEU 82 86.857 -2.646 3.509 411 2HB LEU 82 HB1 LEU 82 88.211 -2.993 4.575 412 HG LEU 82 HG LEU 82 87.141 -1.720 6.093 413 1HD1 LEU 82 HD11 LEU 82 88.905 -0.124 5.320 414 2HD1 LEU 82 HD12 LEU 82 87.491 0.674 6.004 415 3HD1 LEU 82 HD13 LEU 82 87.708 0.613 4.257 416 1HD2 LEU 82 HD21 LEU 82 85.332 -0.011 5.210 417 2HD2 LEU 82 HD22 LEU 82 84.997 -1.741 5.256 418 3HD2 LEU 82 HD23 LEU 82 85.469 -0.976 3.741 419 H GLY 83 HN GLY 83 87.731 -2.265 0.856 420 1HA GLY 83 HA2 GLY 83 88.848 -3.360 -0.966 421 2HA GLY 83 HA1 GLY 83 90.217 -3.689 0.107 422 H TRP 84 HN TRP 84 89.978 -5.933 -0.799 423 HA TRP 84 HA TRP 84 87.835 -7.669 -0.609 424 1HB TRP 84 HB2 TRP 84 90.791 -7.879 -0.178 425 2HB TRP 84 HB1 TRP 84 89.802 -9.298 0.155 426 HD1 TRP 84 HD1 TRP 84 91.676 -7.903 -2.535 427 HE1 TRP 84 HE1 TRP 84 90.810 -8.666 -4.842 428 HE3 TRP 84 HE3 TRP 84 87.117 -9.753 -1.187 429 HZ2 TRP 84 HZ2 TRP 84 88.483 -9.904 -5.963 430 HZ3 TRP 84 HZ3 TRP 84 85.598 -10.717 -2.887 431 HH2 TRP 84 HH2 TRP 84 86.272 -10.795 -5.271 432 H MET 85 HN MET 85 86.721 -8.711 1.054 433 HA MET 85 HA MET 85 87.744 -8.450 3.842 434 1HB MET 85 HB2 MET 85 85.514 -7.012 2.573 435 2HB MET 85 HB1 MET 85 85.061 -7.819 4.074 436 1HG MET 85 HG2 MET 85 87.597 -6.207 3.954 437 2HG MET 85 HG1 MET 85 86.049 -5.389 4.170 438 1HE MET 85 HE1 MET 85 84.426 -5.762 6.270 439 2HE MET 85 HE2 MET 85 85.702 -4.548 6.226 440 3HE MET 85 HE3 MET 85 85.425 -5.471 7.700 441 H THR 86 HN THR 86 87.159 -10.222 5.102 442 HA THR 86 HA THR 86 85.210 -12.157 3.899 443 HB THR 86 HB THR 86 86.897 -13.733 5.297 444 HG1 THR 86 HG1 THR 86 88.735 -12.801 5.655 445 1HG2 THR 86 HG21 THR 86 86.973 -12.677 2.496 446 2HG2 THR 86 HG22 THR 86 86.597 -14.303 3.068 447 3HG2 THR 86 HG23 THR 86 88.269 -13.743 3.039 448 H ARG 87 HN ARG 87 83.890 -13.287 5.418 449 HA ARG 87 HA ARG 87 82.818 -12.009 7.608 450 1HB ARG 87 HB2 ARG 87 82.213 -14.223 6.454 451 2HB ARG 87 HB1 ARG 87 83.366 -14.984 7.552 452 1HG ARG 87 HG2 ARG 87 81.327 -13.149 8.734 453 2HG ARG 87 HG1 ARG 87 80.784 -14.737 8.194 454 1HD ARG 87 HD2 ARG 87 83.021 -15.474 9.528 455 2HD ARG 87 HD1 ARG 87 82.585 -14.026 10.455 456 HE ARG 87 HE ARG 87 80.300 -15.042 10.719 457 1HH1 ARG 87 HH21 ARG 87 81.937 -17.125 8.718 458 2HH1 ARG 87 HH22 ARG 87 81.664 -18.553 9.660 459 1HH2 ARG 87 HH11 ARG 87 80.370 -16.835 12.378 460 2HH2 ARG 87 HH12 ARG 87 80.777 -18.389 11.730 461 H GLY 88 HN GLY 88 85.883 -13.738 7.501 462 1HA GLY 88 HA2 GLY 88 86.310 -14.075 10.295 463 2HA GLY 88 HA1 GLY 88 87.598 -13.924 9.091 464 H SER 89 HN SER 89 86.212 -11.229 8.366 465 HA SER 89 HA SER 89 87.566 -9.660 10.532 466 1HB SER 89 HB2 SER 89 87.999 -9.782 7.809 467 2HB SER 89 HB1 SER 89 86.961 -8.357 7.962 468 HG SER 89 HG SER 89 89.492 -8.859 9.075 469 H MET 90 HN MET 90 85.065 -8.983 8.053 470 HA MET 90 HA MET 90 83.694 -6.949 9.410 471 1HB MET 90 HB2 MET 90 81.763 -7.724 7.984 472 2HB MET 90 HB1 MET 90 83.277 -7.560 7.096 473 1HG MET 90 HG2 MET 90 83.673 -9.950 7.215 474 2HG MET 90 HG1 MET 90 82.282 -10.169 8.278 475 1HE MET 90 HE1 MET 90 83.213 -8.359 4.927 476 2HE MET 90 HE2 MET 90 81.976 -7.413 5.750 477 3HE MET 90 HE3 MET 90 81.604 -8.186 4.211 478 H VAL 91 HN VAL 91 81.522 -7.107 10.507 479 HA VAL 91 HA VAL 91 80.853 -9.665 11.817 480 HB VAL 91 HB VAL 91 81.179 -8.531 14.088 481 1HG1 VAL 91 HG11 VAL 91 83.436 -9.229 14.219 482 2HG1 VAL 91 HG12 VAL 91 83.762 -8.772 12.546 483 3HG1 VAL 91 HG13 VAL 91 82.771 -10.189 12.897 484 1HG2 VAL 91 HG21 VAL 91 81.925 -6.403 14.180 485 2HG2 VAL 91 HG22 VAL 91 81.658 -6.316 12.437 486 3HG2 VAL 91 HG23 VAL 91 83.246 -6.759 13.065 487 H GLY 92 HN GLY 92 79.100 -9.003 13.656 488 1HA GLY 92 HA2 GLY 92 76.841 -8.330 13.824 489 2HA GLY 92 HA1 GLY 92 77.555 -6.722 13.637 490 HA PRO 93 HA PRO 93 74.599 -7.043 10.165 491 1HB PRO 93 HB2 PRO 93 74.974 -4.202 9.884 492 2HB PRO 93 HB1 PRO 93 73.551 -5.062 10.491 493 1HG PRO 93 HG2 PRO 93 75.462 -3.510 11.985 494 2HG PRO 93 HG1 PRO 93 74.023 -4.335 12.585 495 1HD PRO 93 HD2 PRO 93 76.771 -5.070 13.011 496 2HD PRO 93 HD1 PRO 93 75.318 -5.938 13.561 497 H PHE 94 HN PHE 94 77.736 -5.440 10.414 498 HA PHE 94 HA PHE 94 78.388 -4.678 7.852 499 1HB PHE 94 HB2 PHE 94 79.707 -5.297 10.215 500 2HB PHE 94 HB1 PHE 94 80.424 -6.419 9.051 501 HD1 PHE 94 HD1 PHE 94 82.450 -5.582 8.258 502 HD2 PHE 94 HD2 PHE 94 79.135 -2.901 8.780 503 HE1 PHE 94 HE1 PHE 94 83.794 -3.734 7.298 504 HE2 PHE 94 HE2 PHE 94 80.480 -1.052 7.820 505 HZ PHE 94 HZ PHE 94 82.810 -1.468 7.079 506 H GLN 95 HN GLN 95 78.452 -8.055 9.049 507 HA GLN 95 HA GLN 95 79.038 -9.056 6.330 508 1HB GLN 95 HB2 GLN 95 80.187 -10.101 8.146 509 2HB GLN 95 HB1 GLN 95 78.702 -10.265 9.083 510 1HG GLN 95 HG2 GLN 95 78.805 -11.562 6.391 511 2HG GLN 95 HG1 GLN 95 79.704 -12.319 7.705 512 1HE2 GLN 95 HE21 GLN 95 78.060 -11.910 9.911 513 2HE2 GLN 95 HE22 GLN 95 76.551 -12.647 9.665 514 H GLU 96 HN GLU 96 76.374 -9.130 8.694 515 HA GLU 96 HA GLU 96 74.620 -10.932 7.446 516 1HB GLU 96 HB2 GLU 96 74.541 -8.709 9.342 517 2HB GLU 96 HB1 GLU 96 73.030 -8.878 8.449 518 1HG GLU 96 HG2 GLU 96 72.986 -11.296 9.042 519 2HG GLU 96 HG1 GLU 96 74.451 -11.068 9.995 520 H ALA 97 HN ALA 97 75.103 -7.462 6.725 521 HA ALA 97 HA ALA 97 73.077 -7.563 4.574 522 1HB ALA 97 HB1 ALA 97 74.170 -5.108 4.423 523 2HB ALA 97 HB2 ALA 97 74.701 -5.540 6.049 524 3HB ALA 97 HB3 ALA 97 72.982 -5.526 5.657 525 H ALA 98 HN ALA 98 76.156 -5.883 4.373 526 HA ALA 98 HA ALA 98 76.744 -6.108 1.717 527 1HB ALA 98 HB1 ALA 98 79.078 -6.769 3.349 528 2HB ALA 98 HB2 ALA 98 78.090 -5.502 4.079 529 3HB ALA 98 HB3 ALA 98 78.727 -5.296 2.447 530 H PHE 99 HN PHE 99 78.240 -8.478 3.951 531 HA PHE 99 HA PHE 99 79.169 -10.358 2.182 532 1HB PHE 99 HB2 PHE 99 78.800 -10.190 4.862 533 2HB PHE 99 HB1 PHE 99 77.613 -11.442 4.465 534 HD1 PHE 99 HD1 PHE 99 81.140 -10.492 3.571 535 HD2 PHE 99 HD2 PHE 99 78.357 -13.647 4.436 536 HE1 PHE 99 HE1 PHE 99 82.965 -12.158 3.364 537 HE2 PHE 99 HE2 PHE 99 80.182 -15.313 4.230 538 HZ PHE 99 HZ PHE 99 82.486 -14.569 3.694 539 H ALA 100 HN ALA 100 75.844 -10.417 3.492 540 HA ALA 100 HA ALA 100 75.036 -12.424 1.489 541 1HB ALA 100 HB1 ALA 100 74.224 -12.611 3.759 542 2HB ALA 100 HB2 ALA 100 72.850 -12.164 2.745 543 3HB ALA 100 HB3 ALA 100 73.646 -10.945 3.741 544 H LEU 101 HN LEU 101 75.717 -9.394 0.928 545 HA LEU 101 HA LEU 101 73.148 -8.703 -0.444 546 1HB LEU 101 HB2 LEU 101 75.400 -7.206 0.831 547 2HB LEU 101 HB1 LEU 101 74.553 -6.430 -0.516 548 HG LEU 101 HG LEU 101 73.134 -7.631 1.878 549 1HD1 LEU 101 HD11 LEU 101 73.132 -5.547 2.927 550 2HD1 LEU 101 HD12 LEU 101 73.464 -4.682 1.427 551 3HD1 LEU 101 HD13 LEU 101 74.750 -5.582 2.227 552 1HD2 LEU 101 HD21 LEU 101 71.833 -7.398 -0.228 553 2HD2 LEU 101 HD22 LEU 101 72.239 -5.683 -0.269 554 3HD2 LEU 101 HD23 LEU 101 71.238 -6.321 1.036 555 HA PRO 102 HA PRO 102 75.010 -9.416 -4.377 556 1HB PRO 102 HB2 PRO 102 73.652 -7.184 -5.574 557 2HB PRO 102 HB1 PRO 102 73.214 -8.897 -5.650 558 1HG PRO 102 HG2 PRO 102 71.880 -6.799 -4.217 559 2HG PRO 102 HG1 PRO 102 71.460 -8.516 -4.258 560 1HD PRO 102 HD2 PRO 102 72.641 -7.008 -2.078 561 2HD PRO 102 HD1 PRO 102 72.149 -8.721 -2.094 562 H VAL 103 HN VAL 103 76.741 -8.551 -5.627 563 HA VAL 103 HA VAL 103 78.409 -6.583 -4.532 564 HB VAL 103 HB VAL 103 79.363 -6.743 -6.888 565 1HG1 VAL 103 HG11 VAL 103 80.233 -8.159 -5.168 566 2HG1 VAL 103 HG12 VAL 103 79.943 -9.182 -6.575 567 3HG1 VAL 103 HG13 VAL 103 78.803 -9.190 -5.229 568 1HG2 VAL 103 HG21 VAL 103 76.768 -7.838 -7.355 569 2HG2 VAL 103 HG22 VAL 103 77.984 -9.077 -7.676 570 3HG2 VAL 103 HG23 VAL 103 78.055 -7.529 -8.520 571 H SER 104 HN SER 104 79.088 -4.619 -6.021 572 HA SER 104 HA SER 104 78.512 -2.488 -6.855 573 1HB SER 104 HB2 SER 104 76.567 -4.443 -8.013 574 2HB SER 104 HB1 SER 104 76.249 -2.720 -8.251 575 HG SER 104 HG SER 104 77.663 -2.849 -9.776 576 H GLY 105 HN GLY 105 77.684 -0.809 -5.681 577 1HA GLY 105 HA2 GLY 105 74.973 -1.054 -4.490 578 2HA GLY 105 HA1 GLY 105 76.318 -0.681 -3.410 579 H MET 106 HN MET 106 76.883 1.437 -3.210 580 HA MET 106 HA MET 106 77.060 3.736 -3.652 581 1HB MET 106 HB2 MET 106 77.770 2.696 -5.867 582 2HB MET 106 HB1 MET 106 76.122 2.987 -6.420 583 1HG MET 106 HG2 MET 106 76.370 5.388 -5.977 584 2HG MET 106 HG1 MET 106 77.999 5.112 -5.346 585 1HE MET 106 HE1 MET 106 76.523 4.686 -9.666 586 2HE MET 106 HE2 MET 106 75.835 5.785 -8.474 587 3HE MET 106 HE3 MET 106 75.732 4.046 -8.218 588 H ASP 107 HN ASP 107 74.342 2.925 -5.862 589 HA ASP 107 HA ASP 107 72.314 3.850 -3.994 590 1HB ASP 107 HB2 ASP 107 71.912 6.023 -5.027 591 2HB ASP 107 HB1 ASP 107 73.603 5.927 -4.534 592 H LYS 108 HN LYS 108 72.584 1.621 -5.852 593 HA LYS 108 HA LYS 108 70.004 1.798 -7.137 594 1HB LYS 108 HB2 LYS 108 70.947 3.050 -8.813 595 2HB LYS 108 HB1 LYS 108 72.543 2.335 -8.617 596 1HG LYS 108 HG2 LYS 108 71.576 1.571 -10.729 597 2HG LYS 108 HG1 LYS 108 71.654 0.211 -9.610 598 1HD LYS 108 HD2 LYS 108 69.461 0.352 -10.795 599 2HD LYS 108 HD1 LYS 108 69.294 0.493 -9.045 600 1HE LYS 108 HE2 LYS 108 68.927 2.841 -9.160 601 2HE LYS 108 HE1 LYS 108 69.545 2.935 -10.820 602 1HZ LYS 108 HZ1 LYS 108 67.077 2.893 -10.684 603 2HZ LYS 108 HZ2 LYS 108 67.171 1.341 -9.999 604 3HZ LYS 108 HZ3 LYS 108 67.719 1.608 -11.584 605 HA PRO 109 HA PRO 109 71.995 -2.468 -8.365 606 1HB PRO 109 HB2 PRO 109 74.546 -2.605 -7.046 607 2HB PRO 109 HB1 PRO 109 74.210 -2.666 -8.783 608 1HG PRO 109 HG2 PRO 109 75.345 -0.494 -7.236 609 2HG PRO 109 HG1 PRO 109 75.150 -0.614 -8.987 610 1HD PRO 109 HD2 PRO 109 73.692 1.081 -7.227 611 2HD PRO 109 HD1 PRO 109 73.350 0.773 -8.949 612 H VAL 110 HN VAL 110 73.538 -4.039 -6.432 613 HA VAL 110 HA VAL 110 73.130 -5.186 -4.413 614 HB VAL 110 HB VAL 110 73.527 -2.386 -4.016 615 1HG1 VAL 110 HG11 VAL 110 72.330 -1.859 -2.033 616 2HG1 VAL 110 HG12 VAL 110 71.782 -3.522 -1.826 617 3HG1 VAL 110 HG13 VAL 110 71.118 -2.530 -3.124 618 1HG2 VAL 110 HG21 VAL 110 74.031 -3.713 -1.606 619 2HG2 VAL 110 HG22 VAL 110 75.176 -3.460 -2.926 620 3HG2 VAL 110 HG23 VAL 110 74.236 -4.949 -2.847 621 H PHE 111 HN PHE 111 71.304 -5.187 -2.502 622 HA PHE 111 HA PHE 111 68.676 -5.158 -3.939 623 1HB PHE 111 HB2 PHE 111 70.146 -7.111 -2.424 624 2HB PHE 111 HB1 PHE 111 68.617 -6.772 -1.599 625 HD1 PHE 111 HD1 PHE 111 66.977 -8.326 -2.162 626 HD2 PHE 111 HD2 PHE 111 69.677 -6.939 -5.201 627 HE1 PHE 111 HE1 PHE 111 65.766 -9.675 -3.853 628 HE2 PHE 111 HE2 PHE 111 68.466 -8.289 -6.893 629 HZ PHE 111 HZ PHE 111 66.510 -9.656 -6.219 630 H THR 112 HN THR 112 70.340 -4.311 -0.934 631 HA THR 112 HA THR 112 67.831 -3.113 0.148 632 HB THR 112 HB THR 112 69.321 -4.630 1.501 633 HG1 THR 112 HG1 THR 112 68.034 -3.179 2.590 634 1HG2 THR 112 HG21 THR 112 71.428 -3.612 0.415 635 2HG2 THR 112 HG22 THR 112 71.499 -3.958 2.144 636 3HG2 THR 112 HG23 THR 112 71.239 -2.306 1.585 637 H ASP 113 HN ASP 113 68.887 -1.081 1.671 638 HA ASP 113 HA ASP 113 69.494 0.953 -0.377 639 1HB ASP 113 HB2 ASP 113 69.317 1.326 2.619 640 2HB ASP 113 HB1 ASP 113 68.926 2.487 1.352 641 HA PRO 114 HA PRO 114 73.850 0.681 0.196 642 1HB PRO 114 HB2 PRO 114 74.193 3.493 -0.284 643 2HB PRO 114 HB1 PRO 114 74.514 2.140 -1.380 644 1HG PRO 114 HG2 PRO 114 72.355 4.036 -1.502 645 2HG PRO 114 HG1 PRO 114 72.676 2.685 -2.591 646 1HD PRO 114 HD2 PRO 114 70.565 2.914 -0.639 647 2HD PRO 114 HD1 PRO 114 70.905 1.542 -1.721 648 HA PRO 115 HA PRO 115 74.341 4.055 3.648 649 1HB PRO 115 HB2 PRO 115 71.697 5.028 4.250 650 2HB PRO 115 HB1 PRO 115 73.078 5.938 3.626 651 1HG PRO 115 HG2 PRO 115 70.685 5.220 2.231 652 2HG PRO 115 HG1 PRO 115 72.101 6.063 1.583 653 1HD PRO 115 HD2 PRO 115 71.244 3.330 1.083 654 2HD PRO 115 HD1 PRO 115 72.603 4.209 0.354 655 H VAL 116 HN VAL 116 74.430 1.708 4.445 656 HA VAL 116 HA VAL 116 72.073 0.760 5.950 657 HB VAL 116 HB VAL 116 73.371 -1.249 6.132 658 1HG1 VAL 116 HG11 VAL 116 73.407 -1.766 3.909 659 2HG1 VAL 116 HG12 VAL 116 74.455 -0.403 3.514 660 3HG1 VAL 116 HG13 VAL 116 72.723 -0.150 3.730 661 1HG2 VAL 116 HG21 VAL 116 75.749 -1.351 5.693 662 2HG2 VAL 116 HG22 VAL 116 75.461 -0.069 6.870 663 3HG2 VAL 116 HG23 VAL 116 75.766 0.337 5.181 664 H LYS 117 HN LYS 117 72.095 0.480 8.242 665 HA LYS 117 HA LYS 117 74.162 2.116 9.669 666 1HB LYS 117 HB2 LYS 117 71.549 2.577 9.544 667 2HB LYS 117 HB1 LYS 117 71.500 1.357 10.824 668 1HG LYS 117 HG2 LYS 117 73.637 3.082 11.485 669 2HG LYS 117 HG1 LYS 117 72.304 4.133 10.987 670 1HD LYS 117 HD2 LYS 117 70.931 2.374 12.510 671 2HD LYS 117 HD1 LYS 117 72.504 2.288 13.317 672 1HE LYS 117 HE2 LYS 117 72.345 4.438 14.114 673 2HE LYS 117 HE1 LYS 117 71.534 5.025 12.649 674 1HZ LYS 117 HZ1 LYS 117 70.241 3.130 14.529 675 2HZ LYS 117 HZ2 LYS 117 69.509 4.066 13.314 676 3HZ LYS 117 HZ3 LYS 117 70.104 4.810 14.722 677 H THR 118 HN THR 118 75.516 0.978 10.987 678 HA THR 118 HA THR 118 74.698 -1.789 11.805 679 HB THR 118 HB THR 118 77.051 -2.290 11.745 680 HG1 THR 118 HG1 THR 118 77.392 0.509 11.442 681 1HG2 THR 118 HG21 THR 118 76.760 -0.388 9.432 682 2HG2 THR 118 HG22 THR 118 75.746 -1.827 9.534 683 3HG2 THR 118 HG23 THR 118 77.501 -1.988 9.464 684 H LYS 119 HN LYS 119 76.374 1.156 12.952 685 HA LYS 119 HA LYS 119 75.221 1.004 15.589 686 1HB LYS 119 HB2 LYS 119 77.251 0.234 16.781 687 2HB LYS 119 HB1 LYS 119 76.683 -0.992 15.646 688 1HG LYS 119 HG2 LYS 119 78.570 -0.853 14.404 689 2HG LYS 119 HG1 LYS 119 78.532 0.913 14.410 690 1HD LYS 119 HD2 LYS 119 79.968 1.053 16.168 691 2HD LYS 119 HD1 LYS 119 79.209 -0.295 17.014 692 1HE LYS 119 HE2 LYS 119 81.041 -1.512 16.423 693 2HE LYS 119 HE1 LYS 119 80.407 -1.474 14.768 694 1HZ LYS 119 HZ1 LYS 119 82.499 -0.468 14.599 695 2HZ LYS 119 HZ2 LYS 119 82.320 0.384 16.058 696 3HZ LYS 119 HZ3 LYS 119 81.434 0.849 14.685 697 H PHE 120 HN PHE 120 75.754 3.037 13.586 698 HA PHE 120 HA PHE 120 77.024 5.046 15.291 699 1HB PHE 120 HB2 PHE 120 78.648 3.477 13.656 700 2HB PHE 120 HB1 PHE 120 78.423 4.962 12.722 701 HD1 PHE 120 HD1 PHE 120 79.599 3.572 15.953 702 HD2 PHE 120 HD2 PHE 120 79.345 7.061 13.460 703 HE1 PHE 120 HE1 PHE 120 81.208 4.745 17.431 704 HE2 PHE 120 HE2 PHE 120 80.953 8.234 14.938 705 HZ PHE 120 HZ PHE 120 81.885 7.077 16.924 706 H GLY 121 HN GLY 121 76.127 4.307 11.896 707 1HA GLY 121 HA2 GLY 121 74.064 6.282 11.795 708 2HA GLY 121 HA1 GLY 121 75.543 6.967 11.104 709 H TYR 122 HN TYR 122 74.424 7.020 9.026 710 HA TYR 122 HA TYR 122 73.770 4.406 7.779 711 1HB TYR 122 HB2 TYR 122 73.397 7.330 7.127 712 2HB TYR 122 HB1 TYR 122 73.116 6.093 5.904 713 HD1 TYR 122 HD1 TYR 122 72.458 4.694 9.081 714 HD2 TYR 122 HD2 TYR 122 70.760 7.321 6.134 715 HE1 TYR 122 HE1 TYR 122 70.196 4.278 10.010 716 HE2 TYR 122 HE2 TYR 122 68.500 6.903 7.064 717 HH TYR 122 HH TYR 122 67.729 6.055 9.707 718 H HIS 123 HN HIS 123 75.077 3.487 6.190 719 HA HIS 123 HA HIS 123 77.328 5.126 5.099 720 1HB HIS 123 HB2 HIS 123 77.922 2.300 5.803 721 2HB HIS 123 HB1 HIS 123 78.939 3.729 5.967 722 HD1 HIS 123 HD1 HIS 123 77.998 5.442 7.986 723 HD2 HIS 123 HD2 HIS 123 77.010 1.401 8.238 724 HE1 HIS 123 HE1 HIS 123 77.327 5.016 10.392 725 H ILE 124 HN ILE 124 77.767 4.626 2.912 726 HA ILE 124 HA ILE 124 75.888 2.751 1.603 727 HB ILE 124 HB ILE 124 77.996 4.658 0.531 728 1HG1 ILE 124 HG12 ILE 124 74.971 4.873 0.769 729 2HG1 ILE 124 HG11 ILE 124 76.156 5.818 1.680 730 1HG2 ILE 124 HG21 ILE 124 76.867 2.513 -0.777 731 2HG2 ILE 124 HG22 ILE 124 77.503 3.958 -1.564 732 3HG2 ILE 124 HG23 ILE 124 75.780 3.832 -1.209 733 1HD1 ILE 124 HD11 ILE 124 75.347 6.041 -1.192 734 2HD1 ILE 124 HD12 ILE 124 77.025 6.396 -0.786 735 3HD1 ILE 124 HD13 ILE 124 75.722 7.317 -0.033 736 H ILE 125 HN ILE 125 76.591 0.633 1.856 737 HA ILE 125 HA ILE 125 79.460 -0.020 1.665 738 HB ILE 125 HB ILE 125 76.881 -1.486 2.250 739 1HG1 ILE 125 HG12 ILE 125 79.392 -0.902 3.858 740 2HG1 ILE 125 HG11 ILE 125 77.817 -0.121 4.061 741 1HG2 ILE 125 HG21 ILE 125 78.782 -3.304 2.875 742 2HG2 ILE 125 HG22 ILE 125 79.521 -2.560 1.455 743 3HG2 ILE 125 HG23 ILE 125 77.919 -3.290 1.337 744 1HD1 ILE 125 HD11 ILE 125 78.521 -3.023 4.572 745 2HD1 ILE 125 HD12 ILE 125 76.860 -2.437 4.501 746 3HD1 ILE 125 HD13 ILE 125 77.955 -1.832 5.743 747 H MET 126 HN MET 126 80.341 -0.412 -0.300 748 HA MET 126 HA MET 126 78.571 -1.423 -2.487 749 1HB MET 126 HB2 MET 126 80.759 0.537 -2.221 750 2HB MET 126 HB1 MET 126 80.876 -0.499 -3.651 751 1HG MET 126 HG2 MET 126 78.371 0.069 -4.001 752 2HG MET 126 HG1 MET 126 78.663 1.381 -2.848 753 1HE MET 126 HE1 MET 126 81.700 1.756 -3.360 754 2HE MET 126 HE2 MET 126 80.628 3.130 -3.121 755 3HE MET 126 HE3 MET 126 81.757 3.129 -4.474 756 H VAL 127 HN VAL 127 78.830 -3.627 -2.534 757 HA VAL 127 HA VAL 127 81.491 -4.828 -2.000 758 HB VAL 127 HB VAL 127 79.807 -6.112 -1.001 759 1HG1 VAL 127 HG11 VAL 127 77.776 -5.184 -1.585 760 2HG1 VAL 127 HG12 VAL 127 77.691 -6.705 -2.477 761 3HG1 VAL 127 HG13 VAL 127 78.137 -5.219 -3.314 762 1HG2 VAL 127 HG21 VAL 127 79.360 -7.686 -3.403 763 2HG2 VAL 127 HG22 VAL 127 80.250 -8.103 -1.942 764 3HG2 VAL 127 HG23 VAL 127 81.052 -7.220 -3.239 765 H GLU 128 HN GLU 128 82.710 -5.876 -3.699 766 HA GLU 128 HA GLU 128 81.544 -5.749 -6.421 767 1HB GLU 128 HB2 GLU 128 83.373 -3.854 -5.247 768 2HB GLU 128 HB1 GLU 128 84.146 -4.661 -6.619 769 1HG GLU 128 HG2 GLU 128 81.315 -3.771 -6.966 770 2HG GLU 128 HG1 GLU 128 82.566 -2.518 -6.945 771 H GLY 129 HN GLY 129 81.726 -7.993 -6.387 772 1HA GLY 129 HA2 GLY 129 82.836 -9.842 -7.409 773 2HA GLY 129 HA1 GLY 129 84.367 -8.987 -7.193 774 H ARG 130 HN ARG 130 82.575 -11.561 -6.125 775 HA ARG 130 HA ARG 130 84.123 -11.594 -3.577 776 1HB ARG 130 HB2 ARG 130 81.945 -11.366 -2.820 777 2HB ARG 130 HB1 ARG 130 81.259 -12.170 -4.227 778 1HG ARG 130 HG2 ARG 130 82.133 -14.340 -3.367 779 2HG ARG 130 HG1 ARG 130 82.734 -13.505 -1.934 780 1HD ARG 130 HD2 ARG 130 80.669 -14.142 -1.107 781 2HD ARG 130 HD1 ARG 130 80.161 -12.644 -1.910 782 HE ARG 130 HE ARG 130 79.797 -14.190 -3.970 783 1HH1 ARG 130 HH21 ARG 130 78.002 -14.292 -1.308 784 2HH1 ARG 130 HH22 ARG 130 77.582 -15.971 -1.356 785 1HH2 ARG 130 HH11 ARG 130 79.935 -16.762 -3.778 786 2HH2 ARG 130 HH12 ARG 130 78.676 -17.370 -2.755 787 H LYS 131 HN LYS 131 84.318 -13.982 -2.779 788 HA LYS 131 HA LYS 131 84.678 -15.828 -5.115 789 1HB LYS 131 HB2 LYS 131 86.553 -15.109 -2.848 790 2HB LYS 131 HB1 LYS 131 86.797 -16.529 -3.865 791 1HG LYS 131 HG2 LYS 131 87.435 -15.284 -5.672 792 2HG LYS 131 HG1 LYS 131 86.280 -13.998 -5.319 793 1HD LYS 131 HD2 LYS 131 88.287 -12.923 -4.834 794 2HD LYS 131 HD1 LYS 131 87.871 -13.573 -3.248 795 1HE LYS 131 HE2 LYS 131 89.587 -15.104 -3.288 796 2HE LYS 131 HE1 LYS 131 89.420 -15.386 -5.038 797 1HZ LYS 131 HZ1 LYS 131 90.714 -13.607 -5.538 798 2HZ LYS 131 HZ2 LYS 131 91.375 -13.914 -4.002 799 3HZ LYS 131 HZ3 LYS 131 90.201 -12.702 -4.199 Start of MODEL 9 1 1H GLY 28 HT1 GLY 28 84.506 -17.968 -10.945 2 2H GLY 28 HT2 GLY 28 83.965 -18.863 -12.284 3 3H GLY 28 HT3 GLY 28 85.413 -19.287 -11.503 4 1HA GLY 28 HA2 GLY 28 84.316 -20.084 -9.611 5 2HA GLY 28 HA1 GLY 28 82.806 -19.321 -10.106 6 H SER 29 HN SER 29 84.868 -22.090 -10.507 7 HA SER 29 HA SER 29 83.359 -23.195 -12.775 8 1HB SER 29 HB2 SER 29 84.880 -25.167 -12.238 9 2HB SER 29 HB1 SER 29 85.717 -23.654 -12.584 10 HG SER 29 HG SER 29 85.279 -24.926 -10.114 11 H GLY 30 HN GLY 30 83.776 -24.020 -9.310 12 1HA GLY 30 HA2 GLY 30 81.011 -25.068 -9.273 13 2HA GLY 30 HA1 GLY 30 82.291 -26.217 -8.879 14 HA PRO 31 HA PRO 31 82.421 -24.925 -4.703 15 1HB PRO 31 HB2 PRO 31 85.256 -24.428 -4.605 16 2HB PRO 31 HB1 PRO 31 84.378 -25.867 -4.056 17 1HG PRO 31 HG2 PRO 31 86.083 -25.606 -6.356 18 2HG PRO 31 HG1 PRO 31 85.209 -27.039 -5.809 19 1HD PRO 31 HD2 PRO 31 84.640 -25.384 -8.106 20 2HD PRO 31 HD1 PRO 31 83.759 -26.828 -7.555 21 H LYS 32 HN LYS 32 81.353 -22.851 -4.985 22 HA LYS 32 HA LYS 32 83.217 -20.505 -5.165 23 1HB LYS 32 HB2 LYS 32 81.118 -21.215 -6.795 24 2HB LYS 32 HB1 LYS 32 80.334 -20.113 -5.662 25 1HG LYS 32 HG2 LYS 32 82.147 -18.446 -6.108 26 2HG LYS 32 HG1 LYS 32 82.801 -19.535 -7.330 27 1HD LYS 32 HD2 LYS 32 80.961 -19.252 -8.752 28 2HD LYS 32 HD1 LYS 32 79.907 -18.721 -7.441 29 1HE LYS 32 HE2 LYS 32 80.568 -16.544 -7.651 30 2HE LYS 32 HE1 LYS 32 82.269 -16.993 -7.873 31 1HZ LYS 32 HZ1 LYS 32 81.783 -17.700 -10.111 32 2HZ LYS 32 HZ2 LYS 32 81.246 -16.099 -9.921 33 3HZ LYS 32 HZ3 LYS 32 80.130 -17.381 -9.906 34 H GLY 33 HN GLY 33 80.983 -22.212 -3.194 35 1HA GLY 33 HA2 GLY 33 80.368 -21.793 -0.955 36 2HA GLY 33 HA1 GLY 33 81.330 -20.316 -1.014 37 H GLY 34 HN GLY 34 80.334 -18.390 -1.896 38 1HA GLY 34 HA1 GLY 34 77.905 -17.973 -3.068 39 2HA GLY 34 HA2 GLY 34 77.444 -18.297 -1.397 40 H GLY 35 HN GLY 35 80.076 -17.066 -0.501 41 1HA GLY 35 HA2 GLY 35 80.138 -14.322 -1.335 42 2HA GLY 35 HA1 GLY 35 79.149 -14.474 0.124 43 H ASN 36 HN ASN 36 82.310 -15.639 -1.111 44 HA ASN 36 HA ASN 36 83.399 -15.808 1.607 45 1HB ASN 36 HB2 ASN 36 83.959 -17.378 -0.235 46 2HB ASN 36 HB1 ASN 36 84.676 -16.042 -1.136 47 1HD2 ASN 36 HD21 ASN 36 84.904 -17.317 2.247 48 2HD2 ASN 36 HD22 ASN 36 86.597 -17.225 2.319 49 H ALA 37 HN ALA 37 84.802 -14.176 -1.226 50 HA ALA 37 HA ALA 37 85.537 -11.894 0.558 51 1HB ALA 37 HB1 ALA 37 87.588 -11.906 -0.489 52 2HB ALA 37 HB2 ALA 37 86.903 -12.391 -2.040 53 3HB ALA 37 HB3 ALA 37 87.157 -13.593 -0.775 54 H VAL 38 HN VAL 38 85.267 -9.784 -0.279 55 HA VAL 38 HA VAL 38 83.982 -9.405 -2.931 56 HB VAL 38 HB VAL 38 82.182 -8.062 -1.700 57 1HG1 VAL 38 HG11 VAL 38 80.838 -9.894 -1.830 58 2HG1 VAL 38 HG12 VAL 38 81.841 -10.821 -0.714 59 3HG1 VAL 38 HG13 VAL 38 82.287 -10.709 -2.416 60 1HG2 VAL 38 HG21 VAL 38 82.043 -8.090 0.588 61 2HG2 VAL 38 HG22 VAL 38 83.784 -8.340 0.457 62 3HG2 VAL 38 HG23 VAL 38 82.712 -9.717 0.712 63 H LYS 39 HN LYS 39 84.320 -7.094 -3.680 64 HA LYS 39 HA LYS 39 86.415 -5.785 -2.037 65 1HB LYS 39 HB2 LYS 39 85.835 -6.106 -4.738 66 2HB LYS 39 HB1 LYS 39 85.408 -4.419 -4.425 67 1HG LYS 39 HG2 LYS 39 88.061 -5.732 -3.746 68 2HG LYS 39 HG1 LYS 39 87.778 -4.592 -5.070 69 1HD LYS 39 HD2 LYS 39 86.948 -2.952 -3.296 70 2HD LYS 39 HD1 LYS 39 87.609 -4.067 -2.090 71 1HE LYS 39 HE2 LYS 39 89.190 -2.186 -2.812 72 2HE LYS 39 HE1 LYS 39 89.846 -3.824 -2.997 73 1HZ LYS 39 HZ1 LYS 39 89.842 -2.138 -5.002 74 2HZ LYS 39 HZ2 LYS 39 88.248 -2.696 -5.186 75 3HZ LYS 39 HZ3 LYS 39 89.548 -3.789 -5.253 76 H VAL 40 HN VAL 40 85.209 -5.052 -0.233 77 HA VAL 40 HA VAL 40 82.723 -3.546 -0.607 78 HB VAL 40 HB VAL 40 82.756 -3.616 1.867 79 1HG1 VAL 40 HG11 VAL 40 81.791 -5.601 1.351 80 2HG1 VAL 40 HG12 VAL 40 83.354 -6.317 1.745 81 3HG1 VAL 40 HG13 VAL 40 82.960 -5.925 0.071 82 1HG2 VAL 40 HG21 VAL 40 84.684 -3.885 3.001 83 2HG2 VAL 40 HG22 VAL 40 85.536 -3.813 1.458 84 3HG2 VAL 40 HG23 VAL 40 85.044 -5.371 2.123 85 H ARG 41 HN ARG 41 82.395 -1.407 -0.179 86 HA ARG 41 HA ARG 41 84.762 0.315 0.491 87 1HB ARG 41 HB2 ARG 41 82.699 0.417 -1.676 88 2HB ARG 41 HB1 ARG 41 83.284 1.947 -1.027 89 1HG ARG 41 HG2 ARG 41 85.516 1.488 -1.672 90 2HG ARG 41 HG1 ARG 41 85.184 -0.229 -1.904 91 1HD ARG 41 HD2 ARG 41 84.304 0.097 -4.004 92 2HD ARG 41 HD1 ARG 41 83.567 1.654 -3.559 93 HE ARG 41 HE ARG 41 86.326 2.088 -3.410 94 1HH1 ARG 41 HH21 ARG 41 84.043 2.936 -5.489 95 2HH1 ARG 41 HH22 ARG 41 84.939 2.711 -6.955 96 1HH2 ARG 41 HH11 ARG 41 87.511 0.959 -5.426 97 2HH2 ARG 41 HH12 ARG 41 86.902 1.592 -6.919 98 H HIS 42 HN HIS 42 84.182 2.147 1.886 99 HA HIS 42 HA HIS 42 81.409 1.927 3.020 100 1HB HIS 42 HB2 HIS 42 83.968 2.637 4.475 101 2HB HIS 42 HB1 HIS 42 82.401 2.248 5.194 102 HD1 HIS 42 HD1 HIS 42 82.493 -0.035 6.169 103 HD2 HIS 42 HD2 HIS 42 84.620 0.171 2.589 104 HE1 HIS 42 HE1 HIS 42 83.356 -2.372 5.713 105 H ILE 43 HN ILE 43 80.244 3.771 2.910 106 HA ILE 43 HA ILE 43 81.647 6.412 3.020 107 HB ILE 43 HB ILE 43 79.954 5.216 0.895 108 1HG1 ILE 43 HG12 ILE 43 82.137 7.281 1.155 109 2HG1 ILE 43 HG11 ILE 43 82.156 5.755 0.261 110 1HG2 ILE 43 HG21 ILE 43 78.957 7.394 0.252 111 2HG2 ILE 43 HG22 ILE 43 79.599 8.116 1.728 112 3HG2 ILE 43 HG23 ILE 43 78.365 6.861 1.825 113 1HD1 ILE 43 HD11 ILE 43 81.926 7.390 -1.430 114 2HD1 ILE 43 HD12 ILE 43 80.801 8.353 -0.475 115 3HD1 ILE 43 HD13 ILE 43 80.275 6.824 -1.179 116 H LEU 44 HN LEU 44 80.851 7.326 4.910 117 HA LEU 44 HA LEU 44 77.923 6.962 5.470 118 1HB LEU 44 HB2 LEU 44 78.724 5.746 7.210 119 2HB LEU 44 HB1 LEU 44 80.379 6.308 6.937 120 HG LEU 44 HG LEU 44 79.856 8.401 8.138 121 1HD1 LEU 44 HD11 LEU 44 77.456 7.622 9.475 122 2HD1 LEU 44 HD12 LEU 44 77.169 7.487 7.741 123 3HD1 LEU 44 HD13 LEU 44 77.709 9.018 8.429 124 1HD2 LEU 44 HD21 LEU 44 80.456 7.372 10.056 125 2HD2 LEU 44 HD22 LEU 44 80.203 5.842 9.217 126 3HD2 LEU 44 HD23 LEU 44 78.901 6.550 10.173 127 H CYS 45 HN CYS 45 76.864 8.812 6.338 128 HA CYS 45 HA CYS 45 78.489 11.336 6.429 129 1HB CYS 45 HB2 CYS 45 75.776 10.699 5.248 130 2HB CYS 45 HB1 CYS 45 76.292 12.362 5.569 131 HG CYS 45 HG CYS 45 77.766 10.452 3.569 132 H GLU 46 HN GLU 46 78.627 11.452 8.703 133 HA GLU 46 HA GLU 46 76.730 10.766 10.639 134 1HB GLU 46 HB2 GLU 46 79.191 11.879 10.586 135 2HB GLU 46 HB1 GLU 46 78.240 13.306 10.997 136 1HG GLU 46 HG2 GLU 46 77.139 11.882 12.810 137 2HG GLU 46 HG1 GLU 46 78.397 10.685 12.501 138 H LYS 47 HN LYS 47 76.915 13.768 8.728 139 HA LYS 47 HA LYS 47 74.769 15.113 10.143 140 1HB LYS 47 HB2 LYS 47 75.882 15.509 7.347 141 2HB LYS 47 HB1 LYS 47 74.993 16.704 8.292 142 1HG LYS 47 HG2 LYS 47 77.092 15.815 9.957 143 2HG LYS 47 HG1 LYS 47 77.812 16.061 8.366 144 1HD LYS 47 HD2 LYS 47 76.517 18.307 8.357 145 2HD LYS 47 HD1 LYS 47 76.347 18.053 10.094 146 1HE LYS 47 HE2 LYS 47 78.927 17.664 10.066 147 2HE LYS 47 HE1 LYS 47 78.868 18.480 8.491 148 1HZ LYS 47 HZ1 LYS 47 78.081 19.502 11.146 149 2HZ LYS 47 HZ2 LYS 47 77.355 20.138 9.748 150 3HZ LYS 47 HZ3 LYS 47 79.037 20.248 9.962 151 H HIS 48 HN HIS 48 74.829 12.570 7.856 152 HA HIS 48 HA HIS 48 73.109 11.472 6.674 153 1HB HIS 48 HB2 HIS 48 71.741 13.009 8.866 154 2HB HIS 48 HB1 HIS 48 70.774 12.116 7.693 155 HD1 HIS 48 HD1 HIS 48 74.119 11.119 9.210 156 HD2 HIS 48 HD2 HIS 48 70.166 9.798 9.105 157 HE1 HIS 48 HE1 HIS 48 74.082 8.876 10.386 158 H GLY 49 HN GLY 49 73.902 14.533 6.173 159 1HA GLY 49 HA2 GLY 49 71.564 15.217 4.455 160 2HA GLY 49 HA1 GLY 49 72.824 16.356 4.959 161 H LYS 50 HN LYS 50 74.926 14.314 4.440 162 HA LYS 50 HA LYS 50 75.163 14.730 1.496 163 1HB LYS 50 HB2 LYS 50 77.104 13.827 3.651 164 2HB LYS 50 HB1 LYS 50 77.533 14.166 1.978 165 1HG LYS 50 HG2 LYS 50 77.976 16.250 2.784 166 2HG LYS 50 HG1 LYS 50 76.231 16.461 2.629 167 1HD LYS 50 HD2 LYS 50 76.298 16.950 4.849 168 2HD LYS 50 HD1 LYS 50 76.429 15.203 5.064 169 1HE LYS 50 HE2 LYS 50 78.417 15.620 6.098 170 2HE LYS 50 HE1 LYS 50 79.052 16.044 4.493 171 1HZ LYS 50 HZ1 LYS 50 77.465 17.957 6.108 172 2HZ LYS 50 HZ2 LYS 50 78.489 18.284 4.792 173 3HZ LYS 50 HZ3 LYS 50 79.147 17.835 6.293 174 H ILE 51 HN ILE 51 74.739 12.262 3.925 175 HA ILE 51 HA ILE 51 75.657 9.931 2.783 176 HB ILE 51 HB ILE 51 73.972 10.622 4.807 177 1HG1 ILE 51 HG12 ILE 51 75.265 8.655 4.997 178 2HG1 ILE 51 HG11 ILE 51 73.595 8.071 5.035 179 1HG2 ILE 51 HG21 ILE 51 71.805 9.508 4.463 180 2HG2 ILE 51 HG22 ILE 51 72.249 9.145 2.795 181 3HG2 ILE 51 HG23 ILE 51 72.024 10.819 3.303 182 1HD1 ILE 51 HD11 ILE 51 73.793 7.742 2.512 183 2HD1 ILE 51 HD12 ILE 51 74.763 6.650 3.501 184 3HD1 ILE 51 HD13 ILE 51 75.524 8.025 2.701 185 H MET 52 HN MET 52 72.954 11.898 1.638 186 HA MET 52 HA MET 52 72.263 9.933 -0.426 187 1HB MET 52 HB2 MET 52 70.372 11.041 0.387 188 2HB MET 52 HB1 MET 52 71.254 12.544 0.644 189 1HG MET 52 HG2 MET 52 69.814 12.960 -1.198 190 2HG MET 52 HG1 MET 52 71.409 12.717 -1.900 191 1HE MET 52 HE1 MET 52 71.943 9.975 -3.349 192 2HE MET 52 HE2 MET 52 71.856 11.723 -3.532 193 3HE MET 52 HE3 MET 52 70.874 10.688 -4.564 194 H GLU 53 HN GLU 53 73.674 13.175 -0.205 195 HA GLU 53 HA GLU 53 74.213 13.571 -2.962 196 1HB GLU 53 HB2 GLU 53 74.876 14.690 -0.374 197 2HB GLU 53 HB1 GLU 53 76.323 14.617 -1.376 198 1HG GLU 53 HG2 GLU 53 74.871 16.728 -1.568 199 2HG GLU 53 HG1 GLU 53 75.353 15.947 -3.074 200 H ALA 54 HN ALA 54 75.645 11.669 -0.399 201 HA ALA 54 HA ALA 54 78.137 11.008 -1.728 202 1HB ALA 54 HB1 ALA 54 76.520 9.264 0.159 203 2HB ALA 54 HB2 ALA 54 77.393 10.687 0.731 204 3HB ALA 54 HB3 ALA 54 78.275 9.345 0.002 205 H MET 55 HN MET 55 74.827 9.956 -1.854 206 HA MET 55 HA MET 55 75.389 7.634 -3.607 207 1HB MET 55 HB2 MET 55 73.602 7.269 -2.140 208 2HB MET 55 HB1 MET 55 73.037 8.940 -2.255 209 1HG MET 55 HG2 MET 55 72.242 8.533 -4.545 210 2HG MET 55 HG1 MET 55 72.845 6.870 -4.470 211 1HE MET 55 HE1 MET 55 70.955 5.244 -1.682 212 2HE MET 55 HE2 MET 55 71.745 6.634 -0.941 213 3HE MET 55 HE3 MET 55 72.574 5.727 -2.203 214 H GLU 56 HN GLU 56 73.708 10.793 -3.820 215 HA GLU 56 HA GLU 56 73.156 10.717 -6.623 216 1HB GLU 56 HB2 GLU 56 73.226 12.633 -4.394 217 2HB GLU 56 HB1 GLU 56 73.599 13.375 -5.947 218 1HG GLU 56 HG2 GLU 56 71.373 11.519 -6.178 219 2HG GLU 56 HG1 GLU 56 71.047 12.761 -4.970 220 H LYS 57 HN LYS 57 75.832 12.360 -4.870 221 HA LYS 57 HA LYS 57 77.357 13.240 -7.042 222 1HB LYS 57 HB2 LYS 57 78.177 12.013 -4.388 223 2HB LYS 57 HB1 LYS 57 79.298 12.857 -5.450 224 1HG LYS 57 HG2 LYS 57 76.737 14.210 -4.666 225 2HG LYS 57 HG1 LYS 57 78.074 14.173 -3.518 226 1HD LYS 57 HD2 LYS 57 78.205 15.221 -6.361 227 2HD LYS 57 HD1 LYS 57 78.176 16.209 -4.902 228 1HE LYS 57 HE2 LYS 57 80.258 14.237 -4.645 229 2HE LYS 57 HE1 LYS 57 80.471 15.107 -6.176 230 1HZ LYS 57 HZ1 LYS 57 79.799 16.497 -3.644 231 2HZ LYS 57 HZ2 LYS 57 80.412 17.167 -5.079 232 3HZ LYS 57 HZ3 LYS 57 81.407 16.205 -4.094 233 H LEU 58 HN LEU 58 78.127 10.215 -5.292 234 HA LEU 58 HA LEU 58 79.811 9.057 -7.188 235 1HB LEU 58 HB2 LEU 58 77.734 7.854 -5.323 236 2HB LEU 58 HB1 LEU 58 78.964 6.888 -6.146 237 HG LEU 58 HG LEU 58 79.654 9.275 -4.417 238 1HD1 LEU 58 HD11 LEU 58 80.151 6.559 -3.368 239 2HD1 LEU 58 HD12 LEU 58 78.449 7.013 -3.446 240 3HD1 LEU 58 HD13 LEU 58 79.584 8.003 -2.528 241 1HD2 LEU 58 HD21 LEU 58 81.265 8.305 -6.167 242 2HD2 LEU 58 HD22 LEU 58 81.326 6.865 -5.151 243 3HD2 LEU 58 HD23 LEU 58 81.874 8.417 -4.516 244 H LYS 59 HN LYS 59 76.270 9.194 -7.187 245 HA LYS 59 HA LYS 59 75.912 7.341 -9.405 246 1HB LYS 59 HB2 LYS 59 74.303 9.267 -7.774 247 2HB LYS 59 HB1 LYS 59 73.626 8.735 -9.313 248 1HG LYS 59 HG2 LYS 59 74.487 6.361 -8.303 249 2HG LYS 59 HG1 LYS 59 74.072 7.206 -6.815 250 1HD LYS 59 HD2 LYS 59 72.231 6.953 -9.209 251 2HD LYS 59 HD1 LYS 59 72.144 5.933 -7.774 252 1HE LYS 59 HE2 LYS 59 70.950 7.524 -6.689 253 2HE LYS 59 HE1 LYS 59 72.223 8.722 -6.991 254 1HZ LYS 59 HZ1 LYS 59 70.341 9.478 -8.176 255 2HZ LYS 59 HZ2 LYS 59 69.989 7.929 -8.780 256 3HZ LYS 59 HZ3 LYS 59 71.348 8.777 -9.346 257 H SER 60 HN SER 60 75.244 10.845 -9.195 258 HA SER 60 HA SER 60 74.909 11.556 -11.819 259 1HB SER 60 HB2 SER 60 76.319 13.646 -11.049 260 2HB SER 60 HB1 SER 60 74.807 13.266 -10.225 261 HG SER 60 HG SER 60 75.900 12.434 -8.552 262 H GLY 61 HN GLY 61 78.172 11.709 -10.318 263 1HA GLY 61 HA2 GLY 61 79.654 10.163 -12.034 264 2HA GLY 61 HA1 GLY 61 79.411 11.642 -12.971 265 H MET 62 HN MET 62 79.414 13.085 -10.185 266 HA MET 62 HA MET 62 81.964 14.187 -10.256 267 1HB MET 62 HB2 MET 62 81.474 14.110 -7.543 268 2HB MET 62 HB1 MET 62 80.821 15.318 -8.641 269 1HG MET 62 HG2 MET 62 79.301 12.774 -8.404 270 2HG MET 62 HG1 MET 62 79.278 13.842 -7.007 271 1HE MET 62 HE1 MET 62 79.425 16.249 -7.364 272 2HE MET 62 HE2 MET 62 77.974 17.051 -7.960 273 3HE MET 62 HE3 MET 62 79.401 16.944 -8.989 274 H ARG 63 HN ARG 63 83.969 13.662 -9.312 275 HA ARG 63 HA ARG 63 85.050 11.177 -9.339 276 1HB ARG 63 HB2 ARG 63 85.942 12.370 -6.911 277 2HB ARG 63 HB1 ARG 63 86.798 12.304 -8.441 278 1HG ARG 63 HG2 ARG 63 86.597 14.595 -7.667 279 2HG ARG 63 HG1 ARG 63 85.592 14.409 -9.102 280 1HD ARG 63 HD2 ARG 63 83.629 14.715 -7.883 281 2HD ARG 63 HD1 ARG 63 84.273 13.845 -6.483 282 HE ARG 63 HE ARG 63 85.827 16.032 -6.395 283 1HH1 ARG 63 HH21 ARG 63 82.541 15.495 -5.983 284 2HH1 ARG 63 HH22 ARG 63 82.094 17.168 -5.923 285 1HH2 ARG 63 HH11 ARG 63 85.245 18.311 -6.816 286 2HH2 ARG 63 HH12 ARG 63 83.627 18.763 -6.395 287 H PHE 64 HN PHE 64 85.358 9.490 -7.779 288 HA PHE 64 HA PHE 64 83.077 9.191 -5.920 289 1HB PHE 64 HB2 PHE 64 85.287 7.401 -6.971 290 2HB PHE 64 HB1 PHE 64 84.162 6.868 -5.724 291 HD1 PHE 64 HD1 PHE 64 82.574 9.230 -7.837 292 HD2 PHE 64 HD2 PHE 64 83.748 5.104 -7.648 293 HE1 PHE 64 HE1 PHE 64 80.906 8.677 -9.588 294 HE2 PHE 64 HE2 PHE 64 82.081 4.549 -9.398 295 HZ PHE 64 HZ PHE 64 80.659 6.335 -10.368 296 H ASN 65 HN ASN 65 86.574 9.723 -5.894 297 HA ASN 65 HA ASN 65 86.788 9.117 -3.037 298 1HB ASN 65 HB2 ASN 65 89.165 9.869 -3.477 299 2HB ASN 65 HB1 ASN 65 88.604 8.560 -4.518 300 1HD2 ASN 65 HD21 ASN 65 88.471 8.974 -6.777 301 2HD2 ASN 65 HD22 ASN 65 88.875 10.466 -7.479 302 H GLU 66 HN GLU 66 86.452 12.102 -4.939 303 HA GLU 66 HA GLU 66 87.317 13.848 -2.790 304 1HB GLU 66 HB2 GLU 66 85.524 14.173 -5.211 305 2HB GLU 66 HB1 GLU 66 85.959 15.523 -4.168 306 1HG GLU 66 HG2 GLU 66 87.826 13.773 -5.796 307 2HG GLU 66 HG1 GLU 66 87.540 15.502 -5.994 308 H VAL 67 HN VAL 67 84.115 12.892 -3.988 309 HA VAL 67 HA VAL 67 82.586 13.950 -1.829 310 HB VAL 67 HB VAL 67 81.069 13.170 -3.380 311 1HG1 VAL 67 HG11 VAL 67 83.166 11.201 -4.229 312 2HG1 VAL 67 HG12 VAL 67 82.550 12.597 -5.123 313 3HG1 VAL 67 HG13 VAL 67 81.530 11.181 -4.888 314 1HG2 VAL 67 HG21 VAL 67 80.031 11.158 -2.839 315 2HG2 VAL 67 HG22 VAL 67 80.893 11.569 -1.358 316 3HG2 VAL 67 HG23 VAL 67 81.565 10.372 -2.465 317 H ALA 68 HN ALA 68 83.399 10.526 -2.393 318 HA ALA 68 HA ALA 68 82.952 9.515 0.147 319 1HB ALA 68 HB1 ALA 68 83.594 8.136 -1.738 320 2HB ALA 68 HB2 ALA 68 84.803 7.896 -0.474 321 3HB ALA 68 HB3 ALA 68 85.152 8.946 -1.847 322 H ALA 69 HN ALA 69 85.703 11.508 -0.942 323 HA ALA 69 HA ALA 69 87.567 11.241 1.097 324 1HB ALA 69 HB1 ALA 69 88.291 13.322 0.413 325 2HB ALA 69 HB2 ALA 69 86.685 14.030 0.534 326 3HB ALA 69 HB3 ALA 69 87.117 13.066 -0.871 327 H GLN 70 HN GLN 70 85.057 13.777 1.359 328 HA GLN 70 HA GLN 70 85.093 13.401 4.256 329 1HB GLN 70 HB2 GLN 70 84.842 15.547 2.594 330 2HB GLN 70 HB1 GLN 70 83.162 15.239 3.055 331 1HG GLN 70 HG2 GLN 70 85.522 15.403 4.923 332 2HG GLN 70 HG1 GLN 70 84.298 16.672 4.751 333 1HE2 GLN 70 HE21 GLN 70 84.732 13.218 5.872 334 2HE2 GLN 70 HE22 GLN 70 83.318 13.187 6.800 335 H TYR 71 HN TYR 71 82.661 13.537 1.703 336 HA TYR 71 HA TYR 71 80.319 12.912 2.918 337 1HB TYR 71 HB2 TYR 71 81.521 11.806 0.361 338 2HB TYR 71 HB1 TYR 71 79.839 11.554 0.801 339 HD1 TYR 71 HD1 TYR 71 78.220 13.230 0.464 340 HD2 TYR 71 HD2 TYR 71 82.391 14.285 0.179 341 HE1 TYR 71 HE1 TYR 71 77.609 15.473 -0.386 342 HE2 TYR 71 HE2 TYR 71 81.759 16.514 -0.671 343 HH TYR 71 HH TYR 71 79.609 18.037 -0.422 344 H SER 72 HN SER 72 83.087 10.768 2.502 345 HA SER 72 HA SER 72 81.649 8.515 3.796 346 1HB SER 72 HB2 SER 72 83.433 8.405 1.886 347 2HB SER 72 HB1 SER 72 84.599 8.736 3.166 348 HG SER 72 HG SER 72 84.294 6.498 2.828 349 H GLU 73 HN GLU 73 81.280 9.956 5.755 350 HA GLU 73 HA GLU 73 83.345 11.140 7.276 351 1HB GLU 73 HB2 GLU 73 81.030 11.753 7.501 352 2HB GLU 73 HB1 GLU 73 80.567 10.086 7.869 353 1HG GLU 73 HG2 GLU 73 80.821 10.591 10.032 354 2HG GLU 73 HG1 GLU 73 82.550 10.711 9.723 355 H ASP 74 HN ASP 74 84.642 9.045 6.750 356 HA ASP 74 HA ASP 74 85.437 7.774 9.145 357 1HB ASP 74 HB2 ASP 74 83.317 6.741 9.343 358 2HB ASP 74 HB1 ASP 74 83.221 6.413 7.614 359 H LYS 75 HN LYS 75 84.686 5.843 6.265 360 HA LYS 75 HA LYS 75 87.423 4.991 5.934 361 1HB LYS 75 HB2 LYS 75 84.773 4.534 4.808 362 2HB LYS 75 HB1 LYS 75 86.025 4.494 3.568 363 1HG LYS 75 HG2 LYS 75 85.939 2.861 6.121 364 2HG LYS 75 HG1 LYS 75 85.790 2.256 4.471 365 1HD LYS 75 HD2 LYS 75 88.025 2.015 4.403 366 2HD LYS 75 HD1 LYS 75 88.185 3.765 4.556 367 1HE LYS 75 HE2 LYS 75 88.148 3.570 7.014 368 2HE LYS 75 HE1 LYS 75 87.947 1.812 6.876 369 1HZ LYS 75 HZ1 LYS 75 90.116 3.122 5.387 370 2HZ LYS 75 HZ2 LYS 75 90.042 1.546 6.016 371 3HZ LYS 75 HZ3 LYS 75 90.328 2.863 7.050 372 H ALA 76 HN ALA 76 85.715 7.779 4.851 373 HA ALA 76 HA ALA 76 86.557 9.661 3.681 374 1HB ALA 76 HB1 ALA 76 88.806 9.842 3.692 375 2HB ALA 76 HB2 ALA 76 89.010 8.371 2.733 376 3HB ALA 76 HB3 ALA 76 88.796 8.267 4.485 377 H ARG 77 HN ARG 77 88.215 9.558 1.358 378 HA ARG 77 HA ARG 77 86.480 9.355 -0.766 379 1HB ARG 77 HB2 ARG 77 88.637 8.779 -2.060 380 2HB ARG 77 HB1 ARG 77 88.649 10.251 -1.089 381 1HG ARG 77 HG2 ARG 77 89.411 7.933 0.497 382 2HG ARG 77 HG1 ARG 77 90.462 8.123 -0.907 383 1HD ARG 77 HD2 ARG 77 89.850 10.653 0.493 384 2HD ARG 77 HD1 ARG 77 90.803 9.496 1.440 385 HE ARG 77 HE ARG 77 91.901 9.460 -1.147 386 1HH1 ARG 77 HH21 ARG 77 91.308 12.339 -1.295 387 2HH1 ARG 77 HH22 ARG 77 92.683 13.063 -0.528 388 1HH2 ARG 77 HH11 ARG 77 93.706 10.124 1.004 389 2HH2 ARG 77 HH12 ARG 77 94.042 11.808 0.773 390 H GLN 78 HN GLN 78 86.088 7.573 -2.398 391 HA GLN 78 HA GLN 78 85.508 5.033 -1.296 392 1HB GLN 78 HB2 GLN 78 86.167 6.042 -4.067 393 2HB GLN 78 HB1 GLN 78 85.794 4.338 -3.791 394 1HG GLN 78 HG2 GLN 78 84.001 6.700 -3.132 395 2HG GLN 78 HG1 GLN 78 83.735 5.511 -4.409 396 1HE2 GLN 78 HE21 GLN 78 81.762 5.826 -2.421 397 2HE2 GLN 78 HE22 GLN 78 81.749 4.458 -1.416 398 H GLY 79 HN GLY 79 88.439 6.560 -2.322 399 1HA GLY 79 HA2 GLY 79 90.192 4.431 -2.774 400 2HA GLY 79 HA1 GLY 79 90.648 5.940 -1.960 401 H GLY 80 HN GLY 80 88.574 5.535 0.081 402 1HA GLY 80 HA1 GLY 80 90.117 4.200 2.084 403 2HA GLY 80 HA2 GLY 80 88.435 4.721 2.249 404 H ASP 81 HN ASP 81 88.136 3.011 -0.402 405 HA ASP 81 HA ASP 81 86.656 0.879 0.346 406 1HB ASP 81 HB2 ASP 81 87.352 1.430 -1.956 407 2HB ASP 81 HB1 ASP 81 88.974 0.812 -1.616 408 H LEU 82 HN LEU 82 87.062 -0.235 2.276 409 HA LEU 82 HA LEU 82 89.395 -0.988 3.516 410 1HB LEU 82 HB2 LEU 82 86.667 -2.090 3.203 411 2HB LEU 82 HB1 LEU 82 87.863 -3.238 3.806 412 HG LEU 82 HG LEU 82 88.536 -1.190 5.359 413 1HD1 LEU 82 HD11 LEU 82 86.434 -0.045 4.017 414 2HD1 LEU 82 HD12 LEU 82 87.009 0.472 5.601 415 3HD1 LEU 82 HD13 LEU 82 85.645 -0.637 5.478 416 1HD2 LEU 82 HD21 LEU 82 87.604 -2.434 7.030 417 2HD2 LEU 82 HD22 LEU 82 87.220 -3.557 5.725 418 3HD2 LEU 82 HD23 LEU 82 86.005 -2.408 6.284 419 H GLY 83 HN GLY 83 87.953 -2.578 0.673 420 1HA GLY 83 HA2 GLY 83 89.418 -3.565 -1.026 421 2HA GLY 83 HA1 GLY 83 90.570 -3.950 0.258 422 H TRP 84 HN TRP 84 90.255 -6.096 -1.026 423 HA TRP 84 HA TRP 84 87.964 -7.713 -0.911 424 1HB TRP 84 HB2 TRP 84 90.941 -8.191 -0.802 425 2HB TRP 84 HB1 TRP 84 89.819 -9.543 -0.810 426 HD1 TRP 84 HD1 TRP 84 91.131 -6.753 -2.933 427 HE1 TRP 84 HE1 TRP 84 90.324 -7.052 -5.369 428 HE3 TRP 84 HE3 TRP 84 87.902 -10.619 -2.278 429 HZ2 TRP 84 HZ2 TRP 84 88.522 -8.735 -6.835 430 HZ3 TRP 84 HZ3 TRP 84 86.653 -11.559 -4.194 431 HH2 TRP 84 HH2 TRP 84 86.947 -10.618 -6.468 432 H MET 85 HN MET 85 86.913 -8.798 0.746 433 HA MET 85 HA MET 85 88.336 -9.236 3.323 434 1HB MET 85 HB2 MET 85 85.916 -7.477 2.867 435 2HB MET 85 HB1 MET 85 86.331 -8.110 4.460 436 1HG MET 85 HG2 MET 85 88.142 -6.421 2.707 437 2HG MET 85 HG1 MET 85 87.279 -5.854 4.136 438 1HE MET 85 HE1 MET 85 89.743 -5.153 3.848 439 2HE MET 85 HE2 MET 85 91.071 -6.308 3.765 440 3HE MET 85 HE3 MET 85 90.657 -5.561 5.306 441 H THR 86 HN THR 86 87.346 -10.886 4.592 442 HA THR 86 HA THR 86 85.039 -12.300 3.291 443 HB THR 86 HB THR 86 86.451 -14.268 4.547 444 HG1 THR 86 HG1 THR 86 88.506 -13.783 4.651 445 1HG2 THR 86 HG21 THR 86 86.450 -13.136 1.786 446 2HG2 THR 86 HG22 THR 86 85.925 -14.722 2.350 447 3HG2 THR 86 HG23 THR 86 87.644 -14.379 2.162 448 H ARG 87 HN ARG 87 83.516 -13.208 4.751 449 HA ARG 87 HA ARG 87 82.830 -11.948 7.105 450 1HB ARG 87 HB2 ARG 87 82.270 -14.420 5.735 451 2HB ARG 87 HB1 ARG 87 82.297 -14.715 7.474 452 1HG ARG 87 HG2 ARG 87 80.933 -12.238 6.981 453 2HG ARG 87 HG1 ARG 87 80.236 -13.483 5.945 454 1HD ARG 87 HD2 ARG 87 80.270 -14.952 8.122 455 2HD ARG 87 HD1 ARG 87 80.372 -13.386 8.952 456 HE ARG 87 HE ARG 87 78.165 -12.909 8.206 457 1HH1 ARG 87 HH21 ARG 87 78.363 -16.098 7.972 458 2HH1 ARG 87 HH22 ARG 87 77.430 -16.304 6.528 459 1HH2 ARG 87 HH11 ARG 87 77.464 -12.935 5.710 460 2HH2 ARG 87 HH12 ARG 87 76.920 -14.512 5.247 461 H GLY 88 HN GLY 88 83.792 -11.748 9.088 462 1HA GLY 88 HA2 GLY 88 84.760 -13.396 10.911 463 2HA GLY 88 HA1 GLY 88 86.070 -13.548 9.732 464 H SER 89 HN SER 89 85.323 -10.555 9.095 465 HA SER 89 HA SER 89 86.295 -9.156 11.492 466 1HB SER 89 HB2 SER 89 88.039 -10.161 9.363 467 2HB SER 89 HB1 SER 89 88.213 -8.417 9.610 468 HG SER 89 HG SER 89 88.387 -10.442 11.589 469 H MET 90 HN MET 90 83.955 -8.535 10.399 470 HA MET 90 HA MET 90 84.429 -5.907 9.131 471 1HB MET 90 HB2 MET 90 84.105 -8.113 7.538 472 2HB MET 90 HB1 MET 90 82.436 -7.567 7.708 473 1HG MET 90 HG2 MET 90 82.909 -5.450 6.771 474 2HG MET 90 HG1 MET 90 84.645 -5.628 7.027 475 1HE MET 90 HE1 MET 90 81.530 -7.076 5.296 476 2HE MET 90 HE2 MET 90 82.044 -7.073 3.611 477 3HE MET 90 HE3 MET 90 81.980 -5.558 4.507 478 H VAL 91 HN VAL 91 83.436 -6.200 11.647 479 HA VAL 91 HA VAL 91 81.589 -5.616 13.000 480 HB VAL 91 HB VAL 91 80.427 -4.790 10.324 481 1HG1 VAL 91 HG11 VAL 91 79.870 -4.156 13.200 482 2HG1 VAL 91 HG12 VAL 91 78.735 -4.439 11.880 483 3HG1 VAL 91 HG13 VAL 91 79.600 -2.905 11.987 484 1HG2 VAL 91 HG21 VAL 91 82.040 -3.232 10.151 485 2HG2 VAL 91 HG22 VAL 91 82.849 -3.952 11.545 486 3HG2 VAL 91 HG23 VAL 91 81.681 -2.649 11.777 487 H GLY 92 HN GLY 92 79.059 -6.019 13.099 488 1HA GLY 92 HA2 GLY 92 78.654 -8.846 12.320 489 2HA GLY 92 HA1 GLY 92 77.664 -7.938 13.470 490 HA PRO 93 HA PRO 93 74.576 -7.050 10.513 491 1HB PRO 93 HB2 PRO 93 74.689 -4.178 10.689 492 2HB PRO 93 HB1 PRO 93 73.542 -5.278 11.470 493 1HG PRO 93 HG2 PRO 93 75.696 -3.799 12.683 494 2HG PRO 93 HG1 PRO 93 74.529 -4.865 13.468 495 1HD PRO 93 HD2 PRO 93 77.326 -5.356 13.017 496 2HD PRO 93 HD1 PRO 93 76.138 -6.458 13.751 497 H PHE 94 HN PHE 94 77.404 -4.888 10.222 498 HA PHE 94 HA PHE 94 77.128 -3.902 7.636 499 1HB PHE 94 HB2 PHE 94 78.999 -3.703 9.435 500 2HB PHE 94 HB1 PHE 94 79.710 -5.110 8.630 501 HD1 PHE 94 HD1 PHE 94 80.904 -4.878 6.603 502 HD2 PHE 94 HD2 PHE 94 78.482 -1.629 8.036 503 HE1 PHE 94 HE1 PHE 94 81.842 -3.404 4.845 504 HE2 PHE 94 HE2 PHE 94 79.422 -0.156 6.276 505 HZ PHE 94 HZ PHE 94 81.101 -1.043 4.681 506 H GLN 95 HN GLN 95 78.143 -7.176 8.599 507 HA GLN 95 HA GLN 95 78.619 -8.010 5.822 508 1HB GLN 95 HB2 GLN 95 78.493 -9.474 8.479 509 2HB GLN 95 HB1 GLN 95 79.060 -10.181 6.968 510 1HG GLN 95 HG2 GLN 95 80.921 -8.684 6.855 511 2HG GLN 95 HG1 GLN 95 80.262 -7.663 8.133 512 1HE2 GLN 95 HE21 GLN 95 80.076 -11.174 8.416 513 2HE2 GLN 95 HE22 GLN 95 81.238 -11.321 9.643 514 H GLU 96 HN GLU 96 76.171 -8.597 8.354 515 HA GLU 96 HA GLU 96 74.551 -10.541 7.271 516 1HB GLU 96 HB2 GLU 96 74.094 -7.987 8.759 517 2HB GLU 96 HB1 GLU 96 72.677 -8.851 8.163 518 1HG GLU 96 HG2 GLU 96 74.571 -10.685 9.378 519 2HG GLU 96 HG1 GLU 96 74.119 -9.409 10.508 520 H ALA 97 HN ALA 97 74.843 -7.193 6.133 521 HA ALA 97 HA ALA 97 72.723 -7.582 4.109 522 1HB ALA 97 HB1 ALA 97 72.646 -5.425 4.927 523 2HB ALA 97 HB2 ALA 97 73.776 -5.158 3.600 524 3HB ALA 97 HB3 ALA 97 74.380 -5.376 5.243 525 H ALA 98 HN ALA 98 75.789 -5.933 3.570 526 HA ALA 98 HA ALA 98 76.251 -6.501 0.932 527 1HB ALA 98 HB1 ALA 98 78.059 -5.340 1.629 528 2HB ALA 98 HB2 ALA 98 78.747 -6.862 2.191 529 3HB ALA 98 HB3 ALA 98 77.804 -5.860 3.295 530 H PHE 99 HN PHE 99 78.073 -8.470 3.280 531 HA PHE 99 HA PHE 99 78.808 -10.597 1.714 532 1HB PHE 99 HB2 PHE 99 78.112 -10.158 4.548 533 2HB PHE 99 HB1 PHE 99 78.094 -11.854 4.044 534 HD1 PHE 99 HD1 PHE 99 80.151 -9.027 4.920 535 HD2 PHE 99 HD2 PHE 99 80.143 -12.768 2.810 536 HE1 PHE 99 HE1 PHE 99 82.630 -9.071 4.989 537 HE2 PHE 99 HE2 PHE 99 82.622 -12.813 2.880 538 HZ PHE 99 HZ PHE 99 83.865 -10.964 3.970 539 H ALA 100 HN ALA 100 75.803 -10.700 3.644 540 HA ALA 100 HA ALA 100 74.730 -13.023 2.372 541 1HB ALA 100 HB1 ALA 100 72.840 -10.999 3.399 542 2HB ALA 100 HB2 ALA 100 74.148 -11.404 4.510 543 3HB ALA 100 HB3 ALA 100 73.079 -12.671 3.907 544 H LEU 101 HN LEU 101 75.051 -9.812 1.203 545 HA LEU 101 HA LEU 101 72.859 -10.226 -0.790 546 1HB LEU 101 HB2 LEU 101 74.270 -7.845 0.413 547 2HB LEU 101 HB1 LEU 101 73.331 -7.687 -1.076 548 HG LEU 101 HG LEU 101 72.213 -8.923 1.453 549 1HD1 LEU 101 HD11 LEU 101 70.983 -6.460 1.095 550 2HD1 LEU 101 HD12 LEU 101 72.679 -6.117 0.753 551 3HD1 LEU 101 HD13 LEU 101 72.217 -6.824 2.301 552 1HD2 LEU 101 HD21 LEU 101 71.322 -8.972 -1.164 553 2HD2 LEU 101 HD22 LEU 101 70.443 -7.602 -0.484 554 3HD2 LEU 101 HD23 LEU 101 70.304 -9.196 0.259 555 HA PRO 102 HA PRO 102 75.791 -10.831 -4.027 556 1HB PRO 102 HB2 PRO 102 74.283 -9.239 -5.892 557 2HB PRO 102 HB1 PRO 102 74.322 -11.002 -5.745 558 1HG PRO 102 HG2 PRO 102 72.186 -9.214 -5.034 559 2HG PRO 102 HG1 PRO 102 72.225 -10.978 -4.892 560 1HD PRO 102 HD2 PRO 102 72.346 -9.026 -2.769 561 2HD PRO 102 HD1 PRO 102 72.386 -10.801 -2.626 562 H VAL 103 HN VAL 103 76.935 -9.373 -5.806 563 HA VAL 103 HA VAL 103 78.344 -7.259 -4.527 564 HB VAL 103 HB VAL 103 77.938 -8.294 -7.318 565 1HG1 VAL 103 HG11 VAL 103 78.379 -6.244 -8.183 566 2HG1 VAL 103 HG12 VAL 103 80.021 -6.519 -7.602 567 3HG1 VAL 103 HG13 VAL 103 78.882 -5.595 -6.623 568 1HG2 VAL 103 HG21 VAL 103 80.456 -8.565 -7.040 569 2HG2 VAL 103 HG22 VAL 103 79.463 -9.520 -5.938 570 3HG2 VAL 103 HG23 VAL 103 80.238 -8.039 -5.371 571 H SER 104 HN SER 104 78.180 -4.915 -4.898 572 HA SER 104 HA SER 104 76.021 -3.752 -6.440 573 1HB SER 104 HB2 SER 104 74.430 -3.365 -4.719 574 2HB SER 104 HB1 SER 104 74.938 -5.044 -4.494 575 HG SER 104 HG SER 104 76.383 -4.324 -2.901 576 H GLY 105 HN GLY 105 75.736 -1.843 -3.885 577 1HA GLY 105 HA2 GLY 105 76.849 0.048 -3.029 578 2HA GLY 105 HA1 GLY 105 78.333 -0.551 -3.760 579 H MET 106 HN MET 106 77.542 2.188 -3.871 580 HA MET 106 HA MET 106 77.467 3.908 -5.483 581 1HB MET 106 HB2 MET 106 79.230 2.255 -6.275 582 2HB MET 106 HB1 MET 106 78.023 1.586 -7.356 583 1HG MET 106 HG2 MET 106 77.961 4.383 -7.773 584 2HG MET 106 HG1 MET 106 79.665 3.944 -7.665 585 1HE MET 106 HE1 MET 106 77.089 1.098 -10.038 586 2HE MET 106 HE2 MET 106 76.254 2.637 -9.886 587 3HE MET 106 HE3 MET 106 76.774 1.786 -8.443 588 H ASP 107 HN ASP 107 76.414 3.826 -8.173 589 HA ASP 107 HA ASP 107 73.597 3.978 -7.707 590 1HB ASP 107 HB2 ASP 107 75.240 5.086 -9.434 591 2HB ASP 107 HB1 ASP 107 74.841 3.683 -10.423 592 H LYS 108 HN LYS 108 75.207 1.140 -7.722 593 HA LYS 108 HA LYS 108 72.948 -0.281 -9.067 594 1HB LYS 108 HB2 LYS 108 75.718 -0.186 -9.760 595 2HB LYS 108 HB1 LYS 108 75.381 -1.808 -9.139 596 1HG LYS 108 HG2 LYS 108 74.363 -2.333 -11.077 597 2HG LYS 108 HG1 LYS 108 73.201 -1.030 -10.820 598 1HD LYS 108 HD2 LYS 108 74.337 -0.660 -12.942 599 2HD LYS 108 HD1 LYS 108 74.862 0.571 -11.795 600 1HE LYS 108 HE2 LYS 108 76.763 -1.230 -11.269 601 2HE LYS 108 HE1 LYS 108 76.396 -1.739 -12.928 602 1HZ LYS 108 HZ1 LYS 108 77.362 0.864 -11.948 603 2HZ LYS 108 HZ2 LYS 108 76.394 0.821 -13.343 604 3HZ LYS 108 HZ3 LYS 108 77.868 -0.024 -13.302 605 HA PRO 109 HA PRO 109 74.080 -1.543 -4.593 606 1HB PRO 109 HB2 PRO 109 71.454 -0.725 -3.761 607 2HB PRO 109 HB1 PRO 109 73.017 -0.048 -3.272 608 1HG PRO 109 HG2 PRO 109 71.047 1.166 -4.945 609 2HG PRO 109 HG1 PRO 109 72.652 1.789 -4.546 610 1HD PRO 109 HD2 PRO 109 71.740 0.692 -7.070 611 2HD PRO 109 HD1 PRO 109 73.284 1.462 -6.651 612 H VAL 110 HN VAL 110 72.454 -2.958 -3.182 613 HA VAL 110 HA VAL 110 71.238 -4.951 -5.036 614 HB VAL 110 HB VAL 110 72.923 -5.790 -3.518 615 1HG1 VAL 110 HG11 VAL 110 73.241 -4.335 -1.773 616 2HG1 VAL 110 HG12 VAL 110 72.189 -5.482 -0.944 617 3HG1 VAL 110 HG13 VAL 110 71.520 -3.991 -1.608 618 1HG2 VAL 110 HG21 VAL 110 70.873 -7.190 -3.757 619 2HG2 VAL 110 HG22 VAL 110 70.209 -6.416 -2.317 620 3HG2 VAL 110 HG23 VAL 110 71.660 -7.407 -2.195 621 H PHE 111 HN PHE 111 69.223 -6.052 -4.002 622 HA PHE 111 HA PHE 111 66.919 -4.715 -4.009 623 1HB PHE 111 HB2 PHE 111 67.720 -6.575 -1.751 624 2HB PHE 111 HB1 PHE 111 66.078 -6.308 -2.350 625 HD1 PHE 111 HD1 PHE 111 65.536 -6.923 -4.757 626 HD2 PHE 111 HD2 PHE 111 69.188 -8.104 -2.825 627 HE1 PHE 111 HE1 PHE 111 65.895 -8.660 -6.492 628 HE2 PHE 111 HE2 PHE 111 69.548 -9.839 -4.561 629 HZ PHE 111 HZ PHE 111 67.899 -10.116 -6.394 630 H THR 112 HN THR 112 68.991 -4.704 -1.109 631 HA THR 112 HA THR 112 67.305 -2.831 0.350 632 HB THR 112 HB THR 112 68.825 -4.536 1.358 633 HG1 THR 112 HG1 THR 112 69.267 -3.250 3.005 634 1HG2 THR 112 HG21 THR 112 70.784 -4.666 0.164 635 2HG2 THR 112 HG22 THR 112 71.314 -3.534 1.408 636 3HG2 THR 112 HG23 THR 112 70.814 -2.935 -0.174 637 H ASP 113 HN ASP 113 69.326 -1.057 1.331 638 HA ASP 113 HA ASP 113 69.899 0.597 -1.112 639 1HB ASP 113 HB2 ASP 113 69.081 1.421 1.695 640 2HB ASP 113 HB1 ASP 113 69.429 2.536 0.374 641 HA PRO 114 HA PRO 114 74.118 0.627 0.051 642 1HB PRO 114 HB2 PRO 114 74.471 3.425 -0.502 643 2HB PRO 114 HB1 PRO 114 74.931 2.041 -1.507 644 1HG PRO 114 HG2 PRO 114 72.782 3.893 -1.943 645 2HG PRO 114 HG1 PRO 114 73.224 2.498 -2.928 646 1HD PRO 114 HD2 PRO 114 70.922 2.798 -1.204 647 2HD PRO 114 HD1 PRO 114 71.357 1.398 -2.211 648 HA PRO 115 HA PRO 115 74.197 4.158 3.380 649 1HB PRO 115 HB2 PRO 115 71.498 5.126 3.656 650 2HB PRO 115 HB1 PRO 115 72.930 6.020 3.130 651 1HG PRO 115 HG2 PRO 115 70.697 5.198 1.537 652 2HG PRO 115 HG1 PRO 115 72.160 6.037 0.999 653 1HD PRO 115 HD2 PRO 115 71.399 3.272 0.537 654 2HD PRO 115 HD1 PRO 115 72.817 4.140 -0.079 655 H VAL 116 HN VAL 116 74.149 1.754 4.175 656 HA VAL 116 HA VAL 116 71.670 0.958 5.568 657 HB VAL 116 HB VAL 116 72.819 -1.116 5.827 658 1HG1 VAL 116 HG11 VAL 116 72.727 0.211 3.317 659 2HG1 VAL 116 HG12 VAL 116 72.687 -1.526 3.621 660 3HG1 VAL 116 HG13 VAL 116 74.230 -0.710 3.365 661 1HG2 VAL 116 HG21 VAL 116 74.896 -0.280 6.782 662 2HG2 VAL 116 HG22 VAL 116 75.349 0.437 5.235 663 3HG2 VAL 116 HG23 VAL 116 75.268 -1.317 5.404 664 H LYS 117 HN LYS 117 71.558 0.722 7.865 665 HA LYS 117 HA LYS 117 73.427 2.480 9.366 666 1HB LYS 117 HB2 LYS 117 71.112 2.937 9.699 667 2HB LYS 117 HB1 LYS 117 70.723 1.219 9.863 668 1HG LYS 117 HG2 LYS 117 71.741 1.085 12.006 669 2HG LYS 117 HG1 LYS 117 72.584 2.626 11.789 670 1HD LYS 117 HD2 LYS 117 70.711 3.033 13.258 671 2HD LYS 117 HD1 LYS 117 70.311 3.741 11.687 672 1HE LYS 117 HE2 LYS 117 69.082 1.598 11.129 673 2HE LYS 117 HE1 LYS 117 69.331 1.093 12.811 674 1HZ LYS 117 HZ1 LYS 117 67.316 2.238 12.881 675 2HZ LYS 117 HZ2 LYS 117 67.829 3.424 11.776 676 3HZ LYS 117 HZ3 LYS 117 68.435 3.417 13.364 677 H THR 118 HN THR 118 74.590 1.700 11.194 678 HA THR 118 HA THR 118 74.544 -1.260 11.649 679 HB THR 118 HB THR 118 76.925 -1.335 11.441 680 HG1 THR 118 HG1 THR 118 77.100 1.422 11.006 681 1HG2 THR 118 HG21 THR 118 76.100 0.646 9.314 682 2HG2 THR 118 HG22 THR 118 75.563 -1.034 9.300 683 3HG2 THR 118 HG23 THR 118 77.283 -0.656 9.183 684 H LYS 119 HN LYS 119 75.728 1.900 12.830 685 HA LYS 119 HA LYS 119 74.720 1.496 15.499 686 1HB LYS 119 HB2 LYS 119 76.994 1.166 16.555 687 2HB LYS 119 HB1 LYS 119 76.453 -0.202 15.582 688 1HG LYS 119 HG2 LYS 119 77.732 1.349 13.706 689 2HG LYS 119 HG1 LYS 119 78.715 1.636 15.146 690 1HD LYS 119 HD2 LYS 119 77.945 -1.183 14.749 691 2HD LYS 119 HD1 LYS 119 78.985 -0.533 13.482 692 1HE LYS 119 HE2 LYS 119 80.717 -0.004 15.021 693 2HE LYS 119 HE1 LYS 119 79.628 -0.133 16.415 694 1HZ LYS 119 HZ1 LYS 119 81.055 -2.140 16.009 695 2HZ LYS 119 HZ2 LYS 119 80.201 -2.385 14.560 696 3HZ LYS 119 HZ3 LYS 119 79.389 -2.457 16.052 697 H PHE 120 HN PHE 120 77.082 3.072 13.386 698 HA PHE 120 HA PHE 120 77.189 5.466 15.125 699 1HB PHE 120 HB2 PHE 120 78.500 4.723 12.486 700 2HB PHE 120 HB1 PHE 120 78.911 6.133 13.472 701 HD1 PHE 120 HD1 PHE 120 78.951 5.210 16.184 702 HD2 PHE 120 HD2 PHE 120 80.208 3.139 12.635 703 HE1 PHE 120 HE1 PHE 120 80.482 3.811 17.542 704 HE2 PHE 120 HE2 PHE 120 81.739 1.740 13.995 705 HZ PHE 120 HZ PHE 120 81.877 2.076 16.448 706 H GLY 121 HN GLY 121 76.105 4.508 11.864 707 1HA GLY 121 HA2 GLY 121 73.882 6.264 11.796 708 2HA GLY 121 HA1 GLY 121 75.237 7.097 11.021 709 H TYR 122 HN TYR 122 74.200 6.981 8.945 710 HA TYR 122 HA TYR 122 73.679 4.278 7.819 711 1HB TYR 122 HB2 TYR 122 73.108 7.142 7.067 712 2HB TYR 122 HB1 TYR 122 72.917 5.853 5.879 713 HD1 TYR 122 HD1 TYR 122 71.122 7.764 8.098 714 HD2 TYR 122 HD2 TYR 122 71.750 3.635 7.089 715 HE1 TYR 122 HE1 TYR 122 68.915 7.189 9.075 716 HE2 TYR 122 HE2 TYR 122 69.543 3.061 8.066 717 HH TYR 122 HH TYR 122 67.180 5.173 8.634 718 H HIS 123 HN HIS 123 75.184 3.304 6.490 719 HA HIS 123 HA HIS 123 77.330 5.048 5.306 720 1HB HIS 123 HB2 HIS 123 77.740 2.151 6.016 721 2HB HIS 123 HB1 HIS 123 78.931 3.445 5.928 722 HD1 HIS 123 HD1 HIS 123 79.663 4.317 8.141 723 HD2 HIS 123 HD2 HIS 123 75.846 2.661 8.347 724 HE1 HIS 123 HE1 HIS 123 78.955 4.448 10.569 725 H ILE 124 HN ILE 124 77.916 4.521 3.122 726 HA ILE 124 HA ILE 124 75.942 2.840 1.693 727 HB ILE 124 HB ILE 124 78.281 4.461 0.638 728 1HG1 ILE 124 HG12 ILE 124 75.367 5.209 1.054 729 2HG1 ILE 124 HG11 ILE 124 76.763 5.942 1.854 730 1HG2 ILE 124 HG21 ILE 124 76.435 2.653 -0.578 731 2HG2 ILE 124 HG22 ILE 124 77.681 3.631 -1.356 732 3HG2 ILE 124 HG23 ILE 124 76.057 4.283 -1.137 733 1HD1 ILE 124 HD11 ILE 124 76.870 7.419 0.149 734 2HD1 ILE 124 HD12 ILE 124 75.620 6.551 -0.741 735 3HD1 ILE 124 HD13 ILE 124 77.311 6.082 -0.912 736 H ILE 125 HN ILE 125 76.429 0.678 1.800 737 HA ILE 125 HA ILE 125 79.240 -0.208 1.861 738 HB ILE 125 HB ILE 125 76.498 -1.431 2.166 739 1HG1 ILE 125 HG12 ILE 125 78.970 -1.274 3.920 740 2HG1 ILE 125 HG11 ILE 125 77.479 -0.343 4.124 741 1HG2 ILE 125 HG21 ILE 125 77.582 -3.132 0.936 742 2HG2 ILE 125 HG22 ILE 125 77.817 -3.595 2.622 743 3HG2 ILE 125 HG23 ILE 125 79.130 -2.834 1.725 744 1HD1 ILE 125 HD11 ILE 125 77.315 -2.169 5.657 745 2HD1 ILE 125 HD12 ILE 125 77.870 -3.327 4.448 746 3HD1 ILE 125 HD13 ILE 125 76.273 -2.595 4.299 747 H MET 126 HN MET 126 80.274 -1.056 0.083 748 HA MET 126 HA MET 126 78.626 -1.513 -2.366 749 1HB MET 126 HB2 MET 126 81.464 -0.596 -2.567 750 2HB MET 126 HB1 MET 126 80.091 -0.190 -3.600 751 1HG MET 126 HG2 MET 126 79.184 1.277 -1.874 752 2HG MET 126 HG1 MET 126 80.504 0.841 -0.778 753 1HE MET 126 HE1 MET 126 79.409 3.695 -2.084 754 2HE MET 126 HE2 MET 126 79.253 2.919 -3.658 755 3HE MET 126 HE3 MET 126 80.357 4.281 -3.461 756 H VAL 127 HN VAL 127 78.632 -3.770 -2.235 757 HA VAL 127 HA VAL 127 81.206 -5.198 -1.881 758 HB VAL 127 HB VAL 127 78.338 -6.089 -2.357 759 1HG1 VAL 127 HG11 VAL 127 80.121 -8.051 -1.178 760 2HG1 VAL 127 HG12 VAL 127 80.727 -7.523 -2.750 761 3HG1 VAL 127 HG13 VAL 127 79.101 -8.197 -2.609 762 1HG2 VAL 127 HG21 VAL 127 79.484 -4.998 -0.090 763 2HG2 VAL 127 HG22 VAL 127 79.670 -6.731 0.181 764 3HG2 VAL 127 HG23 VAL 127 78.068 -6.049 -0.105 765 H GLU 128 HN GLU 128 82.446 -5.151 -3.740 766 HA GLU 128 HA GLU 128 81.220 -6.110 -6.238 767 1HB GLU 128 HB2 GLU 128 80.948 -3.640 -6.172 768 2HB GLU 128 HB1 GLU 128 82.694 -3.470 -5.938 769 1HG GLU 128 HG2 GLU 128 83.123 -4.524 -8.100 770 2HG GLU 128 HG1 GLU 128 81.394 -4.826 -8.325 771 H GLY 129 HN GLY 129 82.611 -7.867 -6.191 772 1HA GLY 129 HA2 GLY 129 84.838 -8.321 -7.403 773 2HA GLY 129 HA1 GLY 129 85.535 -7.320 -6.125 774 H ARG 130 HN ARG 130 83.810 -10.330 -6.754 775 HA ARG 130 HA ARG 130 84.875 -11.317 -4.138 776 1HB ARG 130 HB2 ARG 130 82.837 -12.675 -4.009 777 2HB ARG 130 HB1 ARG 130 82.412 -10.985 -4.259 778 1HG ARG 130 HG2 ARG 130 82.176 -11.407 -6.687 779 2HG ARG 130 HG1 ARG 130 82.578 -13.104 -6.422 780 1HD ARG 130 HD2 ARG 130 80.461 -12.310 -4.611 781 2HD ARG 130 HD1 ARG 130 80.006 -11.943 -6.287 782 HE ARG 130 HE ARG 130 81.246 -14.590 -5.797 783 1HH1 ARG 130 HH11 ARG 130 78.613 -14.701 -4.490 784 2HH1 ARG 130 HH12 ARG 130 77.548 -15.135 -5.785 785 1HH2 ARG 130 HH21 ARG 130 79.799 -14.280 -8.279 786 2HH2 ARG 130 HH22 ARG 130 78.220 -14.897 -7.928 787 H LYS 131 HN LYS 131 84.168 -14.028 -4.593 788 HA LYS 131 HA LYS 131 85.594 -14.797 -7.098 789 1HB LYS 131 HB2 LYS 131 86.399 -15.253 -4.238 790 2HB LYS 131 HB1 LYS 131 86.837 -16.450 -5.457 791 1HG LYS 131 HG2 LYS 131 88.322 -15.046 -6.495 792 2HG LYS 131 HG1 LYS 131 87.349 -13.611 -6.169 793 1HD LYS 131 HD2 LYS 131 89.338 -13.424 -4.827 794 2HD LYS 131 HD1 LYS 131 88.020 -13.843 -3.731 795 1HE LYS 131 HE2 LYS 131 89.771 -15.331 -3.109 796 2HE LYS 131 HE1 LYS 131 88.750 -16.318 -4.181 797 1HZ LYS 131 HZ1 LYS 131 91.043 -14.667 -5.113 798 2HZ LYS 131 HZ2 LYS 131 90.143 -15.779 -6.029 799 3HZ LYS 131 HZ3 LYS 131 91.159 -16.327 -4.782 Start of MODEL 10 1 1H GLY 28 HT1 GLY 28 74.679 -32.179 8.805 2 2H GLY 28 HT2 GLY 28 76.146 -31.808 9.579 3 3H GLY 28 HT3 GLY 28 76.015 -31.677 7.890 4 1HA GLY 28 HA2 GLY 28 74.217 -29.961 8.310 5 2HA GLY 28 HA1 GLY 28 74.820 -29.946 9.968 6 H SER 29 HN SER 29 76.127 -29.831 6.630 7 HA SER 29 HA SER 29 77.750 -27.467 7.405 8 1HB SER 29 HB2 SER 29 78.699 -30.236 6.923 9 2HB SER 29 HB1 SER 29 79.629 -28.968 6.124 10 HG SER 29 HG SER 29 79.128 -29.349 8.869 11 H GLY 30 HN GLY 30 79.362 -27.423 5.101 12 1HA GLY 30 HA2 GLY 30 79.069 -27.647 2.632 13 2HA GLY 30 HA1 GLY 30 77.346 -27.371 2.889 14 HA PRO 31 HA PRO 31 79.439 -23.355 1.725 15 1HB PRO 31 HB2 PRO 31 77.035 -22.803 0.238 16 2HB PRO 31 HB1 PRO 31 78.667 -23.102 -0.389 17 1HG PRO 31 HG2 PRO 31 76.374 -24.842 -0.504 18 2HG PRO 31 HG1 PRO 31 77.991 -25.128 -1.152 19 1HD PRO 31 HD2 PRO 31 76.760 -26.385 1.129 20 2HD PRO 31 HD1 PRO 31 78.405 -26.643 0.500 21 H LYS 32 HN LYS 32 79.131 -22.494 3.837 22 HA LYS 32 HA LYS 32 76.358 -21.725 4.630 23 1HB LYS 32 HB2 LYS 32 77.848 -23.080 6.126 24 2HB LYS 32 HB1 LYS 32 78.967 -21.719 6.177 25 1HG LYS 32 HG2 LYS 32 76.682 -20.438 6.833 26 2HG LYS 32 HG1 LYS 32 76.311 -22.039 7.474 27 1HD LYS 32 HD2 LYS 32 78.985 -21.515 8.210 28 2HD LYS 32 HD1 LYS 32 78.097 -20.027 8.538 29 1HE LYS 32 HE2 LYS 32 76.335 -21.878 9.505 30 2HE LYS 32 HE1 LYS 32 77.882 -22.672 9.854 31 1HZ LYS 32 HZ1 LYS 32 76.877 -20.061 10.767 32 2HZ LYS 32 HZ2 LYS 32 78.551 -20.261 10.556 33 3HZ LYS 32 HZ3 LYS 32 77.704 -21.255 11.642 34 H GLY 33 HN GLY 33 79.073 -20.394 3.134 35 1HA GLY 33 HA2 GLY 33 78.293 -17.649 4.038 36 2HA GLY 33 HA1 GLY 33 79.961 -18.081 3.661 37 H GLY 34 HN GLY 34 79.591 -19.570 1.327 38 1HA GLY 34 HA2 GLY 34 78.567 -19.369 -0.895 39 2HA GLY 34 HA1 GLY 34 78.186 -17.689 -0.516 40 H GLY 35 HN GLY 35 80.039 -16.182 -0.340 41 1HA GLY 35 HA2 GLY 35 82.158 -16.926 -2.284 42 2HA GLY 35 HA1 GLY 35 81.768 -15.279 -1.765 43 H ASN 36 HN ASN 36 83.852 -14.723 -1.057 44 HA ASN 36 HA ASN 36 84.720 -16.064 1.461 45 1HB ASN 36 HB2 ASN 36 85.916 -17.054 -0.479 46 2HB ASN 36 HB1 ASN 36 86.472 -15.444 -0.937 47 1HD2 ASN 36 HD21 ASN 36 86.323 -17.234 2.204 48 2HD2 ASN 36 HD22 ASN 36 87.943 -16.933 2.614 49 H ALA 37 HN ALA 37 85.403 -13.388 -0.797 50 HA ALA 37 HA ALA 37 85.398 -11.491 1.484 51 1HB ALA 37 HB1 ALA 37 87.640 -10.641 0.746 52 2HB ALA 37 HB2 ALA 37 87.730 -11.981 -0.398 53 3HB ALA 37 HB3 ALA 37 87.700 -12.301 1.336 54 H VAL 38 HN VAL 38 84.084 -9.867 0.772 55 HA VAL 38 HA VAL 38 83.853 -9.331 -2.147 56 HB VAL 38 HB VAL 38 81.739 -8.404 -1.563 57 1HG1 VAL 38 HG11 VAL 38 80.713 -10.280 -0.742 58 2HG1 VAL 38 HG12 VAL 38 81.814 -10.407 0.630 59 3HG1 VAL 38 HG13 VAL 38 82.320 -10.972 -0.962 60 1HG2 VAL 38 HG21 VAL 38 81.125 -7.867 0.766 61 2HG2 VAL 38 HG22 VAL 38 82.553 -6.960 0.270 62 3HG2 VAL 38 HG23 VAL 38 82.725 -8.376 1.307 63 H LYS 39 HN LYS 39 84.199 -7.119 -3.000 64 HA LYS 39 HA LYS 39 86.018 -5.547 -1.264 65 1HB LYS 39 HB2 LYS 39 86.419 -5.962 -3.677 66 2HB LYS 39 HB1 LYS 39 84.900 -5.143 -4.053 67 1HG LYS 39 HG2 LYS 39 86.927 -3.668 -4.310 68 2HG LYS 39 HG1 LYS 39 85.753 -3.049 -3.139 69 1HD LYS 39 HD2 LYS 39 87.239 -3.209 -1.446 70 2HD LYS 39 HD1 LYS 39 87.656 -4.870 -1.889 71 1HE LYS 39 HE2 LYS 39 89.545 -3.088 -2.049 72 2HE LYS 39 HE1 LYS 39 89.314 -4.145 -3.454 73 1HZ LYS 39 HZ1 LYS 39 89.294 -1.496 -3.635 74 2HZ LYS 39 HZ2 LYS 39 87.647 -1.756 -3.313 75 3HZ LYS 39 HZ3 LYS 39 88.376 -2.488 -4.661 76 H VAL 40 HN VAL 40 84.599 -4.714 0.350 77 HA VAL 40 HA VAL 40 82.195 -3.220 -0.507 78 HB VAL 40 HB VAL 40 82.563 -4.983 1.430 79 1HG1 VAL 40 HG11 VAL 40 83.153 -4.080 3.536 80 2HG1 VAL 40 HG12 VAL 40 83.016 -2.420 2.959 81 3HG1 VAL 40 HG13 VAL 40 84.365 -3.428 2.433 82 1HG2 VAL 40 HG21 VAL 40 80.940 -2.442 1.753 83 2HG2 VAL 40 HG22 VAL 40 80.663 -3.948 2.629 84 3HG2 VAL 40 HG23 VAL 40 80.436 -3.891 0.882 85 H ARG 41 HN ARG 41 82.204 -1.039 -0.694 86 HA ARG 41 HA ARG 41 84.462 0.522 0.507 87 1HB ARG 41 HB2 ARG 41 82.458 1.346 -1.618 88 2HB ARG 41 HB1 ARG 41 84.005 2.107 -1.258 89 1HG ARG 41 HG2 ARG 41 85.220 0.468 -2.343 90 2HG ARG 41 HG1 ARG 41 84.029 -0.787 -2.015 91 1HD ARG 41 HD2 ARG 41 82.705 1.120 -3.638 92 2HD ARG 41 HD1 ARG 41 84.297 0.847 -4.380 93 HE ARG 41 HE ARG 41 83.085 -1.639 -3.496 94 1HH1 ARG 41 HH21 ARG 41 84.150 0.171 -6.114 95 2HH1 ARG 41 HH22 ARG 41 83.161 -0.622 -7.294 96 1HH2 ARG 41 HH11 ARG 41 81.341 -2.417 -4.950 97 2HH2 ARG 41 HH12 ARG 41 81.570 -2.087 -6.634 98 H HIS 42 HN HIS 42 83.901 1.988 2.174 99 HA HIS 42 HA HIS 42 80.968 2.255 2.692 100 1HB HIS 42 HB2 HIS 42 81.601 2.311 5.040 101 2HB HIS 42 HB1 HIS 42 82.285 0.881 4.259 102 HD1 HIS 42 HD1 HIS 42 83.213 3.910 6.129 103 HD2 HIS 42 HD2 HIS 42 85.145 1.203 3.613 104 HE1 HIS 42 HE1 HIS 42 85.698 4.257 6.477 105 H ILE 43 HN ILE 43 80.198 4.224 2.360 106 HA ILE 43 HA ILE 43 81.888 6.657 2.838 107 HB ILE 43 HB ILE 43 79.635 5.873 1.019 108 1HG1 ILE 43 HG12 ILE 43 82.119 7.581 0.733 109 2HG1 ILE 43 HG11 ILE 43 81.908 5.924 0.158 110 1HG2 ILE 43 HG21 ILE 43 79.746 8.410 2.476 111 2HG2 ILE 43 HG22 ILE 43 78.437 7.727 1.513 112 3HG2 ILE 43 HG23 ILE 43 79.734 8.626 0.726 113 1HD1 ILE 43 HD11 ILE 43 79.854 6.923 -1.135 114 2HD1 ILE 43 HD12 ILE 43 81.478 7.166 -1.780 115 3HD1 ILE 43 HD13 ILE 43 80.680 8.463 -0.892 116 H LEU 44 HN LEU 44 81.292 7.799 4.805 117 HA LEU 44 HA LEU 44 78.673 6.887 5.988 118 1HB LEU 44 HB2 LEU 44 81.204 8.035 7.175 119 2HB LEU 44 HB1 LEU 44 79.724 7.768 8.103 120 HG LEU 44 HG LEU 44 81.727 5.963 7.804 121 1HD1 LEU 44 HD11 LEU 44 79.994 4.335 8.663 122 2HD1 LEU 44 HD12 LEU 44 78.771 5.559 8.319 123 3HD1 LEU 44 HD13 LEU 44 80.026 5.877 9.518 124 1HD2 LEU 44 HD21 LEU 44 81.286 5.468 5.484 125 2HD2 LEU 44 HD22 LEU 44 79.559 5.286 5.808 126 3HD2 LEU 44 HD23 LEU 44 80.708 4.106 6.444 127 H CYS 45 HN CYS 45 77.274 8.329 6.944 128 HA CYS 45 HA CYS 45 77.813 11.232 6.670 129 1HB CYS 45 HB2 CYS 45 75.428 9.772 5.493 130 2HB CYS 45 HB1 CYS 45 75.644 11.528 5.511 131 HG CYS 45 HG CYS 45 77.658 11.260 3.894 132 H GLU 46 HN GLU 46 77.958 10.606 9.065 133 HA GLU 46 HA GLU 46 76.097 9.643 10.799 134 1HB GLU 46 HB2 GLU 46 78.046 11.832 10.772 135 2HB GLU 46 HB1 GLU 46 76.769 12.071 11.966 136 1HG GLU 46 HG2 GLU 46 78.351 9.500 11.677 137 2HG GLU 46 HG1 GLU 46 78.746 10.771 12.834 138 H LYS 47 HN LYS 47 75.691 12.588 8.890 139 HA LYS 47 HA LYS 47 73.001 13.013 10.153 140 1HB LYS 47 HB2 LYS 47 73.315 15.285 8.930 141 2HB LYS 47 HB1 LYS 47 74.318 14.976 10.346 142 1HG LYS 47 HG2 LYS 47 76.204 14.386 8.979 143 2HG LYS 47 HG1 LYS 47 75.215 14.365 7.519 144 1HD LYS 47 HD2 LYS 47 75.979 16.497 7.257 145 2HD LYS 47 HD1 LYS 47 74.734 16.893 8.441 146 1HE LYS 47 HE2 LYS 47 76.814 17.864 9.232 147 2HE LYS 47 HE1 LYS 47 76.487 16.449 10.250 148 1HZ LYS 47 HZ1 LYS 47 78.168 15.294 9.326 149 2HZ LYS 47 HZ2 LYS 47 78.769 16.816 8.871 150 3HZ LYS 47 HZ3 LYS 47 77.872 15.888 7.766 151 H HIS 48 HN HIS 48 74.650 12.011 7.338 152 HA HIS 48 HA HIS 48 73.869 11.175 5.301 153 1HB HIS 48 HB2 HIS 48 71.649 11.126 7.165 154 2HB HIS 48 HB1 HIS 48 71.089 11.358 5.504 155 HD1 HIS 48 HD1 HIS 48 74.148 9.442 6.645 156 HD2 HIS 48 HD2 HIS 48 70.502 8.701 4.776 157 HE1 HIS 48 HE1 HIS 48 74.310 7.091 5.712 158 H GLY 49 HN GLY 49 73.979 14.192 6.103 159 1HA GLY 49 HA2 GLY 49 72.171 15.473 4.212 160 2HA GLY 49 HA1 GLY 49 73.539 16.251 5.029 161 H LYS 50 HN LYS 50 75.186 13.829 4.054 162 HA LYS 50 HA LYS 50 75.674 14.834 1.266 163 1HB LYS 50 HB2 LYS 50 77.544 13.602 3.317 164 2HB LYS 50 HB1 LYS 50 78.017 14.147 1.710 165 1HG LYS 50 HG2 LYS 50 78.550 16.038 2.922 166 2HG LYS 50 HG1 LYS 50 76.867 16.407 2.535 167 1HD LYS 50 HD2 LYS 50 76.741 16.704 4.814 168 2HD LYS 50 HD1 LYS 50 76.483 14.956 4.775 169 1HE LYS 50 HE2 LYS 50 79.322 15.504 4.716 170 2HE LYS 50 HE1 LYS 50 78.576 16.340 6.098 171 1HZ LYS 50 HZ1 LYS 50 78.360 13.467 5.366 172 2HZ LYS 50 HZ2 LYS 50 77.321 14.208 6.487 173 3HZ LYS 50 HZ3 LYS 50 78.989 14.123 6.797 174 H ILE 51 HN ILE 51 75.011 12.061 3.279 175 HA ILE 51 HA ILE 51 75.987 9.912 1.811 176 HB ILE 51 HB ILE 51 74.477 10.006 3.907 177 1HG1 ILE 51 HG12 ILE 51 73.382 7.739 3.156 178 2HG1 ILE 51 HG11 ILE 51 74.343 7.979 1.691 179 1HG2 ILE 51 HG21 ILE 51 72.643 11.045 2.133 180 2HG2 ILE 51 HG22 ILE 51 72.244 10.342 3.693 181 3HG2 ILE 51 HG23 ILE 51 72.146 9.359 2.237 182 1HD1 ILE 51 HD11 ILE 51 75.534 6.631 3.438 183 2HD1 ILE 51 HD12 ILE 51 75.480 8.035 4.504 184 3HD1 ILE 51 HD13 ILE 51 76.391 8.108 2.997 185 H MET 52 HN MET 52 73.462 12.165 0.900 186 HA MET 52 HA MET 52 72.744 10.598 -1.487 187 1HB MET 52 HB2 MET 52 71.576 12.607 0.157 188 2HB MET 52 HB1 MET 52 71.758 13.303 -1.455 189 1HG MET 52 HG2 MET 52 70.746 10.518 -1.344 190 2HG MET 52 HG1 MET 52 69.650 11.762 -0.743 191 1HE MET 52 HE1 MET 52 71.690 11.639 -4.833 192 2HE MET 52 HE2 MET 52 72.284 11.066 -3.278 193 3HE MET 52 HE3 MET 52 72.308 12.790 -3.641 194 H GLU 53 HN GLU 53 74.272 13.670 -0.661 195 HA GLU 53 HA GLU 53 75.027 14.503 -3.262 196 1HB GLU 53 HB2 GLU 53 75.533 15.175 -0.535 197 2HB GLU 53 HB1 GLU 53 77.104 14.990 -1.313 198 1HG GLU 53 HG2 GLU 53 76.507 16.590 -3.031 199 2HG GLU 53 HG1 GLU 53 74.844 16.663 -2.447 200 H ALA 54 HN ALA 54 76.155 12.061 -1.049 201 HA ALA 54 HA ALA 54 78.579 11.409 -2.607 202 1HB ALA 54 HB1 ALA 54 77.490 9.488 -0.647 203 2HB ALA 54 HB2 ALA 54 77.715 11.113 0.000 204 3HB ALA 54 HB3 ALA 54 79.082 10.247 -0.702 205 H MET 55 HN MET 55 75.239 10.376 -2.242 206 HA MET 55 HA MET 55 75.529 7.904 -3.803 207 1HB MET 55 HB2 MET 55 73.649 9.149 -2.120 208 2HB MET 55 HB1 MET 55 72.862 9.067 -3.699 209 1HG MET 55 HG2 MET 55 73.767 6.601 -3.710 210 2HG MET 55 HG1 MET 55 73.880 6.829 -1.959 211 1HE MET 55 HE1 MET 55 72.640 5.800 -0.834 212 2HE MET 55 HE2 MET 55 71.520 4.719 -1.658 213 3HE MET 55 HE3 MET 55 70.896 5.982 -0.600 214 H GLU 56 HN GLU 56 74.364 11.221 -4.435 215 HA GLU 56 HA GLU 56 73.575 10.781 -7.168 216 1HB GLU 56 HB2 GLU 56 73.564 12.827 -5.237 217 2HB GLU 56 HB1 GLU 56 74.543 13.459 -6.560 218 1HG GLU 56 HG2 GLU 56 72.247 12.105 -7.647 219 2HG GLU 56 HG1 GLU 56 71.713 13.272 -6.436 220 H LYS 57 HN LYS 57 76.455 12.511 -5.889 221 HA LYS 57 HA LYS 57 77.937 12.884 -8.189 222 1HB LYS 57 HB2 LYS 57 78.394 12.580 -5.352 223 2HB LYS 57 HB1 LYS 57 79.732 11.868 -6.252 224 1HG LYS 57 HG2 LYS 57 80.514 13.984 -6.445 225 2HG LYS 57 HG1 LYS 57 79.236 14.211 -7.631 226 1HD LYS 57 HD2 LYS 57 77.834 15.286 -6.139 227 2HD LYS 57 HD1 LYS 57 78.615 14.561 -4.734 228 1HE LYS 57 HE2 LYS 57 80.365 16.090 -4.763 229 2HE LYS 57 HE1 LYS 57 80.261 16.343 -6.513 230 1HZ LYS 57 HZ1 LYS 57 79.177 18.212 -5.820 231 2HZ LYS 57 HZ2 LYS 57 78.666 17.521 -4.354 232 3HZ LYS 57 HZ3 LYS 57 77.853 17.153 -5.800 233 H LEU 58 HN LEU 58 78.497 10.017 -6.126 234 HA LEU 58 HA LEU 58 79.964 8.396 -7.795 235 1HB LEU 58 HB2 LEU 58 77.876 8.037 -5.722 236 2HB LEU 58 HB1 LEU 58 78.152 6.619 -6.744 237 HG LEU 58 HG LEU 58 80.709 7.299 -6.250 238 1HD1 LEU 58 HD11 LEU 58 79.345 7.954 -3.642 239 2HD1 LEU 58 HD12 LEU 58 79.775 9.215 -4.798 240 3HD1 LEU 58 HD13 LEU 58 81.033 8.201 -4.090 241 1HD2 LEU 58 HD21 LEU 58 79.291 5.160 -5.740 242 2HD2 LEU 58 HD22 LEU 58 79.190 5.825 -4.108 243 3HD2 LEU 58 HD23 LEU 58 80.763 5.444 -4.810 244 H LYS 59 HN LYS 59 76.513 9.127 -8.080 245 HA LYS 59 HA LYS 59 76.097 7.236 -10.302 246 1HB LYS 59 HB2 LYS 59 74.529 9.155 -8.634 247 2HB LYS 59 HB1 LYS 59 73.877 8.756 -10.224 248 1HG LYS 59 HG2 LYS 59 74.809 6.352 -8.959 249 2HG LYS 59 HG1 LYS 59 73.732 7.202 -7.852 250 1HD LYS 59 HD2 LYS 59 72.952 6.909 -10.739 251 2HD LYS 59 HD1 LYS 59 72.723 5.551 -9.637 252 1HE LYS 59 HE2 LYS 59 71.119 6.679 -8.373 253 2HE LYS 59 HE1 LYS 59 71.766 8.276 -8.795 254 1HZ LYS 59 HZ1 LYS 59 70.002 6.513 -10.324 255 2HZ LYS 59 HZ2 LYS 59 71.173 7.374 -11.206 256 3HZ LYS 59 HZ3 LYS 59 70.038 8.208 -10.256 257 H SER 60 HN SER 60 75.484 10.739 -10.027 258 HA SER 60 HA SER 60 75.266 11.551 -12.622 259 1HB SER 60 HB2 SER 60 76.634 13.593 -11.791 260 2HB SER 60 HB1 SER 60 75.191 13.152 -10.875 261 HG SER 60 HG SER 60 76.469 12.142 -9.373 262 H GLY 61 HN GLY 61 78.354 10.819 -10.998 263 1HA GLY 61 HA2 GLY 61 80.076 9.646 -12.394 264 2HA GLY 61 HA1 GLY 61 79.638 10.759 -13.700 265 H MET 62 HN MET 62 79.629 12.159 -10.562 266 HA MET 62 HA MET 62 81.846 13.934 -11.250 267 1HB MET 62 HB2 MET 62 79.591 14.138 -9.799 268 2HB MET 62 HB1 MET 62 80.715 13.695 -8.515 269 1HG MET 62 HG2 MET 62 81.412 15.831 -8.442 270 2HG MET 62 HG1 MET 62 82.041 15.639 -10.077 271 1HE MET 62 HE1 MET 62 78.982 16.149 -7.929 272 2HE MET 62 HE2 MET 62 78.180 15.255 -9.219 273 3HE MET 62 HE3 MET 62 77.787 16.953 -8.956 274 H ARG 63 HN ARG 63 82.604 13.956 -8.310 275 HA ARG 63 HA ARG 63 84.884 12.165 -8.500 276 1HB ARG 63 HB2 ARG 63 83.674 13.820 -6.269 277 2HB ARG 63 HB1 ARG 63 85.222 12.970 -6.156 278 1HG ARG 63 HG2 ARG 63 86.288 14.504 -7.416 279 2HG ARG 63 HG1 ARG 63 84.943 14.656 -8.552 280 1HD ARG 63 HD2 ARG 63 83.780 16.197 -7.138 281 2HD ARG 63 HD1 ARG 63 84.807 15.803 -5.743 282 HE ARG 63 HE ARG 63 86.540 17.154 -6.695 283 1HH1 ARG 63 HH11 ARG 63 84.019 18.620 -7.762 284 2HH1 ARG 63 HH12 ARG 63 84.507 18.912 -9.399 285 1HH2 ARG 63 HH21 ARG 63 87.140 16.659 -9.294 286 2HH2 ARG 63 HH22 ARG 63 86.275 17.803 -10.264 287 H PHE 64 HN PHE 64 84.924 10.059 -7.839 288 HA PHE 64 HA PHE 64 82.596 8.972 -6.365 289 1HB PHE 64 HB2 PHE 64 84.620 8.090 -8.242 290 2HB PHE 64 HB1 PHE 64 84.670 7.065 -6.808 291 HD1 PHE 64 HD1 PHE 64 82.844 5.597 -6.243 292 HD2 PHE 64 HD2 PHE 64 82.543 8.287 -9.578 293 HE1 PHE 64 HE1 PHE 64 80.820 4.397 -7.028 294 HE2 PHE 64 HE2 PHE 64 80.517 7.089 -10.362 295 HZ PHE 64 HZ PHE 64 79.655 5.145 -9.086 296 H ASN 65 HN ASN 65 86.087 9.527 -6.058 297 HA ASN 65 HA ASN 65 86.088 8.473 -3.300 298 1HB ASN 65 HB2 ASN 65 88.409 8.474 -3.528 299 2HB ASN 65 HB1 ASN 65 87.819 8.085 -5.140 300 1HD2 ASN 65 HD21 ASN 65 90.340 9.601 -4.097 301 2HD2 ASN 65 HD22 ASN 65 90.351 11.025 -5.022 302 H GLU 66 HN GLU 66 86.624 11.648 -4.916 303 HA GLU 66 HA GLU 66 87.396 13.134 -2.636 304 1HB GLU 66 HB2 GLU 66 85.455 14.077 -4.771 305 2HB GLU 66 HB1 GLU 66 86.623 15.047 -3.882 306 1HG GLU 66 HG2 GLU 66 88.287 13.205 -4.973 307 2HG GLU 66 HG1 GLU 66 87.046 13.278 -6.224 308 H VAL 67 HN VAL 67 84.190 12.294 -3.870 309 HA VAL 67 HA VAL 67 82.667 13.482 -1.740 310 HB VAL 67 HB VAL 67 80.909 12.049 -2.658 311 1HG1 VAL 67 HG11 VAL 67 81.079 12.492 -5.090 312 2HG1 VAL 67 HG12 VAL 67 82.784 12.898 -4.872 313 3HG1 VAL 67 HG13 VAL 67 81.540 13.906 -4.135 314 1HG2 VAL 67 HG21 VAL 67 82.077 9.964 -2.666 315 2HG2 VAL 67 HG22 VAL 67 83.170 10.549 -3.923 316 3HG2 VAL 67 HG23 VAL 67 81.468 10.278 -4.291 317 H ALA 68 HN ALA 68 84.037 10.254 -2.345 318 HA ALA 68 HA ALA 68 83.157 8.857 -0.061 319 1HB ALA 68 HB1 ALA 68 85.936 8.562 -1.159 320 2HB ALA 68 HB2 ALA 68 84.565 8.230 -2.214 321 3HB ALA 68 HB3 ALA 68 84.782 7.302 -0.728 322 H ALA 69 HN ALA 69 85.668 11.227 -0.503 323 HA ALA 69 HA ALA 69 87.065 10.757 1.945 324 1HB ALA 69 HB1 ALA 69 87.053 13.525 1.231 325 2HB ALA 69 HB2 ALA 69 87.024 12.590 -0.265 326 3HB ALA 69 HB3 ALA 69 88.314 12.333 0.910 327 H GLN 70 HN GLN 70 85.141 13.676 1.319 328 HA GLN 70 HA GLN 70 84.302 13.607 4.148 329 1HB GLN 70 HB2 GLN 70 84.484 15.678 2.022 330 2HB GLN 70 HB1 GLN 70 83.575 15.985 3.501 331 1HG GLN 70 HG2 GLN 70 86.262 16.416 3.306 332 2HG GLN 70 HG1 GLN 70 85.459 16.026 4.830 333 1HE2 GLN 70 HE21 GLN 70 85.444 13.523 5.396 334 2HE2 GLN 70 HE22 GLN 70 86.744 12.585 4.846 335 H TYR 71 HN TYR 71 82.596 13.732 1.000 336 HA TYR 71 HA TYR 71 80.005 14.093 2.005 337 1HB TYR 71 HB2 TYR 71 81.071 12.313 -0.204 338 2HB TYR 71 HB1 TYR 71 79.353 12.515 0.086 339 HD1 TYR 71 HD1 TYR 71 79.130 13.528 -2.174 340 HD2 TYR 71 HD2 TYR 71 81.579 15.342 0.863 341 HE1 TYR 71 HE1 TYR 71 79.133 15.662 -3.428 342 HE2 TYR 71 HE2 TYR 71 81.578 17.461 -0.405 343 HH TYR 71 HH TYR 71 80.394 17.675 -3.640 344 H SER 72 HN SER 72 82.201 11.419 2.259 345 HA SER 72 HA SER 72 80.242 9.722 3.708 346 1HB SER 72 HB2 SER 72 81.609 8.447 2.297 347 2HB SER 72 HB1 SER 72 82.990 9.500 2.540 348 HG SER 72 HG SER 72 83.424 7.692 3.687 349 H GLU 73 HN GLU 73 83.221 9.204 5.087 350 HA GLU 73 HA GLU 73 83.717 11.378 6.799 351 1HB GLU 73 HB2 GLU 73 81.313 9.826 7.284 352 2HB GLU 73 HB1 GLU 73 82.393 9.813 8.681 353 1HG GLU 73 HG2 GLU 73 82.085 12.395 7.286 354 2HG GLU 73 HG1 GLU 73 80.649 11.826 8.137 355 H ASP 74 HN ASP 74 85.057 9.133 5.490 356 HA ASP 74 HA ASP 74 86.909 8.385 7.560 357 1HB ASP 74 HB2 ASP 74 84.670 7.068 7.950 358 2HB ASP 74 HB1 ASP 74 85.227 6.078 6.602 359 H LYS 75 HN LYS 75 87.040 5.617 6.042 360 HA LYS 75 HA LYS 75 89.140 6.240 4.252 361 1HB LYS 75 HB2 LYS 75 87.668 4.004 5.173 362 2HB LYS 75 HB1 LYS 75 87.612 3.931 3.413 363 1HG LYS 75 HG2 LYS 75 90.199 4.443 4.882 364 2HG LYS 75 HG1 LYS 75 89.619 2.803 4.592 365 1HD LYS 75 HD2 LYS 75 89.314 3.840 2.110 366 2HD LYS 75 HD1 LYS 75 90.678 4.807 2.670 367 1HE LYS 75 HE2 LYS 75 91.207 2.136 3.486 368 2HE LYS 75 HE1 LYS 75 90.683 2.063 1.792 369 1HZ LYS 75 HZ1 LYS 75 92.178 4.198 1.639 370 2HZ LYS 75 HZ2 LYS 75 92.870 2.651 1.522 371 3HZ LYS 75 HZ3 LYS 75 92.946 3.511 2.985 372 H ALA 76 HN ALA 76 89.160 6.456 1.941 373 HA ALA 76 HA ALA 76 86.531 6.771 0.576 374 1HB ALA 76 HB1 ALA 76 88.687 8.842 1.011 375 2HB ALA 76 HB2 ALA 76 86.952 8.985 1.300 376 3HB ALA 76 HB3 ALA 76 87.574 8.971 -0.352 377 H ARG 77 HN ARG 77 89.143 8.194 -1.093 378 HA ARG 77 HA ARG 77 90.544 7.453 -2.842 379 1HB ARG 77 HB2 ARG 77 90.686 5.610 -0.810 380 2HB ARG 77 HB1 ARG 77 90.216 4.604 -2.180 381 1HG ARG 77 HG2 ARG 77 92.379 6.621 -2.612 382 2HG ARG 77 HG1 ARG 77 92.780 5.173 -1.689 383 1HD ARG 77 HD2 ARG 77 91.217 4.639 -4.140 384 2HD ARG 77 HD1 ARG 77 92.839 5.298 -4.429 385 HE ARG 77 HE ARG 77 92.454 3.006 -2.541 386 1HH1 ARG 77 HH21 ARG 77 93.321 3.969 -5.690 387 2HH1 ARG 77 HH22 ARG 77 94.710 2.940 -5.787 388 1HH2 ARG 77 HH11 ARG 77 94.491 1.884 -2.492 389 2HH2 ARG 77 HH12 ARG 77 95.374 1.759 -3.978 390 H GLN 78 HN GLN 78 87.314 6.819 -2.656 391 HA GLN 78 HA GLN 78 86.858 6.515 -5.424 392 1HB GLN 78 HB2 GLN 78 87.898 4.435 -5.553 393 2HB GLN 78 HB1 GLN 78 87.475 4.014 -3.889 394 1HG GLN 78 HG2 GLN 78 85.182 4.374 -5.752 395 2HG GLN 78 HG1 GLN 78 86.208 2.965 -6.054 396 1HE2 GLN 78 HE21 GLN 78 83.602 4.077 -4.189 397 2HE2 GLN 78 HE22 GLN 78 83.628 2.893 -2.973 398 H GLY 79 HN GLY 79 85.832 5.343 -2.253 399 1HA GLY 79 HA2 GLY 79 83.430 6.710 -2.055 400 2HA GLY 79 HA1 GLY 79 83.025 5.239 -2.924 401 H GLY 80 HN GLY 80 85.523 5.598 -0.452 402 1HA GLY 80 HA2 GLY 80 85.459 4.854 1.824 403 2HA GLY 80 HA1 GLY 80 83.879 4.132 1.517 404 H ASP 81 HN ASP 81 86.336 3.541 -0.845 405 HA ASP 81 HA ASP 81 86.179 0.723 -0.704 406 1HB ASP 81 HB2 ASP 81 87.359 2.609 -2.290 407 2HB ASP 81 HB1 ASP 81 88.777 1.915 -1.490 408 H LEU 82 HN LEU 82 86.309 0.346 1.712 409 HA LEU 82 HA LEU 82 88.681 0.927 3.210 410 1HB LEU 82 HB2 LEU 82 87.145 0.245 4.727 411 2HB LEU 82 HB1 LEU 82 86.145 -0.447 3.455 412 HG LEU 82 HG LEU 82 87.533 -2.498 3.504 413 1HD1 LEU 82 HD11 LEU 82 89.207 -0.775 5.126 414 2HD1 LEU 82 HD12 LEU 82 89.591 -2.344 4.417 415 3HD1 LEU 82 HD13 LEU 82 88.822 -2.257 6.001 416 1HD2 LEU 82 HD21 LEU 82 86.002 -1.482 5.846 417 2HD2 LEU 82 HD22 LEU 82 86.939 -2.954 6.098 418 3HD2 LEU 82 HD23 LEU 82 85.704 -2.898 4.839 419 H GLY 83 HN GLY 83 87.793 -1.739 1.050 420 1HA GLY 83 HA2 GLY 83 89.858 -2.700 -0.117 421 2HA GLY 83 HA1 GLY 83 90.507 -2.918 1.514 422 H TRP 84 HN TRP 84 90.018 -5.018 -0.455 423 HA TRP 84 HA TRP 84 87.714 -6.539 -0.261 424 1HB TRP 84 HB2 TRP 84 90.654 -7.118 -0.351 425 2HB TRP 84 HB1 TRP 84 89.553 -8.464 -0.138 426 HD1 TRP 84 HD1 TRP 84 90.223 -5.589 -2.514 427 HE1 TRP 84 HE1 TRP 84 89.353 -6.217 -4.867 428 HE3 TRP 84 HE3 TRP 84 88.046 -10.050 -1.442 429 HZ2 TRP 84 HZ2 TRP 84 87.909 -8.363 -6.116 430 HZ3 TRP 84 HZ3 TRP 84 86.927 -11.366 -3.214 431 HH2 TRP 84 HH2 TRP 84 86.847 -10.543 -5.541 432 H MET 85 HN MET 85 86.794 -7.926 1.329 433 HA MET 85 HA MET 85 88.209 -8.222 3.927 434 1HB MET 85 HB2 MET 85 86.378 -6.171 3.392 435 2HB MET 85 HB1 MET 85 85.451 -7.369 4.297 436 1HG MET 85 HG2 MET 85 87.483 -7.427 5.902 437 2HG MET 85 HG1 MET 85 87.963 -5.917 5.127 438 1HE MET 85 HE1 MET 85 88.033 -5.154 7.452 439 2HE MET 85 HE2 MET 85 87.072 -6.273 8.414 440 3HE MET 85 HE3 MET 85 86.662 -4.560 8.398 441 H THR 86 HN THR 86 87.398 -9.974 5.172 442 HA THR 86 HA THR 86 85.348 -11.672 3.794 443 HB THR 86 HB THR 86 87.520 -12.667 3.626 444 HG1 THR 86 HG1 THR 86 87.097 -14.427 5.349 445 1HG2 THR 86 HG21 THR 86 88.646 -11.420 5.394 446 2HG2 THR 86 HG22 THR 86 88.843 -13.148 5.687 447 3HG2 THR 86 HG23 THR 86 87.651 -12.226 6.607 448 H ARG 87 HN ARG 87 83.981 -12.816 5.084 449 HA ARG 87 HA ARG 87 82.681 -11.673 7.231 450 1HB ARG 87 HB2 ARG 87 82.782 -14.173 5.912 451 2HB ARG 87 HB1 ARG 87 82.870 -14.532 7.636 452 1HG ARG 87 HG2 ARG 87 80.923 -12.702 7.730 453 2HG ARG 87 HG1 ARG 87 80.671 -13.251 6.073 454 1HD ARG 87 HD2 ARG 87 79.297 -14.661 7.470 455 2HD ARG 87 HD1 ARG 87 80.704 -15.643 7.021 456 HE ARG 87 HE ARG 87 81.670 -14.620 9.270 457 1HH1 ARG 87 HH21 ARG 87 80.316 -17.209 9.636 458 2HH1 ARG 87 HH22 ARG 87 79.097 -16.850 10.813 459 1HH2 ARG 87 HH11 ARG 87 79.279 -13.420 10.346 460 2HH2 ARG 87 HH12 ARG 87 78.510 -14.705 11.215 461 H GLY 88 HN GLY 88 85.713 -13.467 7.339 462 1HA GLY 88 HA2 GLY 88 85.877 -13.988 10.116 463 2HA GLY 88 HA1 GLY 88 87.277 -13.727 9.067 464 H SER 89 HN SER 89 86.459 -11.001 8.313 465 HA SER 89 HA SER 89 87.139 -9.643 10.899 466 1HB SER 89 HB2 SER 89 87.789 -9.181 7.990 467 2HB SER 89 HB1 SER 89 87.948 -7.867 9.165 468 HG SER 89 HG SER 89 89.481 -8.974 10.227 469 H MET 90 HN MET 90 84.399 -10.303 9.572 470 HA MET 90 HA MET 90 83.355 -7.513 9.309 471 1HB MET 90 HB2 MET 90 83.023 -9.896 7.858 472 2HB MET 90 HB1 MET 90 81.508 -9.689 8.737 473 1HG MET 90 HG2 MET 90 81.094 -7.577 7.756 474 2HG MET 90 HG1 MET 90 82.772 -7.390 7.244 475 1HE MET 90 HE1 MET 90 83.229 -7.320 4.984 476 2HE MET 90 HE2 MET 90 81.614 -6.620 4.894 477 3HE MET 90 HE3 MET 90 82.120 -7.805 3.693 478 H VAL 91 HN VAL 91 81.017 -7.328 10.249 479 HA VAL 91 HA VAL 91 81.029 -8.567 12.975 480 HB VAL 91 HB VAL 91 79.589 -6.537 13.482 481 1HG1 VAL 91 HG11 VAL 91 82.126 -6.700 13.767 482 2HG1 VAL 91 HG12 VAL 91 81.465 -5.069 13.645 483 3HG1 VAL 91 HG13 VAL 91 82.254 -5.808 12.251 484 1HG2 VAL 91 HG21 VAL 91 79.326 -6.414 10.750 485 2HG2 VAL 91 HG22 VAL 91 80.549 -5.178 11.049 486 3HG2 VAL 91 HG23 VAL 91 78.979 -5.079 11.849 487 H GLY 92 HN GLY 92 78.085 -7.126 12.537 488 1HA GLY 92 HA2 GLY 92 76.849 -9.726 11.749 489 2HA GLY 92 HA1 GLY 92 76.087 -8.542 12.818 490 HA PRO 93 HA PRO 93 73.916 -6.635 9.550 491 1HB PRO 93 HB2 PRO 93 74.884 -3.961 10.011 492 2HB PRO 93 HB1 PRO 93 73.340 -4.668 10.512 493 1HG PRO 93 HG2 PRO 93 75.627 -4.028 12.152 494 2HG PRO 93 HG1 PRO 93 74.065 -4.672 12.660 495 1HD PRO 93 HD2 PRO 93 76.579 -6.050 12.595 496 2HD PRO 93 HD1 PRO 93 74.986 -6.730 13.005 497 H PHE 94 HN PHE 94 77.282 -5.472 9.854 498 HA PHE 94 HA PHE 94 77.672 -4.405 7.280 499 1HB PHE 94 HB2 PHE 94 79.172 -4.740 9.458 500 2HB PHE 94 HB1 PHE 94 79.774 -6.128 8.541 501 HD1 PHE 94 HD1 PHE 94 79.090 -2.457 8.218 502 HD2 PHE 94 HD2 PHE 94 81.405 -5.819 6.878 503 HE1 PHE 94 HE1 PHE 94 80.499 -0.942 6.851 504 HE2 PHE 94 HE2 PHE 94 82.815 -4.303 5.512 505 HZ PHE 94 HZ PHE 94 82.362 -1.866 5.498 506 H GLN 95 HN GLN 95 78.060 -7.809 8.330 507 HA GLN 95 HA GLN 95 78.535 -8.683 5.551 508 1HB GLN 95 HB2 GLN 95 79.794 -9.703 7.345 509 2HB GLN 95 HB1 GLN 95 78.320 -10.057 8.245 510 1HG GLN 95 HG2 GLN 95 78.007 -11.196 5.659 511 2HG GLN 95 HG1 GLN 95 79.610 -11.655 6.235 512 1HE2 GLN 95 HE21 GLN 95 77.315 -13.482 5.995 513 2HE2 GLN 95 HE22 GLN 95 76.966 -14.039 7.560 514 H GLU 96 HN GLU 96 76.023 -9.062 8.062 515 HA GLU 96 HA GLU 96 74.247 -10.837 6.900 516 1HB GLU 96 HB2 GLU 96 74.017 -8.333 8.520 517 2HB GLU 96 HB1 GLU 96 72.529 -9.049 7.900 518 1HG GLU 96 HG2 GLU 96 73.148 -11.211 8.926 519 2HG GLU 96 HG1 GLU 96 74.628 -10.486 9.555 520 H ALA 97 HN ALA 97 73.846 -7.305 6.440 521 HA ALA 97 HA ALA 97 72.053 -7.452 4.259 522 1HB ALA 97 HB1 ALA 97 72.318 -5.158 4.269 523 2HB ALA 97 HB2 ALA 97 74.075 -5.263 4.379 524 3HB ALA 97 HB3 ALA 97 73.084 -5.517 5.816 525 H ALA 98 HN ALA 98 75.531 -6.670 4.051 526 HA ALA 98 HA ALA 98 75.917 -6.710 1.310 527 1HB ALA 98 HB1 ALA 98 78.104 -8.097 2.399 528 2HB ALA 98 HB2 ALA 98 77.461 -7.141 3.734 529 3HB ALA 98 HB3 ALA 98 77.947 -6.348 2.236 530 H PHE 99 HN PHE 99 76.946 -9.604 3.109 531 HA PHE 99 HA PHE 99 76.965 -11.456 1.069 532 1HB PHE 99 HB2 PHE 99 76.567 -11.444 3.980 533 2HB PHE 99 HB1 PHE 99 75.898 -12.878 3.188 534 HD1 PHE 99 HD1 PHE 99 77.321 -14.673 2.773 535 HD2 PHE 99 HD2 PHE 99 78.972 -10.721 3.096 536 HE1 PHE 99 HE1 PHE 99 79.606 -15.607 2.530 537 HE2 PHE 99 HE2 PHE 99 81.257 -11.654 2.853 538 HZ PHE 99 HZ PHE 99 81.573 -14.098 2.570 539 H ALA 100 HN ALA 100 74.102 -10.185 2.704 540 HA ALA 100 HA ALA 100 72.268 -12.104 1.476 541 1HB ALA 100 HB1 ALA 100 70.633 -10.285 2.413 542 2HB ALA 100 HB2 ALA 100 72.088 -9.590 3.127 543 3HB ALA 100 HB3 ALA 100 71.592 -11.230 3.552 544 H LEU 101 HN LEU 101 73.132 -8.680 0.917 545 HA LEU 101 HA LEU 101 71.364 -8.549 -1.436 546 1HB LEU 101 HB2 LEU 101 72.030 -6.203 -1.399 547 2HB LEU 101 HB1 LEU 101 71.656 -6.720 0.249 548 HG LEU 101 HG LEU 101 74.212 -7.264 0.376 549 1HD1 LEU 101 HD11 LEU 101 75.241 -6.890 -1.606 550 2HD1 LEU 101 HD12 LEU 101 75.129 -5.181 -1.183 551 3HD1 LEU 101 HD13 LEU 101 73.896 -5.920 -2.211 552 1HD2 LEU 101 HD21 LEU 101 72.875 -5.377 1.503 553 2HD2 LEU 101 HD22 LEU 101 73.457 -4.344 0.197 554 3HD2 LEU 101 HD23 LEU 101 74.606 -5.105 1.299 555 HA PRO 102 HA PRO 102 74.300 -9.460 -4.565 556 1HB PRO 102 HB2 PRO 102 73.741 -7.150 -6.175 557 2HB PRO 102 HB1 PRO 102 73.090 -8.787 -6.351 558 1HG PRO 102 HG2 PRO 102 71.702 -6.442 -5.489 559 2HG PRO 102 HG1 PRO 102 71.077 -8.094 -5.577 560 1HD PRO 102 HD2 PRO 102 71.788 -6.547 -3.216 561 2HD PRO 102 HD1 PRO 102 71.002 -8.143 -3.301 562 H VAL 103 HN VAL 103 76.328 -8.810 -5.522 563 HA VAL 103 HA VAL 103 78.130 -7.276 -4.019 564 HB VAL 103 HB VAL 103 77.846 -8.293 -6.819 565 1HG1 VAL 103 HG11 VAL 103 80.184 -6.537 -6.029 566 2HG1 VAL 103 HG12 VAL 103 78.877 -6.025 -7.100 567 3HG1 VAL 103 HG13 VAL 103 79.939 -7.348 -7.574 568 1HG2 VAL 103 HG21 VAL 103 80.377 -8.844 -5.656 569 2HG2 VAL 103 HG22 VAL 103 79.017 -9.950 -5.855 570 3HG2 VAL 103 HG23 VAL 103 79.176 -9.007 -4.373 571 H SER 104 HN SER 104 79.240 -5.183 -5.158 572 HA SER 104 HA SER 104 79.059 -2.939 -5.854 573 1HB SER 104 HB2 SER 104 76.471 -4.098 -6.902 574 2HB SER 104 HB1 SER 104 76.888 -2.400 -7.124 575 HG SER 104 HG SER 104 77.560 -3.835 -8.846 576 H GLY 105 HN GLY 105 77.333 -1.011 -5.624 577 1HA GLY 105 HA2 GLY 105 75.444 -1.138 -3.460 578 2HA GLY 105 HA1 GLY 105 76.976 -0.486 -2.891 579 H MET 106 HN MET 106 77.013 1.696 -2.953 580 HA MET 106 HA MET 106 76.661 3.905 -3.681 581 1HB MET 106 HB2 MET 106 77.711 2.825 -5.694 582 2HB MET 106 HB1 MET 106 76.090 2.499 -6.306 583 1HG MET 106 HG2 MET 106 75.640 5.001 -6.077 584 2HG MET 106 HG1 MET 106 77.376 5.193 -5.793 585 1HE MET 106 HE1 MET 106 75.503 3.159 -9.417 586 2HE MET 106 HE2 MET 106 74.617 4.509 -8.714 587 3HE MET 106 HE3 MET 106 75.014 3.112 -7.717 588 H ASP 107 HN ASP 107 74.307 2.356 -5.886 589 HA ASP 107 HA ASP 107 71.974 2.660 -4.295 590 1HB ASP 107 HB2 ASP 107 71.208 4.870 -5.367 591 2HB ASP 107 HB1 ASP 107 72.460 4.988 -4.134 592 H LYS 108 HN LYS 108 72.248 0.668 -6.003 593 HA LYS 108 HA LYS 108 70.105 0.855 -7.837 594 1HB LYS 108 HB2 LYS 108 72.452 2.215 -8.647 595 2HB LYS 108 HB1 LYS 108 72.327 0.770 -9.655 596 1HG LYS 108 HG2 LYS 108 69.743 2.079 -9.289 597 2HG LYS 108 HG1 LYS 108 70.930 3.151 -10.034 598 1HD LYS 108 HD2 LYS 108 70.614 2.080 -11.989 599 2HD LYS 108 HD1 LYS 108 71.250 0.609 -11.253 600 1HE LYS 108 HE2 LYS 108 69.148 -0.199 -11.746 601 2HE LYS 108 HE1 LYS 108 68.711 0.623 -10.236 602 1HZ LYS 108 HZ1 LYS 108 67.524 1.215 -12.500 603 2HZ LYS 108 HZ2 LYS 108 68.882 2.218 -12.691 604 3HZ LYS 108 HZ3 LYS 108 67.860 2.413 -11.348 605 HA PRO 109 HA PRO 109 72.770 -3.005 -9.094 606 1HB PRO 109 HB2 PRO 109 74.972 -3.148 -7.256 607 2HB PRO 109 HB1 PRO 109 75.029 -2.968 -9.016 608 1HG PRO 109 HG2 PRO 109 75.633 -0.999 -7.011 609 2HG PRO 109 HG1 PRO 109 75.691 -0.816 -8.765 610 1HD PRO 109 HD2 PRO 109 73.779 0.319 -6.933 611 2HD PRO 109 HD1 PRO 109 73.838 0.488 -8.704 612 H VAL 110 HN VAL 110 73.640 -2.467 -5.662 613 HA VAL 110 HA VAL 110 72.995 -4.944 -4.587 614 HB VAL 110 HB VAL 110 72.210 -3.414 -2.575 615 1HG1 VAL 110 HG11 VAL 110 74.535 -4.573 -3.295 616 2HG1 VAL 110 HG12 VAL 110 74.297 -3.651 -1.808 617 3HG1 VAL 110 HG13 VAL 110 75.019 -2.880 -3.221 618 1HG2 VAL 110 HG21 VAL 110 73.753 -1.388 -4.156 619 2HG2 VAL 110 HG22 VAL 110 72.788 -1.154 -2.699 620 3HG2 VAL 110 HG23 VAL 110 71.993 -1.471 -4.240 621 H PHE 111 HN PHE 111 71.104 -4.869 -2.742 622 HA PHE 111 HA PHE 111 68.530 -4.600 -4.234 623 1HB PHE 111 HB2 PHE 111 69.874 -6.702 -2.735 624 2HB PHE 111 HB1 PHE 111 68.235 -6.416 -2.136 625 HD1 PHE 111 HD1 PHE 111 66.890 -8.138 -2.999 626 HD2 PHE 111 HD2 PHE 111 69.660 -6.121 -5.589 627 HE1 PHE 111 HE1 PHE 111 65.963 -9.364 -4.944 628 HE2 PHE 111 HE2 PHE 111 68.732 -7.348 -7.536 629 HZ PHE 111 HZ PHE 111 66.883 -8.968 -7.213 630 H THR 112 HN THR 112 70.378 -3.713 -1.453 631 HA THR 112 HA THR 112 67.914 -2.666 -0.086 632 HB THR 112 HB THR 112 69.347 -4.360 1.095 633 HG1 THR 112 HG1 THR 112 68.193 -2.587 2.163 634 1HG2 THR 112 HG21 THR 112 71.489 -3.634 0.055 635 2HG2 THR 112 HG22 THR 112 71.586 -3.710 1.815 636 3HG2 THR 112 HG23 THR 112 71.417 -2.152 1.008 637 H ASP 113 HN ASP 113 69.323 -0.921 1.624 638 HA ASP 113 HA ASP 113 70.093 1.242 -0.283 639 1HB ASP 113 HB2 ASP 113 69.553 2.683 1.707 640 2HB ASP 113 HB1 ASP 113 68.192 1.688 1.191 641 HA PRO 114 HA PRO 114 74.270 0.471 0.965 642 1HB PRO 114 HB2 PRO 114 75.004 3.188 0.413 643 2HB PRO 114 HB1 PRO 114 75.314 1.745 -0.558 644 1HG PRO 114 HG2 PRO 114 73.385 3.849 -1.050 645 2HG PRO 114 HG1 PRO 114 73.794 2.468 -2.070 646 1HD PRO 114 HD2 PRO 114 71.379 2.856 -0.597 647 2HD PRO 114 HD1 PRO 114 71.870 1.390 -1.480 648 HA PRO 115 HA PRO 115 74.769 4.104 4.193 649 1HB PRO 115 HB2 PRO 115 72.161 5.302 4.422 650 2HB PRO 115 HB1 PRO 115 73.673 6.061 3.911 651 1HG PRO 115 HG2 PRO 115 71.394 5.301 2.288 652 2HG PRO 115 HG1 PRO 115 72.846 6.190 1.803 653 1HD PRO 115 HD2 PRO 115 72.169 3.511 1.093 654 2HD PRO 115 HD1 PRO 115 73.705 4.343 0.788 655 H VAL 116 HN VAL 116 74.566 1.798 5.115 656 HA VAL 116 HA VAL 116 72.008 1.330 6.568 657 HB VAL 116 HB VAL 116 72.792 -0.926 6.685 658 1HG1 VAL 116 HG11 VAL 116 72.213 -1.145 4.517 659 2HG1 VAL 116 HG12 VAL 116 73.889 -0.803 4.081 660 3HG1 VAL 116 HG13 VAL 116 72.722 0.514 4.197 661 1HG2 VAL 116 HG21 VAL 116 75.451 0.121 5.709 662 2HG2 VAL 116 HG22 VAL 116 75.067 -1.570 6.035 663 3HG2 VAL 116 HG23 VAL 116 75.096 -0.400 7.356 664 H LYS 117 HN LYS 117 72.052 0.999 8.859 665 HA LYS 117 HA LYS 117 74.333 2.308 10.230 666 1HB LYS 117 HB2 LYS 117 71.667 2.559 10.448 667 2HB LYS 117 HB1 LYS 117 71.926 1.300 11.664 668 1HG LYS 117 HG2 LYS 117 73.965 2.990 12.277 669 2HG LYS 117 HG1 LYS 117 72.769 4.148 11.677 670 1HD LYS 117 HD2 LYS 117 71.970 4.042 13.814 671 2HD LYS 117 HD1 LYS 117 71.199 2.555 13.243 672 1HE LYS 117 HE2 LYS 117 72.452 2.171 15.362 673 2HE LYS 117 HE1 LYS 117 73.173 1.253 14.026 674 1HZ LYS 117 HZ1 LYS 117 74.968 2.602 13.951 675 2HZ LYS 117 HZ2 LYS 117 74.560 2.943 15.565 676 3HZ LYS 117 HZ3 LYS 117 74.082 3.999 14.324 677 H THR 118 HN THR 118 75.543 1.263 11.860 678 HA THR 118 HA THR 118 74.958 -1.574 12.501 679 HB THR 118 HB THR 118 77.157 -2.286 11.695 680 HG1 THR 118 HG1 THR 118 77.901 -0.161 10.298 681 1HG2 THR 118 HG21 THR 118 75.143 -2.055 10.118 682 2HG2 THR 118 HG22 THR 118 76.731 -2.173 9.362 683 3HG2 THR 118 HG23 THR 118 75.937 -0.604 9.504 684 H LYS 119 HN LYS 119 78.069 0.093 12.753 685 HA LYS 119 HA LYS 119 77.624 0.461 15.691 686 1HB LYS 119 HB2 LYS 119 79.897 -0.941 14.252 687 2HB LYS 119 HB1 LYS 119 79.959 -0.493 15.957 688 1HG LYS 119 HG2 LYS 119 77.613 -1.761 16.002 689 2HG LYS 119 HG1 LYS 119 78.306 -2.584 14.599 690 1HD LYS 119 HD2 LYS 119 80.142 -2.289 16.898 691 2HD LYS 119 HD1 LYS 119 78.754 -3.335 17.191 692 1HE LYS 119 HE2 LYS 119 79.306 -4.648 15.169 693 2HE LYS 119 HE1 LYS 119 80.699 -3.592 14.865 694 1HZ LYS 119 HZ1 LYS 119 81.742 -5.097 16.183 695 2HZ LYS 119 HZ2 LYS 119 80.307 -5.610 16.936 696 3HZ LYS 119 HZ3 LYS 119 81.066 -4.175 17.435 697 H PHE 120 HN PHE 120 77.482 2.566 13.861 698 HA PHE 120 HA PHE 120 79.491 4.383 14.831 699 1HB PHE 120 HB2 PHE 120 80.384 2.628 12.878 700 2HB PHE 120 HB1 PHE 120 79.969 4.075 11.946 701 HD1 PHE 120 HD1 PHE 120 80.906 6.326 12.726 702 HD2 PHE 120 HD2 PHE 120 82.349 2.551 14.183 703 HE1 PHE 120 HE1 PHE 120 82.990 7.422 13.505 704 HE2 PHE 120 HE2 PHE 120 84.432 3.648 14.961 705 HZ PHE 120 HZ PHE 120 84.752 6.083 14.622 706 H GLY 121 HN GLY 121 77.186 3.562 12.280 707 1HA GLY 121 HA2 GLY 121 75.359 5.540 12.467 708 2HA GLY 121 HA1 GLY 121 76.681 6.402 11.665 709 H TYR 122 HN TYR 122 75.247 6.605 9.778 710 HA TYR 122 HA TYR 122 74.497 4.120 8.357 711 1HB TYR 122 HB2 TYR 122 74.252 7.066 7.681 712 2HB TYR 122 HB1 TYR 122 73.483 5.754 6.793 713 HD1 TYR 122 HD1 TYR 122 72.267 8.211 8.324 714 HD2 TYR 122 HD2 TYR 122 72.781 4.059 9.294 715 HE1 TYR 122 HE1 TYR 122 70.315 8.331 9.837 716 HE2 TYR 122 HE2 TYR 122 70.825 4.180 10.820 717 HH TYR 122 HH TYR 122 69.381 5.564 11.852 718 H HIS 123 HN HIS 123 75.732 3.276 6.679 719 HA HIS 123 HA HIS 123 77.769 5.049 5.406 720 1HB HIS 123 HB2 HIS 123 79.353 3.092 5.577 721 2HB HIS 123 HB1 HIS 123 78.902 3.786 7.131 722 HD1 HIS 123 HD1 HIS 123 78.545 0.711 5.051 723 HD2 HIS 123 HD2 HIS 123 77.162 2.142 8.714 724 HE1 HIS 123 HE1 HIS 123 77.587 -1.282 6.285 725 H ILE 124 HN ILE 124 78.190 4.530 3.186 726 HA ILE 124 HA ILE 124 76.115 2.861 1.887 727 HB ILE 124 HB ILE 124 78.352 4.623 0.841 728 1HG1 ILE 124 HG12 ILE 124 75.376 5.051 1.229 729 2HG1 ILE 124 HG11 ILE 124 76.701 5.977 1.949 730 1HG2 ILE 124 HG21 ILE 124 76.991 2.611 -0.512 731 2HG2 ILE 124 HG22 ILE 124 77.852 3.958 -1.256 732 3HG2 ILE 124 HG23 ILE 124 76.118 4.078 -0.954 733 1HD1 ILE 124 HD11 ILE 124 76.393 7.409 0.203 734 2HD1 ILE 124 HD12 ILE 124 75.478 6.219 -0.723 735 3HD1 ILE 124 HD13 ILE 124 77.241 6.191 -0.752 736 H ILE 125 HN ILE 125 76.552 0.718 1.470 737 HA ILE 125 HA ILE 125 79.388 -0.163 1.476 738 HB ILE 125 HB ILE 125 76.683 -1.450 1.853 739 1HG1 ILE 125 HG12 ILE 125 79.178 -1.200 3.563 740 2HG1 ILE 125 HG11 ILE 125 77.644 -0.352 3.807 741 1HG2 ILE 125 HG21 ILE 125 77.488 -3.400 1.090 742 2HG2 ILE 125 HG22 ILE 125 78.719 -3.346 2.352 743 3HG2 ILE 125 HG23 ILE 125 79.054 -2.661 0.763 744 1HD1 ILE 125 HD11 ILE 125 77.309 -3.254 3.593 745 2HD1 ILE 125 HD12 ILE 125 76.707 -2.145 4.824 746 3HD1 ILE 125 HD13 ILE 125 78.344 -2.790 4.944 747 H MET 126 HN MET 126 80.336 -0.422 -0.463 748 HA MET 126 HA MET 126 78.667 -1.249 -2.817 749 1HB MET 126 HB2 MET 126 80.914 0.656 -2.355 750 2HB MET 126 HB1 MET 126 80.949 -0.243 -3.878 751 1HG MET 126 HG2 MET 126 78.456 0.465 -4.093 752 2HG MET 126 HG1 MET 126 78.852 1.668 -2.856 753 1HE MET 126 HE1 MET 126 81.872 3.443 -4.234 754 2HE MET 126 HE2 MET 126 81.103 2.651 -2.855 755 3HE MET 126 HE3 MET 126 80.348 4.068 -3.583 756 H VAL 127 HN VAL 127 78.994 -3.454 -3.065 757 HA VAL 127 HA VAL 127 81.529 -4.679 -2.177 758 HB VAL 127 HB VAL 127 78.850 -5.604 -3.204 759 1HG1 VAL 127 HG11 VAL 127 79.855 -7.955 -2.670 760 2HG1 VAL 127 HG12 VAL 127 81.409 -7.166 -2.947 761 3HG1 VAL 127 HG13 VAL 127 80.205 -7.218 -4.233 762 1HG2 VAL 127 HG21 VAL 127 79.656 -4.937 -0.717 763 2HG2 VAL 127 HG22 VAL 127 80.137 -6.634 -0.729 764 3HG2 VAL 127 HG23 VAL 127 78.455 -6.193 -1.022 765 H GLU 128 HN GLU 128 83.064 -5.587 -3.568 766 HA GLU 128 HA GLU 128 82.510 -5.632 -6.470 767 1HB GLU 128 HB2 GLU 128 83.787 -3.484 -5.146 768 2HB GLU 128 HB1 GLU 128 85.066 -4.370 -5.990 769 1HG GLU 128 HG2 GLU 128 82.515 -3.855 -7.468 770 2HG GLU 128 HG1 GLU 128 83.619 -2.493 -7.228 771 H GLY 129 HN GLY 129 82.829 -7.909 -6.229 772 1HA GLY 129 HA2 GLY 129 84.375 -9.657 -6.846 773 2HA GLY 129 HA1 GLY 129 85.683 -8.677 -6.171 774 H ARG 130 HN ARG 130 83.452 -11.170 -5.568 775 HA ARG 130 HA ARG 130 83.781 -11.060 -2.629 776 1HB ARG 130 HB2 ARG 130 82.246 -12.676 -4.633 777 2HB ARG 130 HB1 ARG 130 82.207 -13.070 -2.913 778 1HG ARG 130 HG2 ARG 130 81.673 -10.439 -2.754 779 2HG ARG 130 HG1 ARG 130 81.027 -10.744 -4.365 780 1HD ARG 130 HD2 ARG 130 80.300 -12.487 -1.994 781 2HD ARG 130 HD1 ARG 130 79.363 -11.048 -2.438 782 HE ARG 130 HE ARG 130 79.834 -12.636 -4.781 783 1HH1 ARG 130 HH11 ARG 130 77.280 -11.479 -3.238 784 2HH1 ARG 130 HH12 ARG 130 76.318 -12.918 -3.224 785 1HH2 ARG 130 HH21 ARG 130 78.931 -14.995 -4.163 786 2HH2 ARG 130 HH22 ARG 130 77.251 -14.908 -3.747 787 H LYS 131 HN LYS 131 85.709 -12.028 -4.998 788 HA LYS 131 HA LYS 131 87.483 -13.589 -5.153 789 1HB LYS 131 HB2 LYS 131 86.930 -13.016 -2.376 790 2HB LYS 131 HB1 LYS 131 87.446 -14.693 -2.540 791 1HG LYS 131 HG2 LYS 131 89.510 -14.094 -3.509 792 2HG LYS 131 HG1 LYS 131 88.942 -12.481 -3.940 793 1HD LYS 131 HD2 LYS 131 89.121 -11.692 -1.738 794 2HD LYS 131 HD1 LYS 131 89.071 -13.316 -1.051 795 1HE LYS 131 HE2 LYS 131 91.328 -13.594 -1.279 796 2HE LYS 131 HE1 LYS 131 91.338 -12.852 -2.897 797 1HZ LYS 131 HZ1 LYS 131 91.592 -10.784 -2.043 798 2HZ LYS 131 HZ2 LYS 131 92.275 -11.618 -0.730 799 3HZ LYS 131 HZ3 LYS 131 90.657 -11.106 -0.665 Start of MODEL 11 1 1H GLY 28 HT1 GLY 28 96.397 -20.327 -4.613 2 2H GLY 28 HT2 GLY 28 95.449 -21.455 -5.460 3 3H GLY 28 HT3 GLY 28 97.007 -21.063 -6.014 4 1HA GLY 28 HA2 GLY 28 96.926 -23.235 -4.891 5 2HA GLY 28 HA1 GLY 28 98.021 -22.088 -4.117 6 H SER 29 HN SER 29 96.461 -24.395 -2.974 7 HA SER 29 HA SER 29 94.881 -22.866 -0.930 8 1HB SER 29 HB2 SER 29 94.499 -25.420 -2.420 9 2HB SER 29 HB1 SER 29 93.951 -25.392 -0.742 10 HG SER 29 HG SER 29 92.613 -24.529 -2.729 11 H GLY 30 HN GLY 30 97.719 -23.210 -0.693 12 1HA GLY 30 HA2 GLY 30 98.073 -25.463 1.199 13 2HA GLY 30 HA1 GLY 30 99.362 -24.441 0.563 14 HA PRO 31 HA PRO 31 99.401 -21.950 4.157 15 1HB PRO 31 HB2 PRO 31 99.191 -19.427 2.788 16 2HB PRO 31 HB1 PRO 31 100.652 -20.213 3.414 17 1HG PRO 31 HG2 PRO 31 99.852 -19.892 0.671 18 2HG PRO 31 HG1 PRO 31 101.308 -20.671 1.294 19 1HD PRO 31 HD2 PRO 31 99.005 -21.926 0.089 20 2HD PRO 31 HD1 PRO 31 100.470 -22.713 0.723 21 H LYS 32 HN LYS 32 96.924 -21.232 1.742 22 HA LYS 32 HA LYS 32 94.642 -20.676 2.031 23 1HB LYS 32 HB2 LYS 32 95.398 -22.295 4.132 24 2HB LYS 32 HB1 LYS 32 94.756 -20.882 4.969 25 1HG LYS 32 HG2 LYS 32 92.640 -21.080 3.886 26 2HG LYS 32 HG1 LYS 32 93.271 -22.228 2.704 27 1HD LYS 32 HD2 LYS 32 92.220 -23.686 4.173 28 2HD LYS 32 HD1 LYS 32 93.836 -23.642 4.877 29 1HE LYS 32 HE2 LYS 32 92.999 -22.773 6.796 30 2HE LYS 32 HE1 LYS 32 92.263 -21.433 5.897 31 1HZ LYS 32 HZ1 LYS 32 90.404 -22.544 6.643 32 2HZ LYS 32 HZ2 LYS 32 91.140 -24.073 6.563 33 3HZ LYS 32 HZ3 LYS 32 90.628 -23.298 5.140 34 H GLY 33 HN GLY 33 93.285 -18.913 3.030 35 1HA GLY 33 HA2 GLY 33 94.535 -16.881 4.670 36 2HA GLY 33 HA1 GLY 33 94.486 -16.396 2.975 37 H GLY 34 HN GLY 34 92.092 -18.334 4.749 38 1HA GLY 34 HA1 GLY 34 89.843 -17.876 5.260 39 2HA GLY 34 HA2 GLY 34 90.223 -16.161 5.103 40 H GLY 35 HN GLY 35 88.246 -18.412 3.855 41 1HA GLY 35 HA1 GLY 35 88.504 -17.516 1.028 42 2HA GLY 35 HA2 GLY 35 87.518 -18.877 1.588 43 H ASN 36 HN ASN 36 86.086 -17.393 0.036 44 HA ASN 36 HA ASN 36 84.193 -15.996 -0.123 45 1HB ASN 36 HB2 ASN 36 84.171 -16.434 2.869 46 2HB ASN 36 HB1 ASN 36 82.794 -16.046 1.843 47 1HD2 ASN 36 HD21 ASN 36 82.714 -18.408 3.400 48 2HD2 ASN 36 HD22 ASN 36 82.834 -19.758 2.378 49 H ALA 37 HN ALA 37 85.203 -14.067 -0.668 50 HA ALA 37 HA ALA 37 85.311 -12.018 1.471 51 1HB ALA 37 HB1 ALA 37 87.594 -12.464 -0.468 52 2HB ALA 37 HB2 ALA 37 87.568 -13.168 1.148 53 3HB ALA 37 HB3 ALA 37 87.581 -11.416 0.949 54 H VAL 38 HN VAL 38 83.936 -10.495 0.633 55 HA VAL 38 HA VAL 38 83.661 -10.141 -2.290 56 HB VAL 38 HB VAL 38 81.706 -8.918 -1.679 57 1HG1 VAL 38 HG11 VAL 38 81.767 -10.792 0.642 58 2HG1 VAL 38 HG12 VAL 38 82.013 -11.478 -0.964 59 3HG1 VAL 38 HG13 VAL 38 80.534 -10.586 -0.601 60 1HG2 VAL 38 HG21 VAL 38 83.052 -8.680 1.019 61 2HG2 VAL 38 HG22 VAL 38 81.340 -8.333 0.783 62 3HG2 VAL 38 HG23 VAL 38 82.558 -7.379 -0.062 63 H LYS 39 HN LYS 39 84.154 -8.031 -3.385 64 HA LYS 39 HA LYS 39 86.210 -6.493 -1.898 65 1HB LYS 39 HB2 LYS 39 85.646 -7.281 -4.547 66 2HB LYS 39 HB1 LYS 39 85.421 -5.529 -4.523 67 1HG LYS 39 HG2 LYS 39 87.884 -7.000 -3.525 68 2HG LYS 39 HG1 LYS 39 87.769 -6.097 -5.042 69 1HD LYS 39 HD2 LYS 39 86.970 -4.139 -3.455 70 2HD LYS 39 HD1 LYS 39 87.824 -5.073 -2.218 71 1HE LYS 39 HE2 LYS 39 89.865 -4.503 -3.068 72 2HE LYS 39 HE1 LYS 39 89.336 -4.777 -4.738 73 1HZ LYS 39 HZ1 LYS 39 89.501 -2.493 -4.689 74 2HZ LYS 39 HZ2 LYS 39 89.039 -2.376 -3.057 75 3HZ LYS 39 HZ3 LYS 39 87.874 -2.694 -4.254 76 H VAL 40 HN VAL 40 84.875 -5.418 -0.325 77 HA VAL 40 HA VAL 40 82.680 -3.732 -1.404 78 HB VAL 40 HB VAL 40 82.314 -5.493 0.355 79 1HG1 VAL 40 HG11 VAL 40 84.323 -5.278 1.652 80 2HG1 VAL 40 HG12 VAL 40 82.996 -4.754 2.688 81 3HG1 VAL 40 HG13 VAL 40 84.039 -3.558 1.919 82 1HG2 VAL 40 HG21 VAL 40 80.748 -3.613 0.058 83 2HG2 VAL 40 HG22 VAL 40 81.732 -2.618 1.133 84 3HG2 VAL 40 HG23 VAL 40 80.895 -4.038 1.763 85 H ARG 41 HN ARG 41 82.451 -1.589 -0.848 86 HA ARG 41 HA ARG 41 84.763 -0.211 0.474 87 1HB ARG 41 HB2 ARG 41 83.103 0.836 -1.845 88 2HB ARG 41 HB1 ARG 41 84.625 1.486 -1.239 89 1HG ARG 41 HG2 ARG 41 85.874 -0.043 -2.384 90 2HG ARG 41 HG1 ARG 41 84.741 -1.351 -2.074 91 1HD ARG 41 HD2 ARG 41 83.320 0.367 -3.760 92 2HD ARG 41 HD1 ARG 41 84.967 0.353 -4.429 93 HE ARG 41 HE ARG 41 83.806 -2.264 -3.643 94 1HH1 ARG 41 HH21 ARG 41 82.793 -0.551 -6.149 95 2HH1 ARG 41 HH22 ARG 41 83.581 -1.446 -7.405 96 1HH2 ARG 41 HH11 ARG 41 85.643 -3.191 -5.230 97 2HH2 ARG 41 HH12 ARG 41 85.196 -2.941 -6.885 98 H HIS 42 HN HIS 42 84.015 1.641 1.816 99 HA HIS 42 HA HIS 42 81.026 1.753 2.070 100 1HB HIS 42 HB2 HIS 42 82.768 2.012 4.484 101 2HB HIS 42 HB1 HIS 42 81.142 1.338 4.339 102 HD1 HIS 42 HD1 HIS 42 80.939 -1.160 3.974 103 HD2 HIS 42 HD2 HIS 42 84.857 0.189 3.523 104 HE1 HIS 42 HE1 HIS 42 82.385 -3.225 3.744 105 H ILE 43 HN ILE 43 80.130 3.661 2.763 106 HA ILE 43 HA ILE 43 81.848 6.061 3.203 107 HB ILE 43 HB ILE 43 79.587 5.735 1.195 108 1HG1 ILE 43 HG12 ILE 43 82.574 6.160 0.914 109 2HG1 ILE 43 HG11 ILE 43 81.611 4.811 0.295 110 1HG2 ILE 43 HG21 ILE 43 79.825 8.056 0.681 111 2HG2 ILE 43 HG22 ILE 43 81.274 8.198 1.672 112 3HG2 ILE 43 HG23 ILE 43 79.704 7.959 2.437 113 1HD1 ILE 43 HD11 ILE 43 81.673 7.675 -0.670 114 2HD1 ILE 43 HD12 ILE 43 80.314 6.614 -1.038 115 3HD1 ILE 43 HD13 ILE 43 81.933 6.198 -1.598 116 H LEU 44 HN LEU 44 81.072 6.882 5.177 117 HA LEU 44 HA LEU 44 78.161 6.441 5.788 118 1HB LEU 44 HB2 LEU 44 79.155 5.322 7.511 119 2HB LEU 44 HB1 LEU 44 80.731 6.032 7.149 120 HG LEU 44 HG LEU 44 80.144 8.057 8.377 121 1HD1 LEU 44 HD11 LEU 44 78.003 8.619 8.788 122 2HD1 LEU 44 HD12 LEU 44 77.757 7.134 9.707 123 3HD1 LEU 44 HD13 LEU 44 77.492 7.146 7.964 124 1HD2 LEU 44 HD21 LEU 44 80.401 5.440 9.505 125 2HD2 LEU 44 HD22 LEU 44 79.295 6.368 10.517 126 3HD2 LEU 44 HD23 LEU 44 80.917 6.981 10.195 127 H CYS 45 HN CYS 45 76.965 8.230 6.561 128 HA CYS 45 HA CYS 45 78.380 10.879 6.530 129 1HB CYS 45 HB2 CYS 45 75.538 10.111 5.779 130 2HB CYS 45 HB1 CYS 45 76.195 11.755 5.727 131 HG CYS 45 HG CYS 45 77.827 9.741 4.085 132 H GLU 46 HN GLU 46 78.493 11.689 8.587 133 HA GLU 46 HA GLU 46 77.072 10.662 10.837 134 1HB GLU 46 HB2 GLU 46 79.227 12.184 10.475 135 2HB GLU 46 HB1 GLU 46 78.067 13.485 10.741 136 1HG GLU 46 HG2 GLU 46 77.324 12.118 12.815 137 2HG GLU 46 HG1 GLU 46 78.845 11.249 12.611 138 H LYS 47 HN LYS 47 76.418 13.508 8.771 139 HA LYS 47 HA LYS 47 73.981 14.127 10.340 140 1HB LYS 47 HB2 LYS 47 73.928 16.091 8.824 141 2HB LYS 47 HB1 LYS 47 75.509 15.905 9.581 142 1HG LYS 47 HG2 LYS 47 75.680 14.351 7.270 143 2HG LYS 47 HG1 LYS 47 74.787 15.782 6.758 144 1HD LYS 47 HD2 LYS 47 77.182 16.200 6.510 145 2HD LYS 47 HD1 LYS 47 76.548 17.207 7.811 146 1HE LYS 47 HE2 LYS 47 77.241 15.204 9.358 147 2HE LYS 47 HE1 LYS 47 78.286 14.753 7.999 148 1HZ LYS 47 HZ1 LYS 47 78.293 17.219 9.614 149 2HZ LYS 47 HZ2 LYS 47 78.830 17.278 8.004 150 3HZ LYS 47 HZ3 LYS 47 79.603 16.261 9.125 151 H HIS 48 HN HIS 48 74.745 11.997 7.910 152 HA HIS 48 HA HIS 48 73.445 10.807 6.347 153 1HB HIS 48 HB2 HIS 48 71.425 12.003 8.249 154 2HB HIS 48 HB1 HIS 48 70.946 10.908 6.954 155 HD1 HIS 48 HD1 HIS 48 74.130 10.593 8.992 156 HD2 HIS 48 HD2 HIS 48 70.487 8.621 8.516 157 HE1 HIS 48 HE1 HIS 48 74.318 8.426 10.284 158 H GLY 49 HN GLY 49 73.885 13.958 6.170 159 1HA GLY 49 HA2 GLY 49 71.707 14.639 4.289 160 2HA GLY 49 HA1 GLY 49 72.988 15.734 4.834 161 H LYS 50 HN LYS 50 75.274 14.931 4.115 162 HA LYS 50 HA LYS 50 75.489 14.982 1.295 163 1HB LYS 50 HB2 LYS 50 77.820 14.215 1.777 164 2HB LYS 50 HB1 LYS 50 77.303 15.501 2.868 165 1HG LYS 50 HG2 LYS 50 76.605 12.821 3.833 166 2HG LYS 50 HG1 LYS 50 78.343 13.062 3.659 167 1HD LYS 50 HD2 LYS 50 77.072 15.394 4.833 168 2HD LYS 50 HD1 LYS 50 76.736 13.945 5.779 169 1HE LYS 50 HE2 LYS 50 79.549 14.371 4.827 170 2HE LYS 50 HE1 LYS 50 78.967 15.340 6.199 171 1HZ LYS 50 HZ1 LYS 50 79.570 13.437 7.293 172 2HZ LYS 50 HZ2 LYS 50 79.266 12.428 5.961 173 3HZ LYS 50 HZ3 LYS 50 77.975 13.019 6.895 174 H ILE 51 HN ILE 51 74.692 12.332 3.406 175 HA ILE 51 HA ILE 51 75.586 10.074 2.040 176 HB ILE 51 HB ILE 51 74.100 10.309 4.125 177 1HG1 ILE 51 HG12 ILE 51 72.779 8.146 3.439 178 2HG1 ILE 51 HG11 ILE 51 73.730 8.260 1.951 179 1HG2 ILE 51 HG21 ILE 51 71.701 10.305 3.785 180 2HG2 ILE 51 HG22 ILE 51 71.905 10.243 2.034 181 3HG2 ILE 51 HG23 ILE 51 72.371 11.692 2.926 182 1HD1 ILE 51 HD11 ILE 51 75.807 8.231 3.237 183 2HD1 ILE 51 HD12 ILE 51 74.826 6.836 3.691 184 3HD1 ILE 51 HD13 ILE 51 74.903 8.243 4.752 185 H MET 52 HN MET 52 72.946 12.268 1.153 186 HA MET 52 HA MET 52 72.290 10.696 -1.236 187 1HB MET 52 HB2 MET 52 71.107 12.723 0.390 188 2HB MET 52 HB1 MET 52 71.232 13.368 -1.247 189 1HG MET 52 HG2 MET 52 70.291 10.565 -1.046 190 2HG MET 52 HG1 MET 52 69.184 11.787 -0.418 191 1HE MET 52 HE1 MET 52 71.708 12.845 -3.401 192 2HE MET 52 HE2 MET 52 71.081 11.691 -4.575 193 3HE MET 52 HE3 MET 52 71.729 11.114 -3.041 194 H GLU 53 HN GLU 53 73.891 13.742 -0.442 195 HA GLU 53 HA GLU 53 74.526 14.591 -3.075 196 1HB GLU 53 HB2 GLU 53 75.008 15.409 -0.467 197 2HB GLU 53 HB1 GLU 53 76.616 14.937 -1.019 198 1HG GLU 53 HG2 GLU 53 75.975 16.312 -3.167 199 2HG GLU 53 HG1 GLU 53 74.790 17.065 -2.096 200 H ALA 54 HN ALA 54 75.742 12.130 -0.920 201 HA ALA 54 HA ALA 54 78.121 11.490 -2.522 202 1HB ALA 54 HB1 ALA 54 77.074 9.384 -0.796 203 2HB ALA 54 HB2 ALA 54 77.074 10.939 0.036 204 3HB ALA 54 HB3 ALA 54 78.573 10.299 -0.635 205 H MET 55 HN MET 55 74.757 10.576 -2.303 206 HA MET 55 HA MET 55 74.987 8.236 -4.057 207 1HB MET 55 HB2 MET 55 73.114 9.434 -2.309 208 2HB MET 55 HB1 MET 55 72.361 9.460 -3.911 209 1HG MET 55 HG2 MET 55 71.766 7.320 -3.360 210 2HG MET 55 HG1 MET 55 73.409 6.951 -3.907 211 1HE MET 55 HE1 MET 55 71.721 7.703 0.161 212 2HE MET 55 HE2 MET 55 71.162 6.201 -0.570 213 3HE MET 55 HE3 MET 55 70.986 7.719 -1.448 214 H GLU 56 HN GLU 56 73.738 11.572 -4.395 215 HA GLU 56 HA GLU 56 73.187 11.410 -7.209 216 1HB GLU 56 HB2 GLU 56 73.201 13.338 -5.037 217 2HB GLU 56 HB1 GLU 56 73.837 14.066 -6.512 218 1HG GLU 56 HG2 GLU 56 71.822 13.133 -7.728 219 2HG GLU 56 HG1 GLU 56 71.167 12.680 -6.155 220 H LYS 57 HN LYS 57 75.937 12.986 -5.488 221 HA LYS 57 HA LYS 57 77.537 13.747 -7.609 222 1HB LYS 57 HB2 LYS 57 78.100 12.519 -4.923 223 2HB LYS 57 HB1 LYS 57 79.440 12.883 -6.002 224 1HG LYS 57 HG2 LYS 57 77.871 15.181 -6.116 225 2HG LYS 57 HG1 LYS 57 77.801 14.712 -4.419 226 1HD LYS 57 HD2 LYS 57 79.966 15.262 -4.074 227 2HD LYS 57 HD1 LYS 57 80.487 14.436 -5.543 228 1HE LYS 57 HE2 LYS 57 80.831 16.494 -6.441 229 2HE LYS 57 HE1 LYS 57 79.068 16.705 -6.436 230 1HZ LYS 57 HZ1 LYS 57 81.027 17.462 -4.348 231 2HZ LYS 57 HZ2 LYS 57 79.386 17.238 -3.970 232 3HZ LYS 57 HZ3 LYS 57 79.848 18.432 -5.087 233 H LEU 58 HN LEU 58 78.117 10.605 -6.005 234 HA LEU 58 HA LEU 58 79.681 9.314 -7.855 235 1HB LEU 58 HB2 LEU 58 77.561 8.566 -5.921 236 2HB LEU 58 HB1 LEU 58 77.953 7.327 -7.121 237 HG LEU 58 HG LEU 58 80.440 7.959 -6.491 238 1HD1 LEU 58 HD11 LEU 58 80.756 8.730 -4.261 239 2HD1 LEU 58 HD12 LEU 58 79.044 8.553 -3.880 240 3HD1 LEU 58 HD13 LEU 58 79.576 9.828 -4.976 241 1HD2 LEU 58 HD21 LEU 58 80.468 6.103 -4.969 242 2HD2 LEU 58 HD22 LEU 58 79.176 5.774 -6.125 243 3HD2 LEU 58 HD23 LEU 58 78.785 6.373 -4.512 244 H LYS 59 HN LYS 59 76.241 10.065 -8.186 245 HA LYS 59 HA LYS 59 75.950 8.470 -10.636 246 1HB LYS 59 HB2 LYS 59 74.080 8.401 -9.301 247 2HB LYS 59 HB1 LYS 59 74.321 10.036 -8.703 248 1HG LYS 59 HG2 LYS 59 72.380 9.668 -10.303 249 2HG LYS 59 HG1 LYS 59 73.473 10.999 -10.654 250 1HD LYS 59 HD2 LYS 59 74.004 10.082 -12.654 251 2HD LYS 59 HD1 LYS 59 74.420 8.553 -11.881 252 1HE LYS 59 HE2 LYS 59 71.906 8.068 -11.786 253 2HE LYS 59 HE1 LYS 59 71.702 9.448 -12.881 254 1HZ LYS 59 HZ1 LYS 59 72.026 7.616 -14.290 255 2HZ LYS 59 HZ2 LYS 59 73.256 6.961 -13.318 256 3HZ LYS 59 HZ3 LYS 59 73.548 8.362 -14.233 257 H SER 60 HN SER 60 75.043 11.838 -9.916 258 HA SER 60 HA SER 60 74.830 13.038 -12.319 259 1HB SER 60 HB2 SER 60 76.727 14.543 -10.684 260 2HB SER 60 HB1 SER 60 75.043 14.907 -11.058 261 HG SER 60 HG SER 60 76.006 13.113 -9.084 262 H GLY 61 HN GLY 61 78.097 13.009 -10.830 263 1HA GLY 61 HA2 GLY 61 79.632 11.800 -12.727 264 2HA GLY 61 HA1 GLY 61 79.284 13.352 -13.496 265 H MET 62 HN MET 62 79.754 12.910 -9.992 266 HA MET 62 HA MET 62 82.002 14.851 -10.156 267 1HB MET 62 HB2 MET 62 81.089 13.666 -7.573 268 2HB MET 62 HB1 MET 62 81.480 15.340 -7.955 269 1HG MET 62 HG2 MET 62 78.950 13.880 -8.763 270 2HG MET 62 HG1 MET 62 79.085 15.102 -7.507 271 1HE MET 62 HE1 MET 62 77.027 15.414 -9.059 272 2HE MET 62 HE2 MET 62 77.005 16.734 -10.228 273 3HE MET 62 HE3 MET 62 77.390 17.066 -8.539 274 H ARG 63 HN ARG 63 83.133 13.765 -7.636 275 HA ARG 63 HA ARG 63 84.752 11.585 -8.843 276 1HB ARG 63 HB2 ARG 63 85.146 12.840 -6.142 277 2HB ARG 63 HB1 ARG 63 86.359 12.209 -7.259 278 1HG ARG 63 HG2 ARG 63 86.693 14.385 -7.702 279 2HG ARG 63 HG1 ARG 63 85.310 14.184 -8.775 280 1HD ARG 63 HD2 ARG 63 84.071 15.626 -7.522 281 2HD ARG 63 HD1 ARG 63 84.414 14.703 -6.044 282 HE ARG 63 HE ARG 63 86.272 16.153 -5.630 283 1HH1 ARG 63 HH21 ARG 63 84.458 18.192 -7.015 284 2HH1 ARG 63 HH22 ARG 63 85.569 18.917 -8.129 285 1HH2 ARG 63 HH11 ARG 63 87.933 16.402 -7.827 286 2HH2 ARG 63 HH12 ARG 63 87.533 17.905 -8.588 287 H PHE 64 HN PHE 64 85.080 9.626 -7.594 288 HA PHE 64 HA PHE 64 82.717 8.898 -5.965 289 1HB PHE 64 HB2 PHE 64 85.011 7.517 -7.340 290 2HB PHE 64 HB1 PHE 64 84.141 6.661 -6.068 291 HD1 PHE 64 HD1 PHE 64 81.823 5.995 -6.348 292 HD2 PHE 64 HD2 PHE 64 83.881 8.179 -9.420 293 HE1 PHE 64 HE1 PHE 64 80.009 5.452 -7.950 294 HE2 PHE 64 HE2 PHE 64 82.066 7.638 -11.022 295 HZ PHE 64 HZ PHE 64 80.130 6.274 -10.287 296 H ASN 65 HN ASN 65 86.193 9.513 -5.669 297 HA ASN 65 HA ASN 65 86.175 8.589 -2.858 298 1HB ASN 65 HB2 ASN 65 88.551 8.862 -3.007 299 2HB ASN 65 HB1 ASN 65 87.990 8.094 -4.489 300 1HD2 ASN 65 HD21 ASN 65 88.725 9.065 -6.387 301 2HD2 ASN 65 HD22 ASN 65 89.273 10.666 -6.518 302 H GLU 66 HN GLU 66 86.368 11.722 -4.599 303 HA GLU 66 HA GLU 66 87.127 13.308 -2.345 304 1HB GLU 66 HB2 GLU 66 85.271 13.903 -4.670 305 2HB GLU 66 HB1 GLU 66 85.969 15.126 -3.614 306 1HG GLU 66 HG2 GLU 66 87.936 13.236 -4.733 307 2HG GLU 66 HG1 GLU 66 87.131 14.237 -5.938 308 H VAL 67 HN VAL 67 83.846 12.619 -3.616 309 HA VAL 67 HA VAL 67 82.351 13.617 -1.458 310 HB VAL 67 HB VAL 67 80.824 11.605 -2.104 311 1HG1 VAL 67 HG11 VAL 67 79.890 12.972 -3.627 312 2HG1 VAL 67 HG12 VAL 67 81.368 13.063 -4.585 313 3HG1 VAL 67 HG13 VAL 67 81.173 14.084 -3.158 314 1HG2 VAL 67 HG21 VAL 67 81.852 9.986 -3.234 315 2HG2 VAL 67 HG22 VAL 67 83.224 11.011 -3.639 316 3HG2 VAL 67 HG23 VAL 67 81.758 11.069 -4.616 317 H ALA 68 HN ALA 68 83.216 10.201 -1.968 318 HA ALA 68 HA ALA 68 82.714 9.094 0.475 319 1HB ALA 68 HB1 ALA 68 84.747 8.742 -1.678 320 2HB ALA 68 HB2 ALA 68 83.519 7.616 -1.104 321 3HB ALA 68 HB3 ALA 68 85.002 7.854 -0.176 322 H ALA 69 HN ALA 69 85.461 11.155 -0.433 323 HA ALA 69 HA ALA 69 87.176 10.855 1.732 324 1HB ALA 69 HB1 ALA 69 86.284 13.586 0.808 325 2HB ALA 69 HB2 ALA 69 87.140 12.513 -0.299 326 3HB ALA 69 HB3 ALA 69 87.914 13.036 1.197 327 H GLN 70 HN GLN 70 84.669 13.419 1.701 328 HA GLN 70 HA GLN 70 84.503 13.062 4.626 329 1HB GLN 70 HB2 GLN 70 84.173 15.239 2.825 330 2HB GLN 70 HB1 GLN 70 82.684 15.028 3.746 331 1HG GLN 70 HG2 GLN 70 85.417 14.960 5.013 332 2HG GLN 70 HG1 GLN 70 84.446 16.438 4.922 333 1HE2 GLN 70 HE21 GLN 70 84.123 12.958 6.120 334 2HE2 GLN 70 HE22 GLN 70 83.079 13.375 7.380 335 H TYR 71 HN TYR 71 82.449 12.866 1.781 336 HA TYR 71 HA TYR 71 79.970 12.463 2.985 337 1HB TYR 71 HB2 TYR 71 81.208 11.164 0.538 338 2HB TYR 71 HB1 TYR 71 79.490 11.159 0.898 339 HD1 TYR 71 HD1 TYR 71 79.267 12.285 -1.351 340 HD2 TYR 71 HD2 TYR 71 81.245 14.224 1.950 341 HE1 TYR 71 HE1 TYR 71 78.975 14.482 -2.453 342 HE2 TYR 71 HE2 TYR 71 80.948 16.399 0.838 343 HH TYR 71 HH TYR 71 79.341 17.390 -0.868 344 H SER 72 HN SER 72 82.716 10.264 2.709 345 HA SER 72 HA SER 72 81.230 7.951 3.724 346 1HB SER 72 HB2 SER 72 84.222 8.452 3.683 347 2HB SER 72 HB1 SER 72 83.418 6.890 3.784 348 HG SER 72 HG SER 72 84.108 7.385 1.662 349 H GLU 73 HN GLU 73 82.680 10.746 5.098 350 HA GLU 73 HA GLU 73 83.297 11.333 7.296 351 1HB GLU 73 HB2 GLU 73 80.679 10.925 6.906 352 2HB GLU 73 HB1 GLU 73 80.960 9.705 8.151 353 1HG GLU 73 HG2 GLU 73 82.225 12.322 8.641 354 2HG GLU 73 HG1 GLU 73 80.463 12.340 8.667 355 H ASP 74 HN ASP 74 84.678 9.089 6.415 356 HA ASP 74 HA ASP 74 85.891 7.983 8.663 357 1HB ASP 74 HB2 ASP 74 83.205 6.927 8.143 358 2HB ASP 74 HB1 ASP 74 84.421 5.652 8.219 359 H LYS 75 HN LYS 75 87.686 7.870 7.244 360 HA LYS 75 HA LYS 75 89.122 6.792 5.693 361 1HB LYS 75 HB2 LYS 75 87.336 4.879 6.696 362 2HB LYS 75 HB1 LYS 75 87.253 4.676 4.946 363 1HG LYS 75 HG2 LYS 75 89.811 4.738 6.578 364 2HG LYS 75 HG1 LYS 75 89.045 3.280 5.947 365 1HD LYS 75 HD2 LYS 75 89.246 5.059 3.761 366 2HD LYS 75 HD1 LYS 75 90.800 5.136 4.593 367 1HE LYS 75 HE2 LYS 75 89.455 2.506 3.895 368 2HE LYS 75 HE1 LYS 75 90.631 3.302 2.832 369 1HZ LYS 75 HZ1 LYS 75 91.462 1.660 4.650 370 2HZ LYS 75 HZ2 LYS 75 91.225 2.974 5.700 371 3HZ LYS 75 HZ3 LYS 75 92.301 3.112 4.394 372 H ALA 76 HN ALA 76 89.401 7.037 3.437 373 HA ALA 76 HA ALA 76 86.922 7.743 1.893 374 1HB ALA 76 HB1 ALA 76 88.297 9.467 0.816 375 2HB ALA 76 HB2 ALA 76 89.714 8.925 1.715 376 3HB ALA 76 HB3 ALA 76 88.357 9.659 2.569 377 H ARG 77 HN ARG 77 89.876 7.927 0.153 378 HA ARG 77 HA ARG 77 90.640 6.645 -1.688 379 1HB ARG 77 HB2 ARG 77 90.357 4.983 0.736 380 2HB ARG 77 HB1 ARG 77 90.456 4.060 -0.765 381 1HG ARG 77 HG2 ARG 77 92.391 6.119 -0.961 382 2HG ARG 77 HG1 ARG 77 92.563 5.426 0.651 383 1HD ARG 77 HD2 ARG 77 93.448 3.508 -0.189 384 2HD ARG 77 HD1 ARG 77 92.162 3.372 -1.403 385 HE ARG 77 HE ARG 77 93.501 5.311 -2.568 386 1HH1 ARG 77 HH11 ARG 77 94.411 2.197 -2.167 387 2HH1 ARG 77 HH12 ARG 77 96.120 2.450 -2.292 388 1HH2 ARG 77 HH21 ARG 77 95.891 5.904 -2.081 389 2HH2 ARG 77 HH22 ARG 77 96.958 4.549 -2.244 390 H GLN 78 HN GLN 78 88.968 6.965 -3.230 391 HA GLN 78 HA GLN 78 87.199 6.320 -4.656 392 1HB GLN 78 HB2 GLN 78 88.313 4.221 -4.898 393 2HB GLN 78 HB1 GLN 78 87.897 3.726 -3.254 394 1HG GLN 78 HG2 GLN 78 85.598 4.398 -5.016 395 2HG GLN 78 HG1 GLN 78 86.490 2.935 -5.441 396 1HE2 GLN 78 HE21 GLN 78 83.951 4.034 -3.532 397 2HE2 GLN 78 HE22 GLN 78 83.934 2.797 -2.370 398 H GLY 79 HN GLY 79 86.576 4.338 -1.759 399 1HA GLY 79 HA2 GLY 79 84.578 6.031 -0.671 400 2HA GLY 79 HA1 GLY 79 83.793 4.828 -1.685 401 H GLY 80 HN GLY 80 86.596 4.710 0.532 402 1HA GLY 80 HA2 GLY 80 86.880 3.438 2.505 403 2HA GLY 80 HA1 GLY 80 85.182 2.972 2.403 404 H ASP 81 HN ASP 81 87.534 2.591 -0.207 405 HA ASP 81 HA ASP 81 86.836 -0.092 -0.798 406 1HB ASP 81 HB2 ASP 81 88.873 -0.010 -2.163 407 2HB ASP 81 HB1 ASP 81 88.036 1.545 -2.252 408 H LEU 82 HN LEU 82 86.825 -0.990 1.483 409 HA LEU 82 HA LEU 82 89.142 -1.280 3.098 410 1HB LEU 82 HB2 LEU 82 86.553 -2.729 2.662 411 2HB LEU 82 HB1 LEU 82 87.772 -3.488 3.686 412 HG LEU 82 HG LEU 82 86.594 -0.715 4.047 413 1HD1 LEU 82 HD11 LEU 82 85.493 -3.102 4.760 414 2HD1 LEU 82 HD12 LEU 82 85.255 -1.608 5.668 415 3HD1 LEU 82 HD13 LEU 82 86.483 -2.766 6.181 416 1HD2 LEU 82 HD21 LEU 82 88.079 -1.546 6.308 417 2HD2 LEU 82 HD22 LEU 82 88.467 -0.232 5.200 418 3HD2 LEU 82 HD23 LEU 82 89.104 -1.849 4.905 419 H GLY 83 HN GLY 83 88.119 -2.963 0.190 420 1HA GLY 83 HA2 GLY 83 89.661 -4.135 -1.248 421 2HA GLY 83 HA1 GLY 83 90.742 -4.351 0.135 422 H TRP 84 HN TRP 84 90.101 -6.525 -1.477 423 HA TRP 84 HA TRP 84 87.956 -8.177 -1.002 424 1HB TRP 84 HB2 TRP 84 90.922 -8.576 -1.217 425 2HB TRP 84 HB1 TRP 84 89.912 -9.973 -0.888 426 HD1 TRP 84 HD1 TRP 84 90.750 -7.468 -3.528 427 HE1 TRP 84 HE1 TRP 84 89.647 -8.142 -5.764 428 HE3 TRP 84 HE3 TRP 84 87.822 -11.294 -1.906 429 HZ2 TRP 84 HZ2 TRP 84 87.754 -10.072 -6.722 430 HZ3 TRP 84 HZ3 TRP 84 86.378 -12.537 -3.487 431 HH2 TRP 84 HH2 TRP 84 86.335 -11.934 -5.889 432 H MET 85 HN MET 85 86.906 -8.616 0.916 433 HA MET 85 HA MET 85 88.593 -9.239 3.315 434 1HB MET 85 HB2 MET 85 86.680 -7.073 2.818 435 2HB MET 85 HB1 MET 85 86.313 -7.985 4.282 436 1HG MET 85 HG2 MET 85 89.128 -7.073 3.710 437 2HG MET 85 HG1 MET 85 87.964 -5.979 4.459 438 1HE MET 85 HE1 MET 85 90.383 -7.007 7.165 439 2HE MET 85 HE2 MET 85 90.416 -6.414 5.506 440 3HE MET 85 HE3 MET 85 90.890 -8.075 5.849 441 H THR 86 HN THR 86 87.829 -10.960 4.522 442 HA THR 86 HA THR 86 85.370 -12.321 3.512 443 HB THR 86 HB THR 86 87.364 -13.640 3.368 444 HG1 THR 86 HG1 THR 86 85.302 -14.444 4.437 445 1HG2 THR 86 HG21 THR 86 87.706 -12.819 6.243 446 2HG2 THR 86 HG22 THR 86 88.823 -12.534 4.907 447 3HG2 THR 86 HG23 THR 86 88.599 -14.167 5.538 448 H ARG 87 HN ARG 87 83.915 -13.134 4.943 449 HA ARG 87 HA ARG 87 82.929 -11.615 7.040 450 1HB ARG 87 HB2 ARG 87 82.374 -14.035 5.828 451 2HB ARG 87 HB1 ARG 87 82.714 -14.515 7.490 452 1HG ARG 87 HG2 ARG 87 80.914 -13.338 8.342 453 2HG ARG 87 HG1 ARG 87 80.954 -12.138 7.051 454 1HD ARG 87 HD2 ARG 87 79.294 -13.282 6.013 455 2HD ARG 87 HD1 ARG 87 80.403 -14.654 5.828 456 HE ARG 87 HE ARG 87 78.239 -14.621 7.651 457 1HH1 ARG 87 HH11 ARG 87 80.988 -16.327 6.999 458 2HH1 ARG 87 HH12 ARG 87 81.273 -16.879 8.616 459 1HH2 ARG 87 HH21 ARG 87 78.880 -14.806 10.030 460 2HH2 ARG 87 HH22 ARG 87 80.078 -16.018 10.331 461 H GLY 88 HN GLY 88 85.602 -13.905 7.153 462 1HA GLY 88 HA2 GLY 88 85.872 -14.495 9.842 463 2HA GLY 88 HA1 GLY 88 87.265 -14.138 8.811 464 H SER 89 HN SER 89 86.297 -11.363 8.306 465 HA SER 89 HA SER 89 86.307 -10.076 10.962 466 1HB SER 89 HB2 SER 89 88.676 -10.471 9.232 467 2HB SER 89 HB1 SER 89 88.464 -8.822 9.838 468 HG SER 89 HG SER 89 89.323 -9.600 11.582 469 H MET 90 HN MET 90 84.450 -8.902 10.342 470 HA MET 90 HA MET 90 84.909 -6.633 8.533 471 1HB MET 90 HB2 MET 90 84.232 -8.812 7.237 472 2HB MET 90 HB1 MET 90 82.620 -8.469 7.867 473 1HG MET 90 HG2 MET 90 82.411 -6.508 6.644 474 2HG MET 90 HG1 MET 90 84.153 -6.237 6.586 475 1HE MET 90 HE1 MET 90 81.855 -5.988 4.679 476 2HE MET 90 HE2 MET 90 81.141 -7.542 4.256 477 3HE MET 90 HE3 MET 90 82.210 -6.732 3.113 478 H VAL 91 HN VAL 91 84.225 -6.970 11.350 479 HA VAL 91 HA VAL 91 82.808 -5.854 12.879 480 HB VAL 91 HB VAL 91 81.142 -4.917 10.557 481 1HG1 VAL 91 HG11 VAL 91 82.055 -2.889 12.370 482 2HG1 VAL 91 HG12 VAL 91 81.459 -4.258 13.310 483 3HG1 VAL 91 HG13 VAL 91 80.411 -3.477 12.125 484 1HG2 VAL 91 HG21 VAL 91 83.019 -3.010 10.571 485 2HG2 VAL 91 HG22 VAL 91 83.150 -4.422 9.523 486 3HG2 VAL 91 HG23 VAL 91 84.040 -4.368 11.046 487 H GLY 92 HN GLY 92 79.887 -5.475 12.217 488 1HA GLY 92 HA2 GLY 92 79.053 -8.345 12.297 489 2HA GLY 92 HA1 GLY 92 78.358 -7.141 13.391 490 HA PRO 93 HA PRO 93 75.189 -6.063 10.583 491 1HB PRO 93 HB2 PRO 93 75.805 -3.254 10.412 492 2HB PRO 93 HB1 PRO 93 74.554 -4.042 11.385 493 1HG PRO 93 HG2 PRO 93 77.043 -2.872 12.272 494 2HG PRO 93 HG1 PRO 93 75.754 -3.577 13.251 495 1HD PRO 93 HD2 PRO 93 78.351 -4.669 12.768 496 2HD PRO 93 HD1 PRO 93 77.005 -5.448 13.629 497 H PHE 94 HN PHE 94 78.325 -4.508 9.883 498 HA PHE 94 HA PHE 94 78.030 -3.816 7.193 499 1HB PHE 94 HB2 PHE 94 80.132 -4.471 9.075 500 2HB PHE 94 HB1 PHE 94 80.547 -5.085 7.468 501 HD1 PHE 94 HD1 PHE 94 82.214 -3.535 6.773 502 HD2 PHE 94 HD2 PHE 94 78.450 -2.111 8.273 503 HE1 PHE 94 HE1 PHE 94 82.796 -1.237 6.047 504 HE2 PHE 94 HE2 PHE 94 79.031 0.188 7.546 505 HZ PHE 94 HZ PHE 94 81.203 0.625 6.432 506 H GLN 95 HN GLN 95 78.718 -7.034 8.569 507 HA GLN 95 HA GLN 95 78.860 -8.374 5.991 508 1HB GLN 95 HB2 GLN 95 78.569 -9.211 8.882 509 2HB GLN 95 HB1 GLN 95 78.617 -10.394 7.576 510 1HG GLN 95 HG2 GLN 95 80.810 -9.674 6.900 511 2HG GLN 95 HG1 GLN 95 80.745 -8.278 7.977 512 1HE2 GLN 95 HE21 GLN 95 79.484 -11.402 9.035 513 2HE2 GLN 95 HE22 GLN 95 80.720 -11.728 10.153 514 H GLU 96 HN GLU 96 76.385 -8.292 8.582 515 HA GLU 96 HA GLU 96 74.407 -9.907 7.465 516 1HB GLU 96 HB2 GLU 96 74.546 -7.531 9.249 517 2HB GLU 96 HB1 GLU 96 72.950 -7.936 8.619 518 1HG GLU 96 HG2 GLU 96 73.519 -10.365 9.348 519 2HG GLU 96 HG1 GLU 96 74.781 -9.615 10.326 520 H ALA 97 HN ALA 97 75.301 -6.618 6.527 521 HA ALA 97 HA ALA 97 72.979 -6.372 4.715 522 1HB ALA 97 HB1 ALA 97 73.631 -4.415 5.924 523 2HB ALA 97 HB2 ALA 97 74.172 -4.149 4.265 524 3HB ALA 97 HB3 ALA 97 75.329 -4.640 5.501 525 H ALA 98 HN ALA 98 76.310 -5.452 3.988 526 HA ALA 98 HA ALA 98 76.226 -6.039 1.239 527 1HB ALA 98 HB1 ALA 98 78.747 -6.082 1.522 528 2HB ALA 98 HB2 ALA 98 78.479 -6.012 3.263 529 3HB ALA 98 HB3 ALA 98 77.946 -4.683 2.234 530 H PHE 99 HN PHE 99 78.398 -7.954 3.283 531 HA PHE 99 HA PHE 99 78.765 -10.201 1.814 532 1HB PHE 99 HB2 PHE 99 79.000 -9.443 4.482 533 2HB PHE 99 HB1 PHE 99 78.030 -10.921 4.546 534 HD1 PHE 99 HD1 PHE 99 81.259 -9.457 3.489 535 HD2 PHE 99 HD2 PHE 99 78.948 -13.059 3.870 536 HE1 PHE 99 HE1 PHE 99 83.299 -10.809 3.084 537 HE2 PHE 99 HE2 PHE 99 80.988 -14.410 3.464 538 HZ PHE 99 HZ PHE 99 83.164 -13.285 3.071 539 H ALA 100 HN ALA 100 75.972 -9.922 4.031 540 HA ALA 100 HA ALA 100 74.680 -12.333 3.313 541 1HB ALA 100 HB1 ALA 100 72.823 -11.384 4.454 542 2HB ALA 100 HB2 ALA 100 73.261 -9.747 3.967 543 3HB ALA 100 HB3 ALA 100 74.226 -10.593 5.174 544 H LEU 101 HN LEU 101 74.109 -9.046 1.987 545 HA LEU 101 HA LEU 101 72.387 -10.113 -0.142 546 1HB LEU 101 HB2 LEU 101 73.503 -7.376 0.549 547 2HB LEU 101 HB1 LEU 101 72.335 -7.668 -0.745 548 HG LEU 101 HG LEU 101 71.587 -8.874 1.835 549 1HD1 LEU 101 HD11 LEU 101 72.600 -6.202 1.839 550 2HD1 LEU 101 HD12 LEU 101 71.823 -7.073 3.161 551 3HD1 LEU 101 HD13 LEU 101 70.851 -6.120 2.040 552 1HD2 LEU 101 HD21 LEU 101 70.069 -6.897 0.129 553 2HD2 LEU 101 HD22 LEU 101 69.420 -8.155 1.182 554 3HD2 LEU 101 HD23 LEU 101 70.220 -8.594 -0.328 555 HA PRO 102 HA PRO 102 75.424 -10.621 -3.281 556 1HB PRO 102 HB2 PRO 102 73.941 -9.204 -5.298 557 2HB PRO 102 HB1 PRO 102 74.041 -10.955 -5.043 558 1HG PRO 102 HG2 PRO 102 71.798 -9.239 -4.561 559 2HG PRO 102 HG1 PRO 102 71.918 -10.977 -4.247 560 1HD PRO 102 HD2 PRO 102 71.900 -8.793 -2.326 561 2HD PRO 102 HD1 PRO 102 71.910 -10.547 -2.009 562 H VAL 103 HN VAL 103 77.046 -9.410 -4.484 563 HA VAL 103 HA VAL 103 77.980 -7.026 -3.481 564 HB VAL 103 HB VAL 103 79.067 -7.001 -5.827 565 1HG1 VAL 103 HG11 VAL 103 80.188 -9.299 -5.243 566 2HG1 VAL 103 HG12 VAL 103 79.206 -9.170 -3.784 567 3HG1 VAL 103 HG13 VAL 103 80.396 -7.923 -4.160 568 1HG2 VAL 103 HG21 VAL 103 77.049 -8.379 -6.725 569 2HG2 VAL 103 HG22 VAL 103 77.947 -9.752 -6.074 570 3HG2 VAL 103 HG23 VAL 103 78.674 -8.731 -7.314 571 H SER 104 HN SER 104 78.287 -5.050 -5.140 572 HA SER 104 HA SER 104 77.302 -3.467 -6.676 573 1HB SER 104 HB2 SER 104 74.624 -4.668 -5.955 574 2HB SER 104 HB1 SER 104 75.026 -3.658 -7.347 575 HG SER 104 HG SER 104 75.011 -5.749 -8.055 576 H GLY 105 HN GLY 105 77.371 -1.515 -5.809 577 1HA GLY 105 HA2 GLY 105 75.469 -0.724 -3.685 578 2HA GLY 105 HA1 GLY 105 77.180 -0.466 -3.372 579 H MET 106 HN MET 106 77.388 1.777 -3.571 580 HA MET 106 HA MET 106 77.571 3.842 -4.709 581 1HB MET 106 HB2 MET 106 78.450 2.006 -6.316 582 2HB MET 106 HB1 MET 106 76.926 2.215 -7.164 583 1HG MET 106 HG2 MET 106 77.751 4.823 -6.889 584 2HG MET 106 HG1 MET 106 79.294 3.979 -7.037 585 1HE MET 106 HE1 MET 106 75.858 3.071 -9.900 586 2HE MET 106 HE2 MET 106 75.760 4.649 -9.126 587 3HE MET 106 HE3 MET 106 75.833 3.197 -8.139 588 H ASP 107 HN ASP 107 76.046 4.698 -7.025 589 HA ASP 107 HA ASP 107 73.500 5.346 -5.793 590 1HB ASP 107 HB2 ASP 107 75.080 6.638 -7.447 591 2HB ASP 107 HB1 ASP 107 74.199 5.751 -8.692 592 H LYS 108 HN LYS 108 74.461 2.544 -7.178 593 HA LYS 108 HA LYS 108 71.693 1.801 -7.971 594 1HB LYS 108 HB2 LYS 108 73.167 2.452 -9.962 595 2HB LYS 108 HB1 LYS 108 74.190 1.069 -9.542 596 1HG LYS 108 HG2 LYS 108 71.714 -0.089 -9.530 597 2HG LYS 108 HG1 LYS 108 71.509 1.127 -10.792 598 1HD LYS 108 HD2 LYS 108 74.072 -0.084 -11.151 599 2HD LYS 108 HD1 LYS 108 72.888 -1.375 -10.953 600 1HE LYS 108 HE2 LYS 108 71.456 0.053 -12.644 601 2HE LYS 108 HE1 LYS 108 73.027 0.754 -13.075 602 1HZ LYS 108 HZ1 LYS 108 72.929 -2.139 -12.715 603 2HZ LYS 108 HZ2 LYS 108 73.800 -1.218 -13.845 604 3HZ LYS 108 HZ3 LYS 108 72.151 -1.537 -14.097 605 HA PRO 109 HA PRO 109 74.340 -0.942 -5.128 606 1HB PRO 109 HB2 PRO 109 72.231 -0.730 -3.179 607 2HB PRO 109 HB1 PRO 109 73.892 -0.135 -3.060 608 1HG PRO 109 HG2 PRO 109 71.527 1.413 -3.352 609 2HG PRO 109 HG1 PRO 109 73.197 1.992 -3.376 610 1HD PRO 109 HD2 PRO 109 71.341 1.767 -5.597 611 2HD PRO 109 HD1 PRO 109 72.958 2.496 -5.539 612 H VAL 110 HN VAL 110 73.630 -3.017 -4.145 613 HA VAL 110 HA VAL 110 72.164 -4.656 -5.901 614 HB VAL 110 HB VAL 110 73.902 -5.052 -3.993 615 1HG1 VAL 110 HG11 VAL 110 73.192 -5.117 -1.847 616 2HG1 VAL 110 HG12 VAL 110 71.703 -5.960 -2.276 617 3HG1 VAL 110 HG13 VAL 110 71.798 -4.204 -2.424 618 1HG2 VAL 110 HG21 VAL 110 72.052 -7.236 -3.682 619 2HG2 VAL 110 HG22 VAL 110 73.578 -7.185 -4.572 620 3HG2 VAL 110 HG23 VAL 110 72.081 -6.693 -5.360 621 H PHE 111 HN PHE 111 70.550 -5.999 -3.743 622 HA PHE 111 HA PHE 111 67.999 -4.819 -4.311 623 1HB PHE 111 HB2 PHE 111 69.088 -6.917 -2.442 624 2HB PHE 111 HB1 PHE 111 67.377 -6.475 -2.397 625 HD1 PHE 111 HD1 PHE 111 65.915 -6.894 -4.331 626 HD2 PHE 111 HD2 PHE 111 70.048 -8.064 -4.357 627 HE1 PHE 111 HE1 PHE 111 65.494 -8.336 -6.305 628 HE2 PHE 111 HE2 PHE 111 69.627 -9.506 -6.331 629 HZ PHE 111 HZ PHE 111 67.350 -9.643 -7.303 630 H THR 112 HN THR 112 70.187 -4.569 -1.522 631 HA THR 112 HA THR 112 68.222 -3.103 0.093 632 HB THR 112 HB THR 112 69.877 -4.458 1.192 633 HG1 THR 112 HG1 THR 112 69.773 -2.880 2.565 634 1HG2 THR 112 HG21 THR 112 71.723 -3.036 -0.664 635 2HG2 THR 112 HG22 THR 112 71.724 -4.725 -0.155 636 3HG2 THR 112 HG23 THR 112 72.356 -3.479 0.923 637 H ASP 113 HN ASP 113 69.152 -0.939 1.098 638 HA ASP 113 HA ASP 113 69.552 0.927 -1.179 639 1HB ASP 113 HB2 ASP 113 69.302 1.694 1.726 640 2HB ASP 113 HB1 ASP 113 68.721 2.555 0.305 641 HA PRO 114 HA PRO 114 73.803 1.537 -0.472 642 1HB PRO 114 HB2 PRO 114 73.752 4.402 -0.573 643 2HB PRO 114 HB1 PRO 114 74.196 3.260 -1.848 644 1HG PRO 114 HG2 PRO 114 71.831 4.864 -1.717 645 2HG PRO 114 HG1 PRO 114 72.242 3.653 -2.934 646 1HD PRO 114 HD2 PRO 114 70.265 3.478 -0.792 647 2HD PRO 114 HD1 PRO 114 70.557 2.337 -2.122 648 HA PRO 115 HA PRO 115 74.047 4.350 3.438 649 1HB PRO 115 HB2 PRO 115 71.386 5.177 4.155 650 2HB PRO 115 HB1 PRO 115 72.740 6.194 3.645 651 1HG PRO 115 HG2 PRO 115 70.355 5.632 2.189 652 2HG PRO 115 HG1 PRO 115 71.768 6.541 1.629 653 1HD PRO 115 HD2 PRO 115 70.911 3.849 0.876 654 2HD PRO 115 HD1 PRO 115 72.190 4.848 0.169 655 H VAL 116 HN VAL 116 74.242 2.014 4.076 656 HA VAL 116 HA VAL 116 71.854 0.741 5.256 657 HB VAL 116 HB VAL 116 73.275 -1.177 5.341 658 1HG1 VAL 116 HG11 VAL 116 72.775 0.075 3.017 659 2HG1 VAL 116 HG12 VAL 116 73.693 -1.430 3.095 660 3HG1 VAL 116 HG13 VAL 116 74.538 0.114 2.976 661 1HG2 VAL 116 HG21 VAL 116 75.691 -1.071 5.164 662 2HG2 VAL 116 HG22 VAL 116 75.173 0.013 6.455 663 3HG2 VAL 116 HG23 VAL 116 75.630 0.669 4.881 664 H LYS 117 HN LYS 117 71.705 0.238 7.508 665 HA LYS 117 HA LYS 117 73.261 2.064 9.259 666 1HB LYS 117 HB2 LYS 117 70.852 2.086 9.459 667 2HB LYS 117 HB1 LYS 117 70.805 0.323 9.608 668 1HG LYS 117 HG2 LYS 117 71.052 0.514 11.838 669 2HG LYS 117 HG1 LYS 117 72.609 1.318 11.586 670 1HD LYS 117 HD2 LYS 117 71.499 3.021 12.684 671 2HD LYS 117 HD1 LYS 117 70.999 3.390 11.026 672 1HE LYS 117 HE2 LYS 117 68.829 2.967 11.540 673 2HE LYS 117 HE1 LYS 117 69.252 1.384 12.220 674 1HZ LYS 117 HZ1 LYS 117 70.095 3.730 13.732 675 2HZ LYS 117 HZ2 LYS 117 69.506 2.237 14.289 676 3HZ LYS 117 HZ3 LYS 117 68.427 3.420 13.719 677 H THR 118 HN THR 118 75.042 1.256 10.270 678 HA THR 118 HA THR 118 75.055 -1.650 11.016 679 HB THR 118 HB THR 118 77.442 -1.636 10.390 680 HG1 THR 118 HG1 THR 118 77.959 0.484 10.807 681 1HG2 THR 118 HG21 THR 118 76.855 -0.651 7.884 682 2HG2 THR 118 HG22 THR 118 75.255 -1.018 8.529 683 3HG2 THR 118 HG23 THR 118 76.482 -2.282 8.443 684 H LYS 119 HN LYS 119 74.150 -0.081 12.962 685 HA LYS 119 HA LYS 119 74.583 0.529 15.208 686 1HB LYS 119 HB2 LYS 119 76.089 -1.568 14.773 687 2HB LYS 119 HB1 LYS 119 77.412 -0.402 14.747 688 1HG LYS 119 HG2 LYS 119 77.080 0.216 16.985 689 2HG LYS 119 HG1 LYS 119 75.414 -0.373 17.001 690 1HD LYS 119 HD2 LYS 119 76.071 -2.438 17.634 691 2HD LYS 119 HD1 LYS 119 77.295 -2.505 16.364 692 1HE LYS 119 HE2 LYS 119 78.921 -2.138 17.900 693 2HE LYS 119 HE1 LYS 119 78.130 -0.630 18.399 694 1HZ LYS 119 HZ1 LYS 119 76.483 -2.148 19.578 695 2HZ LYS 119 HZ2 LYS 119 78.025 -2.012 20.279 696 3HZ LYS 119 HZ3 LYS 119 77.621 -3.387 19.366 697 H PHE 120 HN PHE 120 75.126 2.371 12.905 698 HA PHE 120 HA PHE 120 76.799 4.322 14.399 699 1HB PHE 120 HB2 PHE 120 77.634 2.752 12.128 700 2HB PHE 120 HB1 PHE 120 77.589 4.461 11.674 701 HD1 PHE 120 HD1 PHE 120 78.908 2.076 14.222 702 HD2 PHE 120 HD2 PHE 120 79.228 5.982 12.463 703 HE1 PHE 120 HE1 PHE 120 81.018 2.464 15.467 704 HE2 PHE 120 HE2 PHE 120 81.338 6.370 13.708 705 HZ PHE 120 HZ PHE 120 82.233 4.611 15.210 706 H GLY 121 HN GLY 121 75.059 3.804 11.295 707 1HA GLY 121 HA2 GLY 121 72.987 5.618 11.646 708 2HA GLY 121 HA1 GLY 121 74.337 6.614 11.086 709 H TYR 122 HN TYR 122 74.470 6.834 8.909 710 HA TYR 122 HA TYR 122 73.191 4.732 7.184 711 1HB TYR 122 HB2 TYR 122 73.116 7.677 7.327 712 2HB TYR 122 HB1 TYR 122 73.364 7.053 5.697 713 HD1 TYR 122 HD1 TYR 122 71.590 5.096 8.256 714 HD2 TYR 122 HD2 TYR 122 71.152 7.761 4.917 715 HE1 TYR 122 HE1 TYR 122 69.182 4.518 8.112 716 HE2 TYR 122 HE2 TYR 122 68.744 7.183 4.771 717 HH TYR 122 HH TYR 122 66.987 6.074 6.945 718 H HIS 123 HN HIS 123 74.655 3.646 5.878 719 HA HIS 123 HA HIS 123 77.147 5.103 5.080 720 1HB HIS 123 HB2 HIS 123 77.332 2.197 5.695 721 2HB HIS 123 HB1 HIS 123 78.492 3.482 6.014 722 HD1 HIS 123 HD1 HIS 123 77.391 5.304 7.927 723 HD2 HIS 123 HD2 HIS 123 76.190 1.321 8.044 724 HE1 HIS 123 HE1 HIS 123 76.480 4.905 10.249 725 H ILE 124 HN ILE 124 77.681 4.802 2.916 726 HA ILE 124 HA ILE 124 75.898 3.093 1.284 727 HB ILE 124 HB ILE 124 78.211 4.811 0.374 728 1HG1 ILE 124 HG12 ILE 124 75.355 5.662 0.966 729 2HG1 ILE 124 HG11 ILE 124 76.795 6.183 1.853 730 1HG2 ILE 124 HG21 ILE 124 77.314 4.598 -1.713 731 2HG2 ILE 124 HG22 ILE 124 75.656 4.618 -1.112 732 3HG2 ILE 124 HG23 ILE 124 76.606 3.135 -1.029 733 1HD1 ILE 124 HD11 ILE 124 77.057 6.578 -1.037 734 2HD1 ILE 124 HD12 ILE 124 77.317 7.724 0.278 735 3HD1 ILE 124 HD13 ILE 124 75.693 7.467 -0.359 736 H ILE 125 HN ILE 125 76.559 0.940 1.500 737 HA ILE 125 HA ILE 125 79.452 0.307 1.334 738 HB ILE 125 HB ILE 125 76.924 -1.216 2.009 739 1HG1 ILE 125 HG12 ILE 125 79.324 -0.307 3.632 740 2HG1 ILE 125 HG11 ILE 125 77.670 0.311 3.758 741 1HG2 ILE 125 HG21 ILE 125 79.758 -2.126 1.607 742 2HG2 ILE 125 HG22 ILE 125 78.261 -2.874 1.051 743 3HG2 ILE 125 HG23 ILE 125 78.711 -2.960 2.754 744 1HD1 ILE 125 HD11 ILE 125 77.740 -1.246 5.507 745 2HD1 ILE 125 HD12 ILE 125 78.763 -2.363 4.603 746 3HD1 ILE 125 HD13 ILE 125 77.055 -2.203 4.191 747 H MET 126 HN MET 126 80.311 -0.483 -0.541 748 HA MET 126 HA MET 126 78.449 -1.483 -2.656 749 1HB MET 126 HB2 MET 126 81.207 -0.345 -3.122 750 2HB MET 126 HB1 MET 126 79.844 -0.421 -4.246 751 1HG MET 126 HG2 MET 126 78.690 1.115 -2.400 752 2HG MET 126 HG1 MET 126 80.373 1.517 -2.024 753 1HE MET 126 HE1 MET 126 82.056 2.753 -4.673 754 2HE MET 126 HE2 MET 126 81.749 2.626 -2.942 755 3HE MET 126 HE3 MET 126 81.259 4.077 -3.813 756 H VAL 127 HN VAL 127 78.618 -3.693 -2.103 757 HA VAL 127 HA VAL 127 81.300 -4.907 -1.755 758 HB VAL 127 HB VAL 127 79.696 -5.830 -0.291 759 1HG1 VAL 127 HG11 VAL 127 77.613 -5.038 -0.861 760 2HG1 VAL 127 HG12 VAL 127 77.451 -6.697 -1.431 761 3HG1 VAL 127 HG13 VAL 127 77.825 -5.407 -2.572 762 1HG2 VAL 127 HG21 VAL 127 80.697 -7.454 -2.329 763 2HG2 VAL 127 HG22 VAL 127 78.994 -7.898 -2.202 764 3HG2 VAL 127 HG23 VAL 127 80.039 -7.993 -0.785 765 H GLU 128 HN GLU 128 82.417 -5.650 -3.512 766 HA GLU 128 HA GLU 128 80.946 -6.788 -5.797 767 1HB GLU 128 HB2 GLU 128 81.782 -4.105 -5.668 768 2HB GLU 128 HB1 GLU 128 82.966 -4.915 -6.704 769 1HG GLU 128 HG2 GLU 128 81.208 -5.770 -8.141 770 2HG GLU 128 HG1 GLU 128 79.959 -5.160 -7.045 771 H GLY 129 HN GLY 129 82.066 -8.768 -5.389 772 1HA GLY 129 HA2 GLY 129 84.071 -9.749 -6.666 773 2HA GLY 129 HA1 GLY 129 85.029 -8.637 -5.685 774 H ARG 130 HN ARG 130 82.832 -11.406 -5.471 775 HA ARG 130 HA ARG 130 83.879 -12.019 -2.754 776 1HB ARG 130 HB2 ARG 130 81.784 -13.512 -4.326 777 2HB ARG 130 HB1 ARG 130 81.954 -13.401 -2.576 778 1HG ARG 130 HG2 ARG 130 81.510 -10.902 -2.814 779 2HG ARG 130 HG1 ARG 130 81.051 -11.231 -4.485 780 1HD ARG 130 HD2 ARG 130 79.802 -12.835 -2.259 781 2HD ARG 130 HD1 ARG 130 79.175 -11.223 -2.654 782 HE ARG 130 HE ARG 130 79.508 -12.554 -5.113 783 1HH1 ARG 130 HH11 ARG 130 78.675 -15.023 -3.765 784 2HH1 ARG 130 HH12 ARG 130 76.946 -14.940 -3.815 785 1HH2 ARG 130 HH21 ARG 130 76.863 -11.543 -4.504 786 2HH2 ARG 130 HH22 ARG 130 75.920 -12.971 -4.234 787 H LYS 131 HN LYS 131 84.581 -14.312 -2.372 788 HA LYS 131 HA LYS 131 85.082 -16.203 -4.428 789 1HB LYS 131 HB2 LYS 131 86.983 -15.470 -5.445 790 2HB LYS 131 HB1 LYS 131 86.600 -13.905 -4.739 791 1HG LYS 131 HG2 LYS 131 88.360 -16.023 -3.468 792 2HG LYS 131 HG1 LYS 131 88.928 -14.548 -4.248 793 1HD LYS 131 HD2 LYS 131 88.366 -13.244 -2.470 794 2HD LYS 131 HD1 LYS 131 86.868 -14.127 -2.174 795 1HE LYS 131 HE2 LYS 131 87.884 -15.198 -0.454 796 2HE LYS 131 HE1 LYS 131 89.044 -15.900 -1.607 797 1HZ LYS 131 HZ1 LYS 131 90.095 -13.568 -1.540 798 2HZ LYS 131 HZ2 LYS 131 90.379 -14.605 -0.226 799 3HZ LYS 131 HZ3 LYS 131 89.230 -13.362 -0.096 Start of MODEL 12 1 1H GLY 28 HT1 GLY 28 101.392 -21.802 -1.217 2 2H GLY 28 HT2 GLY 28 101.814 -23.044 -2.297 3 3H GLY 28 HT3 GLY 28 100.781 -21.792 -2.800 4 1HA GLY 28 HA2 GLY 28 103.369 -20.943 -1.802 5 2HA GLY 28 HA1 GLY 28 103.390 -21.838 -3.322 6 H SER 29 HN SER 29 101.629 -21.058 -4.932 7 HA SER 29 HA SER 29 101.679 -18.066 -4.943 8 1HB SER 29 HB2 SER 29 101.049 -19.832 -7.295 9 2HB SER 29 HB1 SER 29 101.839 -18.255 -7.274 10 HG SER 29 HG SER 29 103.454 -19.686 -7.571 11 H GLY 30 HN GLY 30 99.712 -17.063 -6.037 12 1HA GLY 30 HA2 GLY 30 97.379 -16.868 -6.356 13 2HA GLY 30 HA1 GLY 30 97.235 -18.602 -6.072 14 HA PRO 31 HA PRO 31 95.641 -16.087 -2.409 15 1HB PRO 31 HB2 PRO 31 93.295 -17.752 -2.534 16 2HB PRO 31 HB1 PRO 31 93.415 -16.007 -2.827 17 1HG PRO 31 HG2 PRO 31 92.979 -18.095 -4.752 18 2HG PRO 31 HG1 PRO 31 93.107 -16.358 -5.044 19 1HD PRO 31 HD2 PRO 31 95.024 -18.416 -5.709 20 2HD PRO 31 HD1 PRO 31 95.146 -16.666 -6.013 21 H LYS 32 HN LYS 32 94.261 -19.362 -2.634 22 HA LYS 32 HA LYS 32 94.497 -21.204 -1.164 23 1HB LYS 32 HB2 LYS 32 96.803 -20.668 -2.466 24 2HB LYS 32 HB1 LYS 32 97.364 -20.476 -0.805 25 1HG LYS 32 HG2 LYS 32 95.713 -22.876 -1.550 26 2HG LYS 32 HG1 LYS 32 97.438 -22.852 -1.923 27 1HD LYS 32 HD2 LYS 32 97.736 -22.122 0.554 28 2HD LYS 32 HD1 LYS 32 96.091 -22.720 0.771 29 1HE LYS 32 HE2 LYS 32 97.129 -24.823 -0.569 30 2HE LYS 32 HE1 LYS 32 98.599 -24.238 0.232 31 1HZ LYS 32 HZ1 LYS 32 97.427 -25.702 1.724 32 2HZ LYS 32 HZ2 LYS 32 95.982 -24.833 1.519 33 3HZ LYS 32 HZ3 LYS 32 97.300 -24.118 2.315 34 H GLY 33 HN GLY 33 93.260 -20.056 0.553 35 1HA GLY 33 HA2 GLY 33 94.099 -20.224 3.108 36 2HA GLY 33 HA1 GLY 33 94.847 -18.697 2.640 37 H GLY 34 HN GLY 34 91.790 -20.332 3.216 38 1HA GLY 34 HA1 GLY 34 89.813 -19.299 4.059 39 2HA GLY 34 HA2 GLY 34 90.524 -17.721 3.722 40 H GLY 35 HN GLY 35 88.330 -17.285 2.760 41 1HA GLY 35 HA1 GLY 35 88.392 -17.338 -0.074 42 2HA GLY 35 HA2 GLY 35 87.380 -18.690 0.455 43 H ASN 36 HN ASN 36 86.009 -16.948 -0.944 44 HA ASN 36 HA ASN 36 84.172 -15.472 -0.906 45 1HB ASN 36 HB2 ASN 36 84.173 -16.164 2.035 46 2HB ASN 36 HB1 ASN 36 82.797 -15.687 1.044 47 1HD2 ASN 36 HD21 ASN 36 84.051 -17.450 -1.211 48 2HD2 ASN 36 HD22 ASN 36 83.573 -19.022 -0.787 49 H ALA 37 HN ALA 37 85.274 -13.537 -1.281 50 HA ALA 37 HA ALA 37 85.537 -11.734 1.071 51 1HB ALA 37 HB1 ALA 37 87.694 -13.039 -0.145 52 2HB ALA 37 HB2 ALA 37 87.798 -11.620 0.897 53 3HB ALA 37 HB3 ALA 37 87.716 -11.423 -0.854 54 H VAL 38 HN VAL 38 84.071 -10.166 0.444 55 HA VAL 38 HA VAL 38 83.736 -9.481 -2.394 56 HB VAL 38 HB VAL 38 81.872 -8.151 -1.494 57 1HG1 VAL 38 HG11 VAL 38 81.645 -10.623 -1.853 58 2HG1 VAL 38 HG12 VAL 38 80.587 -10.009 -0.582 59 3HG1 VAL 38 HG13 VAL 38 82.069 -10.866 -0.158 60 1HG2 VAL 38 HG21 VAL 38 83.211 -7.542 0.606 61 2HG2 VAL 38 HG22 VAL 38 82.729 -9.117 1.236 62 3HG2 VAL 38 HG23 VAL 38 81.502 -7.913 0.846 63 H LYS 39 HN LYS 39 84.184 -7.293 -3.306 64 HA LYS 39 HA LYS 39 86.219 -5.833 -1.714 65 1HB LYS 39 HB2 LYS 39 85.629 -6.455 -4.400 66 2HB LYS 39 HB1 LYS 39 85.381 -4.709 -4.265 67 1HG LYS 39 HG2 LYS 39 87.884 -6.291 -3.616 68 2HG LYS 39 HG1 LYS 39 87.698 -5.001 -4.813 69 1HD LYS 39 HD2 LYS 39 87.055 -3.504 -2.807 70 2HD LYS 39 HD1 LYS 39 87.757 -4.779 -1.801 71 1HE LYS 39 HE2 LYS 39 89.856 -4.075 -2.291 72 2HE LYS 39 HE1 LYS 39 89.517 -4.139 -4.031 73 1HZ LYS 39 HZ1 LYS 39 89.187 -1.920 -2.143 74 2HZ LYS 39 HZ2 LYS 39 88.057 -2.054 -3.405 75 3HZ LYS 39 HZ3 LYS 39 89.710 -1.890 -3.756 76 H VAL 40 HN VAL 40 84.869 -4.945 -0.041 77 HA VAL 40 HA VAL 40 82.477 -3.401 -0.804 78 HB VAL 40 HB VAL 40 82.697 -5.124 1.055 79 1HG1 VAL 40 HG11 VAL 40 83.930 -2.793 2.538 80 2HG1 VAL 40 HG12 VAL 40 84.887 -4.114 1.869 81 3HG1 VAL 40 HG13 VAL 40 83.691 -4.439 3.124 82 1HG2 VAL 40 HG21 VAL 40 81.724 -2.371 1.865 83 2HG2 VAL 40 HG22 VAL 40 81.150 -3.921 2.482 84 3HG2 VAL 40 HG23 VAL 40 80.829 -3.464 0.809 85 H ARG 41 HN ARG 41 82.099 -1.265 -0.290 86 HA ARG 41 HA ARG 41 84.418 0.417 0.638 87 1HB ARG 41 HB2 ARG 41 82.386 0.936 -1.566 88 2HB ARG 41 HB1 ARG 41 83.610 2.089 -1.038 89 1HG ARG 41 HG2 ARG 41 85.357 0.345 -1.594 90 2HG ARG 41 HG1 ARG 41 84.070 -0.616 -2.323 91 1HD ARG 41 HD2 ARG 41 83.585 1.740 -3.555 92 2HD ARG 41 HD1 ARG 41 85.338 1.899 -3.300 93 HE ARG 41 HE ARG 41 84.399 -0.703 -4.355 94 1HH1 ARG 41 HH11 ARG 41 87.163 0.761 -4.493 95 2HH1 ARG 41 HH12 ARG 41 87.247 1.062 -6.196 96 1HH2 ARG 41 HH21 ARG 41 83.890 0.391 -6.750 97 2HH2 ARG 41 HH22 ARG 41 85.394 0.854 -7.475 98 H HIS 42 HN HIS 42 83.693 2.265 2.018 99 HA HIS 42 HA HIS 42 80.757 2.187 2.628 100 1HB HIS 42 HB2 HIS 42 81.162 1.525 4.738 101 2HB HIS 42 HB1 HIS 42 82.771 1.088 4.156 102 HD1 HIS 42 HD1 HIS 42 81.129 3.108 6.654 103 HD2 HIS 42 HD2 HIS 42 84.656 3.454 4.460 104 HE1 HIS 42 HE1 HIS 42 82.566 4.800 7.872 105 H ILE 43 HN ILE 43 79.801 4.120 2.651 106 HA ILE 43 HA ILE 43 81.454 6.606 3.010 107 HB ILE 43 HB ILE 43 79.487 5.714 1.004 108 1HG1 ILE 43 HG12 ILE 43 81.402 8.062 1.039 109 2HG1 ILE 43 HG11 ILE 43 81.853 6.417 0.570 110 1HG2 ILE 43 HG21 ILE 43 79.218 8.459 2.264 111 2HG2 ILE 43 HG22 ILE 43 77.960 7.239 2.084 112 3HG2 ILE 43 HG23 ILE 43 78.596 8.063 0.662 113 1HD1 ILE 43 HD11 ILE 43 79.965 6.531 -1.139 114 2HD1 ILE 43 HD12 ILE 43 81.335 7.595 -1.460 115 3HD1 ILE 43 HD13 ILE 43 79.850 8.253 -0.774 116 H LEU 44 HN LEU 44 80.980 7.408 5.100 117 HA LEU 44 HA LEU 44 78.297 6.902 6.283 118 1HB LEU 44 HB2 LEU 44 81.022 7.732 7.156 119 2HB LEU 44 HB1 LEU 44 79.683 8.461 8.034 120 HG LEU 44 HG LEU 44 80.774 5.807 8.271 121 1HD1 LEU 44 HD11 LEU 44 78.671 7.338 9.833 122 2HD1 LEU 44 HD12 LEU 44 80.414 7.471 10.081 123 3HD1 LEU 44 HD13 LEU 44 79.590 5.948 10.417 124 1HD2 LEU 44 HD21 LEU 44 77.761 6.018 8.043 125 2HD2 LEU 44 HD22 LEU 44 78.683 4.582 8.492 126 3HD2 LEU 44 HD23 LEU 44 78.807 5.237 6.865 127 H CYS 45 HN CYS 45 76.921 8.542 6.994 128 HA CYS 45 HA CYS 45 77.596 11.351 6.290 129 1HB CYS 45 HB2 CYS 45 75.124 9.807 5.442 130 2HB CYS 45 HB1 CYS 45 75.366 11.545 5.196 131 HG CYS 45 HG CYS 45 76.902 9.286 3.710 132 H GLU 46 HN GLU 46 77.816 11.079 8.751 133 HA GLU 46 HA GLU 46 75.955 10.482 10.655 134 1HB GLU 46 HB2 GLU 46 78.225 11.557 10.903 135 2HB GLU 46 HB1 GLU 46 77.467 13.107 10.541 136 1HG GLU 46 HG2 GLU 46 76.890 13.293 12.707 137 2HG GLU 46 HG1 GLU 46 75.874 11.862 12.534 138 H LYS 47 HN LYS 47 75.655 13.136 8.344 139 HA LYS 47 HA LYS 47 73.144 14.013 9.725 140 1HB LYS 47 HB2 LYS 47 73.538 16.061 8.250 141 2HB LYS 47 HB1 LYS 47 74.761 15.771 9.487 142 1HG LYS 47 HG2 LYS 47 76.373 15.274 7.953 143 2HG LYS 47 HG1 LYS 47 75.248 14.414 6.904 144 1HD LYS 47 HD2 LYS 47 75.509 16.247 5.563 145 2HD LYS 47 HD1 LYS 47 74.311 16.954 6.647 146 1HE LYS 47 HE2 LYS 47 77.032 17.145 7.725 147 2HE LYS 47 HE1 LYS 47 76.844 17.992 6.178 148 1HZ LYS 47 HZ1 LYS 47 74.639 18.225 8.067 149 2HZ LYS 47 HZ2 LYS 47 75.302 19.394 7.027 150 3HZ LYS 47 HZ3 LYS 47 76.065 19.033 8.502 151 H HIS 48 HN HIS 48 74.184 12.108 7.191 152 HA HIS 48 HA HIS 48 73.085 11.182 5.332 153 1HB HIS 48 HB2 HIS 48 70.743 12.428 6.803 154 2HB HIS 48 HB1 HIS 48 70.611 11.202 5.542 155 HD1 HIS 48 HD1 HIS 48 73.530 10.134 7.023 156 HD2 HIS 48 HD2 HIS 48 69.600 10.130 8.409 157 HE1 HIS 48 HE1 HIS 48 73.433 8.404 8.870 158 H GLY 49 HN GLY 49 73.747 14.291 5.612 159 1HA GLY 49 HA2 GLY 49 72.007 15.388 3.507 160 2HA GLY 49 HA1 GLY 49 73.336 16.242 4.309 161 H LYS 50 HN LYS 50 75.257 14.099 3.900 162 HA LYS 50 HA LYS 50 75.957 14.659 1.073 163 1HB LYS 50 HB2 LYS 50 77.461 13.135 3.223 164 2HB LYS 50 HB1 LYS 50 78.135 13.830 1.749 165 1HG LYS 50 HG2 LYS 50 78.595 15.659 2.990 166 2HG LYS 50 HG1 LYS 50 76.861 15.983 2.963 167 1HD LYS 50 HD2 LYS 50 77.359 15.962 5.264 168 2HD LYS 50 HD1 LYS 50 76.755 14.330 4.972 169 1HE LYS 50 HE2 LYS 50 78.909 13.381 5.072 170 2HE LYS 50 HE1 LYS 50 79.707 14.934 4.735 171 1HZ LYS 50 HZ1 LYS 50 78.744 15.761 6.848 172 2HZ LYS 50 HZ2 LYS 50 79.853 14.494 7.079 173 3HZ LYS 50 HZ3 LYS 50 78.183 14.196 7.183 174 H ILE 51 HN ILE 51 74.802 12.048 3.111 175 HA ILE 51 HA ILE 51 75.543 9.759 1.710 176 HB ILE 51 HB ILE 51 74.063 9.989 3.761 177 1HG1 ILE 51 HG12 ILE 51 72.532 8.046 3.006 178 2HG1 ILE 51 HG11 ILE 51 73.359 8.184 1.447 179 1HG2 ILE 51 HG21 ILE 51 71.746 10.141 1.858 180 2HG2 ILE 51 HG22 ILE 51 72.526 11.629 2.397 181 3HG2 ILE 51 HG23 ILE 51 71.804 10.532 3.578 182 1HD1 ILE 51 HD11 ILE 51 75.541 7.919 2.611 183 2HD1 ILE 51 HD12 ILE 51 74.497 6.519 2.849 184 3HD1 ILE 51 HD13 ILE 51 74.686 7.708 4.139 185 H MET 52 HN MET 52 73.229 12.242 0.764 186 HA MET 52 HA MET 52 72.418 10.766 -1.631 187 1HB MET 52 HB2 MET 52 71.498 12.936 -0.046 188 2HB MET 52 HB1 MET 52 71.809 13.585 -1.655 189 1HG MET 52 HG2 MET 52 70.417 10.968 -1.557 190 2HG MET 52 HG1 MET 52 69.493 12.353 -0.976 191 1HE MET 52 HE1 MET 52 71.598 11.992 -5.018 192 2HE MET 52 HE2 MET 52 72.059 11.312 -3.461 193 3HE MET 52 HE3 MET 52 72.323 13.025 -3.778 194 H GLU 53 HN GLU 53 74.304 13.649 -0.859 195 HA GLU 53 HA GLU 53 75.194 14.312 -3.460 196 1HB GLU 53 HB2 GLU 53 75.716 15.002 -0.741 197 2HB GLU 53 HB1 GLU 53 77.274 14.625 -1.477 198 1HG GLU 53 HG2 GLU 53 77.233 16.502 -2.740 199 2HG GLU 53 HG1 GLU 53 75.568 16.208 -3.242 200 H ALA 54 HN ALA 54 76.014 11.824 -1.168 201 HA ALA 54 HA ALA 54 78.399 10.896 -2.618 202 1HB ALA 54 HB1 ALA 54 78.673 9.880 -0.607 203 2HB ALA 54 HB2 ALA 54 77.200 8.945 -0.868 204 3HB ALA 54 HB3 ALA 54 77.115 10.526 -0.093 205 H MET 55 HN MET 55 74.947 10.241 -2.438 206 HA MET 55 HA MET 55 75.076 7.808 -4.082 207 1HB MET 55 HB2 MET 55 72.999 9.606 -2.890 208 2HB MET 55 HB1 MET 55 72.504 8.491 -4.168 209 1HG MET 55 HG2 MET 55 73.846 6.728 -2.734 210 2HG MET 55 HG1 MET 55 73.573 7.885 -1.425 211 1HE MET 55 HE1 MET 55 71.122 7.536 0.087 212 2HE MET 55 HE2 MET 55 72.572 6.550 -0.078 213 3HE MET 55 HE3 MET 55 70.984 5.789 -0.153 214 H GLU 56 HN GLU 56 74.112 11.208 -4.636 215 HA GLU 56 HA GLU 56 73.520 10.837 -7.448 216 1HB GLU 56 HB2 GLU 56 73.367 12.843 -5.417 217 2HB GLU 56 HB1 GLU 56 74.232 13.535 -6.788 218 1HG GLU 56 HG2 GLU 56 72.417 12.841 -8.299 219 2HG GLU 56 HG1 GLU 56 71.555 12.114 -6.942 220 H LYS 57 HN LYS 57 76.172 12.705 -5.896 221 HA LYS 57 HA LYS 57 77.778 13.201 -8.094 222 1HB LYS 57 HB2 LYS 57 78.623 12.266 -5.331 223 2HB LYS 57 HB1 LYS 57 79.653 13.140 -6.465 224 1HG LYS 57 HG2 LYS 57 77.007 14.368 -5.886 225 2HG LYS 57 HG1 LYS 57 78.178 14.387 -4.570 226 1HD LYS 57 HD2 LYS 57 79.152 15.163 -7.274 227 2HD LYS 57 HD1 LYS 57 78.112 16.309 -6.432 228 1HE LYS 57 HE2 LYS 57 79.952 15.384 -4.491 229 2HE LYS 57 HE1 LYS 57 80.904 15.731 -5.947 230 1HZ LYS 57 HZ1 LYS 57 78.751 17.580 -5.187 231 2HZ LYS 57 HZ2 LYS 57 80.208 17.901 -6.000 232 3HZ LYS 57 HZ3 LYS 57 80.207 17.654 -4.320 233 H LEU 58 HN LEU 58 78.271 10.287 -6.009 234 HA LEU 58 HA LEU 58 80.049 8.874 -7.631 235 1HB LEU 58 HB2 LEU 58 77.828 8.193 -5.762 236 2HB LEU 58 HB1 LEU 58 78.443 6.877 -6.763 237 HG LEU 58 HG LEU 58 80.793 7.796 -5.981 238 1HD1 LEU 58 HD11 LEU 58 80.864 8.975 -3.982 239 2HD1 LEU 58 HD12 LEU 58 79.263 8.428 -3.485 240 3HD1 LEU 58 HD13 LEU 58 79.425 9.677 -4.718 241 1HD2 LEU 58 HD21 LEU 58 79.066 6.286 -4.000 242 2HD2 LEU 58 HD22 LEU 58 80.805 6.129 -4.251 243 3HD2 LEU 58 HD23 LEU 58 79.682 5.558 -5.485 244 H LYS 59 HN LYS 59 76.524 9.169 -7.996 245 HA LYS 59 HA LYS 59 76.349 7.380 -10.287 246 1HB LYS 59 HB2 LYS 59 74.631 9.158 -8.650 247 2HB LYS 59 HB1 LYS 59 74.083 8.891 -10.305 248 1HG LYS 59 HG2 LYS 59 74.897 6.366 -9.397 249 2HG LYS 59 HG1 LYS 59 74.022 7.074 -8.039 250 1HD LYS 59 HD2 LYS 59 72.058 6.747 -9.088 251 2HD LYS 59 HD1 LYS 59 72.621 7.664 -10.486 252 1HE LYS 59 HE2 LYS 59 72.128 5.469 -11.321 253 2HE LYS 59 HE1 LYS 59 73.894 5.509 -11.154 254 1HZ LYS 59 HZ1 LYS 59 71.889 4.310 -9.333 255 2HZ LYS 59 HZ2 LYS 59 73.438 4.730 -8.775 256 3HZ LYS 59 HZ3 LYS 59 73.260 3.581 -10.015 257 H SER 60 HN SER 60 75.440 10.835 -10.155 258 HA SER 60 HA SER 60 75.430 11.510 -12.810 259 1HB SER 60 HB2 SER 60 76.916 13.539 -11.437 260 2HB SER 60 HB1 SER 60 75.191 13.514 -11.798 261 HG SER 60 HG SER 60 76.452 12.298 -9.569 262 H GLY 61 HN GLY 61 78.288 10.780 -10.888 263 1HA GLY 61 HA2 GLY 61 80.297 9.915 -11.977 264 2HA GLY 61 HA1 GLY 61 79.895 10.891 -13.398 265 H MET 62 HN MET 62 79.775 12.066 -10.053 266 HA MET 62 HA MET 62 81.577 14.270 -10.791 267 1HB MET 62 HB2 MET 62 79.416 13.912 -9.118 268 2HB MET 62 HB1 MET 62 80.765 13.917 -7.982 269 1HG MET 62 HG2 MET 62 80.430 16.195 -8.129 270 2HG MET 62 HG1 MET 62 81.510 15.998 -9.510 271 1HE MET 62 HE1 MET 62 77.848 16.654 -8.282 272 2HE MET 62 HE2 MET 62 77.929 14.956 -8.746 273 3HE MET 62 HE3 MET 62 76.920 16.068 -9.670 274 H ARG 63 HN ARG 63 82.573 14.372 -7.959 275 HA ARG 63 HA ARG 63 85.075 12.980 -8.361 276 1HB ARG 63 HB2 ARG 63 83.773 14.285 -5.952 277 2HB ARG 63 HB1 ARG 63 85.472 13.797 -6.041 278 1HG ARG 63 HG2 ARG 63 86.008 15.456 -7.562 279 2HG ARG 63 HG1 ARG 63 84.357 15.577 -8.177 280 1HD ARG 63 HD2 ARG 63 83.910 17.249 -6.707 281 2HD ARG 63 HD1 ARG 63 84.382 16.204 -5.348 282 HE ARG 63 HE ARG 63 86.742 17.064 -6.733 283 1HH1 ARG 63 HH11 ARG 63 84.721 17.639 -4.085 284 2HH1 ARG 63 HH12 ARG 63 85.425 19.166 -3.669 285 1HH2 ARG 63 HH21 ARG 63 87.439 19.306 -6.489 286 2HH2 ARG 63 HH22 ARG 63 86.965 20.111 -5.031 287 H PHE 64 HN PHE 64 85.452 10.829 -7.898 288 HA PHE 64 HA PHE 64 83.491 9.347 -6.265 289 1HB PHE 64 HB2 PHE 64 85.865 8.707 -8.026 290 2HB PHE 64 HB1 PHE 64 85.175 7.471 -6.974 291 HD1 PHE 64 HD1 PHE 64 85.122 8.610 -10.219 292 HD2 PHE 64 HD2 PHE 64 82.400 7.599 -7.056 293 HE1 PHE 64 HE1 PHE 64 83.339 8.183 -11.889 294 HE2 PHE 64 HE2 PHE 64 80.618 7.175 -8.723 295 HZ PHE 64 HZ PHE 64 81.085 7.465 -11.140 296 H ASN 65 HN ASN 65 86.777 10.604 -6.196 297 HA ASN 65 HA ASN 65 87.392 9.263 -3.632 298 1HB ASN 65 HB2 ASN 65 89.065 9.444 -5.431 299 2HB ASN 65 HB1 ASN 65 88.932 11.203 -5.388 300 1HD2 ASN 65 HD21 ASN 65 90.471 8.461 -3.915 301 2HD2 ASN 65 HD22 ASN 65 91.270 9.306 -2.679 302 H GLU 66 HN GLU 66 86.671 12.546 -4.832 303 HA GLU 66 HA GLU 66 87.321 13.894 -2.369 304 1HB GLU 66 HB2 GLU 66 85.251 14.672 -4.443 305 2HB GLU 66 HB1 GLU 66 86.162 15.748 -3.390 306 1HG GLU 66 HG2 GLU 66 87.919 14.017 -4.948 307 2HG GLU 66 HG1 GLU 66 86.882 14.998 -5.980 308 H VAL 67 HN VAL 67 84.254 12.660 -3.726 309 HA VAL 67 HA VAL 67 82.642 13.353 -1.473 310 HB VAL 67 HB VAL 67 81.133 11.596 -2.432 311 1HG1 VAL 67 HG11 VAL 67 82.419 13.256 -4.588 312 2HG1 VAL 67 HG12 VAL 67 81.286 13.902 -3.401 313 3HG1 VAL 67 HG13 VAL 67 80.753 12.668 -4.550 314 1HG2 VAL 67 HG21 VAL 67 83.616 10.983 -3.975 315 2HG2 VAL 67 HG22 VAL 67 82.028 10.633 -4.662 316 3HG2 VAL 67 HG23 VAL 67 82.521 9.879 -3.147 317 H ALA 68 HN ALA 68 84.181 10.220 -2.384 318 HA ALA 68 HA ALA 68 83.539 8.762 -0.059 319 1HB ALA 68 HB1 ALA 68 85.930 7.755 -0.672 320 2HB ALA 68 HB2 ALA 68 85.766 8.802 -2.082 321 3HB ALA 68 HB3 ALA 68 84.572 7.542 -1.775 322 H ALA 69 HN ALA 69 86.026 11.144 -0.743 323 HA ALA 69 HA ALA 69 87.622 10.931 1.552 324 1HB ALA 69 HB1 ALA 69 87.063 13.688 0.900 325 2HB ALA 69 HB2 ALA 69 87.140 12.740 -0.585 326 3HB ALA 69 HB3 ALA 69 88.506 12.746 0.530 327 H GLN 70 HN GLN 70 85.257 13.616 1.338 328 HA GLN 70 HA GLN 70 84.829 13.203 4.220 329 1HB GLN 70 HB2 GLN 70 84.634 15.451 2.378 330 2HB GLN 70 HB1 GLN 70 83.307 15.389 3.526 331 1HG GLN 70 HG2 GLN 70 86.250 15.637 4.102 332 2HG GLN 70 HG1 GLN 70 84.914 16.619 4.715 333 1HE2 GLN 70 HE21 GLN 70 83.341 13.972 5.354 334 2HE2 GLN 70 HE22 GLN 70 84.088 13.360 6.751 335 H TYR 71 HN TYR 71 82.749 13.341 1.320 336 HA TYR 71 HA TYR 71 80.248 13.381 2.446 337 1HB TYR 71 HB2 TYR 71 81.306 11.635 0.214 338 2HB TYR 71 HB1 TYR 71 79.599 11.741 0.600 339 HD1 TYR 71 HD1 TYR 71 79.195 12.683 -1.668 340 HD2 TYR 71 HD2 TYR 71 81.668 14.755 1.205 341 HE1 TYR 71 HE1 TYR 71 78.992 14.776 -2.974 342 HE2 TYR 71 HE2 TYR 71 81.452 16.821 -0.120 343 HH TYR 71 HH TYR 71 80.853 17.645 -2.167 344 H SER 72 HN SER 72 82.606 10.847 2.670 345 HA SER 72 HA SER 72 80.807 9.117 4.306 346 1HB SER 72 HB2 SER 72 82.351 8.158 2.588 347 2HB SER 72 HB1 SER 72 83.708 8.891 3.434 348 HG SER 72 HG SER 72 83.361 6.687 4.010 349 H GLU 73 HN GLU 73 80.653 10.233 6.337 350 HA GLU 73 HA GLU 73 82.804 11.775 7.469 351 1HB GLU 73 HB2 GLU 73 81.271 12.180 9.184 352 2HB GLU 73 HB1 GLU 73 80.198 11.735 7.853 353 1HG GLU 73 HG2 GLU 73 79.343 10.152 9.216 354 2HG GLU 73 HG1 GLU 73 80.872 9.295 9.056 355 H ASP 74 HN ASP 74 84.073 9.432 6.824 356 HA ASP 74 HA ASP 74 85.116 8.583 9.400 357 1HB ASP 74 HB2 ASP 74 82.982 7.387 9.363 358 2HB ASP 74 HB1 ASP 74 83.380 6.688 7.794 359 H LYS 75 HN LYS 75 84.962 6.096 6.981 360 HA LYS 75 HA LYS 75 87.840 6.618 6.343 361 1HB LYS 75 HB2 LYS 75 86.574 4.493 7.519 362 2HB LYS 75 HB1 LYS 75 86.652 3.968 5.838 363 1HG LYS 75 HG2 LYS 75 88.993 4.918 7.517 364 2HG LYS 75 HG1 LYS 75 88.663 3.249 7.045 365 1HD LYS 75 HD2 LYS 75 88.732 4.084 4.622 366 2HD LYS 75 HD1 LYS 75 89.427 5.572 5.266 367 1HE LYS 75 HE2 LYS 75 90.627 2.940 6.090 368 2HE LYS 75 HE1 LYS 75 91.034 3.618 4.502 369 1HZ LYS 75 HZ1 LYS 75 92.236 4.356 6.779 370 2HZ LYS 75 HZ2 LYS 75 90.985 5.504 6.716 371 3HZ LYS 75 HZ3 LYS 75 92.088 5.373 5.429 372 H ALA 76 HN ALA 76 85.215 7.480 4.799 373 HA ALA 76 HA ALA 76 84.606 7.633 2.508 374 1HB ALA 76 HB1 ALA 76 87.103 8.327 2.716 375 2HB ALA 76 HB2 ALA 76 86.490 7.941 1.107 376 3HB ALA 76 HB3 ALA 76 87.446 6.754 1.994 377 H ARG 77 HN ARG 77 84.549 6.286 0.406 378 HA ARG 77 HA ARG 77 84.686 3.370 1.066 379 1HB ARG 77 HB2 ARG 77 82.551 3.088 0.144 380 2HB ARG 77 HB1 ARG 77 82.411 4.670 0.895 381 1HG ARG 77 HG2 ARG 77 81.932 5.605 -1.077 382 2HG ARG 77 HG1 ARG 77 83.418 4.998 -1.774 383 1HD ARG 77 HD2 ARG 77 81.435 4.153 -2.993 384 2HD ARG 77 HD1 ARG 77 82.328 2.830 -2.220 385 HE ARG 77 HE ARG 77 80.622 3.389 -0.239 386 1HH1 ARG 77 HH11 ARG 77 79.514 4.694 -3.051 387 2HH1 ARG 77 HH12 ARG 77 78.091 3.717 -3.187 388 1HH2 ARG 77 HH21 ARG 77 79.027 1.534 -0.659 389 2HH2 ARG 77 HH22 ARG 77 77.817 1.924 -1.836 390 H GLN 78 HN GLN 78 85.236 5.883 -1.290 391 HA GLN 78 HA GLN 78 86.102 3.933 -3.347 392 1HB GLN 78 HB2 GLN 78 85.738 6.935 -3.169 393 2HB GLN 78 HB1 GLN 78 86.471 6.157 -4.576 394 1HG GLN 78 HG2 GLN 78 84.471 5.352 -5.312 395 2HG GLN 78 HG1 GLN 78 83.962 4.890 -3.688 396 1HE2 GLN 78 HE21 GLN 78 83.017 6.691 -2.311 397 2HE2 GLN 78 HE22 GLN 78 82.305 8.022 -3.078 398 H GLY 79 HN GLY 79 87.623 7.022 -2.438 399 1HA GLY 79 HA2 GLY 79 90.286 6.028 -2.750 400 2HA GLY 79 HA1 GLY 79 89.854 7.489 -1.850 401 H GLY 80 HN GLY 80 87.911 5.685 -0.297 402 1HA GLY 80 HA1 GLY 80 89.834 4.904 1.801 403 2HA GLY 80 HA2 GLY 80 88.074 4.974 1.968 404 H ASP 81 HN ASP 81 87.382 3.471 -0.315 405 HA ASP 81 HA ASP 81 86.727 1.167 -0.507 406 1HB ASP 81 HB2 ASP 81 88.863 2.063 -1.876 407 2HB ASP 81 HB1 ASP 81 89.632 0.743 -0.988 408 H LEU 82 HN LEU 82 86.217 0.350 1.621 409 HA LEU 82 HA LEU 82 87.832 -0.210 3.778 410 1HB LEU 82 HB2 LEU 82 85.516 -1.582 2.466 411 2HB LEU 82 HB1 LEU 82 86.281 -2.364 3.847 412 HG LEU 82 HG LEU 82 84.359 -0.826 4.432 413 1HD1 LEU 82 HD11 LEU 82 86.449 0.559 5.840 414 2HD1 LEU 82 HD12 LEU 82 86.917 -1.129 5.633 415 3HD1 LEU 82 HD13 LEU 82 85.395 -0.727 6.429 416 1HD2 LEU 82 HD21 LEU 82 86.350 1.253 3.488 417 2HD2 LEU 82 HD22 LEU 82 84.887 1.611 4.405 418 3HD2 LEU 82 HD23 LEU 82 84.766 0.922 2.786 419 H GLY 83 HN GLY 83 87.875 -1.855 0.673 420 1HA GLY 83 HA2 GLY 83 89.757 -3.119 -0.129 421 2HA GLY 83 HA1 GLY 83 90.302 -3.319 1.543 422 H TRP 84 HN TRP 84 90.335 -5.589 0.142 423 HA TRP 84 HA TRP 84 87.986 -7.127 -0.156 424 1HB TRP 84 HB2 TRP 84 90.876 -7.691 0.479 425 2HB TRP 84 HB1 TRP 84 89.723 -9.017 0.365 426 HD1 TRP 84 HD1 TRP 84 92.052 -7.268 -1.702 427 HE1 TRP 84 HE1 TRP 84 91.450 -7.418 -4.205 428 HE3 TRP 84 HE3 TRP 84 87.230 -8.901 -1.349 429 HZ2 TRP 84 HZ2 TRP 84 89.219 -8.147 -5.840 430 HZ3 TRP 84 HZ3 TRP 84 85.892 -9.311 -3.393 431 HH2 TRP 84 HH2 TRP 84 86.879 -8.946 -5.634 432 H MET 85 HN MET 85 86.709 -8.285 1.285 433 HA MET 85 HA MET 85 87.567 -8.479 4.136 434 1HB MET 85 HB2 MET 85 85.379 -6.867 2.935 435 2HB MET 85 HB1 MET 85 84.962 -7.752 4.402 436 1HG MET 85 HG2 MET 85 87.571 -6.399 4.540 437 2HG MET 85 HG1 MET 85 86.212 -5.294 4.343 438 1HE MET 85 HE1 MET 85 85.677 -4.558 7.760 439 2HE MET 85 HE2 MET 85 84.466 -4.725 6.493 440 3HE MET 85 HE3 MET 85 86.073 -4.123 6.092 441 H THR 86 HN THR 86 87.106 -10.524 4.869 442 HA THR 86 HA THR 86 85.173 -12.166 3.287 443 HB THR 86 HB THR 86 86.486 -13.996 4.628 444 HG1 THR 86 HG1 THR 86 87.868 -13.122 5.930 445 1HG2 THR 86 HG21 THR 86 87.409 -14.303 2.611 446 2HG2 THR 86 HG22 THR 86 88.460 -12.904 2.841 447 3HG2 THR 86 HG23 THR 86 86.848 -12.695 2.157 448 H ARG 87 HN ARG 87 83.597 -13.389 4.407 449 HA ARG 87 HA ARG 87 82.158 -12.287 6.492 450 1HB ARG 87 HB2 ARG 87 81.987 -14.501 4.974 451 2HB ARG 87 HB1 ARG 87 82.484 -15.252 6.491 452 1HG ARG 87 HG2 ARG 87 80.472 -13.279 7.054 453 2HG ARG 87 HG1 ARG 87 79.887 -14.337 5.769 454 1HD ARG 87 HD2 ARG 87 81.251 -15.688 8.047 455 2HD ARG 87 HD1 ARG 87 79.653 -14.994 8.378 456 HE ARG 87 HE ARG 87 79.401 -16.287 5.905 457 1HH1 ARG 87 HH11 ARG 87 77.699 -17.171 8.107 458 2HH1 ARG 87 HH12 ARG 87 78.269 -18.771 8.443 459 1HH2 ARG 87 HH21 ARG 87 81.274 -18.339 6.764 460 2HH2 ARG 87 HH22 ARG 87 80.293 -19.433 7.683 461 H GLY 88 HN GLY 88 85.150 -14.114 6.737 462 1HA GLY 88 HA2 GLY 88 84.997 -14.645 9.570 463 2HA GLY 88 HA1 GLY 88 86.472 -14.688 8.593 464 H SER 89 HN SER 89 86.096 -11.911 7.641 465 HA SER 89 HA SER 89 86.884 -10.499 10.168 466 1HB SER 89 HB2 SER 89 87.740 -10.348 7.277 467 2HB SER 89 HB1 SER 89 88.068 -9.010 8.389 468 HG SER 89 HG SER 89 89.223 -11.487 8.217 469 H MET 90 HN MET 90 84.740 -9.748 10.673 470 HA MET 90 HA MET 90 83.948 -7.267 9.477 471 1HB MET 90 HB2 MET 90 83.180 -9.699 8.130 472 2HB MET 90 HB1 MET 90 81.734 -8.881 8.723 473 1HG MET 90 HG2 MET 90 82.043 -7.057 7.361 474 2HG MET 90 HG1 MET 90 83.801 -7.176 7.427 475 1HE MET 90 HE1 MET 90 80.685 -8.657 4.781 476 2HE MET 90 HE2 MET 90 81.599 -7.265 4.211 477 3HE MET 90 HE3 MET 90 80.906 -7.251 5.830 478 H VAL 91 HN VAL 91 81.262 -7.157 10.024 479 HA VAL 91 HA VAL 91 81.044 -8.175 12.837 480 HB VAL 91 HB VAL 91 81.611 -5.709 12.473 481 1HG1 VAL 91 HG11 VAL 91 79.028 -4.698 12.080 482 2HG1 VAL 91 HG12 VAL 91 79.217 -5.936 10.842 483 3HG1 VAL 91 HG13 VAL 91 80.375 -4.612 10.948 484 1HG2 VAL 91 HG21 VAL 91 80.758 -5.533 14.543 485 2HG2 VAL 91 HG22 VAL 91 79.792 -6.980 14.260 486 3HG2 VAL 91 HG23 VAL 91 79.134 -5.389 13.873 487 H GLY 92 HN GLY 92 78.763 -8.372 13.578 488 1HA GLY 92 HA2 GLY 92 77.130 -10.004 12.132 489 2HA GLY 92 HA1 GLY 92 76.461 -8.829 13.269 490 HA PRO 93 HA PRO 93 74.555 -6.359 10.221 491 1HB PRO 93 HB2 PRO 93 76.246 -4.027 10.299 492 2HB PRO 93 HB1 PRO 93 74.666 -4.266 11.061 493 1HG PRO 93 HG2 PRO 93 77.261 -4.184 12.320 494 2HG PRO 93 HG1 PRO 93 75.681 -4.358 13.086 495 1HD PRO 93 HD2 PRO 93 77.711 -6.366 12.813 496 2HD PRO 93 HD1 PRO 93 76.075 -6.570 13.483 497 H PHE 94 HN PHE 94 77.865 -5.093 9.702 498 HA PHE 94 HA PHE 94 77.901 -4.851 6.970 499 1HB PHE 94 HB2 PHE 94 79.839 -5.470 9.093 500 2HB PHE 94 HB1 PHE 94 80.371 -5.969 7.484 501 HD1 PHE 94 HD1 PHE 94 78.525 -3.053 8.990 502 HD2 PHE 94 HD2 PHE 94 81.621 -4.394 6.330 503 HE1 PHE 94 HE1 PHE 94 79.071 -0.698 8.437 504 HE2 PHE 94 HE2 PHE 94 82.167 -2.039 5.778 505 HZ PHE 94 HZ PHE 94 80.892 -0.192 6.832 506 H GLN 95 HN GLN 95 78.300 -7.922 8.743 507 HA GLN 95 HA GLN 95 78.750 -9.487 6.319 508 1HB GLN 95 HB2 GLN 95 78.810 -9.768 9.195 509 2HB GLN 95 HB1 GLN 95 77.932 -11.118 8.479 510 1HG GLN 95 HG2 GLN 95 79.816 -11.526 6.936 511 2HG GLN 95 HG1 GLN 95 80.698 -10.180 7.658 512 1HE2 GLN 95 HE21 GLN 95 81.855 -10.597 9.589 513 2HE2 GLN 95 HE22 GLN 95 81.806 -12.077 10.419 514 H GLU 96 HN GLU 96 75.977 -8.946 8.508 515 HA GLU 96 HA GLU 96 74.233 -10.819 7.155 516 1HB GLU 96 HB2 GLU 96 72.702 -10.125 8.777 517 2HB GLU 96 HB1 GLU 96 74.236 -9.732 9.549 518 1HG GLU 96 HG2 GLU 96 73.069 -7.740 9.845 519 2HG GLU 96 HG1 GLU 96 73.907 -7.416 8.330 520 H ALA 97 HN ALA 97 74.902 -7.369 6.751 521 HA ALA 97 HA ALA 97 72.671 -7.047 4.837 522 1HB ALA 97 HB1 ALA 97 74.319 -4.776 4.844 523 2HB ALA 97 HB2 ALA 97 74.432 -5.410 6.486 524 3HB ALA 97 HB3 ALA 97 72.857 -5.005 5.804 525 H ALA 98 HN ALA 98 75.894 -5.716 4.452 526 HA ALA 98 HA ALA 98 76.111 -5.868 1.690 527 1HB ALA 98 HB1 ALA 98 78.312 -6.340 3.724 528 2HB ALA 98 HB2 ALA 98 77.642 -4.760 3.325 529 3HB ALA 98 HB3 ALA 98 78.512 -5.683 2.100 530 H PHE 99 HN PHE 99 78.017 -8.165 3.653 531 HA PHE 99 HA PHE 99 78.601 -10.065 1.754 532 1HB PHE 99 HB2 PHE 99 78.771 -9.821 4.479 533 2HB PHE 99 HB1 PHE 99 77.664 -11.193 4.315 534 HD1 PHE 99 HD1 PHE 99 78.523 -13.329 3.899 535 HD2 PHE 99 HD2 PHE 99 80.919 -9.883 2.987 536 HE1 PHE 99 HE1 PHE 99 80.433 -14.807 3.337 537 HE2 PHE 99 HE2 PHE 99 82.831 -11.361 2.425 538 HZ PHE 99 HZ PHE 99 82.587 -13.823 2.600 539 H ALA 100 HN ALA 100 75.686 -10.249 3.817 540 HA ALA 100 HA ALA 100 74.496 -12.454 2.436 541 1HB ALA 100 HB1 ALA 100 74.042 -11.029 4.710 542 2HB ALA 100 HB2 ALA 100 72.863 -12.139 4.012 543 3HB ALA 100 HB3 ALA 100 72.747 -10.411 3.686 544 H LEU 101 HN LEU 101 74.954 -9.239 1.419 545 HA LEU 101 HA LEU 101 72.597 -9.313 -0.407 546 1HB LEU 101 HB2 LEU 101 74.440 -7.225 0.731 547 2HB LEU 101 HB1 LEU 101 73.511 -6.868 -0.731 548 HG LEU 101 HG LEU 101 72.246 -7.965 1.793 549 1HD1 LEU 101 HD11 LEU 101 73.029 -5.197 1.039 550 2HD1 LEU 101 HD12 LEU 101 72.829 -5.914 2.638 551 3HD1 LEU 101 HD13 LEU 101 71.414 -5.402 1.720 552 1HD2 LEU 101 HD21 LEU 101 70.205 -7.536 0.741 553 2HD2 LEU 101 HD22 LEU 101 71.199 -8.056 -0.620 554 3HD2 LEU 101 HD23 LEU 101 70.904 -6.339 -0.348 555 HA PRO 102 HA PRO 102 75.074 -10.339 -3.909 556 1HB PRO 102 HB2 PRO 102 73.610 -8.575 -5.642 557 2HB PRO 102 HB1 PRO 102 73.413 -10.325 -5.449 558 1HG PRO 102 HG2 PRO 102 71.637 -8.241 -4.578 559 2HG PRO 102 HG1 PRO 102 71.449 -9.988 -4.368 560 1HD PRO 102 HD2 PRO 102 72.095 -8.007 -2.359 561 2HD PRO 102 HD1 PRO 102 71.860 -9.758 -2.140 562 H VAL 103 HN VAL 103 76.849 -9.462 -5.053 563 HA VAL 103 HA VAL 103 78.203 -7.183 -4.232 564 HB VAL 103 HB VAL 103 78.046 -8.861 -6.699 565 1HG1 VAL 103 HG11 VAL 103 80.158 -7.334 -7.390 566 2HG1 VAL 103 HG12 VAL 103 79.135 -6.095 -6.654 567 3HG1 VAL 103 HG13 VAL 103 78.530 -7.044 -8.008 568 1HG2 VAL 103 HG21 VAL 103 80.314 -8.022 -4.867 569 2HG2 VAL 103 HG22 VAL 103 80.409 -9.253 -6.127 570 3HG2 VAL 103 HG23 VAL 103 79.378 -9.509 -4.719 571 H SER 104 HN SER 104 78.192 -4.958 -4.914 572 HA SER 104 HA SER 104 76.519 -3.907 -7.009 573 1HB SER 104 HB2 SER 104 74.719 -3.020 -5.466 574 2HB SER 104 HB1 SER 104 74.739 -4.785 -5.598 575 HG SER 104 HG SER 104 74.860 -3.417 -3.417 576 H GLY 105 HN GLY 105 75.834 -1.798 -4.585 577 1HA GLY 105 HA2 GLY 105 77.316 -0.239 -3.392 578 2HA GLY 105 HA1 GLY 105 78.524 -0.531 -4.640 579 H MET 106 HN MET 106 77.588 2.049 -3.840 580 HA MET 106 HA MET 106 77.141 4.079 -4.928 581 1HB MET 106 HB2 MET 106 78.225 2.678 -6.794 582 2HB MET 106 HB1 MET 106 76.581 2.412 -7.369 583 1HG MET 106 HG2 MET 106 76.337 4.988 -7.251 584 2HG MET 106 HG1 MET 106 78.104 5.008 -7.163 585 1HE MET 106 HE1 MET 106 75.246 3.283 -8.597 586 2HE MET 106 HE2 MET 106 76.170 2.152 -9.582 587 3HE MET 106 HE3 MET 106 75.315 3.487 -10.352 588 H ASP 107 HN ASP 107 74.972 2.067 -3.905 589 HA ASP 107 HA ASP 107 72.628 2.155 -3.651 590 1HB ASP 107 HB2 ASP 107 73.274 4.486 -3.141 591 2HB ASP 107 HB1 ASP 107 73.138 4.893 -4.851 592 H LYS 108 HN LYS 108 72.848 0.561 -5.708 593 HA LYS 108 HA LYS 108 70.736 1.445 -7.519 594 1HB LYS 108 HB2 LYS 108 72.414 2.446 -8.749 595 2HB LYS 108 HB1 LYS 108 73.616 1.231 -8.325 596 1HG LYS 108 HG2 LYS 108 72.271 -0.428 -9.700 597 2HG LYS 108 HG1 LYS 108 71.278 0.925 -10.239 598 1HD LYS 108 HD2 LYS 108 74.218 1.282 -10.476 599 2HD LYS 108 HD1 LYS 108 73.486 0.107 -11.569 600 1HE LYS 108 HE2 LYS 108 71.804 2.438 -11.492 601 2HE LYS 108 HE1 LYS 108 73.472 2.945 -11.824 602 1HZ LYS 108 HZ1 LYS 108 72.231 2.216 -13.839 603 2HZ LYS 108 HZ2 LYS 108 72.117 0.660 -13.165 604 3HZ LYS 108 HZ3 LYS 108 73.638 1.314 -13.550 605 HA PRO 109 HA PRO 109 71.509 -3.185 -8.532 606 1HB PRO 109 HB2 PRO 109 73.768 -4.134 -7.031 607 2HB PRO 109 HB1 PRO 109 73.585 -4.061 -8.790 608 1HG PRO 109 HG2 PRO 109 75.246 -2.414 -7.109 609 2HG PRO 109 HG1 PRO 109 75.092 -2.374 -8.863 610 1HD PRO 109 HD2 PRO 109 74.121 -0.436 -6.973 611 2HD PRO 109 HD1 PRO 109 73.928 -0.450 -8.745 612 H VAL 110 HN VAL 110 72.272 -5.188 -6.566 613 HA VAL 110 HA VAL 110 71.153 -6.193 -4.727 614 HB VAL 110 HB VAL 110 73.191 -4.701 -4.058 615 1HG1 VAL 110 HG11 VAL 110 70.860 -3.139 -2.920 616 2HG1 VAL 110 HG12 VAL 110 72.117 -2.545 -4.003 617 3HG1 VAL 110 HG13 VAL 110 72.517 -2.981 -2.343 618 1HG2 VAL 110 HG21 VAL 110 72.019 -5.013 -1.531 619 2HG2 VAL 110 HG22 VAL 110 73.023 -6.185 -2.383 620 3HG2 VAL 110 HG23 VAL 110 71.268 -6.250 -2.539 621 H PHE 111 HN PHE 111 69.855 -5.030 -2.504 622 HA PHE 111 HA PHE 111 67.543 -3.596 -3.761 623 1HB PHE 111 HB2 PHE 111 67.590 -5.941 -1.840 624 2HB PHE 111 HB1 PHE 111 66.122 -5.067 -2.299 625 HD1 PHE 111 HD1 PHE 111 68.970 -7.053 -3.663 626 HD2 PHE 111 HD2 PHE 111 65.013 -5.528 -4.341 627 HE1 PHE 111 HE1 PHE 111 68.788 -8.436 -5.715 628 HE2 PHE 111 HE2 PHE 111 64.831 -6.909 -6.393 629 HZ PHE 111 HZ PHE 111 66.719 -8.364 -7.079 630 H THR 112 HN THR 112 69.133 -4.418 -0.668 631 HA THR 112 HA THR 112 67.698 -2.748 1.069 632 HB THR 112 HB THR 112 69.565 -4.405 1.560 633 HG1 THR 112 HG1 THR 112 69.351 -3.488 3.412 634 1HG2 THR 112 HG21 THR 112 71.279 -3.622 0.060 635 2HG2 THR 112 HG22 THR 112 71.856 -3.338 1.704 636 3HG2 THR 112 HG23 THR 112 71.212 -2.001 0.751 637 H ASP 113 HN ASP 113 69.263 -0.858 2.171 638 HA ASP 113 HA ASP 113 69.535 1.183 -0.009 639 1HB ASP 113 HB2 ASP 113 69.189 1.721 2.944 640 2HB ASP 113 HB1 ASP 113 68.786 2.770 1.587 641 HA PRO 114 HA PRO 114 73.845 1.288 0.777 642 1HB PRO 114 HB2 PRO 114 74.027 4.102 0.248 643 2HB PRO 114 HB1 PRO 114 74.446 2.750 -0.819 644 1HG PRO 114 HG2 PRO 114 72.205 4.516 -1.049 645 2HG PRO 114 HG1 PRO 114 72.598 3.127 -2.061 646 1HD PRO 114 HD2 PRO 114 70.473 3.364 -0.107 647 2HD PRO 114 HD1 PRO 114 70.824 2.003 -1.195 648 HA PRO 115 HA PRO 115 74.116 4.752 4.155 649 1HB PRO 115 HB2 PRO 115 71.424 5.629 4.693 650 2HB PRO 115 HB1 PRO 115 72.780 6.578 4.079 651 1HG PRO 115 HG2 PRO 115 70.444 5.747 2.652 652 2HG PRO 115 HG1 PRO 115 71.844 6.622 2.010 653 1HD PRO 115 HD2 PRO 115 71.090 3.848 1.566 654 2HD PRO 115 HD1 PRO 115 72.423 4.757 0.833 655 H VAL 116 HN VAL 116 74.124 2.258 4.778 656 HA VAL 116 HA VAL 116 71.863 1.463 6.502 657 HB VAL 116 HB VAL 116 73.104 -0.633 6.599 658 1HG1 VAL 116 HG11 VAL 116 71.873 0.277 4.431 659 2HG1 VAL 116 HG12 VAL 116 72.767 -1.243 4.382 660 3HG1 VAL 116 HG13 VAL 116 73.504 0.235 3.764 661 1HG2 VAL 116 HG21 VAL 116 75.323 0.903 6.482 662 2HG2 VAL 116 HG22 VAL 116 75.266 0.293 4.830 663 3HG2 VAL 116 HG23 VAL 116 75.318 -0.833 6.188 664 H LYS 117 HN LYS 117 72.118 1.095 8.759 665 HA LYS 117 HA LYS 117 74.438 2.537 9.984 666 1HB LYS 117 HB2 LYS 117 71.947 3.274 10.137 667 2HB LYS 117 HB1 LYS 117 71.794 1.950 11.302 668 1HG LYS 117 HG2 LYS 117 74.146 3.296 12.042 669 2HG LYS 117 HG1 LYS 117 72.991 4.579 11.657 670 1HD LYS 117 HD2 LYS 117 71.566 2.590 13.107 671 2HD LYS 117 HD1 LYS 117 73.077 2.879 13.979 672 1HE LYS 117 HE2 LYS 117 72.508 5.417 13.598 673 2HE LYS 117 HE1 LYS 117 70.858 4.818 13.351 674 1HZ LYS 117 HZ1 LYS 117 72.613 4.245 15.686 675 2HZ LYS 117 HZ2 LYS 117 71.078 3.563 15.437 676 3HZ LYS 117 HZ3 LYS 117 71.236 5.234 15.695 677 H THR 118 HN THR 118 75.910 1.043 10.695 678 HA THR 118 HA THR 118 74.892 -1.477 11.958 679 HB THR 118 HB THR 118 77.059 -2.392 11.328 680 HG1 THR 118 HG1 THR 118 77.836 -0.025 10.094 681 1HG2 THR 118 HG21 THR 118 77.022 -1.950 8.849 682 2HG2 THR 118 HG22 THR 118 75.809 -0.703 9.149 683 3HG2 THR 118 HG23 THR 118 75.454 -2.389 9.526 684 H LYS 119 HN LYS 119 74.658 0.589 13.682 685 HA LYS 119 HA LYS 119 75.308 1.194 15.882 686 1HB LYS 119 HB2 LYS 119 76.401 -1.330 15.341 687 2HB LYS 119 HB1 LYS 119 77.757 -0.386 15.956 688 1HG LYS 119 HG2 LYS 119 76.880 -0.268 18.051 689 2HG LYS 119 HG1 LYS 119 75.241 0.001 17.447 690 1HD LYS 119 HD2 LYS 119 74.738 -2.158 17.827 691 2HD LYS 119 HD1 LYS 119 76.038 -2.661 16.747 692 1HE LYS 119 HE2 LYS 119 76.673 -3.643 18.800 693 2HE LYS 119 HE1 LYS 119 77.584 -2.122 18.820 694 1HZ LYS 119 HZ1 LYS 119 76.307 -2.434 20.874 695 2HZ LYS 119 HZ2 LYS 119 74.869 -2.525 19.975 696 3HZ LYS 119 HZ3 LYS 119 75.762 -1.080 20.012 697 H PHE 120 HN PHE 120 76.044 2.919 13.857 698 HA PHE 120 HA PHE 120 78.329 4.289 14.978 699 1HB PHE 120 HB2 PHE 120 78.997 2.133 13.438 700 2HB PHE 120 HB1 PHE 120 78.970 3.415 12.218 701 HD1 PHE 120 HD1 PHE 120 81.423 1.842 13.354 702 HD2 PHE 120 HD2 PHE 120 79.676 5.655 14.280 703 HE1 PHE 120 HE1 PHE 120 83.624 2.654 14.159 704 HE2 PHE 120 HE2 PHE 120 81.876 6.467 15.085 705 HZ PHE 120 HZ PHE 120 83.850 4.967 15.025 706 H GLY 121 HN GLY 121 77.269 3.897 11.582 707 1HA GLY 121 HA2 GLY 121 75.724 6.368 11.622 708 2HA GLY 121 HA1 GLY 121 77.279 6.547 10.796 709 H TYR 122 HN TYR 122 75.450 6.965 9.035 710 HA TYR 122 HA TYR 122 74.370 4.466 7.884 711 1HB TYR 122 HB2 TYR 122 74.124 7.427 7.420 712 2HB TYR 122 HB1 TYR 122 73.609 6.313 6.155 713 HD1 TYR 122 HD1 TYR 122 73.459 5.641 9.806 714 HD2 TYR 122 HD2 TYR 122 71.241 6.655 6.269 715 HE1 TYR 122 HE1 TYR 122 71.337 5.234 11.021 716 HE2 TYR 122 HE2 TYR 122 69.119 6.249 7.485 717 HH TYR 122 HH TYR 122 68.682 6.291 10.482 718 H HIS 123 HN HIS 123 76.306 3.377 7.137 719 HA HIS 123 HA HIS 123 78.037 4.860 5.250 720 1HB HIS 123 HB2 HIS 123 79.471 2.872 5.420 721 2HB HIS 123 HB1 HIS 123 79.026 3.432 7.023 722 HD1 HIS 123 HD1 HIS 123 78.719 0.560 4.734 723 HD2 HIS 123 HD2 HIS 123 77.072 1.767 8.367 724 HE1 HIS 123 HE1 HIS 123 77.645 -1.497 5.753 725 H ILE 124 HN ILE 124 78.094 4.465 3.052 726 HA ILE 124 HA ILE 124 75.901 2.841 1.903 727 HB ILE 124 HB ILE 124 78.091 4.531 0.620 728 1HG1 ILE 124 HG12 ILE 124 75.222 5.218 1.355 729 2HG1 ILE 124 HG11 ILE 124 76.680 5.909 2.082 730 1HG2 ILE 124 HG21 ILE 124 76.297 2.709 -0.527 731 2HG2 ILE 124 HG22 ILE 124 77.247 3.937 -1.367 732 3HG2 ILE 124 HG23 ILE 124 75.605 4.302 -0.840 733 1HD1 ILE 124 HD11 ILE 124 77.164 6.388 -0.565 734 2HD1 ILE 124 HD12 ILE 124 76.369 7.546 0.502 735 3HD1 ILE 124 HD13 ILE 124 75.403 6.499 -0.536 736 H ILE 125 HN ILE 125 76.348 0.688 1.663 737 HA ILE 125 HA ILE 125 79.124 -0.248 1.517 738 HB ILE 125 HB ILE 125 76.584 -1.869 1.327 739 1HG1 ILE 125 HG12 ILE 125 77.884 -0.805 3.856 740 2HG1 ILE 125 HG11 ILE 125 76.318 -0.286 3.221 741 1HG2 ILE 125 HG21 ILE 125 78.549 -2.960 3.041 742 2HG2 ILE 125 HG22 ILE 125 79.389 -2.372 1.608 743 3HG2 ILE 125 HG23 ILE 125 78.074 -3.533 1.442 744 1HD1 ILE 125 HD11 ILE 125 75.917 -2.952 3.247 745 2HD1 ILE 125 HD12 ILE 125 75.561 -1.931 4.639 746 3HD1 ILE 125 HD13 ILE 125 77.076 -2.832 4.570 747 H MET 126 HN MET 126 80.075 -1.094 -0.253 748 HA MET 126 HA MET 126 78.444 -1.529 -2.690 749 1HB MET 126 HB2 MET 126 79.439 0.404 -3.417 750 2HB MET 126 HB1 MET 126 80.580 0.392 -2.072 751 1HG MET 126 HG2 MET 126 82.176 -0.754 -3.239 752 2HG MET 126 HG1 MET 126 80.999 -1.623 -4.232 753 1HE MET 126 HE1 MET 126 81.938 2.773 -4.380 754 2HE MET 126 HE2 MET 126 81.108 1.817 -3.154 755 3HE MET 126 HE3 MET 126 80.199 2.462 -4.515 756 H VAL 127 HN VAL 127 78.554 -3.779 -2.379 757 HA VAL 127 HA VAL 127 81.173 -5.090 -1.924 758 HB VAL 127 HB VAL 127 79.336 -6.065 -0.741 759 1HG1 VAL 127 HG11 VAL 127 77.287 -5.457 -1.502 760 2HG1 VAL 127 HG12 VAL 127 77.400 -6.893 -2.519 761 3HG1 VAL 127 HG13 VAL 127 77.852 -5.319 -3.165 762 1HG2 VAL 127 HG21 VAL 127 79.954 -8.143 -1.325 763 2HG2 VAL 127 HG22 VAL 127 80.607 -7.516 -2.840 764 3HG2 VAL 127 HG23 VAL 127 78.931 -8.055 -2.757 765 H GLU 128 HN GLU 128 82.445 -5.355 -3.739 766 HA GLU 128 HA GLU 128 81.189 -6.378 -6.176 767 1HB GLU 128 HB2 GLU 128 81.053 -3.923 -6.311 768 2HB GLU 128 HB1 GLU 128 82.790 -3.808 -5.991 769 1HG GLU 128 HG2 GLU 128 82.992 -3.835 -8.258 770 2HG GLU 128 HG1 GLU 128 82.724 -5.577 -8.095 771 H GLY 129 HN GLY 129 82.434 -8.153 -6.242 772 1HA GLY 129 HA2 GLY 129 84.799 -8.520 -7.397 773 2HA GLY 129 HA1 GLY 129 85.326 -7.988 -5.798 774 H ARG 130 HN ARG 130 84.072 -9.204 -4.024 775 HA ARG 130 HA ARG 130 83.780 -11.248 -2.867 776 1HB ARG 130 HB2 ARG 130 81.936 -11.211 -4.598 777 2HB ARG 130 HB1 ARG 130 83.000 -12.184 -5.613 778 1HG ARG 130 HG2 ARG 130 82.404 -14.057 -4.508 779 2HG ARG 130 HG1 ARG 130 82.887 -13.333 -2.975 780 1HD ARG 130 HD2 ARG 130 80.672 -12.178 -2.857 781 2HD ARG 130 HD1 ARG 130 80.190 -13.019 -4.343 782 HE ARG 130 HE ARG 130 80.532 -14.255 -1.692 783 1HH1 ARG 130 HH21 ARG 130 80.706 -14.721 -5.103 784 2HH1 ARG 130 HH22 ARG 130 80.162 -16.364 -5.039 785 1HH2 ARG 130 HH11 ARG 130 79.696 -16.359 -1.603 786 2HH2 ARG 130 HH12 ARG 130 79.590 -17.291 -3.059 787 H LYS 131 HN LYS 131 86.237 -10.747 -4.800 788 HA LYS 131 HA LYS 131 88.177 -11.945 -5.453 789 1HB LYS 131 HB2 LYS 131 87.487 -12.295 -2.761 790 2HB LYS 131 HB1 LYS 131 87.883 -13.919 -3.326 791 1HG LYS 131 HG2 LYS 131 90.086 -13.424 -3.511 792 2HG LYS 131 HG1 LYS 131 89.753 -11.885 -4.305 793 1HD LYS 131 HD2 LYS 131 89.343 -10.804 -2.179 794 2HD LYS 131 HD1 LYS 131 89.432 -12.345 -1.326 795 1HE LYS 131 HE2 LYS 131 91.823 -12.563 -2.134 796 2HE LYS 131 HE1 LYS 131 91.697 -10.894 -2.741 797 1HZ LYS 131 HZ1 LYS 131 90.866 -10.302 -0.461 798 2HZ LYS 131 HZ2 LYS 131 92.501 -10.760 -0.521 799 3HZ LYS 131 HZ3 LYS 131 91.331 -11.850 0.052 Start of MODEL 13 1 1H GLY 28 HT1 GLY 28 66.740 -20.654 4.871 2 2H GLY 28 HT2 GLY 28 66.935 -21.760 3.596 3 3H GLY 28 HT3 GLY 28 65.555 -20.771 3.663 4 1HA GLY 28 HA2 GLY 28 66.913 -18.801 3.338 5 2HA GLY 28 HA1 GLY 28 68.343 -19.830 3.264 6 H SER 29 HN SER 29 65.064 -19.990 1.820 7 HA SER 29 HA SER 29 64.427 -20.461 -0.409 8 1HB SER 29 HB2 SER 29 65.238 -18.798 -1.763 9 2HB SER 29 HB1 SER 29 65.982 -18.230 -0.268 10 HG SER 29 HG SER 29 67.870 -18.805 -0.982 11 H GLY 30 HN GLY 30 66.330 -20.795 -2.632 12 1HA GLY 30 HA2 GLY 30 67.470 -23.451 -1.854 13 2HA GLY 30 HA1 GLY 30 66.792 -23.116 -3.447 14 HA PRO 31 HA PRO 31 70.695 -21.929 -5.027 15 1HB PRO 31 HB2 PRO 31 69.777 -19.468 -6.210 16 2HB PRO 31 HB1 PRO 31 70.048 -21.030 -7.005 17 1HG PRO 31 HG2 PRO 31 67.540 -19.756 -6.415 18 2HG PRO 31 HG1 PRO 31 67.808 -21.314 -7.201 19 1HD PRO 31 HD2 PRO 31 66.790 -20.822 -4.543 20 2HD PRO 31 HD1 PRO 31 67.061 -22.392 -5.336 21 H LYS 32 HN LYS 32 71.459 -19.123 -5.491 22 HA LYS 32 HA LYS 32 72.348 -17.263 -4.322 23 1HB LYS 32 HB2 LYS 32 69.876 -17.739 -3.271 24 2HB LYS 32 HB1 LYS 32 70.880 -17.946 -1.838 25 1HG LYS 32 HG2 LYS 32 70.297 -15.619 -1.927 26 2HG LYS 32 HG1 LYS 32 71.983 -15.732 -2.436 27 1HD LYS 32 HD2 LYS 32 71.477 -15.308 -4.669 28 2HD LYS 32 HD1 LYS 32 69.822 -15.895 -4.512 29 1HE LYS 32 HE2 LYS 32 69.073 -13.808 -4.026 30 2HE LYS 32 HE1 LYS 32 70.301 -13.611 -2.760 31 1HZ LYS 32 HZ1 LYS 32 70.868 -12.058 -4.420 32 2HZ LYS 32 HZ2 LYS 32 70.580 -13.161 -5.680 33 3HZ LYS 32 HZ3 LYS 32 71.931 -13.356 -4.667 34 H GLY 33 HN GLY 33 73.861 -16.843 -2.482 35 1HA GLY 33 HA2 GLY 33 74.720 -19.209 -0.936 36 2HA GLY 33 HA1 GLY 33 75.900 -18.552 -2.071 37 H GLY 34 HN GLY 34 76.783 -16.456 -1.652 38 1HA GLY 34 HA2 GLY 34 76.158 -14.468 0.062 39 2HA GLY 34 HA1 GLY 34 76.692 -15.705 1.199 40 H GLY 35 HN GLY 35 78.772 -16.846 -0.363 41 1HA GLY 35 HA2 GLY 35 80.995 -16.465 -1.060 42 2HA GLY 35 HA1 GLY 35 80.583 -14.758 -1.278 43 H ASN 36 HN ASN 36 83.017 -15.581 -0.063 44 HA ASN 36 HA ASN 36 82.558 -14.964 2.828 45 1HB ASN 36 HB2 ASN 36 84.568 -16.179 3.228 46 2HB ASN 36 HB1 ASN 36 83.717 -17.105 1.991 47 1HD2 ASN 36 HD21 ASN 36 86.753 -15.995 2.731 48 2HD2 ASN 36 HD22 ASN 36 87.393 -15.844 1.166 49 H ALA 37 HN ALA 37 84.651 -14.157 0.061 50 HA ALA 37 HA ALA 37 85.475 -11.660 1.490 51 1HB ALA 37 HB1 ALA 37 87.511 -11.853 0.331 52 2HB ALA 37 HB2 ALA 37 86.790 -12.814 -0.961 53 3HB ALA 37 HB3 ALA 37 87.089 -13.541 0.618 54 H VAL 38 HN VAL 38 85.145 -9.685 0.435 55 HA VAL 38 HA VAL 38 84.055 -9.624 -2.331 56 HB VAL 38 HB VAL 38 81.971 -8.708 -1.655 57 1HG1 VAL 38 HG11 VAL 38 82.673 -10.709 0.506 58 2HG1 VAL 38 HG12 VAL 38 82.189 -11.133 -1.136 59 3HG1 VAL 38 HG13 VAL 38 81.053 -10.312 -0.064 60 1HG2 VAL 38 HG21 VAL 38 83.119 -8.392 1.131 61 2HG2 VAL 38 HG22 VAL 38 81.511 -7.894 0.604 62 3HG2 VAL 38 HG23 VAL 38 82.940 -7.084 -0.038 63 H LYS 39 HN LYS 39 84.342 -7.390 -3.335 64 HA LYS 39 HA LYS 39 86.322 -5.822 -1.742 65 1HB LYS 39 HB2 LYS 39 85.254 -5.965 -4.495 66 2HB LYS 39 HB1 LYS 39 85.890 -4.409 -3.994 67 1HG LYS 39 HG2 LYS 39 87.395 -7.032 -3.759 68 2HG LYS 39 HG1 LYS 39 87.642 -5.843 -5.047 69 1HD LYS 39 HD2 LYS 39 88.177 -4.132 -3.319 70 2HD LYS 39 HD1 LYS 39 88.025 -5.374 -2.066 71 1HE LYS 39 HE2 LYS 39 90.066 -6.290 -2.587 72 2HE LYS 39 HE1 LYS 39 89.810 -6.094 -4.330 73 1HZ LYS 39 HZ1 LYS 39 89.929 -3.573 -3.686 74 2HZ LYS 39 HZ2 LYS 39 91.355 -4.459 -3.948 75 3HZ LYS 39 HZ3 LYS 39 90.819 -4.155 -2.365 76 H VAL 40 HN VAL 40 84.974 -5.046 -0.057 77 HA VAL 40 HA VAL 40 82.646 -3.358 -0.795 78 HB VAL 40 HB VAL 40 82.723 -5.236 0.965 79 1HG1 VAL 40 HG11 VAL 40 84.793 -4.589 2.081 80 2HG1 VAL 40 HG12 VAL 40 83.454 -4.430 3.218 81 3HG1 VAL 40 HG13 VAL 40 84.131 -2.997 2.449 82 1HG2 VAL 40 HG21 VAL 40 80.771 -4.242 1.473 83 2HG2 VAL 40 HG22 VAL 40 81.378 -2.695 0.881 84 3HG2 VAL 40 HG23 VAL 40 81.638 -3.159 2.563 85 H ARG 41 HN ARG 41 82.525 -1.184 -0.367 86 HA ARG 41 HA ARG 41 84.953 0.155 0.781 87 1HB ARG 41 HB2 ARG 41 83.340 1.925 -0.827 88 2HB ARG 41 HB1 ARG 41 85.002 1.421 -1.107 89 1HG ARG 41 HG2 ARG 41 82.561 -0.173 -1.945 90 2HG ARG 41 HG1 ARG 41 83.490 0.872 -3.018 91 1HD ARG 41 HD2 ARG 41 85.149 -1.055 -1.517 92 2HD ARG 41 HD1 ARG 41 84.005 -1.805 -2.654 93 HE ARG 41 HE ARG 41 85.869 0.404 -3.469 94 1HH1 ARG 41 HH21 ARG 41 86.855 -2.365 -3.942 95 2HH1 ARG 41 HH22 ARG 41 86.303 -2.687 -5.553 96 1HH2 ARG 41 HH11 ARG 41 84.007 -0.090 -5.571 97 2HH2 ARG 41 HH12 ARG 41 84.691 -1.400 -6.475 98 H HIS 42 HN HIS 42 84.443 1.882 2.326 99 HA HIS 42 HA HIS 42 81.537 1.942 3.075 100 1HB HIS 42 HB2 HIS 42 82.147 1.701 5.326 101 2HB HIS 42 HB1 HIS 42 83.247 0.607 4.481 102 HD1 HIS 42 HD1 HIS 42 83.455 2.755 7.167 103 HD2 HIS 42 HD2 HIS 42 85.667 2.556 3.641 104 HE1 HIS 42 HE1 HIS 42 85.649 3.930 7.632 105 H ILE 43 HN ILE 43 80.673 3.908 2.939 106 HA ILE 43 HA ILE 43 82.406 6.322 3.418 107 HB ILE 43 HB ILE 43 80.363 5.546 1.383 108 1HG1 ILE 43 HG12 ILE 43 82.594 7.562 1.159 109 2HG1 ILE 43 HG11 ILE 43 82.916 5.824 1.110 110 1HG2 ILE 43 HG21 ILE 43 79.064 7.366 1.751 111 2HG2 ILE 43 HG22 ILE 43 80.409 8.292 1.088 112 3HG2 ILE 43 HG23 ILE 43 80.245 8.103 2.832 113 1HD1 ILE 43 HD11 ILE 43 80.789 7.019 -0.656 114 2HD1 ILE 43 HD12 ILE 43 81.704 5.528 -0.876 115 3HD1 ILE 43 HD13 ILE 43 82.484 7.087 -1.139 116 H LEU 44 HN LEU 44 81.465 7.982 4.873 117 HA LEU 44 HA LEU 44 78.743 7.214 5.967 118 1HB LEU 44 HB2 LEU 44 81.056 8.218 7.645 119 2HB LEU 44 HB1 LEU 44 79.547 7.487 8.202 120 HG LEU 44 HG LEU 44 81.775 6.124 6.690 121 1HD1 LEU 44 HD11 LEU 44 80.711 6.071 9.520 122 2HD1 LEU 44 HD12 LEU 44 82.376 6.314 8.984 123 3HD1 LEU 44 HD13 LEU 44 81.638 4.716 8.868 124 1HD2 LEU 44 HD21 LEU 44 79.774 4.384 7.782 125 2HD2 LEU 44 HD22 LEU 44 80.259 4.560 6.096 126 3HD2 LEU 44 HD23 LEU 44 78.984 5.584 6.764 127 H CYS 45 HN CYS 45 77.517 8.956 6.747 128 HA CYS 45 HA CYS 45 78.608 11.676 6.082 129 1HB CYS 45 HB2 CYS 45 75.797 10.545 5.984 130 2HB CYS 45 HB1 CYS 45 76.211 12.229 5.631 131 HG CYS 45 HG CYS 45 77.955 10.734 3.855 132 H GLU 46 HN GLU 46 77.338 9.658 8.562 133 HA GLU 46 HA GLU 46 77.023 10.099 10.872 134 1HB GLU 46 HB2 GLU 46 78.877 11.931 9.944 135 2HB GLU 46 HB1 GLU 46 77.627 12.976 10.621 136 1HG GLU 46 HG2 GLU 46 77.812 11.065 12.565 137 2HG GLU 46 HG1 GLU 46 79.478 11.117 11.987 138 H LYS 47 HN LYS 47 76.150 13.001 8.999 139 HA LYS 47 HA LYS 47 73.554 13.207 10.405 140 1HB LYS 47 HB2 LYS 47 74.821 14.869 8.197 141 2HB LYS 47 HB1 LYS 47 73.454 15.344 9.203 142 1HG LYS 47 HG2 LYS 47 74.961 15.097 11.216 143 2HG LYS 47 HG1 LYS 47 76.308 14.863 10.103 144 1HD LYS 47 HD2 LYS 47 74.861 17.165 9.239 145 2HD LYS 47 HD1 LYS 47 75.137 17.326 10.972 146 1HE LYS 47 HE2 LYS 47 77.464 16.346 9.410 147 2HE LYS 47 HE1 LYS 47 76.994 18.030 9.114 148 1HZ LYS 47 HZ1 LYS 47 77.239 16.855 11.832 149 2HZ LYS 47 HZ2 LYS 47 77.065 18.496 11.427 150 3HZ LYS 47 HZ3 LYS 47 78.511 17.680 11.071 151 H HIS 48 HN HIS 48 74.921 11.826 7.589 152 HA HIS 48 HA HIS 48 73.968 10.689 5.773 153 1HB HIS 48 HB2 HIS 48 71.497 10.956 7.492 154 2HB HIS 48 HB1 HIS 48 71.803 9.715 6.273 155 HD1 HIS 48 HD1 HIS 48 74.990 9.967 7.510 156 HD2 HIS 48 HD2 HIS 48 71.504 8.521 9.269 157 HE1 HIS 48 HE1 HIS 48 75.734 8.449 9.398 158 H GLY 49 HN GLY 49 73.647 13.782 6.215 159 1HA GLY 49 HA2 GLY 49 71.285 14.472 4.663 160 2HA GLY 49 HA1 GLY 49 72.606 15.574 5.083 161 H LYS 50 HN LYS 50 74.797 14.431 3.964 162 HA LYS 50 HA LYS 50 74.281 14.732 1.065 163 1HB LYS 50 HB2 LYS 50 76.696 14.908 0.952 164 2HB LYS 50 HB1 LYS 50 76.150 15.859 2.332 165 1HG LYS 50 HG2 LYS 50 76.761 13.011 2.893 166 2HG LYS 50 HG1 LYS 50 78.140 14.023 2.476 167 1HD LYS 50 HD2 LYS 50 76.407 15.442 4.296 168 2HD LYS 50 HD1 LYS 50 76.826 13.869 4.974 169 1HE LYS 50 HE2 LYS 50 78.971 15.599 3.740 170 2HE LYS 50 HE1 LYS 50 78.453 15.864 5.420 171 1HZ LYS 50 HZ1 LYS 50 80.254 14.011 4.685 172 2HZ LYS 50 HZ2 LYS 50 78.827 13.090 4.646 173 3HZ LYS 50 HZ3 LYS 50 79.287 13.888 6.073 174 H ILE 51 HN ILE 51 74.310 12.165 3.257 175 HA ILE 51 HA ILE 51 75.691 10.096 1.950 176 HB ILE 51 HB ILE 51 74.349 10.039 4.107 177 1HG1 ILE 51 HG12 ILE 51 73.370 7.671 3.514 178 2HG1 ILE 51 HG11 ILE 51 74.187 7.939 1.966 179 1HG2 ILE 51 HG21 ILE 51 72.301 11.031 2.793 180 2HG2 ILE 51 HG22 ILE 51 72.021 9.869 4.091 181 3HG2 ILE 51 HG23 ILE 51 71.973 9.342 2.408 182 1HD1 ILE 51 HD11 ILE 51 76.300 8.411 3.216 183 2HD1 ILE 51 HD12 ILE 51 75.705 6.773 3.485 184 3HD1 ILE 51 HD13 ILE 51 75.467 8.011 4.719 185 H MET 52 HN MET 52 72.696 11.732 1.098 186 HA MET 52 HA MET 52 72.218 9.957 -1.191 187 1HB MET 52 HB2 MET 52 70.117 10.877 -1.131 188 2HB MET 52 HB1 MET 52 70.617 11.430 0.463 189 1HG MET 52 HG2 MET 52 69.939 13.439 -0.444 190 2HG MET 52 HG1 MET 52 71.626 13.436 -0.940 191 1HE MET 52 HE1 MET 52 72.316 13.168 -3.836 192 2HE MET 52 HE2 MET 52 72.088 14.409 -2.610 193 3HE MET 52 HE3 MET 52 71.301 14.573 -4.177 194 H GLU 53 HN GLU 53 73.551 13.124 -0.489 195 HA GLU 53 HA GLU 53 73.888 14.057 -3.165 196 1HB GLU 53 HB2 GLU 53 74.192 15.125 -0.751 197 2HB GLU 53 HB1 GLU 53 75.841 14.517 -0.921 198 1HG GLU 53 HG2 GLU 53 76.339 16.254 -2.232 199 2HG GLU 53 HG1 GLU 53 75.103 15.735 -3.373 200 H ALA 54 HN ALA 54 75.433 11.817 -1.014 201 HA ALA 54 HA ALA 54 77.818 11.350 -2.660 202 1HB ALA 54 HB1 ALA 54 77.929 9.332 -1.080 203 2HB ALA 54 HB2 ALA 54 76.429 9.922 -0.365 204 3HB ALA 54 HB3 ALA 54 77.890 10.904 -0.282 205 H MET 55 HN MET 55 74.582 10.014 -2.221 206 HA MET 55 HA MET 55 74.861 7.688 -3.906 207 1HB MET 55 HB2 MET 55 72.532 9.470 -3.117 208 2HB MET 55 HB1 MET 55 72.335 7.952 -3.997 209 1HG MET 55 HG2 MET 55 73.956 7.200 -1.898 210 2HG MET 55 HG1 MET 55 72.899 8.410 -1.154 211 1HE MET 55 HE1 MET 55 70.549 7.070 0.116 212 2HE MET 55 HE2 MET 55 72.289 6.916 0.339 213 3HE MET 55 HE3 MET 55 71.296 5.469 0.186 214 H GLU 56 HN GLU 56 73.244 10.812 -4.576 215 HA GLU 56 HA GLU 56 72.941 10.456 -7.375 216 1HB GLU 56 HB2 GLU 56 73.071 12.770 -5.466 217 2HB GLU 56 HB1 GLU 56 72.970 13.084 -7.197 218 1HG GLU 56 HG2 GLU 56 71.004 11.345 -7.121 219 2HG GLU 56 HG1 GLU 56 70.975 11.732 -5.401 220 H LYS 57 HN LYS 57 75.462 12.378 -5.654 221 HA LYS 57 HA LYS 57 77.040 13.215 -7.755 222 1HB LYS 57 HB2 LYS 57 77.621 12.144 -5.011 223 2HB LYS 57 HB1 LYS 57 78.977 12.515 -6.070 224 1HG LYS 57 HG2 LYS 57 77.213 14.712 -6.291 225 2HG LYS 57 HG1 LYS 57 77.301 14.337 -4.575 226 1HD LYS 57 HD2 LYS 57 79.456 15.015 -4.413 227 2HD LYS 57 HD1 LYS 57 79.909 14.205 -5.911 228 1HE LYS 57 HE2 LYS 57 80.111 16.337 -6.725 229 2HE LYS 57 HE1 LYS 57 78.341 16.281 -6.842 230 1HZ LYS 57 HZ1 LYS 57 80.010 17.361 -4.651 231 2HZ LYS 57 HZ2 LYS 57 78.393 16.913 -4.387 232 3HZ LYS 57 HZ3 LYS 57 78.768 18.134 -5.507 233 H LEU 58 HN LEU 58 78.004 10.251 -6.041 234 HA LEU 58 HA LEU 58 79.660 8.982 -7.768 235 1HB LEU 58 HB2 LEU 58 77.500 8.174 -5.917 236 2HB LEU 58 HB1 LEU 58 77.984 6.921 -7.069 237 HG LEU 58 HG LEU 58 80.416 7.665 -6.368 238 1HD1 LEU 58 HD11 LEU 58 80.599 8.469 -4.117 239 2HD1 LEU 58 HD12 LEU 58 78.861 8.315 -3.857 240 3HD1 LEU 58 HD13 LEU 58 79.483 9.548 -4.955 241 1HD2 LEU 58 HD21 LEU 58 80.483 5.723 -5.124 242 2HD2 LEU 58 HD22 LEU 58 78.889 5.512 -5.845 243 3HD2 LEU 58 HD23 LEU 58 79.038 6.142 -4.205 244 H LYS 59 HN LYS 59 76.159 9.347 -8.270 245 HA LYS 59 HA LYS 59 76.225 7.721 -10.742 246 1HB LYS 59 HB2 LYS 59 74.174 9.140 -9.055 247 2HB LYS 59 HB1 LYS 59 73.749 8.601 -10.681 248 1HG LYS 59 HG2 LYS 59 75.003 6.377 -9.707 249 2HG LYS 59 HG1 LYS 59 74.263 7.012 -8.239 250 1HD LYS 59 HD2 LYS 59 72.865 6.329 -10.840 251 2HD LYS 59 HD1 LYS 59 72.670 5.523 -9.284 252 1HE LYS 59 HE2 LYS 59 71.728 7.602 -8.322 253 2HE LYS 59 HE1 LYS 59 71.923 8.409 -9.889 254 1HZ LYS 59 HZ1 LYS 59 69.715 7.515 -9.781 255 2HZ LYS 59 HZ2 LYS 59 70.293 5.990 -9.304 256 3HZ LYS 59 HZ3 LYS 59 70.602 6.567 -10.872 257 H SER 60 HN SER 60 75.127 11.055 -9.965 258 HA SER 60 HA SER 60 74.773 12.140 -12.463 259 1HB SER 60 HB2 SER 60 76.443 13.819 -10.715 260 2HB SER 60 HB1 SER 60 74.798 14.089 -11.288 261 HG SER 60 HG SER 60 75.693 12.587 -9.087 262 H GLY 61 HN GLY 61 77.881 11.322 -10.995 263 1HA GLY 61 HA2 GLY 61 79.628 10.673 -12.715 264 2HA GLY 61 HA1 GLY 61 79.204 12.179 -13.541 265 H MET 62 HN MET 62 79.014 12.721 -10.244 266 HA MET 62 HA MET 62 81.204 14.535 -10.153 267 1HB MET 62 HB2 MET 62 80.059 13.002 -7.809 268 2HB MET 62 HB1 MET 62 80.693 14.645 -7.818 269 1HG MET 62 HG2 MET 62 78.159 13.693 -9.174 270 2HG MET 62 HG1 MET 62 78.273 14.713 -7.756 271 1HE MET 62 HE1 MET 62 76.486 15.688 -9.706 272 2HE MET 62 HE2 MET 62 76.975 17.368 -9.937 273 3HE MET 62 HE3 MET 62 77.067 16.640 -8.332 274 H ARG 63 HN ARG 63 82.254 13.507 -7.562 275 HA ARG 63 HA ARG 63 84.314 11.670 -8.663 276 1HB ARG 63 HB2 ARG 63 84.062 13.285 -6.113 277 2HB ARG 63 HB1 ARG 63 85.501 12.390 -6.618 278 1HG ARG 63 HG2 ARG 63 86.167 14.140 -7.818 279 2HG ARG 63 HG1 ARG 63 84.691 14.059 -8.784 280 1HD ARG 63 HD2 ARG 63 83.563 15.634 -7.445 281 2HD ARG 63 HD1 ARG 63 84.599 15.312 -6.037 282 HE ARG 63 HE ARG 63 86.290 16.262 -8.103 283 1HH1 ARG 63 HH21 ARG 63 84.169 17.244 -5.621 284 2HH1 ARG 63 HH22 ARG 63 84.391 18.939 -5.893 285 1HH2 ARG 63 HH11 ARG 63 86.359 18.499 -8.713 286 2HH2 ARG 63 HH12 ARG 63 85.630 19.650 -7.643 287 H PHE 64 HN PHE 64 84.632 9.637 -7.695 288 HA PHE 64 HA PHE 64 82.444 8.685 -5.944 289 1HB PHE 64 HB2 PHE 64 84.558 7.575 -7.729 290 2HB PHE 64 HB1 PHE 64 84.152 6.588 -6.326 291 HD1 PHE 64 HD1 PHE 64 82.028 5.485 -6.138 292 HD2 PHE 64 HD2 PHE 64 82.799 8.189 -9.383 293 HE1 PHE 64 HE1 PHE 64 79.971 4.701 -7.279 294 HE2 PHE 64 HE2 PHE 64 80.741 7.408 -10.525 295 HZ PHE 64 HZ PHE 64 79.326 5.663 -9.472 296 H ASN 65 HN ASN 65 85.953 9.263 -5.964 297 HA ASN 65 HA ASN 65 86.175 8.370 -3.156 298 1HB ASN 65 HB2 ASN 65 88.523 8.540 -3.539 299 2HB ASN 65 HB1 ASN 65 87.809 7.829 -4.983 300 1HD2 ASN 65 HD21 ASN 65 88.392 8.814 -6.917 301 2HD2 ASN 65 HD22 ASN 65 88.988 10.398 -7.065 302 H GLU 66 HN GLU 66 86.380 11.464 -4.978 303 HA GLU 66 HA GLU 66 87.321 13.048 -2.786 304 1HB GLU 66 HB2 GLU 66 85.391 13.828 -4.993 305 2HB GLU 66 HB1 GLU 66 86.418 14.918 -4.076 306 1HG GLU 66 HG2 GLU 66 88.165 12.967 -5.074 307 2HG GLU 66 HG1 GLU 66 87.079 13.327 -6.414 308 H VAL 67 HN VAL 67 84.013 12.294 -3.922 309 HA VAL 67 HA VAL 67 82.649 13.542 -1.731 310 HB VAL 67 HB VAL 67 80.820 11.997 -2.432 311 1HG1 VAL 67 HG11 VAL 67 80.676 12.589 -4.833 312 2HG1 VAL 67 HG12 VAL 67 82.375 13.077 -4.787 313 3HG1 VAL 67 HG13 VAL 67 81.177 13.971 -3.849 314 1HG2 VAL 67 HG21 VAL 67 81.349 10.398 -4.303 315 2HG2 VAL 67 HG22 VAL 67 82.000 9.977 -2.717 316 3HG2 VAL 67 HG23 VAL 67 83.051 10.691 -3.939 317 H ALA 68 HN ALA 68 83.870 10.236 -2.322 318 HA ALA 68 HA ALA 68 83.133 8.929 0.040 319 1HB ALA 68 HB1 ALA 68 84.350 7.953 -1.905 320 2HB ALA 68 HB2 ALA 68 85.118 7.550 -0.370 321 3HB ALA 68 HB3 ALA 68 85.801 8.807 -1.392 322 H ALA 69 HN ALA 69 85.562 11.386 -0.507 323 HA ALA 69 HA ALA 69 86.956 11.047 1.977 324 1HB ALA 69 HB1 ALA 69 88.193 12.680 1.012 325 2HB ALA 69 HB2 ALA 69 86.818 13.784 1.018 326 3HB ALA 69 HB3 ALA 69 87.047 12.669 -0.328 327 H GLN 70 HN GLN 70 84.928 13.863 1.164 328 HA GLN 70 HA GLN 70 84.119 13.952 4.002 329 1HB GLN 70 HB2 GLN 70 84.183 15.852 1.718 330 2HB GLN 70 HB1 GLN 70 83.246 16.229 3.166 331 1HG GLN 70 HG2 GLN 70 85.888 16.816 2.964 332 2HG GLN 70 HG1 GLN 70 85.124 16.432 4.510 333 1HE2 GLN 70 HE21 GLN 70 85.306 13.957 5.185 334 2HE2 GLN 70 HE22 GLN 70 86.658 13.087 4.645 335 H TYR 71 HN TYR 71 82.481 13.508 0.877 336 HA TYR 71 HA TYR 71 79.856 13.762 1.956 337 1HB TYR 71 HB2 TYR 71 81.071 12.111 -0.262 338 2HB TYR 71 HB1 TYR 71 79.370 11.956 0.136 339 HD1 TYR 71 HD1 TYR 71 78.320 12.997 -1.713 340 HD2 TYR 71 HD2 TYR 71 81.491 15.038 0.357 341 HE1 TYR 71 HE1 TYR 71 77.803 15.076 -2.957 342 HE2 TYR 71 HE2 TYR 71 80.971 17.108 -0.892 343 HH TYR 71 HH TYR 71 79.880 17.876 -2.806 344 H SER 72 HN SER 72 82.398 11.425 2.198 345 HA SER 72 HA SER 72 80.775 9.645 3.950 346 1HB SER 72 HB2 SER 72 82.077 8.069 2.997 347 2HB SER 72 HB1 SER 72 82.826 9.306 2.014 348 HG SER 72 HG SER 72 84.413 8.306 3.216 349 H GLU 73 HN GLU 73 83.037 8.916 5.660 350 HA GLU 73 HA GLU 73 83.999 11.514 6.733 351 1HB GLU 73 HB2 GLU 73 81.986 9.671 7.892 352 2HB GLU 73 HB1 GLU 73 83.176 10.331 9.011 353 1HG GLU 73 HG2 GLU 73 82.579 12.592 7.736 354 2HG GLU 73 HG1 GLU 73 81.074 11.733 7.411 355 H ASP 74 HN ASP 74 85.449 9.430 5.450 356 HA ASP 74 HA ASP 74 87.621 9.009 7.247 357 1HB ASP 74 HB2 ASP 74 87.240 6.560 7.699 358 2HB ASP 74 HB1 ASP 74 86.043 7.596 8.460 359 H LYS 75 HN LYS 75 87.745 6.071 6.024 360 HA LYS 75 HA LYS 75 89.567 6.414 3.987 361 1HB LYS 75 HB2 LYS 75 88.589 4.297 5.071 362 2HB LYS 75 HB1 LYS 75 87.308 4.403 3.863 363 1HG LYS 75 HG2 LYS 75 88.729 3.159 2.589 364 2HG LYS 75 HG1 LYS 75 89.533 4.702 2.299 365 1HD LYS 75 HD2 LYS 75 91.379 3.945 3.339 366 2HD LYS 75 HD1 LYS 75 90.446 3.669 4.811 367 1HE LYS 75 HE2 LYS 75 89.892 1.427 4.145 368 2HE LYS 75 HE1 LYS 75 90.485 1.703 2.496 369 1HZ LYS 75 HZ1 LYS 75 92.691 2.039 3.335 370 2HZ LYS 75 HZ2 LYS 75 92.122 0.567 3.964 371 3HZ LYS 75 HZ3 LYS 75 92.159 1.954 4.943 372 H ALA 76 HN ALA 76 89.420 7.674 2.161 373 HA ALA 76 HA ALA 76 86.728 8.042 0.916 374 1HB ALA 76 HB1 ALA 76 89.186 9.600 0.191 375 2HB ALA 76 HB2 ALA 76 88.434 9.887 1.759 376 3HB ALA 76 HB3 ALA 76 87.509 10.138 0.277 377 H ARG 77 HN ARG 77 89.740 6.443 0.457 378 HA ARG 77 HA ARG 77 90.337 6.424 -2.232 379 1HB ARG 77 HB2 ARG 77 90.824 4.842 -0.019 380 2HB ARG 77 HB1 ARG 77 89.994 3.725 -1.102 381 1HG ARG 77 HG2 ARG 77 91.783 3.597 -2.475 382 2HG ARG 77 HG1 ARG 77 91.950 5.352 -2.525 383 1HD ARG 77 HD2 ARG 77 93.954 4.664 -1.471 384 2HD ARG 77 HD1 ARG 77 92.911 5.056 -0.089 385 HE ARG 77 HE ARG 77 92.277 2.435 -0.545 386 1HH1 ARG 77 HH11 ARG 77 94.595 3.970 1.183 387 2HH1 ARG 77 HH12 ARG 77 95.766 2.693 1.156 388 1HH2 ARG 77 HH21 ARG 77 94.074 0.835 -1.234 389 2HH2 ARG 77 HH22 ARG 77 95.472 0.920 -0.215 390 H GLN 78 HN GLN 78 88.742 6.629 -3.796 391 HA GLN 78 HA GLN 78 86.969 5.992 -5.217 392 1HB GLN 78 HB2 GLN 78 87.954 3.853 -5.437 393 2HB GLN 78 HB1 GLN 78 87.644 3.438 -3.751 394 1HG GLN 78 HG2 GLN 78 85.271 4.060 -5.452 395 2HG GLN 78 HG1 GLN 78 86.093 2.523 -5.747 396 1HE2 GLN 78 HE21 GLN 78 83.546 3.711 -4.033 397 2HE2 GLN 78 HE22 GLN 78 83.589 2.696 -2.672 398 H GLY 79 HN GLY 79 86.388 4.353 -2.099 399 1HA GLY 79 HA2 GLY 79 84.255 6.100 -1.322 400 2HA GLY 79 HA1 GLY 79 83.601 4.621 -2.016 401 H GLY 80 HN GLY 80 86.640 4.822 -0.254 402 1HA GLY 80 HA2 GLY 80 87.185 4.073 1.933 403 2HA GLY 80 HA1 GLY 80 85.473 3.742 2.214 404 H ASP 81 HN ASP 81 87.284 2.612 -0.585 405 HA ASP 81 HA ASP 81 86.368 -0.034 -0.554 406 1HB ASP 81 HB2 ASP 81 87.687 1.327 -2.292 407 2HB ASP 81 HB1 ASP 81 89.137 0.816 -1.419 408 H LEU 82 HN LEU 82 86.478 -0.633 1.810 409 HA LEU 82 HA LEU 82 88.792 -0.846 3.378 410 1HB LEU 82 HB2 LEU 82 86.231 -2.362 3.051 411 2HB LEU 82 HB1 LEU 82 87.473 -3.070 4.084 412 HG LEU 82 HG LEU 82 87.613 -0.723 5.169 413 1HD1 LEU 82 HD11 LEU 82 85.314 -0.462 3.326 414 2HD1 LEU 82 HD12 LEU 82 86.371 0.779 3.994 415 3HD1 LEU 82 HD13 LEU 82 85.043 0.142 4.960 416 1HD2 LEU 82 HD21 LEU 82 86.438 -1.680 6.847 417 2HD2 LEU 82 HD22 LEU 82 86.112 -3.007 5.733 418 3HD2 LEU 82 HD23 LEU 82 84.955 -1.686 5.893 419 H GLY 83 HN GLY 83 87.925 -2.601 0.497 420 1HA GLY 83 HA2 GLY 83 89.498 -3.846 -0.829 421 2HA GLY 83 HA1 GLY 83 90.525 -4.019 0.601 422 H TRP 84 HN TRP 84 90.146 -6.317 -0.733 423 HA TRP 84 HA TRP 84 87.938 -7.954 -0.441 424 1HB TRP 84 HB2 TRP 84 90.905 -8.316 -0.176 425 2HB TRP 84 HB1 TRP 84 89.867 -9.690 0.176 426 HD1 TRP 84 HD1 TRP 84 91.515 -8.005 -2.589 427 HE1 TRP 84 HE1 TRP 84 90.603 -8.816 -4.864 428 HE3 TRP 84 HE3 TRP 84 87.343 -10.473 -1.018 429 HZ2 TRP 84 HZ2 TRP 84 88.388 -10.324 -5.875 430 HZ3 TRP 84 HZ3 TRP 84 85.854 -11.591 -2.649 431 HH2 TRP 84 HH2 TRP 84 86.363 -11.520 -5.075 432 H MET 85 HN MET 85 86.709 -8.606 1.325 433 HA MET 85 HA MET 85 88.031 -8.674 4.006 434 1HB MET 85 HB2 MET 85 85.876 -6.889 2.996 435 2HB MET 85 HB1 MET 85 85.665 -7.525 4.627 436 1HG MET 85 HG2 MET 85 88.260 -6.261 3.729 437 2HG MET 85 HG1 MET 85 86.945 -5.306 4.418 438 1HE MET 85 HE1 MET 85 89.713 -5.406 5.217 439 2HE MET 85 HE2 MET 85 90.067 -6.028 6.827 440 3HE MET 85 HE3 MET 85 88.946 -4.682 6.638 441 H THR 86 HN THR 86 87.128 -10.191 5.414 442 HA THR 86 HA THR 86 84.863 -11.835 4.341 443 HB THR 86 HB THR 86 86.249 -13.583 5.833 444 HG1 THR 86 HG1 THR 86 87.949 -12.496 6.490 445 1HG2 THR 86 HG21 THR 86 86.907 -12.682 3.019 446 2HG2 THR 86 HG22 THR 86 85.764 -13.938 3.492 447 3HG2 THR 86 HG23 THR 86 87.493 -14.185 3.732 448 H ARG 87 HN ARG 87 83.378 -12.616 5.928 449 HA ARG 87 HA ARG 87 82.499 -11.048 7.994 450 1HB ARG 87 HB2 ARG 87 81.437 -13.117 7.161 451 2HB ARG 87 HB1 ARG 87 82.684 -14.079 7.957 452 1HG ARG 87 HG2 ARG 87 81.960 -12.870 10.123 453 2HG ARG 87 HG1 ARG 87 80.521 -12.392 9.221 454 1HD ARG 87 HD2 ARG 87 81.440 -15.278 9.450 455 2HD ARG 87 HD1 ARG 87 80.249 -14.545 10.542 456 HE ARG 87 HE ARG 87 79.314 -13.864 8.030 457 1HH1 ARG 87 HH21 ARG 87 79.276 -16.491 10.123 458 2HH1 ARG 87 HH22 ARG 87 78.640 -17.621 8.976 459 1HH2 ARG 87 HH11 ARG 87 78.918 -15.449 6.286 460 2HH2 ARG 87 HH12 ARG 87 78.434 -17.030 6.802 461 H GLY 88 HN GLY 88 85.078 -13.509 8.282 462 1HA GLY 88 HA2 GLY 88 85.535 -13.436 11.039 463 2HA GLY 88 HA1 GLY 88 86.827 -13.655 9.850 464 H SER 89 HN SER 89 86.173 -10.968 8.654 465 HA SER 89 HA SER 89 87.599 -9.323 10.710 466 1HB SER 89 HB2 SER 89 88.646 -9.865 8.465 467 2HB SER 89 HB1 SER 89 87.354 -8.919 7.712 468 HG SER 89 HG SER 89 89.611 -8.063 8.845 469 H MET 90 HN MET 90 84.930 -9.283 8.354 470 HA MET 90 HA MET 90 84.064 -6.587 8.888 471 1HB MET 90 HB2 MET 90 82.738 -9.077 7.779 472 2HB MET 90 HB1 MET 90 81.955 -7.498 7.787 473 1HG MET 90 HG2 MET 90 84.544 -7.066 6.752 474 2HG MET 90 HG1 MET 90 83.948 -8.525 5.961 475 1HE MET 90 HE1 MET 90 80.781 -8.119 4.972 476 2HE MET 90 HE2 MET 90 82.343 -8.889 4.706 477 3HE MET 90 HE3 MET 90 81.714 -7.753 3.515 478 H VAL 91 HN VAL 91 81.315 -6.930 9.461 479 HA VAL 91 HA VAL 91 81.360 -8.076 12.232 480 HB VAL 91 HB VAL 91 81.562 -5.517 11.901 481 1HG1 VAL 91 HG11 VAL 91 79.366 -5.937 10.265 482 2HG1 VAL 91 HG12 VAL 91 79.896 -4.377 10.892 483 3HG1 VAL 91 HG13 VAL 91 78.648 -5.288 11.740 484 1HG2 VAL 91 HG21 VAL 91 80.889 -5.488 14.045 485 2HG2 VAL 91 HG22 VAL 91 80.237 -7.112 13.823 486 3HG2 VAL 91 HG23 VAL 91 79.209 -5.703 13.557 487 H GLY 92 HN GLY 92 78.765 -7.858 12.945 488 1HA GLY 92 HA2 GLY 92 77.451 -9.836 11.295 489 2HA GLY 92 HA1 GLY 92 76.738 -9.022 12.694 490 HA PRO 93 HA PRO 93 74.246 -6.323 10.330 491 1HB PRO 93 HB2 PRO 93 75.553 -3.829 10.939 492 2HB PRO 93 HB1 PRO 93 74.077 -4.494 11.654 493 1HG PRO 93 HG2 PRO 93 76.720 -4.305 12.825 494 2HG PRO 93 HG1 PRO 93 75.221 -4.848 13.581 495 1HD PRO 93 HD2 PRO 93 77.454 -6.467 12.860 496 2HD PRO 93 HD1 PRO 93 75.867 -7.034 13.427 497 H PHE 94 HN PHE 94 77.369 -4.577 10.144 498 HA PHE 94 HA PHE 94 77.294 -3.603 7.576 499 1HB PHE 94 HB2 PHE 94 79.111 -3.568 9.415 500 2HB PHE 94 HB1 PHE 94 79.724 -5.041 8.652 501 HD1 PHE 94 HD1 PHE 94 79.042 -1.431 8.151 502 HD2 PHE 94 HD2 PHE 94 80.829 -4.977 6.510 503 HE1 PHE 94 HE1 PHE 94 80.190 -0.058 6.434 504 HE2 PHE 94 HE2 PHE 94 81.977 -3.602 4.793 505 HZ PHE 94 HZ PHE 94 81.658 -1.144 4.756 506 H GLN 95 HN GLN 95 78.045 -6.978 8.468 507 HA GLN 95 HA GLN 95 78.454 -7.727 5.640 508 1HB GLN 95 HB2 GLN 95 79.832 -8.645 7.465 509 2HB GLN 95 HB1 GLN 95 78.388 -9.310 8.229 510 1HG GLN 95 HG2 GLN 95 78.354 -10.182 5.530 511 2HG GLN 95 HG1 GLN 95 79.992 -10.446 6.125 512 1HE2 GLN 95 HE21 GLN 95 76.733 -10.704 7.677 513 2HE2 GLN 95 HE22 GLN 95 76.983 -12.276 8.268 514 H GLU 96 HN GLU 96 76.090 -8.388 8.237 515 HA GLU 96 HA GLU 96 74.405 -10.264 7.151 516 1HB GLU 96 HB2 GLU 96 74.097 -7.804 8.785 517 2HB GLU 96 HB1 GLU 96 72.608 -8.474 8.121 518 1HG GLU 96 HG2 GLU 96 73.118 -10.658 9.107 519 2HG GLU 96 HG1 GLU 96 74.655 -10.045 9.716 520 H ALA 97 HN ALA 97 74.731 -6.907 6.070 521 HA ALA 97 HA ALA 97 72.463 -7.052 4.229 522 1HB ALA 97 HB1 ALA 97 72.804 -4.868 4.793 523 2HB ALA 97 HB2 ALA 97 73.987 -4.898 3.485 524 3HB ALA 97 HB3 ALA 97 74.511 -5.135 5.152 525 H ALA 98 HN ALA 98 75.819 -6.210 3.418 526 HA ALA 98 HA ALA 98 75.825 -6.860 0.725 527 1HB ALA 98 HB1 ALA 98 77.676 -5.807 1.932 528 2HB ALA 98 HB2 ALA 98 78.272 -7.226 1.072 529 3HB ALA 98 HB3 ALA 98 77.984 -7.305 2.811 530 H PHE 99 HN PHE 99 77.134 -9.136 3.172 531 HA PHE 99 HA PHE 99 77.410 -11.419 1.644 532 1HB PHE 99 HB2 PHE 99 76.709 -10.786 4.463 533 2HB PHE 99 HB1 PHE 99 76.435 -12.458 3.953 534 HD1 PHE 99 HD1 PHE 99 78.223 -13.417 5.287 535 HD2 PHE 99 HD2 PHE 99 79.023 -10.291 2.452 536 HE1 PHE 99 HE1 PHE 99 80.654 -13.873 5.471 537 HE2 PHE 99 HE2 PHE 99 81.454 -10.747 2.636 538 HZ PHE 99 HZ PHE 99 82.270 -12.537 4.146 539 H ALA 100 HN ALA 100 74.383 -9.956 2.671 540 HA ALA 100 HA ALA 100 72.874 -12.281 1.542 541 1HB ALA 100 HB1 ALA 100 72.365 -11.691 3.847 542 2HB ALA 100 HB2 ALA 100 70.993 -11.230 2.841 543 3HB ALA 100 HB3 ALA 100 72.127 -10.002 3.400 544 H LEU 101 HN LEU 101 73.985 -9.255 0.646 545 HA LEU 101 HA LEU 101 71.673 -8.836 -1.220 546 1HB LEU 101 HB2 LEU 101 73.395 -7.041 0.447 547 2HB LEU 101 HB1 LEU 101 72.793 -6.415 -1.093 548 HG LEU 101 HG LEU 101 70.800 -7.830 0.589 549 1HD1 LEU 101 HD11 LEU 101 72.381 -5.528 1.554 550 2HD1 LEU 101 HD12 LEU 101 71.412 -6.688 2.463 551 3HD1 LEU 101 HD13 LEU 101 70.632 -5.322 1.664 552 1HD2 LEU 101 HD21 LEU 101 70.221 -6.744 -1.544 553 2HD2 LEU 101 HD22 LEU 101 70.823 -5.204 -0.931 554 3HD2 LEU 101 HD23 LEU 101 69.400 -5.946 -0.202 555 HA PRO 102 HA PRO 102 74.346 -9.130 -4.696 556 1HB PRO 102 HB2 PRO 102 73.748 -6.549 -5.811 557 2HB PRO 102 HB1 PRO 102 73.068 -8.118 -6.269 558 1HG PRO 102 HG2 PRO 102 71.782 -5.966 -4.846 559 2HG PRO 102 HG1 PRO 102 71.088 -7.520 -5.331 560 1HD PRO 102 HD2 PRO 102 71.795 -6.649 -2.672 561 2HD PRO 102 HD1 PRO 102 71.126 -8.228 -3.162 562 H VAL 103 HN VAL 103 76.467 -8.426 -5.379 563 HA VAL 103 HA VAL 103 78.048 -7.010 -3.531 564 HB VAL 103 HB VAL 103 79.580 -7.004 -5.586 565 1HG1 VAL 103 HG11 VAL 103 79.129 -8.884 -3.786 566 2HG1 VAL 103 HG12 VAL 103 80.147 -9.213 -5.189 567 3HG1 VAL 103 HG13 VAL 103 78.461 -9.733 -5.179 568 1HG2 VAL 103 HG21 VAL 103 78.696 -7.343 -7.604 569 2HG2 VAL 103 HG22 VAL 103 77.100 -7.503 -6.870 570 3HG2 VAL 103 HG23 VAL 103 78.126 -8.925 -7.072 571 H SER 104 HN SER 104 79.500 -5.158 -5.103 572 HA SER 104 HA SER 104 79.468 -2.877 -5.719 573 1HB SER 104 HB2 SER 104 76.856 -3.955 -6.811 574 2HB SER 104 HB1 SER 104 77.425 -2.316 -7.153 575 HG SER 104 HG SER 104 78.984 -3.087 -8.369 576 H GLY 105 HN GLY 105 78.293 -0.784 -5.289 577 1HA GLY 105 HA2 GLY 105 76.193 -0.933 -3.200 578 2HA GLY 105 HA1 GLY 105 77.691 -0.103 -2.786 579 H MET 106 HN MET 106 77.630 2.068 -3.127 580 HA MET 106 HA MET 106 77.039 4.150 -4.062 581 1HB MET 106 HB2 MET 106 77.968 2.931 -6.042 582 2HB MET 106 HB1 MET 106 76.336 2.382 -6.425 583 1HG MET 106 HG2 MET 106 76.199 5.194 -6.012 584 2HG MET 106 HG1 MET 106 77.576 4.888 -7.079 585 1HE MET 106 HE1 MET 106 77.596 3.393 -8.957 586 2HE MET 106 HE2 MET 106 77.131 4.929 -9.683 587 3HE MET 106 HE3 MET 106 76.339 3.443 -10.201 588 H ASP 107 HN ASP 107 74.626 2.107 -5.737 589 HA ASP 107 HA ASP 107 72.407 2.381 -4.059 590 1HB ASP 107 HB2 ASP 107 71.384 4.478 -5.236 591 2HB ASP 107 HB1 ASP 107 72.589 4.731 -3.977 592 H LYS 108 HN LYS 108 73.642 2.416 -7.340 593 HA LYS 108 HA LYS 108 71.044 1.675 -8.517 594 1HB LYS 108 HB2 LYS 108 73.318 2.991 -9.352 595 2HB LYS 108 HB1 LYS 108 73.481 1.414 -10.137 596 1HG LYS 108 HG2 LYS 108 71.638 1.735 -11.463 597 2HG LYS 108 HG1 LYS 108 70.781 2.657 -10.228 598 1HD LYS 108 HD2 LYS 108 71.286 4.443 -11.550 599 2HD LYS 108 HD1 LYS 108 72.869 4.335 -10.779 600 1HE LYS 108 HE2 LYS 108 72.175 2.808 -13.309 601 2HE LYS 108 HE1 LYS 108 72.938 4.410 -13.323 602 1HZ LYS 108 HZ1 LYS 108 74.468 3.282 -11.540 603 2HZ LYS 108 HZ2 LYS 108 74.781 3.067 -13.195 604 3HZ LYS 108 HZ3 LYS 108 73.984 1.853 -12.315 605 HA PRO 109 HA PRO 109 73.590 -2.364 -9.386 606 1HB PRO 109 HB2 PRO 109 75.558 -2.583 -7.298 607 2HB PRO 109 HB1 PRO 109 75.819 -2.465 -9.046 608 1HG PRO 109 HG2 PRO 109 76.366 -0.478 -7.070 609 2HG PRO 109 HG1 PRO 109 76.525 -0.324 -8.821 610 1HD PRO 109 HD2 PRO 109 74.521 0.849 -7.073 611 2HD PRO 109 HD1 PRO 109 74.769 1.134 -8.817 612 H VAL 110 HN VAL 110 74.163 -1.933 -5.867 613 HA VAL 110 HA VAL 110 73.093 -4.349 -4.979 614 HB VAL 110 HB VAL 110 72.390 -2.840 -2.939 615 1HG1 VAL 110 HG11 VAL 110 75.123 -2.423 -2.844 616 2HG1 VAL 110 HG12 VAL 110 74.948 -3.799 -3.936 617 3HG1 VAL 110 HG13 VAL 110 74.266 -3.869 -2.309 618 1HG2 VAL 110 HG21 VAL 110 74.268 -0.910 -4.245 619 2HG2 VAL 110 HG22 VAL 110 73.125 -0.645 -2.927 620 3HG2 VAL 110 HG23 VAL 110 72.538 -0.822 -4.580 621 H PHE 111 HN PHE 111 71.072 -4.152 -3.364 622 HA PHE 111 HA PHE 111 68.714 -3.232 -4.969 623 1HB PHE 111 HB2 PHE 111 69.606 -5.800 -3.920 624 2HB PHE 111 HB1 PHE 111 67.970 -5.400 -3.370 625 HD1 PHE 111 HD1 PHE 111 70.083 -5.375 -6.475 626 HD2 PHE 111 HD2 PHE 111 66.161 -5.848 -4.789 627 HE1 PHE 111 HE1 PHE 111 69.194 -5.978 -8.710 628 HE2 PHE 111 HE2 PHE 111 65.273 -6.450 -7.025 629 HZ PHE 111 HZ PHE 111 66.790 -6.515 -8.986 630 H THR 112 HN THR 112 70.405 -3.266 -1.948 631 HA THR 112 HA THR 112 68.003 -2.370 -0.418 632 HB THR 112 HB THR 112 69.636 -4.158 0.379 633 HG1 THR 112 HG1 THR 112 68.586 -3.375 2.048 634 1HG2 THR 112 HG21 THR 112 71.675 -3.042 -0.479 635 2HG2 THR 112 HG22 THR 112 71.796 -3.385 1.246 636 3HG2 THR 112 HG23 THR 112 71.444 -1.746 0.696 637 H ASP 113 HN ASP 113 69.512 -0.827 1.461 638 HA ASP 113 HA ASP 113 69.924 1.652 -0.135 639 1HB ASP 113 HB2 ASP 113 69.655 2.727 2.077 640 2HB ASP 113 HB1 ASP 113 68.330 1.602 1.778 641 HA PRO 114 HA PRO 114 74.281 0.977 0.242 642 1HB PRO 114 HB2 PRO 114 74.809 3.784 -0.058 643 2HB PRO 114 HB1 PRO 114 74.993 2.492 -1.254 644 1HG PRO 114 HG2 PRO 114 72.979 4.539 -1.179 645 2HG PRO 114 HG1 PRO 114 73.157 3.237 -2.358 646 1HD PRO 114 HD2 PRO 114 71.150 3.499 -0.293 647 2HD PRO 114 HD1 PRO 114 71.319 2.201 -1.498 648 HA PRO 115 HA PRO 115 75.108 4.009 3.946 649 1HB PRO 115 HB2 PRO 115 72.601 5.247 4.614 650 2HB PRO 115 HB1 PRO 115 74.076 6.025 4.032 651 1HG PRO 115 HG2 PRO 115 71.607 5.687 2.626 652 2HG PRO 115 HG1 PRO 115 73.109 6.394 2.012 653 1HD PRO 115 HD2 PRO 115 71.931 3.815 1.363 654 2HD PRO 115 HD1 PRO 115 73.365 4.585 0.663 655 H VAL 116 HN VAL 116 74.831 1.568 4.560 656 HA VAL 116 HA VAL 116 72.322 0.903 5.967 657 HB VAL 116 HB VAL 116 73.276 -1.299 6.028 658 1HG1 VAL 116 HG11 VAL 116 74.515 -1.042 3.533 659 2HG1 VAL 116 HG12 VAL 116 73.355 0.284 3.591 660 3HG1 VAL 116 HG13 VAL 116 72.809 -1.376 3.823 661 1HG2 VAL 116 HG21 VAL 116 75.911 -0.027 5.249 662 2HG2 VAL 116 HG22 VAL 116 75.628 -1.739 5.568 663 3HG2 VAL 116 HG23 VAL 116 75.499 -0.564 6.878 664 H LYS 117 HN LYS 117 72.234 0.449 8.225 665 HA LYS 117 HA LYS 117 74.302 1.845 9.838 666 1HB LYS 117 HB2 LYS 117 72.023 2.477 10.236 667 2HB LYS 117 HB1 LYS 117 71.509 0.785 10.314 668 1HG LYS 117 HG2 LYS 117 72.079 0.614 12.500 669 2HG LYS 117 HG1 LYS 117 73.636 1.411 12.232 670 1HD LYS 117 HD2 LYS 117 72.836 3.340 13.075 671 2HD LYS 117 HD1 LYS 117 71.503 3.328 11.912 672 1HE LYS 117 HE2 LYS 117 70.899 1.333 13.845 673 2HE LYS 117 HE1 LYS 117 71.404 2.779 14.740 674 1HZ LYS 117 HZ1 LYS 117 69.204 2.447 12.818 675 2HZ LYS 117 HZ2 LYS 117 69.982 3.954 12.900 676 3HZ LYS 117 HZ3 LYS 117 69.231 3.307 14.279 677 H THR 118 HN THR 118 75.443 0.770 11.518 678 HA THR 118 HA THR 118 75.003 -2.155 11.852 679 HB THR 118 HB THR 118 76.608 -2.081 10.089 680 HG1 THR 118 HG1 THR 118 78.659 -2.419 11.504 681 1HG2 THR 118 HG21 THR 118 77.074 0.417 10.504 682 2HG2 THR 118 HG22 THR 118 78.429 -0.567 9.952 683 3HG2 THR 118 HG23 THR 118 78.296 -0.128 11.654 684 H LYS 119 HN LYS 119 77.072 0.608 12.830 685 HA LYS 119 HA LYS 119 76.397 0.383 15.620 686 1HB LYS 119 HB2 LYS 119 78.647 -0.572 16.314 687 2HB LYS 119 HB1 LYS 119 77.587 -1.713 15.486 688 1HG LYS 119 HG2 LYS 119 78.813 -1.585 13.479 689 2HG LYS 119 HG1 LYS 119 79.580 -0.062 13.939 690 1HD LYS 119 HD2 LYS 119 80.212 -2.020 15.930 691 2HD LYS 119 HD1 LYS 119 80.554 -2.715 14.347 692 1HE LYS 119 HE2 LYS 119 81.514 -0.090 14.159 693 2HE LYS 119 HE1 LYS 119 82.001 -0.629 15.776 694 1HZ LYS 119 HZ1 LYS 119 83.015 -2.544 14.893 695 2HZ LYS 119 HZ2 LYS 119 83.516 -1.287 13.867 696 3HZ LYS 119 HZ3 LYS 119 82.284 -2.347 13.376 697 H PHE 120 HN PHE 120 77.017 2.360 13.421 698 HA PHE 120 HA PHE 120 78.645 4.199 15.052 699 1HB PHE 120 HB2 PHE 120 79.652 2.626 12.820 700 2HB PHE 120 HB1 PHE 120 79.796 4.357 12.492 701 HD1 PHE 120 HD1 PHE 120 81.809 1.901 13.440 702 HD2 PHE 120 HD2 PHE 120 80.202 5.495 15.162 703 HE1 PHE 120 HE1 PHE 120 83.752 2.035 14.975 704 HE2 PHE 120 HE2 PHE 120 82.144 5.627 16.697 705 HZ PHE 120 HZ PHE 120 83.919 3.899 16.604 706 H GLY 121 HN GLY 121 76.935 3.563 12.004 707 1HA GLY 121 HA2 GLY 121 75.126 5.682 12.133 708 2HA GLY 121 HA1 GLY 121 76.555 6.350 11.326 709 H TYR 122 HN TYR 122 75.529 6.530 9.281 710 HA TYR 122 HA TYR 122 74.496 4.027 8.034 711 1HB TYR 122 HB2 TYR 122 74.305 6.992 7.494 712 2HB TYR 122 HB1 TYR 122 73.867 5.826 6.245 713 HD1 TYR 122 HD1 TYR 122 73.390 6.005 9.969 714 HD2 TYR 122 HD2 TYR 122 71.555 5.516 6.117 715 HE1 TYR 122 HE1 TYR 122 71.193 5.654 11.061 716 HE2 TYR 122 HE2 TYR 122 69.355 5.170 7.209 717 HH TYR 122 HH TYR 122 68.356 4.687 9.216 718 H HIS 123 HN HIS 123 75.900 2.903 6.743 719 HA HIS 123 HA HIS 123 78.242 4.373 5.597 720 1HB HIS 123 HB2 HIS 123 78.048 1.396 6.025 721 2HB HIS 123 HB1 HIS 123 79.493 2.393 5.934 722 HD1 HIS 123 HD1 HIS 123 80.562 2.213 8.167 723 HD2 HIS 123 HD2 HIS 123 76.447 2.783 8.508 724 HE1 HIS 123 HE1 HIS 123 80.069 2.443 10.639 725 H ILE 124 HN ILE 124 78.521 4.296 3.362 726 HA ILE 124 HA ILE 124 76.478 2.824 1.785 727 HB ILE 124 HB ILE 124 78.721 4.747 1.053 728 1HG1 ILE 124 HG12 ILE 124 75.695 5.030 1.151 729 2HG1 ILE 124 HG11 ILE 124 76.865 5.860 2.186 730 1HG2 ILE 124 HG21 ILE 124 78.142 4.560 -1.191 731 2HG2 ILE 124 HG22 ILE 124 76.537 3.925 -0.829 732 3HG2 ILE 124 HG23 ILE 124 77.955 2.892 -0.646 733 1HD1 ILE 124 HD11 ILE 124 75.827 6.933 -0.115 734 2HD1 ILE 124 HD12 ILE 124 77.315 6.206 -0.725 735 3HD1 ILE 124 HD13 ILE 124 77.383 7.396 0.575 736 H ILE 125 HN ILE 125 77.010 0.674 1.650 737 HA ILE 125 HA ILE 125 79.855 -0.117 1.419 738 HB ILE 125 HB ILE 125 77.231 -1.450 2.075 739 1HG1 ILE 125 HG12 ILE 125 79.819 -1.312 3.640 740 2HG1 ILE 125 HG11 ILE 125 78.546 -0.091 3.778 741 1HG2 ILE 125 HG21 ILE 125 79.514 -2.667 0.849 742 2HG2 ILE 125 HG22 ILE 125 78.032 -3.434 1.415 743 3HG2 ILE 125 HG23 ILE 125 79.398 -3.235 2.513 744 1HD1 ILE 125 HD11 ILE 125 77.856 -1.515 5.459 745 2HD1 ILE 125 HD12 ILE 125 78.558 -2.937 4.686 746 3HD1 ILE 125 HD13 ILE 125 77.030 -2.278 4.100 747 H MET 126 HN MET 126 80.652 -0.505 -0.583 748 HA MET 126 HA MET 126 78.794 -1.578 -2.674 749 1HB MET 126 HB2 MET 126 79.333 0.385 -3.708 750 2HB MET 126 HB1 MET 126 80.638 0.709 -2.562 751 1HG MET 126 HG2 MET 126 82.172 -0.666 -3.804 752 2HG MET 126 HG1 MET 126 80.878 -1.273 -4.845 753 1HE MET 126 HE1 MET 126 81.818 3.199 -4.593 754 2HE MET 126 HE2 MET 126 81.809 2.015 -3.287 755 3HE MET 126 HE3 MET 126 80.290 2.508 -4.031 756 H VAL 127 HN VAL 127 79.316 -3.706 -2.955 757 HA VAL 127 HA VAL 127 81.990 -4.704 -2.225 758 HB VAL 127 HB VAL 127 79.310 -5.815 -2.989 759 1HG1 VAL 127 HG11 VAL 127 80.403 -8.109 -2.675 760 2HG1 VAL 127 HG12 VAL 127 81.948 -7.290 -2.908 761 3HG1 VAL 127 HG13 VAL 127 80.749 -7.290 -4.196 762 1HG2 VAL 127 HG21 VAL 127 79.958 -7.095 -0.772 763 2HG2 VAL 127 HG22 VAL 127 79.388 -5.428 -0.698 764 3HG2 VAL 127 HG23 VAL 127 81.114 -5.775 -0.594 765 H GLU 128 HN GLU 128 83.415 -5.764 -3.759 766 HA GLU 128 HA GLU 128 82.636 -5.489 -6.618 767 1HB GLU 128 HB2 GLU 128 84.317 -3.762 -5.263 768 2HB GLU 128 HB1 GLU 128 85.448 -4.887 -6.031 769 1HG GLU 128 HG2 GLU 128 83.247 -3.316 -7.413 770 2HG GLU 128 HG1 GLU 128 84.988 -3.037 -7.559 771 H GLY 129 HN GLY 129 82.401 -7.721 -6.590 772 1HA GLY 129 HA2 GLY 129 83.134 -9.843 -7.303 773 2HA GLY 129 HA1 GLY 129 84.788 -9.217 -7.266 774 H ARG 130 HN ARG 130 82.939 -11.507 -5.935 775 HA ARG 130 HA ARG 130 84.157 -11.175 -3.251 776 1HB ARG 130 HB2 ARG 130 82.452 -13.025 -2.714 777 2HB ARG 130 HB1 ARG 130 81.818 -11.433 -3.116 778 1HG ARG 130 HG2 ARG 130 81.276 -12.112 -5.349 779 2HG ARG 130 HG1 ARG 130 82.200 -13.606 -5.188 780 1HD ARG 130 HD2 ARG 130 80.027 -14.394 -4.820 781 2HD ARG 130 HD1 ARG 130 80.511 -14.012 -3.157 782 HE ARG 130 HE ARG 130 79.157 -11.937 -4.835 783 1HH1 ARG 130 HH21 ARG 130 79.937 -11.531 -1.927 784 2HH1 ARG 130 HH22 ARG 130 78.422 -11.793 -1.128 785 1HH2 ARG 130 HH11 ARG 130 76.941 -13.323 -3.865 786 2HH2 ARG 130 HH12 ARG 130 76.726 -12.806 -2.225 787 H LYS 131 HN LYS 131 84.726 -13.374 -2.219 788 HA LYS 131 HA LYS 131 86.047 -15.342 -2.253 789 1HB LYS 131 HB2 LYS 131 85.409 -15.451 -5.206 790 2HB LYS 131 HB1 LYS 131 85.662 -16.796 -4.094 791 1HG LYS 131 HG2 LYS 131 83.283 -14.933 -4.251 792 2HG LYS 131 HG1 LYS 131 83.305 -16.686 -4.422 793 1HD LYS 131 HD2 LYS 131 83.913 -15.131 -1.886 794 2HD LYS 131 HD1 LYS 131 82.459 -16.083 -2.203 795 1HE LYS 131 HE2 LYS 131 85.302 -17.160 -2.036 796 2HE LYS 131 HE1 LYS 131 83.991 -17.441 -0.865 797 1HZ LYS 131 HZ1 LYS 131 82.762 -18.094 -3.118 798 2HZ LYS 131 HZ2 LYS 131 83.631 -19.228 -2.200 799 3HZ LYS 131 HZ3 LYS 131 84.344 -18.510 -3.564 Start of MODEL 14 1 1H GLY 28 HT1 GLY 28 89.974 -22.452 10.260 2 2H GLY 28 HT2 GLY 28 88.804 -23.674 10.418 3 3H GLY 28 HT3 GLY 28 88.923 -22.449 11.589 4 1HA GLY 28 HA2 GLY 28 87.842 -22.304 8.853 5 2HA GLY 28 HA1 GLY 28 87.115 -21.754 10.362 6 H SER 29 HN SER 29 87.816 -19.747 11.255 7 HA SER 29 HA SER 29 88.437 -17.655 9.474 8 1HB SER 29 HB2 SER 29 88.434 -16.371 11.414 9 2HB SER 29 HB1 SER 29 87.631 -17.827 12.003 10 HG SER 29 HG SER 29 89.383 -17.101 13.337 11 H GLY 30 HN GLY 30 90.379 -16.735 8.771 12 1HA GLY 30 HA2 GLY 30 92.932 -17.092 9.948 13 2HA GLY 30 HA1 GLY 30 92.742 -18.339 8.715 14 HA PRO 31 HA PRO 31 94.499 -14.586 6.651 15 1HB PRO 31 HB2 PRO 31 95.706 -16.452 4.820 16 2HB PRO 31 HB1 PRO 31 96.506 -15.436 6.033 17 1HG PRO 31 HG2 PRO 31 96.112 -18.285 6.090 18 2HG PRO 31 HG1 PRO 31 96.912 -17.274 7.296 19 1HD PRO 31 HD2 PRO 31 94.347 -18.581 7.502 20 2HD PRO 31 HD1 PRO 31 95.150 -17.557 8.715 21 H LYS 32 HN LYS 32 94.584 -14.470 3.980 22 HA LYS 32 HA LYS 32 91.820 -14.652 3.137 23 1HB LYS 32 HB2 LYS 32 93.796 -13.056 2.479 24 2HB LYS 32 HB1 LYS 32 94.182 -14.311 1.302 25 1HG LYS 32 HG2 LYS 32 91.880 -14.168 0.406 26 2HG LYS 32 HG1 LYS 32 91.509 -12.899 1.573 27 1HD LYS 32 HD2 LYS 32 93.759 -12.698 -0.449 28 2HD LYS 32 HD1 LYS 32 92.139 -12.060 -0.732 29 1HE LYS 32 HE2 LYS 32 93.792 -11.296 1.697 30 2HE LYS 32 HE1 LYS 32 93.796 -10.359 0.189 31 1HZ LYS 32 HZ1 LYS 32 91.476 -11.003 1.929 32 2HZ LYS 32 HZ2 LYS 32 91.301 -10.412 0.346 33 3HZ LYS 32 HZ3 LYS 32 92.071 -9.467 1.528 34 H GLY 33 HN GLY 33 90.871 -16.557 2.536 35 1HA GLY 33 HA2 GLY 33 92.560 -18.771 1.530 36 2HA GLY 33 HA1 GLY 33 90.865 -18.900 2.001 37 H GLY 34 HN GLY 34 89.637 -16.969 0.508 38 1HA GLY 34 HA1 GLY 34 90.182 -16.350 -2.063 39 2HA GLY 34 HA2 GLY 34 89.897 -18.084 -2.211 40 H GLY 35 HN GLY 35 87.833 -18.337 -0.272 41 1HA GLY 35 HA1 GLY 35 85.639 -16.927 -1.721 42 2HA GLY 35 HA2 GLY 35 85.451 -18.436 -0.816 43 H ASN 36 HN ASN 36 83.650 -16.550 -0.166 44 HA ASN 36 HA ASN 36 82.797 -15.385 1.718 45 1HB ASN 36 HB2 ASN 36 84.617 -17.345 2.551 46 2HB ASN 36 HB1 ASN 36 85.079 -15.892 3.432 47 1HD2 ASN 36 HD21 ASN 36 82.283 -18.035 2.762 48 2HD2 ASN 36 HD22 ASN 36 81.420 -17.612 4.161 49 H ALA 37 HN ALA 37 84.501 -14.047 -0.205 50 HA ALA 37 HA ALA 37 85.546 -11.827 1.512 51 1HB ALA 37 HB1 ALA 37 87.653 -12.359 0.852 52 2HB ALA 37 HB2 ALA 37 87.166 -12.119 -0.826 53 3HB ALA 37 HB3 ALA 37 87.023 -13.714 -0.087 54 H VAL 38 HN VAL 38 85.296 -9.756 0.401 55 HA VAL 38 HA VAL 38 84.025 -9.804 -2.290 56 HB VAL 38 HB VAL 38 82.227 -8.271 -1.247 57 1HG1 VAL 38 HG11 VAL 38 81.567 -10.469 -1.915 58 2HG1 VAL 38 HG12 VAL 38 80.994 -10.276 -0.259 59 3HG1 VAL 38 HG13 VAL 38 82.451 -11.212 -0.582 60 1HG2 VAL 38 HG21 VAL 38 81.927 -8.351 1.118 61 2HG2 VAL 38 HG22 VAL 38 83.640 -8.009 0.871 62 3HG2 VAL 38 HG23 VAL 38 83.118 -9.639 1.296 63 H LYS 39 HN LYS 39 84.232 -7.680 -3.466 64 HA LYS 39 HA LYS 39 86.312 -6.020 -2.164 65 1HB LYS 39 HB2 LYS 39 85.624 -6.883 -4.707 66 2HB LYS 39 HB1 LYS 39 85.127 -5.189 -4.720 67 1HG LYS 39 HG2 LYS 39 87.880 -6.245 -3.964 68 2HG LYS 39 HG1 LYS 39 87.470 -5.394 -5.459 69 1HD LYS 39 HD2 LYS 39 86.805 -3.410 -4.126 70 2HD LYS 39 HD1 LYS 39 87.280 -4.260 -2.648 71 1HE LYS 39 HE2 LYS 39 89.407 -3.539 -2.975 72 2HE LYS 39 HE1 LYS 39 89.460 -4.461 -4.489 73 1HZ LYS 39 HZ1 LYS 39 88.824 -1.639 -4.047 74 2HZ LYS 39 HZ2 LYS 39 87.946 -2.448 -5.255 75 3HZ LYS 39 HZ3 LYS 39 89.641 -2.370 -5.341 76 H VAL 40 HN VAL 40 85.037 -5.104 -0.442 77 HA VAL 40 HA VAL 40 82.617 -3.562 -1.173 78 HB VAL 40 HB VAL 40 82.297 -3.612 1.287 79 1HG1 VAL 40 HG11 VAL 40 82.472 -6.286 1.346 80 2HG1 VAL 40 HG12 VAL 40 82.717 -6.045 -0.383 81 3HG1 VAL 40 HG13 VAL 40 81.245 -5.455 0.390 82 1HG2 VAL 40 HG21 VAL 40 83.866 -4.619 2.731 83 2HG2 VAL 40 HG22 VAL 40 84.867 -3.660 1.640 84 3HG2 VAL 40 HG23 VAL 40 84.718 -5.401 1.399 85 H ARG 41 HN ARG 41 82.318 -1.425 -0.601 86 HA ARG 41 HA ARG 41 84.681 0.145 0.366 87 1HB ARG 41 HB2 ARG 41 82.701 1.049 -1.743 88 2HB ARG 41 HB1 ARG 41 84.285 1.733 -1.384 89 1HG ARG 41 HG2 ARG 41 85.383 -0.287 -2.212 90 2HG ARG 41 HG1 ARG 41 83.820 -1.052 -2.489 91 1HD ARG 41 HD2 ARG 41 83.664 -0.067 -4.521 92 2HD ARG 41 HD1 ARG 41 83.908 1.539 -3.796 93 HE ARG 41 HE ARG 41 86.423 0.764 -3.744 94 1HH1 ARG 41 HH21 ARG 41 84.206 0.916 -6.291 95 2HH1 ARG 41 HH22 ARG 41 85.272 0.245 -7.481 96 1HH2 ARG 41 HH11 ARG 41 87.754 -0.547 -5.189 97 2HH2 ARG 41 HH12 ARG 41 87.282 -0.584 -6.855 98 H HIS 42 HN HIS 42 83.991 1.952 1.779 99 HA HIS 42 HA HIS 42 81.047 1.911 2.383 100 1HB HIS 42 HB2 HIS 42 83.296 2.137 4.390 101 2HB HIS 42 HB1 HIS 42 81.585 1.829 4.717 102 HD1 HIS 42 HD1 HIS 42 80.842 -0.574 4.715 103 HD2 HIS 42 HD2 HIS 42 84.584 -0.098 2.941 104 HE1 HIS 42 HE1 HIS 42 81.720 -2.905 4.258 105 H ILE 43 HN ILE 43 80.068 3.826 2.698 106 HA ILE 43 HA ILE 43 81.680 6.311 3.123 107 HB ILE 43 HB ILE 43 80.292 5.470 0.777 108 1HG1 ILE 43 HG12 ILE 43 81.272 8.246 1.496 109 2HG1 ILE 43 HG11 ILE 43 82.319 6.924 0.961 110 1HG2 ILE 43 HG21 ILE 43 78.904 7.770 2.180 111 2HG2 ILE 43 HG22 ILE 43 78.185 6.223 1.736 112 3HG2 ILE 43 HG23 ILE 43 78.681 7.355 0.480 113 1HD1 ILE 43 HD11 ILE 43 81.124 6.782 -1.157 114 2HD1 ILE 43 HD12 ILE 43 81.661 8.442 -0.908 115 3HD1 ILE 43 HD13 ILE 43 79.975 8.010 -0.628 116 H LEU 44 HN LEU 44 80.900 7.191 5.088 117 HA LEU 44 HA LEU 44 78.008 6.662 5.734 118 1HB LEU 44 HB2 LEU 44 78.986 5.507 7.440 119 2HB LEU 44 HB1 LEU 44 80.567 6.232 7.125 120 HG LEU 44 HG LEU 44 79.814 8.287 8.314 121 1HD1 LEU 44 HD11 LEU 44 77.272 7.069 8.015 122 2HD1 LEU 44 HD12 LEU 44 77.639 8.594 8.818 123 3HD1 LEU 44 HD13 LEU 44 77.608 7.096 9.745 124 1HD2 LEU 44 HD21 LEU 44 80.771 7.318 10.109 125 2HD2 LEU 44 HD22 LEU 44 80.438 5.728 9.420 126 3HD2 LEU 44 HD23 LEU 44 79.254 6.497 10.478 127 H CYS 45 HN CYS 45 76.863 8.409 6.743 128 HA CYS 45 HA CYS 45 78.283 11.054 6.670 129 1HB CYS 45 HB2 CYS 45 76.501 10.462 4.893 130 2HB CYS 45 HB1 CYS 45 75.336 10.604 6.217 131 HG CYS 45 HG CYS 45 76.681 13.089 6.497 132 H GLU 46 HN GLU 46 78.649 11.413 8.863 133 HA GLU 46 HA GLU 46 77.168 10.528 11.072 134 1HB GLU 46 HB2 GLU 46 79.378 12.019 10.649 135 2HB GLU 46 HB1 GLU 46 78.258 13.302 11.106 136 1HG GLU 46 HG2 GLU 46 78.743 12.737 13.246 137 2HG GLU 46 HG1 GLU 46 77.717 11.330 12.968 138 H LYS 47 HN LYS 47 76.295 12.924 8.711 139 HA LYS 47 HA LYS 47 73.977 13.764 10.423 140 1HB LYS 47 HB2 LYS 47 74.100 15.799 8.805 141 2HB LYS 47 HB1 LYS 47 75.338 15.662 10.053 142 1HG LYS 47 HG2 LYS 47 76.889 14.663 8.452 143 2HG LYS 47 HG1 LYS 47 75.647 14.674 7.202 144 1HD LYS 47 HD2 LYS 47 76.847 16.624 6.714 145 2HD LYS 47 HD1 LYS 47 75.536 17.244 7.718 146 1HE LYS 47 HE2 LYS 47 77.444 16.519 9.595 147 2HE LYS 47 HE1 LYS 47 78.420 17.176 8.267 148 1HZ LYS 47 HZ1 LYS 47 76.394 18.888 8.270 149 2HZ LYS 47 HZ2 LYS 47 77.795 19.133 9.200 150 3HZ LYS 47 HZ3 LYS 47 76.397 18.484 9.917 151 H HIS 48 HN HIS 48 74.753 11.782 7.915 152 HA HIS 48 HA HIS 48 73.488 10.788 6.190 153 1HB HIS 48 HB2 HIS 48 71.316 12.122 7.830 154 2HB HIS 48 HB1 HIS 48 71.036 10.869 6.620 155 HD1 HIS 48 HD1 HIS 48 74.118 9.915 7.987 156 HD2 HIS 48 HD2 HIS 48 70.217 9.739 9.447 157 HE1 HIS 48 HE1 HIS 48 74.124 8.174 9.827 158 H GLY 49 HN GLY 49 74.181 13.911 6.233 159 1HA GLY 49 HA2 GLY 49 72.202 15.009 4.391 160 2HA GLY 49 HA1 GLY 49 73.732 15.772 4.846 161 H LYS 50 HN LYS 50 75.718 14.442 3.959 162 HA LYS 50 HA LYS 50 75.471 14.359 1.056 163 1HB LYS 50 HB2 LYS 50 77.732 13.402 2.840 164 2HB LYS 50 HB1 LYS 50 77.854 13.931 1.161 165 1HG LYS 50 HG2 LYS 50 78.405 15.941 2.070 166 2HG LYS 50 HG1 LYS 50 76.666 16.106 2.329 167 1HD LYS 50 HD2 LYS 50 77.165 16.301 4.531 168 2HD LYS 50 HD1 LYS 50 77.494 14.568 4.487 169 1HE LYS 50 HE2 LYS 50 79.780 14.872 4.515 170 2HE LYS 50 HE1 LYS 50 79.690 16.375 3.568 171 1HZ LYS 50 HZ1 LYS 50 78.690 17.465 5.495 172 2HZ LYS 50 HZ2 LYS 50 80.221 16.843 5.888 173 3HZ LYS 50 HZ3 LYS 50 78.817 16.034 6.395 174 H ILE 51 HN ILE 51 75.124 12.041 3.608 175 HA ILE 51 HA ILE 51 75.928 9.634 2.451 176 HB ILE 51 HB ILE 51 74.400 10.508 4.603 177 1HG1 ILE 51 HG12 ILE 51 75.888 8.689 4.871 178 2HG1 ILE 51 HG11 ILE 51 74.287 7.987 5.140 179 1HG2 ILE 51 HG21 ILE 51 72.668 8.699 2.900 180 2HG2 ILE 51 HG22 ILE 51 72.333 10.387 3.289 181 3HG2 ILE 51 HG23 ILE 51 72.334 9.171 4.567 182 1HD1 ILE 51 HD11 ILE 51 74.626 7.787 2.388 183 2HD1 ILE 51 HD12 ILE 51 74.843 6.477 3.549 184 3HD1 ILE 51 HD13 ILE 51 76.231 7.430 3.024 185 H MET 52 HN MET 52 73.168 11.664 1.668 186 HA MET 52 HA MET 52 72.210 9.753 -0.364 187 1HB MET 52 HB2 MET 52 70.252 10.818 0.111 188 2HB MET 52 HB1 MET 52 71.128 11.799 1.282 189 1HG MET 52 HG2 MET 52 70.035 13.324 -0.218 190 2HG MET 52 HG1 MET 52 71.750 13.346 -0.631 191 1HE MET 52 HE1 MET 52 71.254 13.744 -4.004 192 2HE MET 52 HE2 MET 52 72.511 12.625 -3.486 193 3HE MET 52 HE3 MET 52 72.084 13.993 -2.461 194 H GLU 53 HN GLU 53 73.806 12.870 -0.100 195 HA GLU 53 HA GLU 53 73.945 13.595 -2.815 196 1HB GLU 53 HB2 GLU 53 74.618 14.873 -0.700 197 2HB GLU 53 HB1 GLU 53 76.090 13.897 -0.698 198 1HG GLU 53 HG2 GLU 53 76.561 14.648 -3.004 199 2HG GLU 53 HG1 GLU 53 75.124 15.666 -2.942 200 H ALA 54 HN ALA 54 75.618 11.282 -0.780 201 HA ALA 54 HA ALA 54 77.788 10.611 -2.521 202 1HB ALA 54 HB1 ALA 54 77.826 8.561 -1.208 203 2HB ALA 54 HB2 ALA 54 76.129 8.760 -0.767 204 3HB ALA 54 HB3 ALA 54 77.342 9.866 -0.125 205 H MET 55 HN MET 55 74.370 9.921 -2.490 206 HA MET 55 HA MET 55 74.423 7.837 -4.538 207 1HB MET 55 HB2 MET 55 72.152 9.655 -3.671 208 2HB MET 55 HB1 MET 55 72.026 8.034 -4.366 209 1HG MET 55 HG2 MET 55 73.309 7.171 -2.366 210 2HG MET 55 HG1 MET 55 73.149 8.783 -1.652 211 1HE MET 55 HE1 MET 55 71.585 5.387 -2.339 212 2HE MET 55 HE2 MET 55 70.480 5.449 -0.969 213 3HE MET 55 HE3 MET 55 72.189 5.805 -0.730 214 H GLU 56 HN GLU 56 73.191 11.221 -4.620 215 HA GLU 56 HA GLU 56 72.874 11.309 -7.463 216 1HB GLU 56 HB2 GLU 56 73.012 13.226 -5.175 217 2HB GLU 56 HB1 GLU 56 73.174 13.896 -6.797 218 1HG GLU 56 HG2 GLU 56 70.939 12.003 -6.045 219 2HG GLU 56 HG1 GLU 56 70.791 13.752 -5.875 220 H LYS 57 HN LYS 57 75.467 12.823 -5.470 221 HA LYS 57 HA LYS 57 77.092 13.764 -7.516 222 1HB LYS 57 HB2 LYS 57 77.468 12.768 -4.752 223 2HB LYS 57 HB1 LYS 57 78.931 12.794 -5.727 224 1HG LYS 57 HG2 LYS 57 77.617 15.209 -6.308 225 2HG LYS 57 HG1 LYS 57 77.493 15.020 -4.560 226 1HD LYS 57 HD2 LYS 57 79.684 15.480 -4.292 227 2HD LYS 57 HD1 LYS 57 80.134 14.263 -5.486 228 1HE LYS 57 HE2 LYS 57 80.890 16.183 -6.574 229 2HE LYS 57 HE1 LYS 57 79.221 16.143 -7.178 230 1HZ LYS 57 HZ1 LYS 57 79.287 18.235 -6.264 231 2HZ LYS 57 HZ2 LYS 57 80.402 17.804 -5.057 232 3HZ LYS 57 HZ3 LYS 57 78.772 17.351 -4.912 233 H LEU 58 HN LEU 58 77.841 10.595 -5.981 234 HA LEU 58 HA LEU 58 79.550 9.489 -7.793 235 1HB LEU 58 HB2 LEU 58 77.356 8.502 -6.084 236 2HB LEU 58 HB1 LEU 58 77.885 7.371 -7.331 237 HG LEU 58 HG LEU 58 80.281 7.989 -6.530 238 1HD1 LEU 58 HD11 LEU 58 79.182 9.831 -5.020 239 2HD1 LEU 58 HD12 LEU 58 80.562 8.917 -4.423 240 3HD1 LEU 58 HD13 LEU 58 78.931 8.492 -3.903 241 1HD2 LEU 58 HD21 LEU 58 80.265 5.974 -5.459 242 2HD2 LEU 58 HD22 LEU 58 78.584 5.907 -5.986 243 3HD2 LEU 58 HD23 LEU 58 78.977 6.463 -4.358 244 H LYS 59 HN LYS 59 76.052 9.916 -8.387 245 HA LYS 59 HA LYS 59 76.110 8.350 -10.857 246 1HB LYS 59 HB2 LYS 59 74.195 9.933 -9.227 247 2HB LYS 59 HB1 LYS 59 73.794 9.736 -10.933 248 1HG LYS 59 HG2 LYS 59 74.740 7.259 -9.684 249 2HG LYS 59 HG1 LYS 59 73.268 7.885 -8.941 250 1HD LYS 59 HD2 LYS 59 72.380 6.627 -10.692 251 2HD LYS 59 HD1 LYS 59 72.513 8.213 -11.451 252 1HE LYS 59 HE2 LYS 59 75.006 7.215 -11.950 253 2HE LYS 59 HE1 LYS 59 74.033 5.733 -12.006 254 1HZ LYS 59 HZ1 LYS 59 73.995 6.827 -14.155 255 2HZ LYS 59 HZ2 LYS 59 73.462 8.276 -13.446 256 3HZ LYS 59 HZ3 LYS 59 72.454 6.908 -13.451 257 H SER 60 HN SER 60 75.307 11.803 -10.343 258 HA SER 60 HA SER 60 75.245 12.850 -12.840 259 1HB SER 60 HB2 SER 60 77.058 14.499 -11.365 260 2HB SER 60 HB1 SER 60 75.315 14.697 -11.549 261 HG SER 60 HG SER 60 76.576 13.001 -9.658 262 H GLY 61 HN GLY 61 78.400 12.837 -11.182 263 1HA GLY 61 HA2 GLY 61 80.104 11.481 -12.786 264 2HA GLY 61 HA1 GLY 61 79.777 12.897 -13.796 265 H MET 62 HN MET 62 79.959 12.822 -10.298 266 HA MET 62 HA MET 62 81.960 14.987 -10.283 267 1HB MET 62 HB2 MET 62 81.428 14.593 -7.701 268 2HB MET 62 HB1 MET 62 80.261 15.391 -8.744 269 1HG MET 62 HG2 MET 62 79.432 13.522 -7.220 270 2HG MET 62 HG1 MET 62 78.926 13.457 -8.893 271 1HE MET 62 HE1 MET 62 79.804 11.320 -6.135 272 2HE MET 62 HE2 MET 62 81.317 12.211 -6.200 273 3HE MET 62 HE3 MET 62 81.309 10.481 -6.512 274 H ARG 63 HN ARG 63 83.206 14.458 -7.852 275 HA ARG 63 HA ARG 63 85.364 12.701 -8.601 276 1HB ARG 63 HB2 ARG 63 84.523 13.947 -5.981 277 2HB ARG 63 HB1 ARG 63 86.116 13.286 -6.349 278 1HG ARG 63 HG2 ARG 63 86.731 15.130 -7.470 279 2HG ARG 63 HG1 ARG 63 85.195 15.223 -8.335 280 1HD ARG 63 HD2 ARG 63 84.369 16.767 -6.874 281 2HD ARG 63 HD1 ARG 63 84.908 15.820 -5.469 282 HE ARG 63 HE ARG 63 87.284 16.740 -6.336 283 1HH1 ARG 63 HH11 ARG 63 85.269 18.683 -7.844 284 2HH1 ARG 63 HH12 ARG 63 85.482 20.096 -6.865 285 1HH2 ARG 63 HH21 ARG 63 87.124 18.408 -4.319 286 2HH2 ARG 63 HH22 ARG 63 86.532 19.940 -4.868 287 H PHE 64 HN PHE 64 85.732 10.609 -7.969 288 HA PHE 64 HA PHE 64 83.579 9.179 -6.506 289 1HB PHE 64 HB2 PHE 64 85.364 8.633 -8.633 290 2HB PHE 64 HB1 PHE 64 85.899 7.617 -7.298 291 HD1 PHE 64 HD1 PHE 64 82.391 8.738 -7.841 292 HD2 PHE 64 HD2 PHE 64 85.196 5.496 -8.147 293 HE1 PHE 64 HE1 PHE 64 80.528 7.165 -8.288 294 HE2 PHE 64 HE2 PHE 64 83.332 3.925 -8.591 295 HZ PHE 64 HZ PHE 64 80.998 4.759 -8.662 296 H ASN 65 HN ASN 65 86.986 10.100 -6.221 297 HA ASN 65 HA ASN 65 87.273 8.647 -3.660 298 1HB ASN 65 HB2 ASN 65 88.941 9.097 -5.703 299 2HB ASN 65 HB1 ASN 65 89.313 10.537 -4.755 300 1HD2 ASN 65 HD21 ASN 65 90.981 8.039 -5.227 301 2HD2 ASN 65 HD22 ASN 65 91.354 7.468 -3.672 302 H GLU 66 HN GLU 66 86.934 11.981 -4.807 303 HA GLU 66 HA GLU 66 87.619 13.214 -2.294 304 1HB GLU 66 HB2 GLU 66 85.994 14.056 -4.697 305 2HB GLU 66 HB1 GLU 66 86.383 15.149 -3.380 306 1HG GLU 66 HG2 GLU 66 88.242 15.575 -4.662 307 2HG GLU 66 HG1 GLU 66 88.833 14.124 -3.861 308 H VAL 67 HN VAL 67 84.409 12.542 -3.826 309 HA VAL 67 HA VAL 67 82.830 13.218 -1.584 310 HB VAL 67 HB VAL 67 81.291 11.406 -2.528 311 1HG1 VAL 67 HG11 VAL 67 82.313 13.181 -4.713 312 2HG1 VAL 67 HG12 VAL 67 81.439 13.838 -3.330 313 3HG1 VAL 67 HG13 VAL 67 80.648 12.673 -4.400 314 1HG2 VAL 67 HG21 VAL 67 83.720 10.942 -4.169 315 2HG2 VAL 67 HG22 VAL 67 82.131 10.719 -4.899 316 3HG2 VAL 67 HG23 VAL 67 82.583 9.785 -3.481 317 H ALA 68 HN ALA 68 84.163 10.025 -2.532 318 HA ALA 68 HA ALA 68 83.493 8.484 -0.305 319 1HB ALA 68 HB1 ALA 68 85.990 8.639 -2.024 320 2HB ALA 68 HB2 ALA 68 84.623 7.542 -2.216 321 3HB ALA 68 HB3 ALA 68 85.725 7.345 -0.854 322 H ALA 69 HN ALA 69 86.084 10.847 -0.714 323 HA ALA 69 HA ALA 69 87.476 10.453 1.712 324 1HB ALA 69 HB1 ALA 69 87.711 12.062 -0.423 325 2HB ALA 69 HB2 ALA 69 88.495 12.442 1.111 326 3HB ALA 69 HB3 ALA 69 86.966 13.212 0.687 327 H GLN 70 HN GLN 70 85.138 13.153 1.183 328 HA GLN 70 HA GLN 70 84.635 13.132 4.063 329 1HB GLN 70 HB2 GLN 70 84.757 15.032 2.023 330 2HB GLN 70 HB1 GLN 70 83.081 15.020 2.568 331 1HG GLN 70 HG2 GLN 70 85.430 15.030 4.449 332 2HG GLN 70 HG1 GLN 70 84.630 16.520 3.925 333 1HE2 GLN 70 HE21 GLN 70 83.814 13.310 5.506 334 2HE2 GLN 70 HE22 GLN 70 82.535 13.945 6.414 335 H TYR 71 HN TYR 71 82.617 12.845 1.111 336 HA TYR 71 HA TYR 71 80.102 12.711 2.275 337 1HB TYR 71 HB2 TYR 71 81.372 11.187 -0.007 338 2HB TYR 71 HB1 TYR 71 79.677 10.965 0.400 339 HD1 TYR 71 HD1 TYR 71 78.853 11.900 -1.678 340 HD2 TYR 71 HD2 TYR 71 81.406 14.222 0.898 341 HE1 TYR 71 HE1 TYR 71 78.276 13.950 -2.942 342 HE2 TYR 71 HE2 TYR 71 80.818 16.263 -0.368 343 HH TYR 71 HH TYR 71 79.973 16.923 -2.504 344 H SER 72 HN SER 72 82.688 10.367 2.425 345 HA SER 72 HA SER 72 81.106 8.208 3.585 346 1HB SER 72 HB2 SER 72 83.168 7.877 2.273 347 2HB SER 72 HB1 SER 72 84.083 8.788 3.470 348 HG SER 72 HG SER 72 83.857 7.192 4.902 349 H GLU 73 HN GLU 73 82.019 11.163 4.825 350 HA GLU 73 HA GLU 73 82.757 11.914 6.981 351 1HB GLU 73 HB2 GLU 73 80.129 11.380 6.498 352 2HB GLU 73 HB1 GLU 73 80.392 10.469 7.988 353 1HG GLU 73 HG2 GLU 73 80.737 12.364 9.228 354 2HG GLU 73 HG1 GLU 73 81.570 13.185 7.906 355 H ASP 74 HN ASP 74 84.229 9.635 6.478 356 HA ASP 74 HA ASP 74 85.245 8.766 8.913 357 1HB ASP 74 HB2 ASP 74 83.175 7.877 9.643 358 2HB ASP 74 HB1 ASP 74 82.763 7.282 8.036 359 H LYS 75 HN LYS 75 87.201 8.218 7.957 360 HA LYS 75 HA LYS 75 88.730 7.125 6.520 361 1HB LYS 75 HB2 LYS 75 87.690 5.188 7.634 362 2HB LYS 75 HB1 LYS 75 86.374 5.204 6.460 363 1HG LYS 75 HG2 LYS 75 88.033 3.509 5.832 364 2HG LYS 75 HG1 LYS 75 88.023 4.808 4.641 365 1HD LYS 75 HD2 LYS 75 90.167 5.353 5.096 366 2HD LYS 75 HD1 LYS 75 89.863 5.367 6.833 367 1HE LYS 75 HE2 LYS 75 89.838 2.741 6.563 368 2HE LYS 75 HE1 LYS 75 90.759 3.086 5.087 369 1HZ LYS 75 HZ1 LYS 75 92.434 3.089 6.642 370 2HZ LYS 75 HZ2 LYS 75 91.436 3.664 7.891 371 3HZ LYS 75 HZ3 LYS 75 91.995 4.726 6.689 372 H ALA 76 HN ALA 76 86.297 5.572 4.609 373 HA ALA 76 HA ALA 76 85.443 7.515 2.792 374 1HB ALA 76 HB1 ALA 76 87.604 8.274 2.308 375 2HB ALA 76 HB2 ALA 76 87.370 7.076 1.036 376 3HB ALA 76 HB3 ALA 76 88.307 6.665 2.472 377 H ARG 77 HN ARG 77 84.433 6.558 0.940 378 HA ARG 77 HA ARG 77 84.041 3.654 1.117 379 1HB ARG 77 HB2 ARG 77 82.125 5.012 0.660 380 2HB ARG 77 HB1 ARG 77 82.971 5.899 -0.607 381 1HG ARG 77 HG2 ARG 77 82.276 4.396 -2.135 382 2HG ARG 77 HG1 ARG 77 83.074 3.108 -1.240 383 1HD ARG 77 HD2 ARG 77 81.040 2.285 -0.686 384 2HD ARG 77 HD1 ARG 77 80.697 3.783 0.192 385 HE ARG 77 HE ARG 77 79.492 3.107 -2.271 386 1HH1 ARG 77 HH11 ARG 77 78.626 5.519 -0.814 387 2HH1 ARG 77 HH12 ARG 77 79.129 6.806 -1.854 388 1HH2 ARG 77 HH21 ARG 77 81.314 4.842 -3.683 389 2HH2 ARG 77 HH22 ARG 77 80.646 6.424 -3.473 390 H GLN 78 HN GLN 78 84.810 5.751 -1.680 391 HA GLN 78 HA GLN 78 86.007 3.582 -3.180 392 1HB GLN 78 HB2 GLN 78 85.833 6.587 -3.385 393 2HB GLN 78 HB1 GLN 78 86.768 5.652 -4.561 394 1HG GLN 78 HG2 GLN 78 84.871 5.119 -5.651 395 2HG GLN 78 HG1 GLN 78 84.244 4.352 -4.191 396 1HE2 GLN 78 HE21 GLN 78 83.191 5.938 -2.566 397 2HE2 GLN 78 HE22 GLN 78 82.351 7.265 -3.207 398 H GLY 79 HN GLY 79 87.562 6.618 -2.061 399 1HA GLY 79 HA2 GLY 79 90.220 5.592 -2.257 400 2HA GLY 79 HA1 GLY 79 89.753 7.006 -1.309 401 H GLY 80 HN GLY 80 87.797 5.431 0.264 402 1HA GLY 80 HA1 GLY 80 89.749 4.206 2.138 403 2HA GLY 80 HA2 GLY 80 88.113 4.717 2.554 404 H ASP 81 HN ASP 81 88.019 3.155 -0.401 405 HA ASP 81 HA ASP 81 86.350 1.063 0.190 406 1HB ASP 81 HB2 ASP 81 86.936 1.462 -2.062 407 2HB ASP 81 HB1 ASP 81 88.668 1.352 -1.721 408 H LEU 82 HN LEU 82 86.670 -0.090 2.135 409 HA LEU 82 HA LEU 82 88.989 -0.973 3.359 410 1HB LEU 82 HB2 LEU 82 86.187 -1.895 3.095 411 2HB LEU 82 HB1 LEU 82 87.319 -3.119 3.671 412 HG LEU 82 HG LEU 82 88.126 -1.040 5.185 413 1HD1 LEU 82 HD11 LEU 82 86.147 0.245 4.014 414 2HD1 LEU 82 HD12 LEU 82 86.429 0.459 5.742 415 3HD1 LEU 82 HD13 LEU 82 85.153 -0.622 5.185 416 1HD2 LEU 82 HD21 LEU 82 85.818 -2.127 6.492 417 2HD2 LEU 82 HD22 LEU 82 87.512 -2.547 6.740 418 3HD2 LEU 82 HD23 LEU 82 86.562 -3.399 5.524 419 H GLY 83 HN GLY 83 87.586 -2.151 0.369 420 1HA GLY 83 HA2 GLY 83 88.626 -3.461 -1.298 421 2HA GLY 83 HA1 GLY 83 90.032 -3.630 -0.238 422 H TRP 84 HN TRP 84 89.630 -5.915 -1.291 423 HA TRP 84 HA TRP 84 87.643 -7.723 -0.722 424 1HB TRP 84 HB2 TRP 84 90.643 -7.837 -0.734 425 2HB TRP 84 HB1 TRP 84 89.738 -9.290 -0.329 426 HD1 TRP 84 HD1 TRP 84 91.097 -7.551 -3.182 427 HE1 TRP 84 HE1 TRP 84 90.014 -8.339 -5.387 428 HE3 TRP 84 HE3 TRP 84 87.073 -10.061 -1.321 429 HZ2 TRP 84 HZ2 TRP 84 87.735 -9.849 -6.241 430 HZ3 TRP 84 HZ3 TRP 84 85.465 -11.167 -2.843 431 HH2 TRP 84 HH2 TRP 84 85.787 -11.066 -5.300 432 H MET 85 HN MET 85 86.728 -8.580 1.121 433 HA MET 85 HA MET 85 88.257 -8.567 3.669 434 1HB MET 85 HB2 MET 85 86.182 -6.680 2.881 435 2HB MET 85 HB1 MET 85 85.727 -7.560 4.341 436 1HG MET 85 HG2 MET 85 88.518 -6.498 4.143 437 2HG MET 85 HG1 MET 85 87.215 -5.358 4.480 438 1HE MET 85 HE1 MET 85 88.346 -5.468 7.957 439 2HE MET 85 HE2 MET 85 88.464 -4.746 6.355 440 3HE MET 85 HE3 MET 85 89.617 -5.987 6.841 441 H THR 86 HN THR 86 87.682 -10.345 4.917 442 HA THR 86 HA THR 86 85.418 -12.005 3.898 443 HB THR 86 HB THR 86 86.774 -13.711 5.393 444 HG1 THR 86 HG1 THR 86 89.087 -12.869 4.990 445 1HG2 THR 86 HG21 THR 86 86.937 -12.823 2.657 446 2HG2 THR 86 HG22 THR 86 87.101 -14.454 3.304 447 3HG2 THR 86 HG23 THR 86 88.512 -13.398 3.201 448 H ARG 87 HN ARG 87 83.917 -12.876 5.399 449 HA ARG 87 HA ARG 87 82.873 -11.320 7.426 450 1HB ARG 87 HB2 ARG 87 81.788 -13.317 6.581 451 2HB ARG 87 HB1 ARG 87 83.084 -14.339 7.204 452 1HG ARG 87 HG2 ARG 87 82.494 -13.478 9.522 453 2HG ARG 87 HG1 ARG 87 81.062 -12.745 8.801 454 1HD ARG 87 HD2 ARG 87 80.241 -14.923 8.083 455 2HD ARG 87 HD1 ARG 87 81.742 -15.704 8.618 456 HE ARG 87 HE ARG 87 80.213 -14.139 10.632 457 1HH1 ARG 87 HH11 ARG 87 80.110 -17.165 9.158 458 2HH1 ARG 87 HH12 ARG 87 80.204 -18.076 10.628 459 1HH2 ARG 87 HH21 ARG 87 80.821 -15.301 12.615 460 2HH2 ARG 87 HH22 ARG 87 80.607 -17.019 12.586 461 H GLY 88 HN GLY 88 85.716 -13.385 7.620 462 1HA GLY 88 HA2 GLY 88 86.065 -13.787 10.339 463 2HA GLY 88 HA1 GLY 88 87.413 -13.398 9.259 464 H SER 89 HN SER 89 86.281 -10.746 8.581 465 HA SER 89 HA SER 89 86.438 -9.324 11.202 466 1HB SER 89 HB2 SER 89 88.694 -9.695 9.976 467 2HB SER 89 HB1 SER 89 88.089 -8.515 8.803 468 HG SER 89 HG SER 89 88.892 -8.175 11.432 469 H MET 90 HN MET 90 84.040 -9.307 10.243 470 HA MET 90 HA MET 90 83.766 -6.769 8.670 471 1HB MET 90 HB2 MET 90 83.436 -8.978 7.400 472 2HB MET 90 HB1 MET 90 81.993 -9.205 8.390 473 1HG MET 90 HG2 MET 90 80.888 -7.389 7.432 474 2HG MET 90 HG1 MET 90 82.389 -6.600 6.948 475 1HE MET 90 HE1 MET 90 82.121 -6.444 3.932 476 2HE MET 90 HE2 MET 90 83.431 -7.619 3.832 477 3HE MET 90 HE3 MET 90 83.341 -6.526 5.211 478 H VAL 91 HN VAL 91 83.561 -7.402 11.607 479 HA VAL 91 HA VAL 91 82.097 -6.948 13.410 480 HB VAL 91 HB VAL 91 80.553 -5.286 11.423 481 1HG1 VAL 91 HG11 VAL 91 79.724 -4.596 13.414 482 2HG1 VAL 91 HG12 VAL 91 81.265 -3.767 13.631 483 3HG1 VAL 91 HG13 VAL 91 81.025 -5.376 14.314 484 1HG2 VAL 91 HG21 VAL 91 83.437 -5.215 11.895 485 2HG2 VAL 91 HG22 VAL 91 82.658 -3.683 12.294 486 3HG2 VAL 91 HG23 VAL 91 82.482 -4.368 10.677 487 H GLY 92 HN GLY 92 79.392 -6.583 13.612 488 1HA GLY 92 HA2 GLY 92 78.366 -9.217 12.782 489 2HA GLY 92 HA1 GLY 92 77.566 -8.092 13.886 490 HA PRO 93 HA PRO 93 74.897 -6.527 10.804 491 1HB PRO 93 HB2 PRO 93 75.730 -3.772 10.876 492 2HB PRO 93 HB1 PRO 93 74.329 -4.514 11.667 493 1HG PRO 93 HG2 PRO 93 76.753 -3.562 12.887 494 2HG PRO 93 HG1 PRO 93 75.354 -4.294 13.676 495 1HD PRO 93 HD2 PRO 93 77.966 -5.450 13.277 496 2HD PRO 93 HD1 PRO 93 76.553 -6.195 14.062 497 H PHE 94 HN PHE 94 78.013 -4.771 10.470 498 HA PHE 94 HA PHE 94 78.036 -4.067 7.811 499 1HB PHE 94 HB2 PHE 94 79.876 -4.502 9.887 500 2HB PHE 94 HB1 PHE 94 80.503 -5.435 8.522 501 HD1 PHE 94 HD1 PHE 94 78.677 -2.160 8.849 502 HD2 PHE 94 HD2 PHE 94 82.121 -4.247 7.350 503 HE1 PHE 94 HE1 PHE 94 79.490 -0.066 7.798 504 HE2 PHE 94 HE2 PHE 94 82.932 -2.153 6.298 505 HZ PHE 94 HZ PHE 94 81.616 -0.063 6.523 506 H GLN 95 HN GLN 95 78.415 -7.358 9.088 507 HA GLN 95 HA GLN 95 78.869 -8.471 6.384 508 1HB GLN 95 HB2 GLN 95 80.129 -9.361 8.248 509 2HB GLN 95 HB1 GLN 95 78.657 -9.612 9.186 510 1HG GLN 95 HG2 GLN 95 78.058 -11.040 6.948 511 2HG GLN 95 HG1 GLN 95 79.808 -11.248 6.999 512 1HE2 GLN 95 HE21 GLN 95 77.766 -13.330 7.579 513 2HE2 GLN 95 HE22 GLN 95 78.034 -13.824 9.180 514 H GLU 96 HN GLU 96 76.304 -8.210 8.793 515 HA GLU 96 HA GLU 96 74.464 -10.147 8.043 516 1HB GLU 96 HB2 GLU 96 74.428 -7.401 9.129 517 2HB GLU 96 HB1 GLU 96 72.900 -7.923 8.421 518 1HG GLU 96 HG2 GLU 96 73.432 -10.138 9.807 519 2HG GLU 96 HG1 GLU 96 74.362 -9.008 10.791 520 H ALA 97 HN ALA 97 74.815 -6.924 6.501 521 HA ALA 97 HA ALA 97 72.953 -7.693 4.345 522 1HB ALA 97 HB1 ALA 97 74.090 -5.259 3.710 523 2HB ALA 97 HB2 ALA 97 74.228 -5.293 5.468 524 3HB ALA 97 HB3 ALA 97 72.648 -5.468 4.703 525 H ALA 98 HN ALA 98 75.983 -5.940 3.916 526 HA ALA 98 HA ALA 98 76.761 -6.625 1.418 527 1HB ALA 98 HB1 ALA 98 78.834 -6.984 3.537 528 2HB ALA 98 HB2 ALA 98 77.943 -5.462 3.520 529 3HB ALA 98 HB3 ALA 98 78.866 -5.959 2.102 530 H PHE 99 HN PHE 99 77.373 -8.771 4.234 531 HA PHE 99 HA PHE 99 78.387 -10.905 2.483 532 1HB PHE 99 HB2 PHE 99 78.575 -10.116 5.183 533 2HB PHE 99 HB1 PHE 99 77.734 -11.674 5.204 534 HD1 PHE 99 HD1 PHE 99 78.988 -13.643 5.071 535 HD2 PHE 99 HD2 PHE 99 80.670 -9.976 3.598 536 HE1 PHE 99 HE1 PHE 99 81.135 -14.805 4.630 537 HE2 PHE 99 HE2 PHE 99 82.816 -11.137 3.157 538 HZ PHE 99 HZ PHE 99 83.049 -13.552 3.673 539 H ALA 100 HN ALA 100 75.750 -10.209 1.743 540 HA ALA 100 HA ALA 100 74.402 -12.794 2.097 541 1HB ALA 100 HB1 ALA 100 73.681 -11.770 4.125 542 2HB ALA 100 HB2 ALA 100 72.337 -11.547 3.005 543 3HB ALA 100 HB3 ALA 100 73.439 -10.210 3.338 544 H LEU 101 HN LEU 101 74.143 -9.419 0.967 545 HA LEU 101 HA LEU 101 72.326 -10.271 -1.216 546 1HB LEU 101 HB2 LEU 101 71.763 -7.985 -1.296 547 2HB LEU 101 HB1 LEU 101 72.111 -8.245 0.411 548 HG LEU 101 HG LEU 101 74.582 -7.603 -0.850 549 1HD1 LEU 101 HD11 LEU 101 74.162 -5.946 -2.335 550 2HD1 LEU 101 HD12 LEU 101 72.941 -5.223 -1.289 551 3HD1 LEU 101 HD13 LEU 101 72.503 -6.546 -2.369 552 1HD2 LEU 101 HD21 LEU 101 72.716 -6.432 1.166 553 2HD2 LEU 101 HD22 LEU 101 74.017 -5.411 0.554 554 3HD2 LEU 101 HD23 LEU 101 74.396 -6.936 1.352 555 HA PRO 102 HA PRO 102 75.285 -10.196 -4.470 556 1HB PRO 102 HB2 PRO 102 74.006 -8.193 -6.086 557 2HB PRO 102 HB1 PRO 102 73.903 -9.953 -6.251 558 1HG PRO 102 HG2 PRO 102 71.870 -8.136 -5.334 559 2HG PRO 102 HG1 PRO 102 71.762 -9.889 -5.501 560 1HD PRO 102 HD2 PRO 102 71.913 -8.345 -3.073 561 2HD PRO 102 HD1 PRO 102 71.788 -10.115 -3.238 562 H VAL 103 HN VAL 103 76.774 -8.633 -5.770 563 HA VAL 103 HA VAL 103 77.707 -6.512 -3.998 564 HB VAL 103 HB VAL 103 79.376 -6.371 -5.957 565 1HG1 VAL 103 HG11 VAL 103 80.314 -7.428 -4.159 566 2HG1 VAL 103 HG12 VAL 103 80.216 -8.801 -5.260 567 3HG1 VAL 103 HG13 VAL 103 78.979 -8.572 -4.024 568 1HG2 VAL 103 HG21 VAL 103 77.739 -7.595 -7.495 569 2HG2 VAL 103 HG22 VAL 103 78.334 -9.056 -6.699 570 3HG2 VAL 103 HG23 VAL 103 79.451 -8.013 -7.580 571 H SER 104 HN SER 104 78.270 -4.355 -5.163 572 HA SER 104 HA SER 104 77.043 -3.354 -7.477 573 1HB SER 104 HB2 SER 104 75.219 -3.893 -5.209 574 2HB SER 104 HB1 SER 104 75.002 -2.316 -5.979 575 HG SER 104 HG SER 104 74.110 -4.611 -6.826 576 H GLY 105 HN GLY 105 76.056 -1.796 -4.490 577 1HA GLY 105 HA2 GLY 105 76.965 0.030 -3.315 578 2HA GLY 105 HA1 GLY 105 78.464 -0.211 -4.207 579 H MET 106 HN MET 106 77.753 2.350 -3.857 580 HA MET 106 HA MET 106 77.532 4.332 -5.096 581 1HB MET 106 HB2 MET 106 78.726 2.814 -6.740 582 2HB MET 106 HB1 MET 106 77.146 2.468 -7.440 583 1HG MET 106 HG2 MET 106 77.092 5.204 -7.319 584 2HG MET 106 HG1 MET 106 78.803 4.899 -7.646 585 1HE MET 106 HE1 MET 106 75.538 5.315 -10.368 586 2HE MET 106 HE2 MET 106 76.951 6.357 -10.228 587 3HE MET 106 HE3 MET 106 76.005 5.967 -8.793 588 H ASP 107 HN ASP 107 75.617 3.574 -7.690 589 HA ASP 107 HA ASP 107 73.288 4.872 -6.561 590 1HB ASP 107 HB2 ASP 107 74.163 4.988 -8.922 591 2HB ASP 107 HB1 ASP 107 73.597 3.334 -9.153 592 H LYS 108 HN LYS 108 73.653 2.634 -4.947 593 HA LYS 108 HA LYS 108 72.672 0.563 -4.271 594 1HB LYS 108 HB2 LYS 108 71.158 2.386 -3.634 595 2HB LYS 108 HB1 LYS 108 70.385 2.315 -5.223 596 1HG LYS 108 HG2 LYS 108 70.336 -0.326 -4.231 597 2HG LYS 108 HG1 LYS 108 69.859 0.702 -2.880 598 1HD LYS 108 HD2 LYS 108 67.871 1.185 -3.835 599 2HD LYS 108 HD1 LYS 108 68.629 1.555 -5.383 600 1HE LYS 108 HE2 LYS 108 67.993 -0.453 -6.222 601 2HE LYS 108 HE1 LYS 108 68.732 -1.303 -4.852 602 1HZ LYS 108 HZ1 LYS 108 66.312 -1.589 -4.878 603 2HZ LYS 108 HZ2 LYS 108 66.102 0.095 -4.813 604 3HZ LYS 108 HZ3 LYS 108 66.807 -0.727 -3.505 605 HA PRO 109 HA PRO 109 71.836 -0.791 -8.767 606 1HB PRO 109 HB2 PRO 109 74.127 -2.519 -8.594 607 2HB PRO 109 HB1 PRO 109 73.893 -1.124 -9.655 608 1HG PRO 109 HG2 PRO 109 75.654 -1.331 -7.411 609 2HG PRO 109 HG1 PRO 109 75.364 0.083 -8.425 610 1HD PRO 109 HD2 PRO 109 74.488 -0.386 -5.688 611 2HD PRO 109 HD1 PRO 109 74.318 1.088 -6.678 612 H VAL 110 HN VAL 110 72.645 -2.321 -5.708 613 HA VAL 110 HA VAL 110 71.630 -4.953 -6.514 614 HB VAL 110 HB VAL 110 73.475 -4.041 -4.746 615 1HG1 VAL 110 HG11 VAL 110 71.260 -3.376 -3.348 616 2HG1 VAL 110 HG12 VAL 110 72.762 -3.882 -2.580 617 3HG1 VAL 110 HG13 VAL 110 71.460 -5.047 -2.817 618 1HG2 VAL 110 HG21 VAL 110 72.876 -6.388 -5.668 619 2HG2 VAL 110 HG22 VAL 110 71.975 -6.575 -4.161 620 3HG2 VAL 110 HG23 VAL 110 73.714 -6.285 -4.120 621 H PHE 111 HN PHE 111 70.288 -5.647 -4.106 622 HA PHE 111 HA PHE 111 67.650 -4.500 -4.665 623 1HB PHE 111 HB2 PHE 111 68.713 -6.696 -2.883 624 2HB PHE 111 HB1 PHE 111 66.994 -6.292 -2.994 625 HD1 PHE 111 HD1 PHE 111 69.951 -7.407 -4.967 626 HD2 PHE 111 HD2 PHE 111 65.676 -7.007 -4.843 627 HE1 PHE 111 HE1 PHE 111 69.764 -8.777 -7.025 628 HE2 PHE 111 HE2 PHE 111 65.489 -8.378 -6.901 629 HZ PHE 111 HZ PHE 111 67.532 -9.263 -7.992 630 H THR 112 HN THR 112 69.723 -4.832 -1.769 631 HA THR 112 HA THR 112 67.972 -3.303 -0.062 632 HB THR 112 HB THR 112 69.846 -4.951 0.531 633 HG1 THR 112 HG1 THR 112 69.864 -4.068 2.455 634 1HG2 THR 112 HG21 THR 112 72.081 -4.205 0.596 635 2HG2 THR 112 HG22 THR 112 71.610 -2.515 0.415 636 3HG2 THR 112 HG23 THR 112 71.489 -3.615 -0.960 637 H ASP 113 HN ASP 113 69.585 -1.432 1.137 638 HA ASP 113 HA ASP 113 69.964 0.617 -1.022 639 1HB ASP 113 HB2 ASP 113 69.250 1.006 1.903 640 2HB ASP 113 HB1 ASP 113 69.195 2.225 0.630 641 HA PRO 114 HA PRO 114 74.196 0.716 0.155 642 1HB PRO 114 HB2 PRO 114 74.421 3.532 -0.359 643 2HB PRO 114 HB1 PRO 114 74.955 2.181 -1.370 644 1HG PRO 114 HG2 PRO 114 72.726 3.936 -1.817 645 2HG PRO 114 HG1 PRO 114 73.247 2.572 -2.809 646 1HD PRO 114 HD2 PRO 114 70.914 2.744 -1.104 647 2HD PRO 114 HD1 PRO 114 71.425 1.379 -2.123 648 HA PRO 115 HA PRO 115 74.093 4.177 3.537 649 1HB PRO 115 HB2 PRO 115 71.366 5.070 3.782 650 2HB PRO 115 HB1 PRO 115 72.783 6.010 3.296 651 1HG PRO 115 HG2 PRO 115 70.599 5.160 1.650 652 2HG PRO 115 HG1 PRO 115 72.050 6.046 1.152 653 1HD PRO 115 HD2 PRO 115 71.367 3.269 0.630 654 2HD PRO 115 HD1 PRO 115 72.769 4.186 0.050 655 H VAL 116 HN VAL 116 74.144 1.834 4.381 656 HA VAL 116 HA VAL 116 71.637 0.972 5.720 657 HB VAL 116 HB VAL 116 72.723 -1.137 5.832 658 1HG1 VAL 116 HG11 VAL 116 74.121 -0.643 3.377 659 2HG1 VAL 116 HG12 VAL 116 72.642 0.315 3.398 660 3HG1 VAL 116 HG13 VAL 116 72.561 -1.434 3.609 661 1HG2 VAL 116 HG21 VAL 116 74.817 -0.569 6.806 662 2HG2 VAL 116 HG22 VAL 116 75.264 0.435 5.426 663 3HG2 VAL 116 HG23 VAL 116 75.196 -1.319 5.256 664 H LYS 117 HN LYS 117 71.592 0.629 8.011 665 HA LYS 117 HA LYS 117 73.624 2.212 9.517 666 1HB LYS 117 HB2 LYS 117 71.254 2.814 9.727 667 2HB LYS 117 HB1 LYS 117 70.866 1.154 10.200 668 1HG LYS 117 HG2 LYS 117 73.005 2.402 11.807 669 2HG LYS 117 HG1 LYS 117 71.427 3.187 11.966 670 1HD LYS 117 HD2 LYS 117 71.318 0.239 12.010 671 2HD LYS 117 HD1 LYS 117 72.205 0.952 13.366 672 1HE LYS 117 HE2 LYS 117 70.202 1.414 14.330 673 2HE LYS 117 HE1 LYS 117 69.880 2.546 13.003 674 1HZ LYS 117 HZ1 LYS 117 69.191 0.598 11.655 675 2HZ LYS 117 HZ2 LYS 117 68.182 0.868 12.994 676 3HZ LYS 117 HZ3 LYS 117 69.334 -0.379 13.035 677 H THR 118 HN THR 118 74.678 1.283 11.350 678 HA THR 118 HA THR 118 74.247 -1.624 11.860 679 HB THR 118 HB THR 118 76.671 -2.009 11.583 680 HG1 THR 118 HG1 THR 118 76.908 0.552 10.472 681 1HG2 THR 118 HG21 THR 118 76.801 -1.625 9.126 682 2HG2 THR 118 HG22 THR 118 75.364 -0.609 9.236 683 3HG2 THR 118 HG23 THR 118 75.260 -2.328 9.620 684 H LYS 119 HN LYS 119 76.778 0.733 12.776 685 HA LYS 119 HA LYS 119 75.760 0.737 15.574 686 1HB LYS 119 HB2 LYS 119 77.904 -0.867 14.552 687 2HB LYS 119 HB1 LYS 119 78.590 0.347 15.631 688 1HG LYS 119 HG2 LYS 119 76.318 -0.488 16.986 689 2HG LYS 119 HG1 LYS 119 76.926 -1.981 16.263 690 1HD LYS 119 HD2 LYS 119 78.547 -0.043 17.946 691 2HD LYS 119 HD1 LYS 119 77.936 -1.607 18.483 692 1HE LYS 119 HE2 LYS 119 79.327 -2.777 16.871 693 2HE LYS 119 HE1 LYS 119 79.823 -1.244 16.128 694 1HZ LYS 119 HZ1 LYS 119 80.397 -0.703 18.634 695 2HZ LYS 119 HZ2 LYS 119 81.511 -1.495 17.624 696 3HZ LYS 119 HZ3 LYS 119 80.570 -2.387 18.721 697 H PHE 120 HN PHE 120 76.103 2.741 13.336 698 HA PHE 120 HA PHE 120 77.507 4.797 14.943 699 1HB PHE 120 HB2 PHE 120 78.679 3.367 12.757 700 2HB PHE 120 HB1 PHE 120 78.417 5.038 12.239 701 HD1 PHE 120 HD1 PHE 120 80.592 2.861 13.997 702 HD2 PHE 120 HD2 PHE 120 79.083 6.882 14.010 703 HE1 PHE 120 HE1 PHE 120 82.541 3.588 15.347 704 HE2 PHE 120 HE2 PHE 120 81.032 7.609 15.360 705 HZ PHE 120 HZ PHE 120 82.761 5.963 16.028 706 H GLY 121 HN GLY 121 75.819 4.044 11.883 707 1HA GLY 121 HA2 GLY 121 73.723 5.889 12.211 708 2HA GLY 121 HA1 GLY 121 75.006 6.755 11.354 709 H TYR 122 HN TYR 122 75.211 6.405 9.172 710 HA TYR 122 HA TYR 122 73.909 4.005 7.961 711 1HB TYR 122 HB2 TYR 122 73.309 6.930 7.514 712 2HB TYR 122 HB1 TYR 122 72.993 5.747 6.245 713 HD1 TYR 122 HD1 TYR 122 72.305 6.475 9.851 714 HD2 TYR 122 HD2 TYR 122 71.038 4.443 6.289 715 HE1 TYR 122 HE1 TYR 122 70.188 5.830 10.971 716 HE2 TYR 122 HE2 TYR 122 68.923 3.796 7.407 717 HH TYR 122 HH TYR 122 68.449 3.769 10.565 718 H HIS 123 HN HIS 123 75.395 3.124 6.530 719 HA HIS 123 HA HIS 123 77.311 5.027 5.229 720 1HB HIS 123 HB2 HIS 123 78.965 3.115 5.456 721 2HB HIS 123 HB1 HIS 123 78.463 3.844 6.978 722 HD1 HIS 123 HD1 HIS 123 78.653 0.646 5.266 723 HD2 HIS 123 HD2 HIS 123 76.304 2.265 8.303 724 HE1 HIS 123 HE1 HIS 123 77.567 -1.309 6.457 725 H ILE 124 HN ILE 124 77.925 4.479 3.052 726 HA ILE 124 HA ILE 124 75.966 2.758 1.658 727 HB ILE 124 HB ILE 124 78.204 4.588 0.715 728 1HG1 ILE 124 HG12 ILE 124 75.178 4.863 0.827 729 2HG1 ILE 124 HG11 ILE 124 76.360 5.813 1.737 730 1HG2 ILE 124 HG21 ILE 124 77.823 3.939 -1.424 731 2HG2 ILE 124 HG22 ILE 124 76.082 3.827 -1.173 732 3HG2 ILE 124 HG23 ILE 124 77.127 2.488 -0.700 733 1HD1 ILE 124 HD11 ILE 124 76.648 5.797 -1.233 734 2HD1 ILE 124 HD12 ILE 124 76.923 7.104 -0.083 735 3HD1 ILE 124 HD13 ILE 124 75.280 6.690 -0.571 736 H ILE 125 HN ILE 125 76.497 0.598 1.774 737 HA ILE 125 HA ILE 125 79.326 -0.240 1.703 738 HB ILE 125 HB ILE 125 76.625 -1.486 2.190 739 1HG1 ILE 125 HG12 ILE 125 79.251 -1.382 3.709 740 2HG1 ILE 125 HG11 ILE 125 77.774 -0.485 4.086 741 1HG2 ILE 125 HG21 ILE 125 77.321 -3.372 1.146 742 2HG2 ILE 125 HG22 ILE 125 78.395 -3.573 2.530 743 3HG2 ILE 125 HG23 ILE 125 78.990 -2.811 1.055 744 1HD1 ILE 125 HD11 ILE 125 77.737 -3.496 3.930 745 2HD1 ILE 125 HD12 ILE 125 76.631 -2.420 4.783 746 3HD1 ILE 125 HD13 ILE 125 78.262 -2.683 5.404 747 H MET 126 HN MET 126 80.211 -0.289 -0.284 748 HA MET 126 HA MET 126 78.567 -1.142 -2.599 749 1HB MET 126 HB2 MET 126 79.510 0.862 -3.219 750 2HB MET 126 HB1 MET 126 80.751 0.740 -1.970 751 1HG MET 126 HG2 MET 126 82.198 -0.454 -3.321 752 2HG MET 126 HG1 MET 126 80.904 -1.068 -4.360 753 1HE MET 126 HE1 MET 126 80.516 3.010 -3.836 754 2HE MET 126 HE2 MET 126 82.258 3.224 -3.971 755 3HE MET 126 HE3 MET 126 81.605 2.118 -2.767 756 H VAL 127 HN VAL 127 78.735 -3.426 -2.353 757 HA VAL 127 HA VAL 127 81.392 -4.674 -1.979 758 HB VAL 127 HB VAL 127 78.661 -5.889 -2.514 759 1HG1 VAL 127 HG11 VAL 127 79.639 -7.889 -2.112 760 2HG1 VAL 127 HG12 VAL 127 80.531 -7.260 -0.728 761 3HG1 VAL 127 HG13 VAL 127 81.173 -7.053 -2.358 762 1HG2 VAL 127 HG21 VAL 127 78.014 -5.191 -0.478 763 2HG2 VAL 127 HG22 VAL 127 79.543 -4.334 -0.280 764 3HG2 VAL 127 HG23 VAL 127 79.399 -6.013 0.240 765 H GLU 128 HN GLU 128 82.553 -5.594 -3.707 766 HA GLU 128 HA GLU 128 81.170 -5.952 -6.288 767 1HB GLU 128 HB2 GLU 128 82.093 -3.553 -5.861 768 2HB GLU 128 HB1 GLU 128 83.675 -4.290 -6.149 769 1HG GLU 128 HG2 GLU 128 83.091 -4.934 -8.360 770 2HG GLU 128 HG1 GLU 128 81.366 -4.672 -8.066 771 H GLY 129 HN GLY 129 81.782 -8.198 -6.101 772 1HA GLY 129 HA2 GLY 129 83.731 -9.270 -7.505 773 2HA GLY 129 HA1 GLY 129 84.678 -8.749 -6.116 774 H ARG 130 HN ARG 130 83.537 -9.513 -3.988 775 HA ARG 130 HA ARG 130 83.141 -11.309 -2.596 776 1HB ARG 130 HB2 ARG 130 81.793 -12.881 -4.619 777 2HB ARG 130 HB1 ARG 130 81.198 -12.366 -3.060 778 1HG ARG 130 HG2 ARG 130 81.060 -10.008 -4.167 779 2HG ARG 130 HG1 ARG 130 81.102 -10.903 -5.688 780 1HD ARG 130 HD2 ARG 130 79.237 -12.103 -3.780 781 2HD ARG 130 HD1 ARG 130 78.816 -10.423 -4.162 782 HE ARG 130 HE ARG 130 78.987 -11.086 -6.594 783 1HH1 ARG 130 HH21 ARG 130 77.375 -12.929 -4.354 784 2HH1 ARG 130 HH22 ARG 130 77.287 -14.369 -5.313 785 1HH2 ARG 130 HH11 ARG 130 79.439 -13.187 -7.762 786 2HH2 ARG 130 HH12 ARG 130 78.454 -14.515 -7.243 787 H LYS 131 HN LYS 131 84.087 -13.386 -2.150 788 HA LYS 131 HA LYS 131 85.700 -15.087 -2.429 789 1HB LYS 131 HB2 LYS 131 84.961 -15.186 -5.327 790 2HB LYS 131 HB1 LYS 131 85.116 -16.505 -4.171 791 1HG LYS 131 HG2 LYS 131 82.831 -14.529 -4.407 792 2HG LYS 131 HG1 LYS 131 82.775 -16.265 -4.663 793 1HD LYS 131 HD2 LYS 131 83.664 -15.190 -1.992 794 2HD LYS 131 HD1 LYS 131 81.944 -15.277 -2.380 795 1HE LYS 131 HE2 LYS 131 82.802 -17.758 -3.208 796 2HE LYS 131 HE1 LYS 131 83.823 -17.468 -1.780 797 1HZ LYS 131 HZ1 LYS 131 81.672 -18.396 -1.140 798 2HZ LYS 131 HZ2 LYS 131 80.868 -17.115 -1.915 799 3HZ LYS 131 HZ3 LYS 131 81.836 -16.814 -0.551 Start of MODEL 15 1 1H GLY 28 HT1 GLY 28 71.389 -28.196 1.392 2 2H GLY 28 HT2 GLY 28 70.895 -27.297 0.037 3 3H GLY 28 HT3 GLY 28 71.265 -26.507 1.494 4 1HA GLY 28 HA2 GLY 28 73.260 -28.101 -0.004 5 2HA GLY 28 HA1 GLY 28 73.018 -26.377 -0.284 6 H SER 29 HN SER 29 74.069 -28.777 2.070 7 HA SER 29 HA SER 29 75.237 -26.552 3.713 8 1HB SER 29 HB2 SER 29 74.603 -29.337 4.687 9 2HB SER 29 HB1 SER 29 74.749 -27.852 5.627 10 HG SER 29 HG SER 29 72.706 -28.528 3.785 11 H GLY 30 HN GLY 30 77.444 -26.683 4.128 12 1HA GLY 30 HA2 GLY 30 79.258 -28.564 4.491 13 2HA GLY 30 HA1 GLY 30 78.905 -28.904 2.796 14 HA PRO 31 HA PRO 31 82.351 -25.736 3.170 15 1HB PRO 31 HB2 PRO 31 83.653 -27.224 1.076 16 2HB PRO 31 HB1 PRO 31 84.166 -27.030 2.762 17 1HG PRO 31 HG2 PRO 31 83.088 -29.378 1.498 18 2HG PRO 31 HG1 PRO 31 83.606 -29.188 3.174 19 1HD PRO 31 HD2 PRO 31 80.911 -29.430 2.172 20 2HD PRO 31 HD1 PRO 31 81.432 -29.229 3.861 21 H LYS 32 HN LYS 32 82.370 -23.968 1.772 22 HA LYS 32 HA LYS 32 80.712 -24.175 -0.693 23 1HB LYS 32 HB2 LYS 32 81.440 -22.145 1.324 24 2HB LYS 32 HB1 LYS 32 81.367 -21.533 -0.328 25 1HG LYS 32 HG2 LYS 32 79.120 -21.528 -0.232 26 2HG LYS 32 HG1 LYS 32 79.128 -23.265 0.074 27 1HD LYS 32 HD2 LYS 32 79.651 -22.662 2.520 28 2HD LYS 32 HD1 LYS 32 79.197 -21.013 2.089 29 1HE LYS 32 HE2 LYS 32 76.997 -21.545 2.221 30 2HE LYS 32 HE1 LYS 32 77.220 -22.899 1.097 31 1HZ LYS 32 HZ1 LYS 32 76.549 -23.592 3.379 32 2HZ LYS 32 HZ2 LYS 32 78.011 -22.955 3.965 33 3HZ LYS 32 HZ3 LYS 32 78.026 -24.259 2.877 34 H GLY 33 HN GLY 33 83.980 -24.218 0.223 35 1HA GLY 33 HA2 GLY 33 85.709 -24.577 -1.463 36 2HA GLY 33 HA1 GLY 33 84.780 -23.572 -2.575 37 H GLY 34 HN GLY 34 85.737 -22.964 0.811 38 1HA GLY 34 HA1 GLY 34 86.784 -21.078 1.743 39 2HA GLY 34 HA2 GLY 34 87.901 -21.242 0.389 40 H GLY 35 HN GLY 35 87.822 -18.770 0.712 41 1HA GLY 35 HA1 GLY 35 87.292 -16.981 -0.900 42 2HA GLY 35 HA2 GLY 35 85.674 -17.682 -1.059 43 H ASN 36 HN ASN 36 84.096 -16.742 0.153 44 HA ASN 36 HA ASN 36 83.070 -15.427 1.830 45 1HB ASN 36 HB2 ASN 36 85.630 -16.001 3.340 46 2HB ASN 36 HB1 ASN 36 84.032 -15.695 4.020 47 1HD2 ASN 36 HD21 ASN 36 86.092 -18.186 3.637 48 2HD2 ASN 36 HD22 ASN 36 85.005 -19.460 3.355 49 H ALA 37 HN ALA 37 85.485 -14.396 -0.003 50 HA ALA 37 HA ALA 37 85.940 -11.853 1.493 51 1HB ALA 37 HB1 ALA 37 87.834 -13.485 0.743 52 2HB ALA 37 HB2 ALA 37 88.037 -11.767 0.400 53 3HB ALA 37 HB3 ALA 37 87.513 -12.864 -0.877 54 H VAL 38 HN VAL 38 85.613 -9.906 0.334 55 HA VAL 38 HA VAL 38 84.478 -10.026 -2.416 56 HB VAL 38 HB VAL 38 82.401 -9.076 -1.730 57 1HG1 VAL 38 HG11 VAL 38 81.487 -10.673 -0.296 58 2HG1 VAL 38 HG12 VAL 38 82.911 -10.706 0.741 59 3HG1 VAL 38 HG13 VAL 38 82.949 -11.495 -0.831 60 1HG2 VAL 38 HG21 VAL 38 82.015 -8.065 0.444 61 2HG2 VAL 38 HG22 VAL 38 83.465 -7.349 -0.260 62 3HG2 VAL 38 HG23 VAL 38 83.609 -8.570 1.004 63 H LYS 39 HN LYS 39 84.753 -7.838 -3.524 64 HA LYS 39 HA LYS 39 86.797 -6.244 -2.074 65 1HB LYS 39 HB2 LYS 39 86.531 -7.009 -4.591 66 2HB LYS 39 HB1 LYS 39 85.558 -5.546 -4.713 67 1HG LYS 39 HG2 LYS 39 88.459 -5.765 -3.816 68 2HG LYS 39 HG1 LYS 39 87.859 -4.988 -5.287 69 1HD LYS 39 HD2 LYS 39 86.811 -3.231 -4.037 70 2HD LYS 39 HD1 LYS 39 87.053 -4.089 -2.508 71 1HE LYS 39 HE2 LYS 39 88.736 -2.288 -2.776 72 2HE LYS 39 HE1 LYS 39 89.521 -3.878 -2.809 73 1HZ LYS 39 HZ1 LYS 39 89.333 -3.847 -5.242 74 2HZ LYS 39 HZ2 LYS 39 90.267 -2.545 -4.676 75 3HZ LYS 39 HZ3 LYS 39 88.664 -2.290 -5.176 76 H VAL 40 HN VAL 40 85.485 -5.329 -0.386 77 HA VAL 40 HA VAL 40 83.214 -3.604 -1.220 78 HB VAL 40 HB VAL 40 83.042 -3.481 1.389 79 1HG1 VAL 40 HG11 VAL 40 82.200 -6.060 1.144 80 2HG1 VAL 40 HG12 VAL 40 82.296 -5.573 -0.550 81 3HG1 VAL 40 HG13 VAL 40 81.287 -4.664 0.574 82 1HG2 VAL 40 HG21 VAL 40 84.576 -6.064 1.161 83 2HG2 VAL 40 HG22 VAL 40 84.101 -5.196 2.619 84 3HG2 VAL 40 HG23 VAL 40 85.373 -4.551 1.583 85 H ARG 41 HN ARG 41 83.063 -1.495 -0.645 86 HA ARG 41 HA ARG 41 85.394 -0.079 0.529 87 1HB ARG 41 HB2 ARG 41 83.973 0.605 -2.070 88 2HB ARG 41 HB1 ARG 41 85.290 1.526 -1.340 89 1HG ARG 41 HG2 ARG 41 86.698 0.232 -2.542 90 2HG ARG 41 HG1 ARG 41 86.267 -1.085 -1.452 91 1HD ARG 41 HD2 ARG 41 85.191 -2.166 -3.129 92 2HD ARG 41 HD1 ARG 41 84.204 -0.726 -3.468 93 HE ARG 41 HE ARG 41 86.920 -0.350 -4.388 94 1HH1 ARG 41 HH11 ARG 41 83.783 -1.553 -5.121 95 2HH1 ARG 41 HH12 ARG 41 84.111 -1.770 -6.808 96 1HH2 ARG 41 HH21 ARG 41 87.426 -0.790 -6.564 97 2HH2 ARG 41 HH22 ARG 41 86.172 -1.338 -7.624 98 H HIS 42 HN HIS 42 84.566 1.967 1.636 99 HA HIS 42 HA HIS 42 81.587 2.147 1.531 100 1HB HIS 42 HB2 HIS 42 81.364 1.664 3.833 101 2HB HIS 42 HB1 HIS 42 82.484 0.457 3.202 102 HD1 HIS 42 HD1 HIS 42 82.137 2.605 5.990 103 HD2 HIS 42 HD2 HIS 42 85.347 1.626 3.518 104 HE1 HIS 42 HE1 HIS 42 84.237 3.186 7.280 105 H ILE 43 HN ILE 43 80.646 4.020 2.261 106 HA ILE 43 HA ILE 43 82.457 6.298 2.987 107 HB ILE 43 HB ILE 43 80.198 5.984 1.011 108 1HG1 ILE 43 HG12 ILE 43 82.687 7.606 0.597 109 2HG1 ILE 43 HG11 ILE 43 82.800 5.843 0.570 110 1HG2 ILE 43 HG21 ILE 43 80.923 8.709 1.062 111 2HG2 ILE 43 HG22 ILE 43 80.612 8.262 2.736 112 3HG2 ILE 43 HG23 ILE 43 79.369 8.009 1.513 113 1HD1 ILE 43 HD11 ILE 43 82.303 7.121 -1.662 114 2HD1 ILE 43 HD12 ILE 43 80.664 7.251 -1.020 115 3HD1 ILE 43 HD13 ILE 43 81.383 5.662 -1.293 116 H LEU 44 HN LEU 44 81.764 7.382 4.918 117 HA LEU 44 HA LEU 44 79.001 6.653 5.914 118 1HB LEU 44 HB2 LEU 44 81.474 7.606 7.407 119 2HB LEU 44 HB1 LEU 44 79.919 7.222 8.149 120 HG LEU 44 HG LEU 44 81.984 5.410 7.041 121 1HD1 LEU 44 HD11 LEU 44 81.841 5.606 9.432 122 2HD1 LEU 44 HD12 LEU 44 81.079 4.069 9.030 123 3HD1 LEU 44 HD13 LEU 44 80.081 5.480 9.395 124 1HD2 LEU 44 HD21 LEU 44 80.357 3.615 6.739 125 2HD2 LEU 44 HD22 LEU 44 79.908 4.962 5.706 126 3HD2 LEU 44 HD23 LEU 44 79.044 4.693 7.216 127 H CYS 45 HN CYS 45 77.739 8.290 6.808 128 HA CYS 45 HA CYS 45 78.726 11.093 6.463 129 1HB CYS 45 HB2 CYS 45 76.249 9.726 5.467 130 2HB CYS 45 HB1 CYS 45 76.172 11.446 5.889 131 HG CYS 45 HG CYS 45 78.526 11.301 4.195 132 H GLU 46 HN GLU 46 79.104 10.480 8.883 133 HA GLU 46 HA GLU 46 77.438 9.905 10.917 134 1HB GLU 46 HB2 GLU 46 78.390 12.157 11.971 135 2HB GLU 46 HB1 GLU 46 79.463 10.812 11.594 136 1HG GLU 46 HG2 GLU 46 80.248 11.849 9.625 137 2HG GLU 46 HG1 GLU 46 78.882 12.959 9.560 138 H LYS 47 HN LYS 47 77.109 12.906 9.028 139 HA LYS 47 HA LYS 47 74.779 13.778 10.636 140 1HB LYS 47 HB2 LYS 47 76.029 14.990 8.156 141 2HB LYS 47 HB1 LYS 47 75.022 15.810 9.349 142 1HG LYS 47 HG2 LYS 47 76.741 15.446 11.071 143 2HG LYS 47 HG1 LYS 47 77.742 14.584 9.902 144 1HD LYS 47 HD2 LYS 47 77.939 16.595 8.530 145 2HD LYS 47 HD1 LYS 47 76.839 17.466 9.599 146 1HE LYS 47 HE2 LYS 47 79.049 16.267 11.088 147 2HE LYS 47 HE1 LYS 47 79.621 17.392 9.841 148 1HZ LYS 47 HZ1 LYS 47 79.059 18.633 11.812 149 2HZ LYS 47 HZ2 LYS 47 77.522 17.912 11.888 150 3HZ LYS 47 HZ3 LYS 47 77.904 18.971 10.618 151 H HIS 48 HN HIS 48 75.394 12.020 7.745 152 HA HIS 48 HA HIS 48 73.957 11.074 6.151 153 1HB HIS 48 HB2 HIS 48 71.895 11.995 8.181 154 2HB HIS 48 HB1 HIS 48 71.601 10.839 6.884 155 HD1 HIS 48 HD1 HIS 48 74.784 9.859 7.533 156 HD2 HIS 48 HD2 HIS 48 71.374 9.618 9.911 157 HE1 HIS 48 HE1 HIS 48 75.265 8.078 9.270 158 H GLY 49 HN GLY 49 74.404 14.215 6.581 159 1HA GLY 49 HA2 GLY 49 72.198 15.296 4.969 160 2HA GLY 49 HA1 GLY 49 73.614 16.198 5.538 161 H LYS 50 HN LYS 50 75.551 14.291 4.580 162 HA LYS 50 HA LYS 50 75.514 14.966 1.681 163 1HB LYS 50 HB2 LYS 50 77.680 13.767 3.444 164 2HB LYS 50 HB1 LYS 50 77.901 14.449 1.834 165 1HG LYS 50 HG2 LYS 50 78.557 16.230 3.181 166 2HG LYS 50 HG1 LYS 50 76.852 16.606 2.918 167 1HD LYS 50 HD2 LYS 50 76.369 16.343 5.110 168 2HD LYS 50 HD1 LYS 50 77.221 14.800 5.178 169 1HE LYS 50 HE2 LYS 50 78.733 15.920 6.480 170 2HE LYS 50 HE1 LYS 50 79.293 16.643 4.954 171 1HZ LYS 50 HZ1 LYS 50 77.046 17.684 6.610 172 2HZ LYS 50 HZ2 LYS 50 77.681 18.399 5.204 173 3HZ LYS 50 HZ3 LYS 50 78.617 18.324 6.621 174 H ILE 51 HN ILE 51 75.048 12.332 3.857 175 HA ILE 51 HA ILE 51 75.903 10.075 2.493 176 HB ILE 51 HB ILE 51 74.646 10.198 4.661 177 1HG1 ILE 51 HG12 ILE 51 73.377 8.103 4.318 178 2HG1 ILE 51 HG11 ILE 51 73.486 8.332 2.567 179 1HG2 ILE 51 HG21 ILE 51 72.846 11.709 3.441 180 2HG2 ILE 51 HG22 ILE 51 72.372 10.649 4.769 181 3HG2 ILE 51 HG23 ILE 51 72.088 10.152 3.099 182 1HD1 ILE 51 HD11 ILE 51 75.606 7.548 2.512 183 2HD1 ILE 51 HD12 ILE 51 75.336 6.990 4.163 184 3HD1 ILE 51 HD13 ILE 51 76.087 8.559 3.875 185 H MET 52 HN MET 52 73.201 12.182 1.647 186 HA MET 52 HA MET 52 72.493 10.431 -0.621 187 1HB MET 52 HB2 MET 52 70.462 11.353 -0.156 188 2HB MET 52 HB1 MET 52 71.222 12.357 1.075 189 1HG MET 52 HG2 MET 52 70.170 13.884 -0.417 190 2HG MET 52 HG1 MET 52 71.884 13.934 -0.830 191 1HE MET 52 HE1 MET 52 71.377 14.063 -4.423 192 2HE MET 52 HE2 MET 52 72.564 14.072 -3.121 193 3HE MET 52 HE3 MET 52 71.144 15.108 -3.015 194 H GLU 53 HN GLU 53 74.014 13.508 0.064 195 HA GLU 53 HA GLU 53 74.332 14.399 -2.649 196 1HB GLU 53 HB2 GLU 53 74.950 15.257 -0.041 197 2HB GLU 53 HB1 GLU 53 76.515 15.068 -0.832 198 1HG GLU 53 HG2 GLU 53 75.847 16.531 -2.639 199 2HG GLU 53 HG1 GLU 53 74.188 16.582 -2.042 200 H ALA 54 HN ALA 54 75.882 12.123 -0.516 201 HA ALA 54 HA ALA 54 78.194 11.669 -2.303 202 1HB ALA 54 HB1 ALA 54 77.528 11.295 0.399 203 2HB ALA 54 HB2 ALA 54 79.002 10.738 -0.393 204 3HB ALA 54 HB3 ALA 54 77.611 9.663 -0.262 205 H MET 55 HN MET 55 75.024 10.337 -1.582 206 HA MET 55 HA MET 55 75.436 7.880 -3.133 207 1HB MET 55 HB2 MET 55 73.662 7.355 -1.833 208 2HB MET 55 HB1 MET 55 73.559 9.030 -1.290 209 1HG MET 55 HG2 MET 55 72.216 9.558 -3.337 210 2HG MET 55 HG1 MET 55 72.220 7.830 -3.727 211 1HE MET 55 HE1 MET 55 70.862 6.642 -0.074 212 2HE MET 55 HE2 MET 55 72.491 7.227 -0.404 213 3HE MET 55 HE3 MET 55 71.726 6.092 -1.514 214 H GLU 56 HN GLU 56 73.890 11.043 -3.662 215 HA GLU 56 HA GLU 56 72.893 10.433 -6.313 216 1HB GLU 56 HB2 GLU 56 72.685 12.427 -4.367 217 2HB GLU 56 HB1 GLU 56 73.473 13.233 -5.723 218 1HG GLU 56 HG2 GLU 56 71.502 11.729 -6.954 219 2HG GLU 56 HG1 GLU 56 70.716 12.270 -5.470 220 H LYS 57 HN LYS 57 75.550 12.620 -5.264 221 HA LYS 57 HA LYS 57 76.755 13.207 -7.687 222 1HB LYS 57 HB2 LYS 57 77.833 12.540 -4.949 223 2HB LYS 57 HB1 LYS 57 78.921 13.021 -6.252 224 1HG LYS 57 HG2 LYS 57 77.054 14.944 -6.526 225 2HG LYS 57 HG1 LYS 57 76.871 14.627 -4.803 226 1HD LYS 57 HD2 LYS 57 79.123 15.189 -4.346 227 2HD LYS 57 HD1 LYS 57 79.586 15.044 -6.042 228 1HE LYS 57 HE2 LYS 57 79.348 17.326 -6.063 229 2HE LYS 57 HE1 LYS 57 77.611 16.974 -6.148 230 1HZ LYS 57 HZ1 LYS 57 78.150 18.417 -4.254 231 2HZ LYS 57 HZ2 LYS 57 79.200 17.230 -3.642 232 3HZ LYS 57 HZ3 LYS 57 77.533 16.924 -3.737 233 H LEU 58 HN LEU 58 77.866 10.462 -5.665 234 HA LEU 58 HA LEU 58 79.465 9.021 -7.342 235 1HB LEU 58 HB2 LEU 58 77.497 8.483 -5.234 236 2HB LEU 58 HB1 LEU 58 77.752 7.095 -6.300 237 HG LEU 58 HG LEU 58 80.306 7.826 -5.947 238 1HD1 LEU 58 HD11 LEU 58 79.272 9.668 -4.354 239 2HD1 LEU 58 HD12 LEU 58 80.765 8.841 -3.915 240 3HD1 LEU 58 HD13 LEU 58 79.237 8.336 -3.199 241 1HD2 LEU 58 HD21 LEU 58 78.458 6.053 -4.393 242 2HD2 LEU 58 HD22 LEU 58 80.118 6.235 -3.823 243 3HD2 LEU 58 HD23 LEU 58 79.805 5.611 -5.442 244 H LYS 59 HN LYS 59 75.885 8.945 -7.437 245 HA LYS 59 HA LYS 59 75.750 7.154 -9.715 246 1HB LYS 59 HB2 LYS 59 74.043 8.430 -7.796 247 2HB LYS 59 HB1 LYS 59 73.394 8.738 -9.408 248 1HG LYS 59 HG2 LYS 59 73.811 6.210 -9.820 249 2HG LYS 59 HG1 LYS 59 73.920 6.092 -8.064 250 1HD LYS 59 HD2 LYS 59 71.577 7.256 -9.604 251 2HD LYS 59 HD1 LYS 59 71.615 5.657 -8.859 252 1HE LYS 59 HE2 LYS 59 71.740 6.586 -6.650 253 2HE LYS 59 HE1 LYS 59 72.087 8.207 -7.282 254 1HZ LYS 59 HZ1 LYS 59 69.952 8.438 -8.099 255 2HZ LYS 59 HZ2 LYS 59 69.660 7.582 -6.661 256 3HZ LYS 59 HZ3 LYS 59 69.666 6.767 -8.153 257 H SER 60 HN SER 60 74.419 10.457 -9.568 258 HA SER 60 HA SER 60 74.168 11.101 -12.208 259 1HB SER 60 HB2 SER 60 75.490 13.312 -10.968 260 2HB SER 60 HB1 SER 60 73.757 13.067 -11.177 261 HG SER 60 HG SER 60 75.322 11.994 -9.070 262 H GLY 61 HN GLY 61 77.236 10.890 -10.456 263 1HA GLY 61 HA2 GLY 61 79.236 10.178 -11.712 264 2HA GLY 61 HA1 GLY 61 78.635 11.117 -13.085 265 H MET 62 HN MET 62 78.522 12.317 -9.769 266 HA MET 62 HA MET 62 80.081 14.671 -10.562 267 1HB MET 62 HB2 MET 62 78.066 14.060 -8.756 268 2HB MET 62 HB1 MET 62 79.478 14.257 -7.720 269 1HG MET 62 HG2 MET 62 78.767 16.463 -7.869 270 2HG MET 62 HG1 MET 62 79.874 16.398 -9.241 271 1HE MET 62 HE1 MET 62 75.293 16.062 -9.353 272 2HE MET 62 HE2 MET 62 76.235 16.659 -7.989 273 3HE MET 62 HE3 MET 62 76.376 14.972 -8.476 274 H ARG 63 HN ARG 63 81.247 14.841 -7.784 275 HA ARG 63 HA ARG 63 83.831 13.709 -8.371 276 1HB ARG 63 HB2 ARG 63 82.533 14.810 -5.870 277 2HB ARG 63 HB1 ARG 63 84.248 14.375 -5.981 278 1HG ARG 63 HG2 ARG 63 84.731 16.279 -7.064 279 2HG ARG 63 HG1 ARG 63 83.419 16.033 -8.220 280 1HD ARG 63 HD2 ARG 63 82.036 17.461 -7.099 281 2HD ARG 63 HD1 ARG 63 82.461 16.746 -5.524 282 HE ARG 63 HE ARG 63 84.286 18.298 -5.368 283 1HH1 ARG 63 HH21 ARG 63 82.050 19.695 -7.200 284 2HH1 ARG 63 HH22 ARG 63 83.107 20.567 -8.259 285 1HH2 ARG 63 HH11 ARG 63 85.952 18.852 -7.262 286 2HH2 ARG 63 HH12 ARG 63 85.318 20.090 -8.294 287 H PHE 64 HN PHE 64 84.348 11.584 -8.174 288 HA PHE 64 HA PHE 64 82.733 9.814 -6.437 289 1HB PHE 64 HB2 PHE 64 84.801 9.555 -8.605 290 2HB PHE 64 HB1 PHE 64 84.533 8.189 -7.524 291 HD1 PHE 64 HD1 PHE 64 83.530 9.648 -10.544 292 HD2 PHE 64 HD2 PHE 64 81.923 7.673 -7.085 293 HE1 PHE 64 HE1 PHE 64 81.512 9.022 -11.840 294 HE2 PHE 64 HE2 PHE 64 79.904 7.047 -8.382 295 HZ PHE 64 HZ PHE 64 79.699 7.721 -10.759 296 H ASN 65 HN ASN 65 85.928 11.292 -6.672 297 HA ASN 65 HA ASN 65 86.932 9.761 -4.345 298 1HB ASN 65 HB2 ASN 65 88.355 10.163 -6.306 299 2HB ASN 65 HB1 ASN 65 88.161 11.903 -6.102 300 1HD2 ASN 65 HD21 ASN 65 88.463 9.782 -3.290 301 2HD2 ASN 65 HD22 ASN 65 90.014 10.299 -2.841 302 H GLU 66 HN GLU 66 86.046 13.109 -5.170 303 HA GLU 66 HA GLU 66 86.899 14.220 -2.657 304 1HB GLU 66 HB2 GLU 66 86.406 16.105 -3.806 305 2HB GLU 66 HB1 GLU 66 85.896 15.080 -5.142 306 1HG GLU 66 HG2 GLU 66 84.090 16.585 -4.640 307 2HG GLU 66 HG1 GLU 66 83.608 14.982 -4.091 308 H VAL 67 HN VAL 67 83.752 13.003 -3.860 309 HA VAL 67 HA VAL 67 82.330 13.584 -1.442 310 HB VAL 67 HB VAL 67 80.699 11.996 -2.379 311 1HG1 VAL 67 HG11 VAL 67 80.418 12.991 -4.620 312 2HG1 VAL 67 HG12 VAL 67 82.053 13.650 -4.498 313 3HG1 VAL 67 HG13 VAL 67 80.796 14.209 -3.396 314 1HG2 VAL 67 HG21 VAL 67 82.082 10.199 -3.075 315 2HG2 VAL 67 HG22 VAL 67 83.000 11.251 -4.156 316 3HG2 VAL 67 HG23 VAL 67 81.327 10.837 -4.535 317 H ALA 68 HN ALA 68 83.878 10.574 -2.693 318 HA ALA 68 HA ALA 68 83.480 8.982 -0.376 319 1HB ALA 68 HB1 ALA 68 85.117 7.582 -1.394 320 2HB ALA 68 HB2 ALA 68 85.949 8.954 -2.127 321 3HB ALA 68 HB3 ALA 68 84.387 8.430 -2.757 322 H ALA 69 HN ALA 69 85.942 11.319 -1.333 323 HA ALA 69 HA ALA 69 87.782 11.043 0.741 324 1HB ALA 69 HB1 ALA 69 88.495 12.761 -0.567 325 2HB ALA 69 HB2 ALA 69 87.430 13.797 0.383 326 3HB ALA 69 HB3 ALA 69 86.856 13.093 -1.128 327 H GLN 70 HN GLN 70 85.384 13.720 0.918 328 HA GLN 70 HA GLN 70 85.400 13.244 3.816 329 1HB GLN 70 HB2 GLN 70 84.861 15.524 2.082 330 2HB GLN 70 HB1 GLN 70 83.738 15.396 3.425 331 1HG GLN 70 HG2 GLN 70 86.729 15.715 3.534 332 2HG GLN 70 HG1 GLN 70 85.484 16.649 4.372 333 1HE2 GLN 70 HE21 GLN 70 84.095 13.938 5.176 334 2HE2 GLN 70 HE22 GLN 70 85.067 13.316 6.421 335 H TYR 71 HN TYR 71 82.832 13.563 1.331 336 HA TYR 71 HA TYR 71 80.576 13.407 2.865 337 1HB TYR 71 HB2 TYR 71 81.222 11.803 0.373 338 2HB TYR 71 HB1 TYR 71 79.608 11.953 1.040 339 HD1 TYR 71 HD1 TYR 71 81.666 14.918 1.598 340 HD2 TYR 71 HD2 TYR 71 79.101 12.942 -1.259 341 HE1 TYR 71 HE1 TYR 71 81.333 17.050 0.403 342 HE2 TYR 71 HE2 TYR 71 78.782 15.095 -2.442 343 HH TYR 71 HH TYR 71 79.171 17.898 -1.294 344 H SER 72 HN SER 72 82.963 10.907 2.431 345 HA SER 72 HA SER 72 81.489 9.011 4.186 346 1HB SER 72 HB2 SER 72 82.635 7.981 2.370 347 2HB SER 72 HB1 SER 72 84.046 8.999 2.588 348 HG SER 72 HG SER 72 84.508 7.928 4.488 349 H GLU 73 HN GLU 73 81.640 9.847 6.331 350 HA GLU 73 HA GLU 73 83.867 11.377 7.302 351 1HB GLU 73 HB2 GLU 73 81.291 10.727 8.092 352 2HB GLU 73 HB1 GLU 73 82.301 9.922 9.304 353 1HG GLU 73 HG2 GLU 73 83.468 12.458 8.852 354 2HG GLU 73 HG1 GLU 73 81.736 12.738 9.004 355 H ASP 74 HN ASP 74 85.161 9.343 6.192 356 HA ASP 74 HA ASP 74 87.011 8.340 7.983 357 1HB ASP 74 HB2 ASP 74 86.030 5.938 8.289 358 2HB ASP 74 HB1 ASP 74 85.409 7.225 9.318 359 H LYS 75 HN LYS 75 87.458 5.699 7.149 360 HA LYS 75 HA LYS 75 88.800 5.827 4.753 361 1HB LYS 75 HB2 LYS 75 88.790 3.909 6.276 362 2HB LYS 75 HB1 LYS 75 87.113 3.563 5.866 363 1HG LYS 75 HG2 LYS 75 88.362 2.057 4.524 364 2HG LYS 75 HG1 LYS 75 87.948 3.377 3.426 365 1HD LYS 75 HD2 LYS 75 90.174 3.471 2.995 366 2HD LYS 75 HD1 LYS 75 90.299 4.270 4.562 367 1HE LYS 75 HE2 LYS 75 90.355 1.251 4.321 368 2HE LYS 75 HE1 LYS 75 91.831 2.229 4.205 369 1HZ LYS 75 HZ1 LYS 75 90.711 3.368 6.301 370 2HZ LYS 75 HZ2 LYS 75 91.723 2.013 6.458 371 3HZ LYS 75 HZ3 LYS 75 90.034 1.824 6.482 372 H ALA 76 HN ALA 76 87.776 7.075 3.147 373 HA ALA 76 HA ALA 76 85.122 7.038 2.257 374 1HB ALA 76 HB1 ALA 76 86.095 7.954 0.199 375 2HB ALA 76 HB2 ALA 76 87.671 7.301 0.633 376 3HB ALA 76 HB3 ALA 76 86.955 8.584 1.602 377 H ARG 77 HN ARG 77 84.506 6.190 -0.060 378 HA ARG 77 HA ARG 77 85.043 3.257 -0.151 379 1HB ARG 77 HB2 ARG 77 82.703 4.165 -0.197 380 2HB ARG 77 HB1 ARG 77 83.094 5.025 -1.685 381 1HG ARG 77 HG2 ARG 77 83.094 2.016 -1.288 382 2HG ARG 77 HG1 ARG 77 81.939 2.936 -2.230 383 1HD ARG 77 HD2 ARG 77 84.082 3.729 -3.556 384 2HD ARG 77 HD1 ARG 77 84.796 2.273 -2.898 385 HE ARG 77 HE ARG 77 82.359 1.398 -3.827 386 1HH1 ARG 77 HH11 ARG 77 85.326 2.572 -5.022 387 2HH1 ARG 77 HH12 ARG 77 84.947 2.272 -6.685 388 1HH2 ARG 77 HH21 ARG 77 81.697 1.255 -6.035 389 2HH2 ARG 77 HH22 ARG 77 82.892 1.527 -7.259 390 H GLN 78 HN GLN 78 84.721 5.954 -2.464 391 HA GLN 78 HA GLN 78 86.012 4.690 -4.639 392 1HB GLN 78 HB2 GLN 78 85.866 7.600 -3.799 393 2HB GLN 78 HB1 GLN 78 86.308 7.029 -5.402 394 1HG GLN 78 HG2 GLN 78 83.627 7.163 -4.094 395 2HG GLN 78 HG1 GLN 78 84.058 7.378 -5.787 396 1HE2 GLN 78 HE21 GLN 78 82.304 5.435 -3.849 397 2HE2 GLN 78 HE22 GLN 78 82.425 3.960 -4.679 398 H GLY 79 HN GLY 79 87.644 7.558 -3.463 399 1HA GLY 79 HA2 GLY 79 90.248 6.408 -3.806 400 2HA GLY 79 HA1 GLY 79 89.908 7.950 -3.016 401 H GLY 80 HN GLY 80 87.950 6.170 -1.302 402 1HA GLY 80 HA2 GLY 80 89.937 5.670 0.822 403 2HA GLY 80 HA1 GLY 80 88.182 5.602 1.009 404 H ASP 81 HN ASP 81 87.847 3.925 -1.381 405 HA ASP 81 HA ASP 81 87.321 1.549 -1.386 406 1HB ASP 81 HB2 ASP 81 89.110 2.159 -2.974 407 2HB ASP 81 HB1 ASP 81 90.321 1.866 -1.718 408 H LEU 82 HN LEU 82 86.746 1.094 0.935 409 HA LEU 82 HA LEU 82 88.486 0.684 3.054 410 1HB LEU 82 HB2 LEU 82 86.497 0.085 3.928 411 2HB LEU 82 HB1 LEU 82 85.818 0.060 2.308 412 HG LEU 82 HG LEU 82 86.648 -2.303 2.081 413 1HD1 LEU 82 HD11 LEU 82 86.820 -2.905 4.869 414 2HD1 LEU 82 HD12 LEU 82 87.945 -1.590 4.528 415 3HD1 LEU 82 HD13 LEU 82 88.065 -3.107 3.637 416 1HD2 LEU 82 HD21 LEU 82 84.539 -1.332 3.916 417 2HD2 LEU 82 HD22 LEU 82 84.981 -3.028 4.115 418 3HD2 LEU 82 HD23 LEU 82 84.417 -2.442 2.551 419 H GLY 83 HN GLY 83 87.731 -1.740 0.494 420 1HA GLY 83 HA2 GLY 83 89.730 -3.024 -0.338 421 2HA GLY 83 HA1 GLY 83 90.225 -3.166 1.352 422 H TRP 84 HN TRP 84 90.103 -5.493 0.088 423 HA TRP 84 HA TRP 84 87.683 -6.913 -0.195 424 1HB TRP 84 HB2 TRP 84 90.534 -7.509 0.481 425 2HB TRP 84 HB1 TRP 84 89.371 -8.809 0.658 426 HD1 TRP 84 HD1 TRP 84 91.124 -6.719 -1.879 427 HE1 TRP 84 HE1 TRP 84 90.629 -7.610 -4.252 428 HE3 TRP 84 HE3 TRP 84 87.481 -10.097 -0.776 429 HZ2 TRP 84 HZ2 TRP 84 88.901 -9.523 -5.504 430 HZ3 TRP 84 HZ3 TRP 84 86.427 -11.447 -2.567 431 HH2 TRP 84 HH2 TRP 84 87.131 -11.164 -4.928 432 H MET 85 HN MET 85 86.706 -8.523 1.365 433 HA MET 85 HA MET 85 87.293 -8.007 4.234 434 1HB MET 85 HB2 MET 85 84.918 -7.099 2.686 435 2HB MET 85 HB1 MET 85 84.609 -7.742 4.298 436 1HG MET 85 HG2 MET 85 86.774 -6.144 4.781 437 2HG MET 85 HG1 MET 85 85.971 -5.243 3.494 438 1HE MET 85 HE1 MET 85 86.210 -6.118 7.080 439 2HE MET 85 HE2 MET 85 85.171 -4.854 7.730 440 3HE MET 85 HE3 MET 85 86.476 -4.430 6.624 441 H THR 86 HN THR 86 86.832 -9.807 5.499 442 HA THR 86 HA THR 86 85.229 -12.005 4.254 443 HB THR 86 HB THR 86 87.206 -13.302 5.649 444 HG1 THR 86 HG1 THR 86 88.660 -11.402 4.248 445 1HG2 THR 86 HG21 THR 86 88.245 -13.657 3.402 446 2HG2 THR 86 HG22 THR 86 87.200 -12.390 2.762 447 3HG2 THR 86 HG23 THR 86 86.495 -13.875 3.399 448 H ARG 87 HN ARG 87 83.734 -12.820 5.684 449 HA ARG 87 HA ARG 87 82.985 -11.737 8.100 450 1HB ARG 87 HB2 ARG 87 82.609 -14.188 6.636 451 2HB ARG 87 HB1 ARG 87 82.695 -14.553 8.359 452 1HG ARG 87 HG2 ARG 87 80.796 -13.331 8.852 453 2HG ARG 87 HG1 ARG 87 81.038 -12.209 7.513 454 1HD ARG 87 HD2 ARG 87 79.609 -13.428 6.244 455 2HD ARG 87 HD1 ARG 87 80.644 -14.856 6.443 456 HE ARG 87 HE ARG 87 79.145 -14.352 8.858 457 1HH1 ARG 87 HH11 ARG 87 79.578 -17.041 7.528 458 2HH1 ARG 87 HH12 ARG 87 77.967 -17.450 7.044 459 1HH2 ARG 87 HH21 ARG 87 76.750 -14.225 7.417 460 2HH2 ARG 87 HH22 ARG 87 76.366 -15.856 6.981 461 H GLY 88 HN GLY 88 83.361 -12.400 10.356 462 1HA GLY 88 HA2 GLY 88 84.738 -13.764 11.935 463 2HA GLY 88 HA1 GLY 88 86.073 -13.597 10.784 464 H SER 89 HN SER 89 86.183 -10.996 10.172 465 HA SER 89 HA SER 89 86.746 -9.692 12.796 466 1HB SER 89 HB2 SER 89 87.875 -9.734 10.073 467 2HB SER 89 HB1 SER 89 87.798 -8.117 10.786 468 HG SER 89 HG SER 89 89.179 -10.399 11.654 469 H MET 90 HN MET 90 84.636 -9.559 10.052 470 HA MET 90 HA MET 90 83.890 -6.798 10.075 471 1HB MET 90 HB2 MET 90 83.049 -9.348 8.948 472 2HB MET 90 HB1 MET 90 81.658 -8.345 9.358 473 1HG MET 90 HG2 MET 90 82.083 -6.910 7.662 474 2HG MET 90 HG1 MET 90 83.791 -6.799 8.095 475 1HE MET 90 HE1 MET 90 82.692 -7.998 4.272 476 2HE MET 90 HE2 MET 90 82.414 -6.661 5.386 477 3HE MET 90 HE3 MET 90 81.326 -8.046 5.396 478 H VAL 91 HN VAL 91 81.049 -6.980 10.476 479 HA VAL 91 HA VAL 91 80.913 -7.440 13.439 480 HB VAL 91 HB VAL 91 79.159 -5.483 13.168 481 1HG1 VAL 91 HG11 VAL 91 81.941 -5.639 13.764 482 2HG1 VAL 91 HG12 VAL 91 80.777 -4.440 14.326 483 3HG1 VAL 91 HG13 VAL 91 81.679 -4.161 12.838 484 1HG2 VAL 91 HG21 VAL 91 79.529 -5.667 10.586 485 2HG2 VAL 91 HG22 VAL 91 80.999 -4.747 10.902 486 3HG2 VAL 91 HG23 VAL 91 79.427 -4.066 11.317 487 H GLY 92 HN GLY 92 78.142 -6.328 11.646 488 1HA GLY 92 HA2 GLY 92 77.073 -9.066 11.328 489 2HA GLY 92 HA1 GLY 92 76.224 -8.016 12.470 490 HA PRO 93 HA PRO 93 73.870 -6.069 9.344 491 1HB PRO 93 HB2 PRO 93 74.751 -3.371 9.842 492 2HB PRO 93 HB1 PRO 93 73.254 -4.148 10.380 493 1HG PRO 93 HG2 PRO 93 75.569 -3.458 11.955 494 2HG PRO 93 HG1 PRO 93 74.057 -4.187 12.500 495 1HD PRO 93 HD2 PRO 93 76.629 -5.445 12.295 496 2HD PRO 93 HD1 PRO 93 75.088 -6.203 12.759 497 H PHE 94 HN PHE 94 77.189 -4.791 9.589 498 HA PHE 94 HA PHE 94 77.424 -3.715 6.965 499 1HB PHE 94 HB2 PHE 94 78.945 -3.865 9.203 500 2HB PHE 94 HB1 PHE 94 79.755 -5.086 8.209 501 HD1 PHE 94 HD1 PHE 94 81.533 -4.310 6.938 502 HD2 PHE 94 HD2 PHE 94 78.220 -1.685 7.699 503 HE1 PHE 94 HE1 PHE 94 82.658 -2.518 5.646 504 HE2 PHE 94 HE2 PHE 94 79.345 0.109 6.407 505 HZ PHE 94 HZ PHE 94 81.564 -0.308 5.380 506 H GLN 95 HN GLN 95 78.028 -7.017 8.189 507 HA GLN 95 HA GLN 95 78.789 -7.976 5.508 508 1HB GLN 95 HB2 GLN 95 79.990 -8.867 7.362 509 2HB GLN 95 HB1 GLN 95 78.510 -9.156 8.277 510 1HG GLN 95 HG2 GLN 95 78.324 -10.543 5.772 511 2HG GLN 95 HG1 GLN 95 79.862 -10.954 6.532 512 1HE2 GLN 95 HE21 GLN 95 79.330 -11.043 9.212 513 2HE2 GLN 95 HE22 GLN 95 78.094 -12.153 9.562 514 H GLU 96 HN GLU 96 76.333 -9.054 7.896 515 HA GLU 96 HA GLU 96 74.781 -10.774 6.469 516 1HB GLU 96 HB2 GLU 96 73.054 -10.195 7.959 517 2HB GLU 96 HB1 GLU 96 74.497 -9.627 8.796 518 1HG GLU 96 HG2 GLU 96 73.105 -7.761 8.959 519 2HG GLU 96 HG1 GLU 96 74.017 -7.387 7.496 520 H ALA 97 HN ALA 97 74.953 -7.297 5.871 521 HA ALA 97 HA ALA 97 72.715 -7.295 3.980 522 1HB ALA 97 HB1 ALA 97 73.882 -4.955 3.570 523 2HB ALA 97 HB2 ALA 97 74.787 -5.389 5.020 524 3HB ALA 97 HB3 ALA 97 73.029 -5.262 5.083 525 H ALA 98 HN ALA 98 75.963 -6.054 3.334 526 HA ALA 98 HA ALA 98 76.102 -6.358 0.605 527 1HB ALA 98 HB1 ALA 98 78.190 -5.671 1.110 528 2HB ALA 98 HB2 ALA 98 78.582 -7.270 1.743 529 3HB ALA 98 HB3 ALA 98 77.880 -6.050 2.806 530 H PHE 99 HN PHE 99 76.679 -8.955 2.994 531 HA PHE 99 HA PHE 99 77.400 -10.968 1.053 532 1HB PHE 99 HB2 PHE 99 76.903 -10.680 3.917 533 2HB PHE 99 HB1 PHE 99 76.334 -12.236 3.298 534 HD1 PHE 99 HD1 PHE 99 79.276 -9.944 2.797 535 HD2 PHE 99 HD2 PHE 99 77.877 -13.969 3.338 536 HE1 PHE 99 HE1 PHE 99 81.614 -10.766 2.722 537 HE2 PHE 99 HE2 PHE 99 80.216 -14.792 3.262 538 HZ PHE 99 HZ PHE 99 82.084 -13.189 2.956 539 H ALA 100 HN ALA 100 74.436 -10.746 3.034 540 HA ALA 100 HA ALA 100 72.893 -12.628 1.607 541 1HB ALA 100 HB1 ALA 100 72.412 -11.540 3.823 542 2HB ALA 100 HB2 ALA 100 71.020 -11.559 2.740 543 3HB ALA 100 HB3 ALA 100 71.951 -10.076 2.953 544 H LEU 101 HN LEU 101 73.435 -9.181 0.960 545 HA LEU 101 HA LEU 101 71.577 -9.251 -1.354 546 1HB LEU 101 HB2 LEU 101 73.138 -7.174 0.179 547 2HB LEU 101 HB1 LEU 101 72.411 -6.778 -1.384 548 HG LEU 101 HG LEU 101 70.663 -8.189 0.567 549 1HD1 LEU 101 HD11 LEU 101 72.028 -5.648 1.154 550 2HD1 LEU 101 HD12 LEU 101 71.162 -6.734 2.239 551 3HD1 LEU 101 HD13 LEU 101 70.272 -5.555 1.274 552 1HD2 LEU 101 HD21 LEU 101 69.882 -7.466 -1.664 553 2HD2 LEU 101 HD22 LEU 101 70.300 -5.799 -1.269 554 3HD2 LEU 101 HD23 LEU 101 69.012 -6.618 -0.385 555 HA PRO 102 HA PRO 102 74.618 -9.752 -4.493 556 1HB PRO 102 HB2 PRO 102 73.990 -7.342 -5.933 557 2HB PRO 102 HB1 PRO 102 73.454 -8.991 -6.289 558 1HG PRO 102 HG2 PRO 102 71.909 -6.799 -5.217 559 2HG PRO 102 HG1 PRO 102 71.356 -8.426 -5.641 560 1HD PRO 102 HD2 PRO 102 71.677 -7.314 -3.011 561 2HD PRO 102 HD1 PRO 102 71.211 -8.983 -3.432 562 H VAL 103 HN VAL 103 76.722 -8.847 -5.182 563 HA VAL 103 HA VAL 103 78.091 -7.281 -3.295 564 HB VAL 103 HB VAL 103 79.670 -7.102 -5.302 565 1HG1 VAL 103 HG11 VAL 103 78.686 -9.896 -4.796 566 2HG1 VAL 103 HG12 VAL 103 79.560 -8.980 -3.569 567 3HG1 VAL 103 HG13 VAL 103 80.342 -9.370 -5.102 568 1HG2 VAL 103 HG21 VAL 103 78.178 -9.132 -6.762 569 2HG2 VAL 103 HG22 VAL 103 79.016 -7.705 -7.371 570 3HG2 VAL 103 HG23 VAL 103 77.374 -7.563 -6.745 571 H SER 104 HN SER 104 79.368 -5.277 -4.848 572 HA SER 104 HA SER 104 79.076 -3.076 -5.693 573 1HB SER 104 HB2 SER 104 77.411 -2.949 -7.245 574 2HB SER 104 HB1 SER 104 77.045 -4.621 -6.801 575 HG SER 104 HG SER 104 75.881 -2.241 -5.825 576 H GLY 105 HN GLY 105 77.510 -1.108 -5.226 577 1HA GLY 105 HA2 GLY 105 76.161 -1.245 -2.615 578 2HA GLY 105 HA1 GLY 105 77.587 -0.208 -2.678 579 H MET 106 HN MET 106 77.100 1.893 -3.151 580 HA MET 106 HA MET 106 75.718 3.731 -3.791 581 1HB MET 106 HB2 MET 106 77.183 2.728 -5.721 582 2HB MET 106 HB1 MET 106 75.630 2.214 -6.385 583 1HG MET 106 HG2 MET 106 74.891 4.676 -5.991 584 2HG MET 106 HG1 MET 106 76.621 5.015 -5.853 585 1HE MET 106 HE1 MET 106 78.173 4.772 -9.053 586 2HE MET 106 HE2 MET 106 78.150 3.239 -8.185 587 3HE MET 106 HE3 MET 106 78.253 4.752 -7.287 588 H ASP 107 HN ASP 107 73.849 3.151 -6.233 589 HA ASP 107 HA ASP 107 71.677 1.697 -4.798 590 1HB ASP 107 HB2 ASP 107 71.804 4.279 -4.432 591 2HB ASP 107 HB1 ASP 107 71.190 4.377 -6.082 592 H LYS 108 HN LYS 108 72.804 0.439 -6.880 593 HA LYS 108 HA LYS 108 70.732 0.634 -8.969 594 1HB LYS 108 HB2 LYS 108 73.440 1.680 -9.193 595 2HB LYS 108 HB1 LYS 108 73.090 0.484 -10.446 596 1HG LYS 108 HG2 LYS 108 71.344 1.737 -11.345 597 2HG LYS 108 HG1 LYS 108 71.049 2.597 -9.833 598 1HD LYS 108 HD2 LYS 108 72.199 4.291 -10.828 599 2HD LYS 108 HD1 LYS 108 73.625 3.351 -10.394 600 1HE LYS 108 HE2 LYS 108 74.102 3.090 -12.593 601 2HE LYS 108 HE1 LYS 108 72.544 2.276 -12.831 602 1HZ LYS 108 HZ1 LYS 108 71.509 4.522 -12.836 603 2HZ LYS 108 HZ2 LYS 108 72.556 4.263 -14.149 604 3HZ LYS 108 HZ3 LYS 108 73.061 5.207 -12.830 605 HA PRO 109 HA PRO 109 73.186 -3.419 -9.810 606 1HB PRO 109 HB2 PRO 109 75.262 -3.700 -7.846 607 2HB PRO 109 HB1 PRO 109 75.440 -3.548 -9.599 608 1HG PRO 109 HG2 PRO 109 76.059 -1.593 -7.573 609 2HG PRO 109 HG1 PRO 109 76.283 -1.466 -9.319 610 1HD PRO 109 HD2 PRO 109 74.339 -0.103 -7.694 611 2HD PRO 109 HD1 PRO 109 74.541 -0.026 -9.463 612 H VAL 110 HN VAL 110 73.981 -2.864 -6.366 613 HA VAL 110 HA VAL 110 72.912 -5.174 -5.228 614 HB VAL 110 HB VAL 110 72.327 -3.444 -3.296 615 1HG1 VAL 110 HG11 VAL 110 75.214 -3.382 -3.860 616 2HG1 VAL 110 HG12 VAL 110 74.478 -4.985 -3.878 617 3HG1 VAL 110 HG13 VAL 110 74.341 -3.967 -2.443 618 1HG2 VAL 110 HG21 VAL 110 73.222 -1.311 -3.504 619 2HG2 VAL 110 HG22 VAL 110 72.516 -1.590 -5.096 620 3HG2 VAL 110 HG23 VAL 110 74.255 -1.769 -4.859 621 H PHE 111 HN PHE 111 70.995 -4.691 -3.476 622 HA PHE 111 HA PHE 111 68.553 -3.972 -5.058 623 1HB PHE 111 HB2 PHE 111 69.465 -6.310 -3.539 624 2HB PHE 111 HB1 PHE 111 67.836 -5.782 -3.090 625 HD1 PHE 111 HD1 PHE 111 66.025 -6.510 -4.388 626 HD2 PHE 111 HD2 PHE 111 69.950 -6.401 -6.132 627 HE1 PHE 111 HE1 PHE 111 65.134 -7.548 -6.458 628 HE2 PHE 111 HE2 PHE 111 69.059 -7.438 -8.201 629 HZ PHE 111 HZ PHE 111 66.652 -8.012 -8.364 630 H THR 112 HN THR 112 70.439 -3.524 -2.192 631 HA THR 112 HA THR 112 68.169 -2.300 -0.693 632 HB THR 112 HB THR 112 69.635 -3.946 0.417 633 HG1 THR 112 HG1 THR 112 68.822 -2.113 1.589 634 1HG2 THR 112 HG21 THR 112 71.698 -3.812 -0.694 635 2HG2 THR 112 HG22 THR 112 72.047 -3.067 0.867 636 3HG2 THR 112 HG23 THR 112 71.766 -2.056 -0.551 637 H ASP 113 HN ASP 113 69.724 -0.500 0.825 638 HA ASP 113 HA ASP 113 70.353 1.603 -1.213 639 1HB ASP 113 HB2 ASP 113 69.180 1.547 1.557 640 2HB ASP 113 HB1 ASP 113 69.962 3.017 0.981 641 HA PRO 114 HA PRO 114 74.547 1.424 -0.047 642 1HB PRO 114 HB2 PRO 114 74.956 4.251 -0.105 643 2HB PRO 114 HB1 PRO 114 75.335 3.062 -1.351 644 1HG PRO 114 HG2 PRO 114 73.184 4.996 -1.327 645 2HG PRO 114 HG1 PRO 114 73.675 3.915 -2.624 646 1HD PRO 114 HD2 PRO 114 71.323 3.710 -1.001 647 2HD PRO 114 HD1 PRO 114 71.894 2.534 -2.207 648 HA PRO 115 HA PRO 115 74.771 4.403 3.821 649 1HB PRO 115 HB2 PRO 115 72.075 5.312 4.273 650 2HB PRO 115 HB1 PRO 115 73.506 6.281 3.903 651 1HG PRO 115 HG2 PRO 115 71.260 5.630 2.181 652 2HG PRO 115 HG1 PRO 115 72.610 6.733 1.867 653 1HD PRO 115 HD2 PRO 115 72.174 4.188 0.656 654 2HD PRO 115 HD1 PRO 115 73.620 5.205 0.522 655 H VAL 116 HN VAL 116 74.729 1.926 4.286 656 HA VAL 116 HA VAL 116 72.198 0.911 5.421 657 HB VAL 116 HB VAL 116 73.345 -1.175 5.413 658 1HG1 VAL 116 HG11 VAL 116 74.928 -0.277 3.152 659 2HG1 VAL 116 HG12 VAL 116 73.325 0.456 3.134 660 3HG1 VAL 116 HG13 VAL 116 73.491 -1.300 3.168 661 1HG2 VAL 116 HG21 VAL 116 75.864 0.496 5.355 662 2HG2 VAL 116 HG22 VAL 116 75.858 -1.244 5.065 663 3HG2 VAL 116 HG23 VAL 116 75.334 -0.608 6.627 664 H LYS 117 HN LYS 117 71.956 0.413 7.651 665 HA LYS 117 HA LYS 117 73.712 1.976 9.454 666 1HB LYS 117 HB2 LYS 117 71.225 2.148 9.469 667 2HB LYS 117 HB1 LYS 117 71.143 0.441 9.932 668 1HG LYS 117 HG2 LYS 117 72.977 1.639 11.717 669 2HG LYS 117 HG1 LYS 117 71.613 2.761 11.603 670 1HD LYS 117 HD2 LYS 117 70.885 -0.105 11.816 671 2HD LYS 117 HD1 LYS 117 71.650 0.591 13.252 672 1HE LYS 117 HE2 LYS 117 69.792 1.807 13.749 673 2HE LYS 117 HE1 LYS 117 69.622 2.365 12.075 674 1HZ LYS 117 HZ1 LYS 117 69.152 -0.468 12.525 675 2HZ LYS 117 HZ2 LYS 117 68.308 0.627 11.537 676 3HZ LYS 117 HZ3 LYS 117 67.993 0.568 13.205 677 H THR 118 HN THR 118 74.875 1.028 11.163 678 HA THR 118 HA THR 118 74.667 -1.851 11.714 679 HB THR 118 HB THR 118 75.986 -1.845 9.671 680 HG1 THR 118 HG1 THR 118 77.510 -2.163 12.034 681 1HG2 THR 118 HG21 THR 118 78.337 -0.458 10.478 682 2HG2 THR 118 HG22 THR 118 76.964 0.612 10.762 683 3HG2 THR 118 HG23 THR 118 77.243 -0.058 9.155 684 H LYS 119 HN LYS 119 74.200 -0.190 13.669 685 HA LYS 119 HA LYS 119 74.911 0.454 15.833 686 1HB LYS 119 HB2 LYS 119 76.192 -1.853 15.142 687 2HB LYS 119 HB1 LYS 119 77.571 -0.794 15.443 688 1HG LYS 119 HG2 LYS 119 76.137 -0.146 17.598 689 2HG LYS 119 HG1 LYS 119 75.467 -1.760 17.336 690 1HD LYS 119 HD2 LYS 119 78.446 -1.250 17.378 691 2HD LYS 119 HD1 LYS 119 77.540 -1.605 18.848 692 1HE LYS 119 HE2 LYS 119 76.928 -3.775 18.071 693 2HE LYS 119 HE1 LYS 119 77.387 -3.389 16.402 694 1HZ LYS 119 HZ1 LYS 119 79.096 -3.932 18.730 695 2HZ LYS 119 HZ2 LYS 119 79.658 -2.836 17.561 696 3HZ LYS 119 HZ3 LYS 119 79.283 -4.434 17.121 697 H PHE 120 HN PHE 120 76.038 1.731 13.093 698 HA PHE 120 HA PHE 120 77.953 3.557 14.508 699 1HB PHE 120 HB2 PHE 120 78.109 1.989 11.982 700 2HB PHE 120 HB1 PHE 120 78.773 3.627 11.925 701 HD1 PHE 120 HD1 PHE 120 80.184 4.247 14.160 702 HD2 PHE 120 HD2 PHE 120 79.577 0.297 12.585 703 HE1 PHE 120 HE1 PHE 120 82.215 3.461 15.349 704 HE2 PHE 120 HE2 PHE 120 81.606 -0.489 13.773 705 HZ PHE 120 HZ PHE 120 82.924 1.092 15.156 706 H GLY 121 HN GLY 121 76.704 3.629 11.198 707 1HA GLY 121 HA2 GLY 121 74.743 5.721 11.752 708 2HA GLY 121 HA1 GLY 121 76.200 6.324 10.951 709 H TYR 122 HN TYR 122 75.862 6.479 8.798 710 HA TYR 122 HA TYR 122 74.234 4.358 7.438 711 1HB TYR 122 HB2 TYR 122 74.410 7.323 7.265 712 2HB TYR 122 HB1 TYR 122 74.263 6.481 5.725 713 HD1 TYR 122 HD1 TYR 122 72.006 7.347 5.300 714 HD2 TYR 122 HD2 TYR 122 72.882 5.049 8.817 715 HE1 TYR 122 HE1 TYR 122 69.581 7.034 5.697 716 HE2 TYR 122 HE2 TYR 122 70.457 4.734 9.216 717 HH TYR 122 HH TYR 122 68.062 6.494 7.440 718 H HIS 123 HN HIS 123 75.841 2.980 6.660 719 HA HIS 123 HA HIS 123 78.235 4.215 5.392 720 1HB HIS 123 HB2 HIS 123 77.774 1.308 6.080 721 2HB HIS 123 HB1 HIS 123 79.312 2.140 5.876 722 HD1 HIS 123 HD1 HIS 123 80.411 2.359 8.092 723 HD2 HIS 123 HD2 HIS 123 76.290 2.908 8.401 724 HE1 HIS 123 HE1 HIS 123 79.940 2.911 10.515 725 H ILE 124 HN ILE 124 78.462 4.130 3.207 726 HA ILE 124 HA ILE 124 76.463 2.640 1.607 727 HB ILE 124 HB ILE 124 78.755 4.493 0.860 728 1HG1 ILE 124 HG12 ILE 124 75.801 4.960 1.357 729 2HG1 ILE 124 HG11 ILE 124 77.170 5.773 2.119 730 1HG2 ILE 124 HG21 ILE 124 77.144 2.761 -0.724 731 2HG2 ILE 124 HG22 ILE 124 78.322 3.953 -1.273 732 3HG2 ILE 124 HG23 ILE 124 76.635 4.415 -1.062 733 1HD1 ILE 124 HD11 ILE 124 77.597 6.250 -0.577 734 2HD1 ILE 124 HD12 ILE 124 76.874 7.391 0.558 735 3HD1 ILE 124 HD13 ILE 124 75.843 6.359 -0.431 736 H ILE 125 HN ILE 125 77.049 0.466 1.695 737 HA ILE 125 HA ILE 125 79.873 -0.327 1.473 738 HB ILE 125 HB ILE 125 77.205 -1.603 2.007 739 1HG1 ILE 125 HG12 ILE 125 79.836 -1.788 3.498 740 2HG1 ILE 125 HG11 ILE 125 78.653 -0.503 3.784 741 1HG2 ILE 125 HG21 ILE 125 78.853 -3.721 2.280 742 2HG2 ILE 125 HG22 ILE 125 79.636 -2.918 0.918 743 3HG2 ILE 125 HG23 ILE 125 77.944 -3.403 0.803 744 1HD1 ILE 125 HD11 ILE 125 78.611 -3.292 4.665 745 2HD1 ILE 125 HD12 ILE 125 77.127 -2.835 3.829 746 3HD1 ILE 125 HD13 ILE 125 77.660 -1.921 5.240 747 H MET 126 HN MET 126 80.742 -0.411 -0.529 748 HA MET 126 HA MET 126 79.048 -1.352 -2.815 749 1HB MET 126 HB2 MET 126 81.401 0.515 -2.489 750 2HB MET 126 HB1 MET 126 81.060 -0.213 -4.065 751 1HG MET 126 HG2 MET 126 78.693 0.670 -3.846 752 2HG MET 126 HG1 MET 126 79.230 1.562 -2.415 753 1HE MET 126 HE1 MET 126 80.825 4.547 -3.444 754 2HE MET 126 HE2 MET 126 80.155 3.439 -2.245 755 3HE MET 126 HE3 MET 126 79.075 4.283 -3.350 756 H VAL 127 HN VAL 127 79.409 -3.587 -2.812 757 HA VAL 127 HA VAL 127 82.099 -4.672 -2.244 758 HB VAL 127 HB VAL 127 79.517 -6.037 -3.067 759 1HG1 VAL 127 HG11 VAL 127 80.628 -7.866 -1.602 760 2HG1 VAL 127 HG12 VAL 127 82.113 -6.943 -1.828 761 3HG1 VAL 127 HG13 VAL 127 81.269 -7.612 -3.224 762 1HG2 VAL 127 HG21 VAL 127 79.992 -4.484 -0.774 763 2HG2 VAL 127 HG22 VAL 127 80.186 -6.155 -0.242 764 3HG2 VAL 127 HG23 VAL 127 78.683 -5.642 -1.008 765 H GLU 128 HN GLU 128 83.332 -5.875 -3.826 766 HA GLU 128 HA GLU 128 82.305 -5.872 -6.605 767 1HB GLU 128 HB2 GLU 128 83.760 -3.765 -5.646 768 2HB GLU 128 HB1 GLU 128 85.036 -4.792 -6.314 769 1HG GLU 128 HG2 GLU 128 84.371 -3.468 -8.152 770 2HG GLU 128 HG1 GLU 128 83.500 -4.988 -8.395 771 H GLY 129 HN GLY 129 82.464 -8.150 -6.393 772 1HA GLY 129 HA2 GLY 129 83.626 -10.039 -7.278 773 2HA GLY 129 HA1 GLY 129 85.143 -9.178 -7.002 774 H ARG 130 HN ARG 130 83.180 -11.646 -5.902 775 HA ARG 130 HA ARG 130 84.813 -11.813 -3.421 776 1HB ARG 130 HB2 ARG 130 82.592 -12.690 -2.371 777 2HB ARG 130 HB1 ARG 130 82.785 -10.955 -2.587 778 1HG ARG 130 HG2 ARG 130 81.174 -10.852 -4.203 779 2HG ARG 130 HG1 ARG 130 81.652 -12.394 -4.914 780 1HD ARG 130 HD2 ARG 130 80.631 -13.471 -2.787 781 2HD ARG 130 HD1 ARG 130 79.844 -11.900 -2.540 782 HE ARG 130 HE ARG 130 79.594 -12.929 -5.274 783 1HH1 ARG 130 HH11 ARG 130 77.964 -11.680 -2.653 784 2HH1 ARG 130 HH12 ARG 130 76.509 -12.591 -2.882 785 1HH2 ARG 130 HH21 ARG 130 77.859 -14.633 -5.337 786 2HH2 ARG 130 HH22 ARG 130 76.450 -14.264 -4.401 787 H LYS 131 HN LYS 131 84.206 -14.163 -2.416 788 HA LYS 131 HA LYS 131 83.686 -16.196 -4.487 789 1HB LYS 131 HB2 LYS 131 86.002 -17.202 -3.967 790 2HB LYS 131 HB1 LYS 131 85.976 -15.754 -4.973 791 1HG LYS 131 HG2 LYS 131 86.032 -15.053 -2.157 792 2HG LYS 131 HG1 LYS 131 87.388 -16.104 -2.568 793 1HD LYS 131 HD2 LYS 131 86.629 -13.499 -3.923 794 2HD LYS 131 HD1 LYS 131 88.070 -13.807 -2.952 795 1HE LYS 131 HE2 LYS 131 88.149 -15.820 -4.884 796 2HE LYS 131 HE1 LYS 131 87.595 -14.387 -5.782 797 1HZ LYS 131 HZ1 LYS 131 89.411 -13.255 -4.260 798 2HZ LYS 131 HZ2 LYS 131 89.829 -13.972 -5.743 799 3HZ LYS 131 HZ3 LYS 131 90.086 -14.811 -4.288 Start of MODEL 16 1 1H GLY 28 HT1 GLY 28 93.403 -22.594 -13.456 2 2H GLY 28 HT2 GLY 28 92.388 -23.949 -13.310 3 3H GLY 28 HT3 GLY 28 92.192 -22.621 -12.268 4 1HA GLY 28 HA2 GLY 28 91.848 -21.333 -14.507 5 2HA GLY 28 HA1 GLY 28 91.379 -22.940 -15.063 6 H SER 29 HN SER 29 89.293 -23.532 -14.672 7 HA SER 29 HA SER 29 87.574 -21.747 -13.079 8 1HB SER 29 HB2 SER 29 87.048 -24.289 -14.658 9 2HB SER 29 HB1 SER 29 85.805 -23.210 -14.022 10 HG SER 29 HG SER 29 86.316 -22.774 -16.215 11 H GLY 30 HN GLY 30 85.773 -23.254 -11.833 12 1HA GLY 30 HA2 GLY 30 86.345 -25.625 -10.544 13 2HA GLY 30 HA1 GLY 30 87.250 -24.433 -9.612 14 HA PRO 31 HA PRO 31 82.622 -24.720 -8.436 15 1HB PRO 31 HB2 PRO 31 83.457 -25.617 -5.830 16 2HB PRO 31 HB1 PRO 31 82.495 -26.496 -7.034 17 1HG PRO 31 HG2 PRO 31 85.219 -26.980 -6.254 18 2HG PRO 31 HG1 PRO 31 84.262 -27.850 -7.455 19 1HD PRO 31 HD2 PRO 31 86.458 -26.028 -7.914 20 2HD PRO 31 HD1 PRO 31 85.502 -26.914 -9.126 21 H LYS 32 HN LYS 32 81.875 -22.777 -7.637 22 HA LYS 32 HA LYS 32 83.703 -20.823 -6.508 23 1HB LYS 32 HB2 LYS 32 81.654 -19.448 -6.464 24 2HB LYS 32 HB1 LYS 32 81.776 -20.320 -7.993 25 1HG LYS 32 HG2 LYS 32 80.419 -22.138 -6.476 26 2HG LYS 32 HG1 LYS 32 79.818 -20.627 -5.794 27 1HD LYS 32 HD2 LYS 32 79.829 -21.351 -8.742 28 2HD LYS 32 HD1 LYS 32 78.413 -21.366 -7.690 29 1HE LYS 32 HE2 LYS 32 78.575 -18.963 -7.341 30 2HE LYS 32 HE1 LYS 32 80.112 -18.901 -8.224 31 1HZ LYS 32 HZ1 LYS 32 78.728 -18.505 -9.963 32 2HZ LYS 32 HZ2 LYS 32 77.396 -19.266 -9.233 33 3HZ LYS 32 HZ3 LYS 32 78.607 -20.197 -9.979 34 H GLY 33 HN GLY 33 82.619 -19.590 -4.442 35 1HA GLY 33 HA2 GLY 33 82.163 -21.706 -2.374 36 2HA GLY 33 HA1 GLY 33 83.126 -20.262 -2.064 37 H GLY 34 HN GLY 34 81.402 -20.179 -0.252 38 1HA GLY 34 HA1 GLY 34 78.798 -19.117 -1.183 39 2HA GLY 34 HA2 GLY 34 79.205 -19.526 0.484 40 H GLY 35 HN GLY 35 81.688 -17.787 -1.037 41 1HA GLY 35 HA2 GLY 35 81.867 -15.340 -1.255 42 2HA GLY 35 HA1 GLY 35 80.617 -15.192 -0.012 43 H ASN 36 HN ASN 36 84.014 -15.643 -0.607 44 HA ASN 36 HA ASN 36 84.517 -15.751 2.349 45 1HB ASN 36 HB2 ASN 36 86.744 -16.672 1.576 46 2HB ASN 36 HB1 ASN 36 85.360 -17.676 1.144 47 1HD2 ASN 36 HD21 ASN 36 85.378 -18.333 -1.007 48 2HD2 ASN 36 HD22 ASN 36 86.112 -17.487 -2.283 49 H ALA 37 HN ALA 37 85.092 -13.993 -0.622 50 HA ALA 37 HA ALA 37 86.341 -11.795 0.942 51 1HB ALA 37 HB1 ALA 37 87.645 -12.490 -1.634 52 2HB ALA 37 HB2 ALA 37 87.892 -13.636 -0.317 53 3HB ALA 37 HB3 ALA 37 88.371 -11.950 -0.121 54 H VAL 38 HN VAL 38 85.889 -9.764 0.038 55 HA VAL 38 HA VAL 38 84.674 -9.566 -2.677 56 HB VAL 38 HB VAL 38 82.587 -8.792 -1.869 57 1HG1 VAL 38 HG11 VAL 38 83.361 -10.684 0.363 58 2HG1 VAL 38 HG12 VAL 38 83.077 -11.239 -1.284 59 3HG1 VAL 38 HG13 VAL 38 81.775 -10.474 -0.376 60 1HG2 VAL 38 HG21 VAL 38 84.075 -8.247 0.706 61 2HG2 VAL 38 HG22 VAL 38 82.313 -8.234 0.624 62 3HG2 VAL 38 HG23 VAL 38 83.249 -7.091 -0.341 63 H LYS 39 HN LYS 39 84.907 -7.247 -3.523 64 HA LYS 39 HA LYS 39 86.857 -5.783 -1.852 65 1HB LYS 39 HB2 LYS 39 86.274 -6.197 -4.606 66 2HB LYS 39 HB1 LYS 39 86.099 -4.467 -4.286 67 1HG LYS 39 HG2 LYS 39 88.524 -6.204 -3.752 68 2HG LYS 39 HG1 LYS 39 88.409 -4.813 -4.841 69 1HD LYS 39 HD2 LYS 39 87.722 -3.507 -2.678 70 2HD LYS 39 HD1 LYS 39 88.474 -4.864 -1.828 71 1HE LYS 39 HE2 LYS 39 90.038 -2.905 -2.315 72 2HE LYS 39 HE1 LYS 39 90.597 -4.469 -2.935 73 1HZ LYS 39 HZ1 LYS 39 90.396 -2.343 -4.485 74 2HZ LYS 39 HZ2 LYS 39 88.799 -2.906 -4.629 75 3HZ LYS 39 HZ3 LYS 39 90.099 -3.909 -5.068 76 H VAL 40 HN VAL 40 85.443 -5.054 -0.150 77 HA VAL 40 HA VAL 40 83.070 -3.453 -0.895 78 HB VAL 40 HB VAL 40 83.121 -5.255 0.871 79 1HG1 VAL 40 HG11 VAL 40 85.422 -3.939 1.676 80 2HG1 VAL 40 HG12 VAL 40 84.547 -5.137 2.629 81 3HG1 VAL 40 HG13 VAL 40 84.234 -3.418 2.870 82 1HG2 VAL 40 HG21 VAL 40 82.275 -2.417 1.411 83 2HG2 VAL 40 HG22 VAL 40 82.019 -3.661 2.635 84 3HG2 VAL 40 HG23 VAL 40 81.272 -3.821 1.045 85 H ARG 41 HN ARG 41 82.760 -1.322 -0.252 86 HA ARG 41 HA ARG 41 85.122 0.198 0.793 87 1HB ARG 41 HB2 ARG 41 83.336 1.607 -1.092 88 2HB ARG 41 HB1 ARG 41 85.095 1.570 -1.044 89 1HG ARG 41 HG2 ARG 41 83.344 -0.652 -2.136 90 2HG ARG 41 HG1 ARG 41 84.188 0.540 -3.122 91 1HD ARG 41 HD2 ARG 41 85.955 -0.790 -1.187 92 2HD ARG 41 HD1 ARG 41 85.227 -1.912 -2.355 93 HE ARG 41 HE ARG 41 86.734 0.563 -3.134 94 1HH1 ARG 41 HH21 ARG 41 84.817 -1.945 -4.306 95 2HH1 ARG 41 HH22 ARG 41 85.906 -2.419 -5.566 96 1HH2 ARG 41 HH11 ARG 41 88.462 -0.331 -4.507 97 2HH2 ARG 41 HH12 ARG 41 87.969 -1.506 -5.680 98 H HIS 42 HN HIS 42 84.430 2.029 2.190 99 HA HIS 42 HA HIS 42 81.486 1.989 2.755 100 1HB HIS 42 HB2 HIS 42 81.879 1.490 4.965 101 2HB HIS 42 HB1 HIS 42 83.286 0.706 4.242 102 HD1 HIS 42 HD1 HIS 42 82.347 3.244 6.693 103 HD2 HIS 42 HD2 HIS 42 85.698 2.462 4.340 104 HE1 HIS 42 HE1 HIS 42 84.253 4.574 7.698 105 H ILE 43 HN ILE 43 80.547 3.919 2.811 106 HA ILE 43 HA ILE 43 82.145 6.397 3.412 107 HB ILE 43 HB ILE 43 79.875 5.853 1.456 108 1HG1 ILE 43 HG12 ILE 43 82.693 6.916 1.055 109 2HG1 ILE 43 HG11 ILE 43 82.150 5.277 0.664 110 1HG2 ILE 43 HG21 ILE 43 79.730 8.185 1.011 111 2HG2 ILE 43 HG22 ILE 43 81.188 8.531 1.941 112 3HG2 ILE 43 HG23 ILE 43 79.708 8.049 2.770 113 1HD1 ILE 43 HD11 ILE 43 80.273 6.710 -0.665 114 2HD1 ILE 43 HD12 ILE 43 81.793 6.211 -1.405 115 3HD1 ILE 43 HD13 ILE 43 81.623 7.843 -0.759 116 H LEU 44 HN LEU 44 81.249 7.496 5.275 117 HA LEU 44 HA LEU 44 78.422 6.706 5.962 118 1HB LEU 44 HB2 LEU 44 79.471 5.593 7.647 119 2HB LEU 44 HB1 LEU 44 81.000 6.418 7.341 120 HG LEU 44 HG LEU 44 80.240 8.358 8.610 121 1HD1 LEU 44 HD11 LEU 44 77.919 7.268 9.892 122 2HD1 LEU 44 HD12 LEU 44 77.674 7.238 8.147 123 3HD1 LEU 44 HD13 LEU 44 78.056 8.756 8.957 124 1HD2 LEU 44 HD21 LEU 44 81.240 7.142 10.238 125 2HD2 LEU 44 HD22 LEU 44 80.416 5.659 9.748 126 3HD2 LEU 44 HD23 LEU 44 79.595 6.819 10.795 127 H CYS 45 HN CYS 45 77.175 8.539 5.816 128 HA CYS 45 HA CYS 45 78.369 11.212 6.162 129 1HB CYS 45 HB2 CYS 45 75.477 10.386 5.765 130 2HB CYS 45 HB1 CYS 45 76.203 11.956 5.390 131 HG CYS 45 HG CYS 45 77.202 9.417 3.872 132 H GLU 46 HN GLU 46 78.445 12.206 8.144 133 HA GLU 46 HA GLU 46 77.378 11.031 10.535 134 1HB GLU 46 HB2 GLU 46 79.325 12.541 10.427 135 2HB GLU 46 HB1 GLU 46 78.281 13.858 9.889 136 1HG GLU 46 HG2 GLU 46 77.569 14.283 11.995 137 2HG GLU 46 HG1 GLU 46 77.304 12.573 12.331 138 H LYS 47 HN LYS 47 76.230 13.671 8.439 139 HA LYS 47 HA LYS 47 73.721 13.832 10.060 140 1HB LYS 47 HB2 LYS 47 74.753 15.680 7.893 141 2HB LYS 47 HB1 LYS 47 73.527 16.036 9.110 142 1HG LYS 47 HG2 LYS 47 75.157 15.968 10.879 143 2HG LYS 47 HG1 LYS 47 76.392 15.328 9.796 144 1HD LYS 47 HD2 LYS 47 75.356 17.740 8.654 145 2HD LYS 47 HD1 LYS 47 75.780 18.062 10.336 146 1HE LYS 47 HE2 LYS 47 78.027 17.729 9.961 147 2HE LYS 47 HE1 LYS 47 77.738 16.450 8.765 148 1HZ LYS 47 HZ1 LYS 47 77.199 19.350 8.361 149 2HZ LYS 47 HZ2 LYS 47 76.940 18.122 7.215 150 3HZ LYS 47 HZ3 LYS 47 78.519 18.507 7.712 151 H HIS 48 HN HIS 48 74.886 12.289 7.345 152 HA HIS 48 HA HIS 48 73.790 11.217 5.546 153 1HB HIS 48 HB2 HIS 48 71.276 12.079 6.997 154 2HB HIS 48 HB1 HIS 48 71.502 10.648 5.988 155 HD1 HIS 48 HD1 HIS 48 74.506 10.462 7.558 156 HD2 HIS 48 HD2 HIS 48 70.653 10.055 9.093 157 HE1 HIS 48 HE1 HIS 48 74.737 9.162 9.719 158 H GLY 49 HN GLY 49 73.976 14.384 5.918 159 1HA GLY 49 HA2 GLY 49 71.892 15.349 4.119 160 2HA GLY 49 HA1 GLY 49 73.265 16.291 4.719 161 H LYS 50 HN LYS 50 74.839 13.722 3.679 162 HA LYS 50 HA LYS 50 74.943 14.611 0.815 163 1HB LYS 50 HB2 LYS 50 77.436 14.054 1.091 164 2HB LYS 50 HB1 LYS 50 76.862 15.505 1.911 165 1HG LYS 50 HG2 LYS 50 76.857 12.865 3.354 166 2HG LYS 50 HG1 LYS 50 78.344 13.805 3.229 167 1HD LYS 50 HD2 LYS 50 76.323 15.643 3.946 168 2HD LYS 50 HD1 LYS 50 76.089 14.231 4.976 169 1HE LYS 50 HE2 LYS 50 77.811 14.981 6.252 170 2HE LYS 50 HE1 LYS 50 78.890 14.667 4.874 171 1HZ LYS 50 HZ1 LYS 50 77.521 17.162 5.642 172 2HZ LYS 50 HZ2 LYS 50 77.850 16.874 4.000 173 3HZ LYS 50 HZ3 LYS 50 79.120 16.935 5.127 174 H ILE 51 HN ILE 51 74.385 12.055 2.934 175 HA ILE 51 HA ILE 51 75.565 9.822 1.677 176 HB ILE 51 HB ILE 51 74.289 9.710 3.759 177 1HG1 ILE 51 HG12 ILE 51 72.590 7.877 3.045 178 2HG1 ILE 51 HG11 ILE 51 73.223 8.142 1.414 179 1HG2 ILE 51 HG21 ILE 51 71.638 9.905 2.484 180 2HG2 ILE 51 HG22 ILE 51 72.540 11.420 2.509 181 3HG2 ILE 51 HG23 ILE 51 72.203 10.569 4.017 182 1HD1 ILE 51 HD11 ILE 51 75.469 7.600 2.131 183 2HD1 ILE 51 HD12 ILE 51 74.404 6.312 2.694 184 3HD1 ILE 51 HD13 ILE 51 74.970 7.544 3.821 185 H MET 52 HN MET 52 72.830 11.835 0.716 186 HA MET 52 HA MET 52 72.212 10.071 -1.554 187 1HB MET 52 HB2 MET 52 70.983 12.766 -1.418 188 2HB MET 52 HB1 MET 52 70.222 11.204 -1.635 189 1HG MET 52 HG2 MET 52 69.501 11.323 0.481 190 2HG MET 52 HG1 MET 52 71.162 11.177 1.023 191 1HE MET 52 HE1 MET 52 72.817 13.628 1.128 192 2HE MET 52 HE2 MET 52 72.088 15.097 0.489 193 3HE MET 52 HE3 MET 52 72.222 13.676 -0.534 194 H GLU 53 HN GLU 53 73.864 13.082 -0.867 195 HA GLU 53 HA GLU 53 74.238 13.900 -3.618 196 1HB GLU 53 HB2 GLU 53 74.891 14.797 -1.002 197 2HB GLU 53 HB1 GLU 53 76.431 14.570 -1.829 198 1HG GLU 53 HG2 GLU 53 75.800 16.050 -3.601 199 2HG GLU 53 HG1 GLU 53 74.113 16.052 -3.083 200 H ALA 54 HN ALA 54 75.603 11.662 -1.338 201 HA ALA 54 HA ALA 54 77.969 10.948 -2.908 202 1HB ALA 54 HB1 ALA 54 77.024 8.848 -1.186 203 2HB ALA 54 HB2 ALA 54 76.763 10.388 -0.367 204 3HB ALA 54 HB3 ALA 54 78.380 9.942 -0.911 205 H MET 55 HN MET 55 74.611 9.951 -2.589 206 HA MET 55 HA MET 55 74.780 7.601 -4.300 207 1HB MET 55 HB2 MET 55 72.557 9.434 -3.337 208 2HB MET 55 HB1 MET 55 72.251 7.980 -4.298 209 1HG MET 55 HG2 MET 55 74.013 7.210 -2.217 210 2HG MET 55 HG1 MET 55 72.752 8.203 -1.469 211 1HE MET 55 HE1 MET 55 72.207 6.509 -0.111 212 2HE MET 55 HE2 MET 55 71.134 5.150 -0.434 213 3HE MET 55 HE3 MET 55 70.518 6.797 -0.547 214 H GLU 56 HN GLU 56 74.042 11.037 -4.749 215 HA GLU 56 HA GLU 56 73.316 10.786 -7.563 216 1HB GLU 56 HB2 GLU 56 73.924 13.020 -5.624 217 2HB GLU 56 HB1 GLU 56 73.608 13.351 -7.328 218 1HG GLU 56 HG2 GLU 56 71.404 12.529 -7.201 219 2HG GLU 56 HG1 GLU 56 71.725 11.638 -5.714 220 H LYS 57 HN LYS 57 75.984 12.654 -6.071 221 HA LYS 57 HA LYS 57 77.613 13.107 -8.236 222 1HB LYS 57 HB2 LYS 57 78.118 12.369 -5.368 223 2HB LYS 57 HB1 LYS 57 79.491 12.612 -6.447 224 1HG LYS 57 HG2 LYS 57 77.968 14.792 -7.060 225 2HG LYS 57 HG1 LYS 57 77.580 14.586 -5.352 226 1HD LYS 57 HD2 LYS 57 79.786 14.914 -4.673 227 2HD LYS 57 HD1 LYS 57 80.443 14.418 -6.233 228 1HE LYS 57 HE2 LYS 57 80.658 16.645 -6.669 229 2HE LYS 57 HE1 LYS 57 78.891 16.658 -6.854 230 1HZ LYS 57 HZ1 LYS 57 80.214 16.824 -4.204 231 2HZ LYS 57 HZ2 LYS 57 78.601 17.189 -4.594 232 3HZ LYS 57 HZ3 LYS 57 79.857 18.211 -5.109 233 H LEU 58 HN LEU 58 77.692 10.128 -6.264 234 HA LEU 58 HA LEU 58 79.643 8.731 -7.813 235 1HB LEU 58 HB2 LEU 58 77.361 7.819 -6.037 236 2HB LEU 58 HB1 LEU 58 78.682 6.776 -6.574 237 HG LEU 58 HG LEU 58 79.028 9.344 -4.993 238 1HD1 LEU 58 HD11 LEU 58 78.114 6.892 -4.069 239 2HD1 LEU 58 HD12 LEU 58 78.893 8.131 -3.084 240 3HD1 LEU 58 HD13 LEU 58 79.850 6.815 -3.763 241 1HD2 LEU 58 HD21 LEU 58 81.112 9.172 -5.878 242 2HD2 LEU 58 HD22 LEU 58 80.854 7.505 -6.396 243 3HD2 LEU 58 HD23 LEU 58 81.315 7.850 -4.728 244 H LYS 59 HN LYS 59 76.063 8.689 -8.005 245 HA LYS 59 HA LYS 59 76.103 6.720 -10.182 246 1HB LYS 59 HB2 LYS 59 73.776 6.691 -9.828 247 2HB LYS 59 HB1 LYS 59 74.418 7.077 -8.234 248 1HG LYS 59 HG2 LYS 59 74.019 9.456 -8.619 249 2HG LYS 59 HG1 LYS 59 73.462 9.119 -10.256 250 1HD LYS 59 HD2 LYS 59 71.743 7.540 -9.087 251 2HD LYS 59 HD1 LYS 59 72.127 8.468 -7.637 252 1HE LYS 59 HE2 LYS 59 70.613 10.004 -8.354 253 2HE LYS 59 HE1 LYS 59 71.745 10.394 -9.663 254 1HZ LYS 59 HZ1 LYS 59 70.723 8.120 -10.570 255 2HZ LYS 59 HZ2 LYS 59 70.043 9.634 -10.934 256 3HZ LYS 59 HZ3 LYS 59 69.383 8.680 -9.693 257 H SER 60 HN SER 60 75.775 10.208 -9.869 258 HA SER 60 HA SER 60 74.763 10.681 -12.551 259 1HB SER 60 HB2 SER 60 76.319 12.538 -10.725 260 2HB SER 60 HB1 SER 60 75.159 12.996 -11.970 261 HG SER 60 HG SER 60 74.563 11.448 -9.679 262 H GLY 61 HN GLY 61 77.948 11.293 -11.057 263 1HA GLY 61 HA2 GLY 61 79.692 10.089 -12.701 264 2HA GLY 61 HA1 GLY 61 79.175 11.427 -13.735 265 H MET 62 HN MET 62 79.553 11.579 -10.197 266 HA MET 62 HA MET 62 81.588 13.721 -10.624 267 1HB MET 62 HB2 MET 62 79.334 13.220 -8.867 268 2HB MET 62 HB1 MET 62 80.786 13.558 -7.928 269 1HG MET 62 HG2 MET 62 79.752 15.678 -8.377 270 2HG MET 62 HG1 MET 62 81.151 15.569 -9.442 271 1HE MET 62 HE1 MET 62 77.185 14.329 -9.642 272 2HE MET 62 HE2 MET 62 76.788 15.915 -10.298 273 3HE MET 62 HE3 MET 62 77.669 15.794 -8.775 274 H ARG 63 HN ARG 63 83.256 13.748 -8.734 275 HA ARG 63 HA ARG 63 85.072 11.683 -8.792 276 1HB ARG 63 HB2 ARG 63 84.163 13.221 -6.349 277 2HB ARG 63 HB1 ARG 63 85.750 12.473 -6.568 278 1HG ARG 63 HG2 ARG 63 86.495 14.257 -7.663 279 2HG ARG 63 HG1 ARG 63 85.140 14.203 -8.795 280 1HD ARG 63 HD2 ARG 63 83.946 15.793 -7.633 281 2HD ARG 63 HD1 ARG 63 84.472 15.168 -6.053 282 HE ARG 63 HE ARG 63 86.757 16.246 -7.375 283 1HH1 ARG 63 HH21 ARG 63 84.893 16.907 -4.792 284 2HH1 ARG 63 HH22 ARG 63 84.929 18.634 -4.922 285 1HH2 ARG 63 HH11 ARG 63 86.311 18.632 -8.102 286 2HH2 ARG 63 HH12 ARG 63 85.733 19.610 -6.795 287 H PHE 64 HN PHE 64 85.328 9.683 -7.694 288 HA PHE 64 HA PHE 64 82.889 8.599 -6.397 289 1HB PHE 64 HB2 PHE 64 85.308 7.620 -7.784 290 2HB PHE 64 HB1 PHE 64 84.874 6.665 -6.366 291 HD1 PHE 64 HD1 PHE 64 83.919 7.653 -9.754 292 HD2 PHE 64 HD2 PHE 64 82.649 5.573 -6.217 293 HE1 PHE 64 HE1 PHE 64 82.114 6.552 -11.049 294 HE2 PHE 64 HE2 PHE 64 80.845 4.473 -7.512 295 HZ PHE 64 HZ PHE 64 80.576 4.961 -9.929 296 H ASN 65 HN ASN 65 86.279 9.400 -5.777 297 HA ASN 65 HA ASN 65 86.068 8.584 -2.948 298 1HB ASN 65 HB2 ASN 65 88.452 9.000 -2.954 299 2HB ASN 65 HB1 ASN 65 88.022 8.102 -4.408 300 1HD2 ASN 65 HD21 ASN 65 88.714 9.010 -6.364 301 2HD2 ASN 65 HD22 ASN 65 89.218 10.619 -6.561 302 H GLU 66 HN GLU 66 86.439 11.680 -4.776 303 HA GLU 66 HA GLU 66 86.940 13.390 -2.588 304 1HB GLU 66 HB2 GLU 66 85.042 13.825 -4.917 305 2HB GLU 66 HB1 GLU 66 85.758 15.098 -3.940 306 1HG GLU 66 HG2 GLU 66 87.249 13.131 -5.704 307 2HG GLU 66 HG1 GLU 66 87.051 14.859 -5.993 308 H VAL 67 HN VAL 67 83.769 12.377 -3.875 309 HA VAL 67 HA VAL 67 82.112 13.371 -1.833 310 HB VAL 67 HB VAL 67 80.888 11.056 -2.357 311 1HG1 VAL 67 HG11 VAL 67 79.640 12.422 -3.600 312 2HG1 VAL 67 HG12 VAL 67 80.855 12.393 -4.881 313 3HG1 VAL 67 HG13 VAL 67 80.952 13.600 -3.594 314 1HG2 VAL 67 HG21 VAL 67 82.143 10.989 -4.922 315 2HG2 VAL 67 HG22 VAL 67 81.859 9.675 -3.791 316 3HG2 VAL 67 HG23 VAL 67 83.318 10.659 -3.657 317 H ALA 68 HN ALA 68 82.945 9.917 -2.026 318 HA ALA 68 HA ALA 68 82.585 8.968 0.469 319 1HB ALA 68 HB1 ALA 68 83.499 7.524 -1.130 320 2HB ALA 68 HB2 ALA 68 84.864 7.758 -0.035 321 3HB ALA 68 HB3 ALA 68 84.785 8.654 -1.551 322 H ALA 69 HN ALA 69 85.285 11.027 -0.555 323 HA ALA 69 HA ALA 69 86.912 10.974 1.697 324 1HB ALA 69 HB1 ALA 69 86.689 12.465 -0.596 325 2HB ALA 69 HB2 ALA 69 87.838 12.808 0.694 326 3HB ALA 69 HB3 ALA 69 86.299 13.663 0.637 327 H GLN 70 HN GLN 70 84.583 13.658 1.281 328 HA GLN 70 HA GLN 70 84.230 13.524 4.200 329 1HB GLN 70 HB2 GLN 70 84.107 15.599 2.208 330 2HB GLN 70 HB1 GLN 70 82.723 15.645 3.303 331 1HG GLN 70 HG2 GLN 70 85.621 15.445 4.195 332 2HG GLN 70 HG1 GLN 70 84.619 16.902 4.304 333 1HE2 GLN 70 HE21 GLN 70 85.007 13.555 5.683 334 2HE2 GLN 70 HE22 GLN 70 83.964 13.811 6.994 335 H TYR 71 HN TYR 71 82.334 13.063 1.305 336 HA TYR 71 HA TYR 71 79.755 13.136 2.360 337 1HB TYR 71 HB2 TYR 71 81.114 11.340 0.358 338 2HB TYR 71 HB1 TYR 71 79.394 11.196 0.690 339 HD1 TYR 71 HD1 TYR 71 78.566 11.958 -1.414 340 HD2 TYR 71 HD2 TYR 71 81.306 14.444 0.818 341 HE1 TYR 71 HE1 TYR 71 78.065 13.868 -2.909 342 HE2 TYR 71 HE2 TYR 71 80.793 16.331 -0.690 343 HH TYR 71 HH TYR 71 79.066 17.076 -2.191 344 H SER 72 HN SER 72 82.377 10.929 2.860 345 HA SER 72 HA SER 72 80.810 9.035 4.468 346 1HB SER 72 HB2 SER 72 82.933 7.919 4.684 347 2HB SER 72 HB1 SER 72 82.935 8.592 3.055 348 HG SER 72 HG SER 72 84.555 9.782 3.604 349 H GLU 73 HN GLU 73 83.101 9.051 6.539 350 HA GLU 73 HA GLU 73 82.442 11.634 7.911 351 1HB GLU 73 HB2 GLU 73 80.972 10.210 8.991 352 2HB GLU 73 HB1 GLU 73 81.964 8.786 8.651 353 1HG GLU 73 HG2 GLU 73 82.016 9.260 11.041 354 2HG GLU 73 HG1 GLU 73 83.605 9.548 10.334 355 H ASP 74 HN ASP 74 84.819 9.625 6.780 356 HA ASP 74 HA ASP 74 86.994 10.975 8.064 357 1HB ASP 74 HB2 ASP 74 85.961 9.690 9.994 358 2HB ASP 74 HB1 ASP 74 86.371 8.205 9.146 359 H LYS 75 HN LYS 75 86.596 7.467 7.489 360 HA LYS 75 HA LYS 75 88.970 7.196 5.927 361 1HB LYS 75 HB2 LYS 75 86.968 5.595 7.039 362 2HB LYS 75 HB1 LYS 75 86.813 5.318 5.305 363 1HG LYS 75 HG2 LYS 75 89.394 5.101 6.885 364 2HG LYS 75 HG1 LYS 75 88.420 3.737 6.338 365 1HD LYS 75 HD2 LYS 75 88.697 5.044 3.994 366 2HD LYS 75 HD1 LYS 75 90.192 5.551 4.780 367 1HE LYS 75 HE2 LYS 75 89.265 2.683 4.368 368 2HE LYS 75 HE1 LYS 75 90.628 3.480 3.557 369 1HZ LYS 75 HZ1 LYS 75 90.311 2.905 6.455 370 2HZ LYS 75 HZ2 LYS 75 91.481 3.982 5.855 371 3HZ LYS 75 HZ3 LYS 75 91.529 2.342 5.416 372 H ALA 76 HN ALA 76 89.116 6.855 3.577 373 HA ALA 76 HA ALA 76 86.783 7.698 1.962 374 1HB ALA 76 HB1 ALA 76 88.079 9.556 0.969 375 2HB ALA 76 HB2 ALA 76 89.422 9.190 2.053 376 3HB ALA 76 HB3 ALA 76 87.888 9.762 2.712 377 H ARG 77 HN ARG 77 89.648 8.284 0.271 378 HA ARG 77 HA ARG 77 90.673 7.071 -1.490 379 1HB ARG 77 HB2 ARG 77 91.273 5.912 0.806 380 2HB ARG 77 HB1 ARG 77 90.221 4.628 0.211 381 1HG ARG 77 HG2 ARG 77 92.281 3.947 -0.641 382 2HG ARG 77 HG1 ARG 77 91.653 4.891 -1.993 383 1HD ARG 77 HD2 ARG 77 93.736 5.894 -1.796 384 2HD ARG 77 HD1 ARG 77 92.861 6.876 -0.603 385 HE ARG 77 HE ARG 77 93.907 4.379 0.504 386 1HH1 ARG 77 HH11 ARG 77 93.606 7.297 1.630 387 2HH1 ARG 77 HH12 ARG 77 95.269 7.644 1.969 388 1HH2 ARG 77 HH21 ARG 77 96.478 4.975 0.114 389 2HH2 ARG 77 HH22 ARG 77 96.895 6.329 1.110 390 H GLN 78 HN GLN 78 89.047 7.161 -3.101 391 HA GLN 78 HA GLN 78 87.401 6.295 -4.567 392 1HB GLN 78 HB2 GLN 78 88.702 4.263 -4.599 393 2HB GLN 78 HB1 GLN 78 88.168 3.822 -2.979 394 1HG GLN 78 HG2 GLN 78 86.011 4.284 -4.979 395 2HG GLN 78 HG1 GLN 78 86.999 2.834 -5.208 396 1HE2 GLN 78 HE21 GLN 78 84.239 3.921 -3.668 397 2HE2 GLN 78 HE22 GLN 78 84.165 2.798 -2.401 398 H GLY 79 HN GLY 79 86.838 4.420 -1.608 399 1HA GLY 79 HA2 GLY 79 84.649 5.988 -0.673 400 2HA GLY 79 HA1 GLY 79 84.038 4.614 -1.580 401 H GLY 80 HN GLY 80 86.587 5.265 0.849 402 1HA GLY 80 HA2 GLY 80 87.192 4.054 2.763 403 2HA GLY 80 HA1 GLY 80 85.496 3.574 2.855 404 H ASP 81 HN ASP 81 87.844 2.907 0.252 405 HA ASP 81 HA ASP 81 87.043 0.204 -0.101 406 1HB ASP 81 HB2 ASP 81 89.185 0.100 -1.387 407 2HB ASP 81 HB1 ASP 81 88.247 1.554 -1.750 408 H LEU 82 HN LEU 82 87.036 -0.336 2.367 409 HA LEU 82 HA LEU 82 89.275 -0.608 4.003 410 1HB LEU 82 HB2 LEU 82 86.717 -2.061 3.544 411 2HB LEU 82 HB1 LEU 82 87.918 -2.889 4.533 412 HG LEU 82 HG LEU 82 88.108 -0.549 5.728 413 1HD1 LEU 82 HD11 LEU 82 85.388 0.047 5.629 414 2HD1 LEU 82 HD12 LEU 82 85.820 -0.243 3.944 415 3HD1 LEU 82 HD13 LEU 82 86.683 0.979 4.878 416 1HD2 LEU 82 HD21 LEU 82 87.393 -2.208 7.155 417 2HD2 LEU 82 HD22 LEU 82 86.149 -2.772 6.039 418 3HD2 LEU 82 HD23 LEU 82 85.872 -1.326 7.009 419 H GLY 83 HN GLY 83 88.445 -2.475 1.139 420 1HA GLY 83 HA2 GLY 83 90.234 -3.584 -0.126 421 2HA GLY 83 HA1 GLY 83 91.051 -3.907 1.410 422 H TRP 84 HN TRP 84 90.705 -6.061 -0.190 423 HA TRP 84 HA TRP 84 88.379 -7.560 -0.242 424 1HB TRP 84 HB2 TRP 84 91.288 -8.164 0.170 425 2HB TRP 84 HB1 TRP 84 90.131 -9.488 0.252 426 HD1 TRP 84 HD1 TRP 84 92.102 -7.588 -2.132 427 HE1 TRP 84 HE1 TRP 84 91.280 -7.963 -4.549 428 HE3 TRP 84 HE3 TRP 84 87.637 -9.857 -1.184 429 HZ2 TRP 84 HZ2 TRP 84 89.016 -9.087 -5.896 430 HZ3 TRP 84 HZ3 TRP 84 86.168 -10.578 -3.053 431 HH2 TRP 84 HH2 TRP 84 86.850 -10.187 -5.388 432 H MET 85 HN MET 85 87.119 -8.649 1.269 433 HA MET 85 HA MET 85 88.133 -8.876 4.068 434 1HB MET 85 HB2 MET 85 86.006 -7.130 2.982 435 2HB MET 85 HB1 MET 85 85.557 -8.024 4.434 436 1HG MET 85 HG2 MET 85 88.037 -6.300 4.131 437 2HG MET 85 HG1 MET 85 86.573 -5.838 5.002 438 1HE MET 85 HE1 MET 85 87.068 -5.541 7.312 439 2HE MET 85 HE2 MET 85 88.740 -5.395 6.776 440 3HE MET 85 HE3 MET 85 88.361 -6.357 8.203 441 H THR 86 HN THR 86 87.108 -10.562 5.249 442 HA THR 86 HA THR 86 85.287 -12.317 3.643 443 HB THR 86 HB THR 86 87.441 -13.335 3.896 444 HG1 THR 86 HG1 THR 86 85.549 -14.616 4.294 445 1HG2 THR 86 HG21 THR 86 88.363 -13.731 6.197 446 2HG2 THR 86 HG22 THR 86 87.077 -12.695 6.820 447 3HG2 THR 86 HG23 THR 86 88.306 -12.026 5.746 448 H ARG 87 HN ARG 87 83.707 -13.380 4.750 449 HA ARG 87 HA ARG 87 82.295 -11.981 6.786 450 1HB ARG 87 HB2 ARG 87 81.336 -13.610 5.188 451 2HB ARG 87 HB1 ARG 87 82.210 -14.912 5.996 452 1HG ARG 87 HG2 ARG 87 81.013 -14.165 8.143 453 2HG ARG 87 HG1 ARG 87 79.963 -13.212 7.093 454 1HD ARG 87 HD2 ARG 87 80.429 -16.154 6.562 455 2HD ARG 87 HD1 ARG 87 79.164 -15.606 7.679 456 HE ARG 87 HE ARG 87 79.169 -14.179 5.121 457 1HH1 ARG 87 HH21 ARG 87 78.546 -17.338 6.182 458 2HH1 ARG 87 HH22 ARG 87 76.951 -17.421 5.512 459 1HH2 ARG 87 HH11 ARG 87 76.897 -14.088 4.554 460 2HH2 ARG 87 HH12 ARG 87 76.017 -15.580 4.591 461 H GLY 88 HN GLY 88 85.016 -14.083 7.027 462 1HA GLY 88 HA2 GLY 88 84.532 -15.111 9.683 463 2HA GLY 88 HA1 GLY 88 86.104 -15.055 8.871 464 H SER 89 HN SER 89 85.384 -12.016 8.500 465 HA SER 89 HA SER 89 85.673 -11.008 11.258 466 1HB SER 89 HB2 SER 89 87.933 -11.704 10.800 467 2HB SER 89 HB1 SER 89 87.885 -10.988 9.183 468 HG SER 89 HG SER 89 88.842 -9.818 11.183 469 H MET 90 HN MET 90 83.578 -10.285 9.825 470 HA MET 90 HA MET 90 84.245 -7.548 8.814 471 1HB MET 90 HB2 MET 90 83.089 -9.871 7.428 472 2HB MET 90 HB1 MET 90 82.137 -8.399 7.242 473 1HG MET 90 HG2 MET 90 85.112 -8.241 6.905 474 2HG MET 90 HG1 MET 90 84.146 -8.917 5.593 475 1HE MET 90 HE1 MET 90 83.624 -7.602 3.767 476 2HE MET 90 HE2 MET 90 82.622 -6.154 3.826 477 3HE MET 90 HE3 MET 90 82.032 -7.654 4.536 478 H VAL 91 HN VAL 91 83.208 -8.294 11.409 479 HA VAL 91 HA VAL 91 81.472 -7.651 12.877 480 HB VAL 91 HB VAL 91 80.452 -6.016 10.548 481 1HG1 VAL 91 HG11 VAL 91 79.198 -5.119 12.190 482 2HG1 VAL 91 HG12 VAL 91 80.677 -4.573 12.981 483 3HG1 VAL 91 HG13 VAL 91 79.988 -6.144 13.387 484 1HG2 VAL 91 HG21 VAL 91 82.631 -5.332 10.329 485 2HG2 VAL 91 HG22 VAL 91 83.070 -5.865 11.952 486 3HG2 VAL 91 HG23 VAL 91 82.216 -4.339 11.725 487 H GLY 92 HN GLY 92 78.999 -7.703 13.068 488 1HA GLY 92 HA2 GLY 92 78.008 -10.056 11.609 489 2HA GLY 92 HA1 GLY 92 77.188 -9.241 12.947 490 HA PRO 93 HA PRO 93 74.518 -6.990 10.312 491 1HB PRO 93 HB2 PRO 93 75.369 -4.325 10.993 492 2HB PRO 93 HB1 PRO 93 73.966 -5.216 11.607 493 1HG PRO 93 HG2 PRO 93 76.397 -4.571 12.999 494 2HG PRO 93 HG1 PRO 93 75.000 -5.460 13.610 495 1HD PRO 93 HD2 PRO 93 77.607 -6.498 12.941 496 2HD PRO 93 HD1 PRO 93 76.202 -7.397 13.558 497 H PHE 94 HN PHE 94 77.760 -5.474 10.356 498 HA PHE 94 HA PHE 94 77.685 -4.152 7.868 499 1HB PHE 94 HB2 PHE 94 79.466 -4.483 9.858 500 2HB PHE 94 HB1 PHE 94 80.160 -5.607 8.681 501 HD1 PHE 94 HD1 PHE 94 81.144 -4.822 6.622 502 HD2 PHE 94 HD2 PHE 94 79.202 -2.082 9.298 503 HE1 PHE 94 HE1 PHE 94 82.102 -2.912 5.363 504 HE2 PHE 94 HE2 PHE 94 80.160 -0.172 8.040 505 HZ PHE 94 HZ PHE 94 81.610 -0.587 6.072 506 H GLN 95 HN GLN 95 78.642 -7.535 8.562 507 HA GLN 95 HA GLN 95 78.989 -8.122 5.708 508 1HB GLN 95 HB2 GLN 95 79.878 -10.149 6.513 509 2HB GLN 95 HB1 GLN 95 80.266 -9.008 7.797 510 1HG GLN 95 HG2 GLN 95 78.350 -9.741 9.097 511 2HG GLN 95 HG1 GLN 95 77.806 -10.773 7.776 512 1HE2 GLN 95 HE21 GLN 95 81.249 -10.518 8.465 513 2HE2 GLN 95 HE22 GLN 95 81.422 -12.072 9.128 514 H GLU 96 HN GLU 96 76.647 -8.934 8.275 515 HA GLU 96 HA GLU 96 75.022 -10.816 7.060 516 1HB GLU 96 HB2 GLU 96 74.759 -8.631 8.995 517 2HB GLU 96 HB1 GLU 96 73.238 -8.998 8.180 518 1HG GLU 96 HG2 GLU 96 74.863 -11.315 9.119 519 2HG GLU 96 HG1 GLU 96 74.055 -10.350 10.356 520 H ALA 97 HN ALA 97 75.207 -7.359 6.285 521 HA ALA 97 HA ALA 97 72.948 -7.462 4.417 522 1HB ALA 97 HB1 ALA 97 74.374 -5.135 3.961 523 2HB ALA 97 HB2 ALA 97 74.785 -5.517 5.634 524 3HB ALA 97 HB3 ALA 97 73.097 -5.319 5.163 525 H ALA 98 HN ALA 98 76.162 -6.166 3.710 526 HA ALA 98 HA ALA 98 76.322 -6.483 1.005 527 1HB ALA 98 HB1 ALA 98 78.235 -6.697 3.271 528 2HB ALA 98 HB2 ALA 98 78.233 -5.582 1.905 529 3HB ALA 98 HB3 ALA 98 78.829 -7.230 1.698 530 H PHE 99 HN PHE 99 77.815 -9.037 3.028 531 HA PHE 99 HA PHE 99 78.141 -11.034 1.169 532 1HB PHE 99 HB2 PHE 99 77.316 -10.999 4.057 533 2HB PHE 99 HB1 PHE 99 77.456 -12.545 3.213 534 HD1 PHE 99 HD1 PHE 99 79.251 -9.748 4.687 535 HD2 PHE 99 HD2 PHE 99 79.636 -13.190 2.146 536 HE1 PHE 99 HE1 PHE 99 81.714 -9.679 4.966 537 HE2 PHE 99 HE2 PHE 99 82.100 -13.120 2.424 538 HZ PHE 99 HZ PHE 99 83.138 -11.364 3.834 539 H ALA 100 HN ALA 100 75.159 -10.688 3.109 540 HA ALA 100 HA ALA 100 73.664 -12.645 1.620 541 1HB ALA 100 HB1 ALA 100 71.793 -11.738 2.920 542 2HB ALA 100 HB2 ALA 100 72.728 -10.290 3.292 543 3HB ALA 100 HB3 ALA 100 73.222 -11.852 3.947 544 H LEU 101 HN LEU 101 74.536 -9.393 0.907 545 HA LEU 101 HA LEU 101 72.321 -9.162 -1.094 546 1HB LEU 101 HB2 LEU 101 74.007 -7.276 0.520 547 2HB LEU 101 HB1 LEU 101 73.324 -6.711 -1.010 548 HG LEU 101 HG LEU 101 71.487 -8.177 0.818 549 1HD1 LEU 101 HD11 LEU 101 72.781 -5.544 1.443 550 2HD1 LEU 101 HD12 LEU 101 72.320 -6.848 2.538 551 3HD1 LEU 101 HD13 LEU 101 71.085 -5.783 1.865 552 1HD2 LEU 101 HD21 LEU 101 71.349 -5.811 -1.059 553 2HD2 LEU 101 HD22 LEU 101 70.012 -6.239 0.007 554 3HD2 LEU 101 HD23 LEU 101 70.556 -7.379 -1.223 555 HA PRO 102 HA PRO 102 75.054 -9.562 -4.510 556 1HB PRO 102 HB2 PRO 102 74.127 -7.201 -5.867 557 2HB PRO 102 HB1 PRO 102 73.658 -8.884 -6.158 558 1HG PRO 102 HG2 PRO 102 72.087 -6.798 -4.973 559 2HG PRO 102 HG1 PRO 102 71.631 -8.490 -5.229 560 1HD PRO 102 HD2 PRO 102 72.268 -7.161 -2.729 561 2HD PRO 102 HD1 PRO 102 71.745 -8.846 -2.979 562 H VAL 103 HN VAL 103 76.737 -8.321 -5.806 563 HA VAL 103 HA VAL 103 78.146 -6.379 -4.040 564 HB VAL 103 HB VAL 103 78.814 -8.659 -5.597 565 1HG1 VAL 103 HG11 VAL 103 79.199 -7.488 -7.606 566 2HG1 VAL 103 HG12 VAL 103 80.798 -7.602 -6.870 567 3HG1 VAL 103 HG13 VAL 103 79.885 -6.097 -6.769 568 1HG2 VAL 103 HG21 VAL 103 80.432 -8.659 -4.047 569 2HG2 VAL 103 HG22 VAL 103 79.874 -7.071 -3.523 570 3HG2 VAL 103 HG23 VAL 103 81.143 -7.200 -4.738 571 H SER 104 HN SER 104 78.474 -4.231 -4.740 572 HA SER 104 HA SER 104 78.571 -3.207 -7.344 573 1HB SER 104 HB2 SER 104 75.873 -4.035 -6.443 574 2HB SER 104 HB1 SER 104 75.949 -2.439 -7.194 575 HG SER 104 HG SER 104 76.164 -4.882 -8.326 576 H GLY 105 HN GLY 105 76.615 -2.434 -4.407 577 1HA GLY 105 HA2 GLY 105 76.368 -0.406 -3.260 578 2HA GLY 105 HA1 GLY 105 78.115 -0.403 -3.348 579 H MET 106 HN MET 106 77.470 2.000 -3.300 580 HA MET 106 HA MET 106 77.922 3.990 -4.500 581 1HB MET 106 HB2 MET 106 78.886 2.417 -6.235 582 2HB MET 106 HB1 MET 106 77.292 2.392 -6.981 583 1HG MET 106 HG2 MET 106 77.461 4.978 -6.947 584 2HG MET 106 HG1 MET 106 79.188 4.713 -6.678 585 1HE MET 106 HE1 MET 106 76.410 2.845 -9.018 586 2HE MET 106 HE2 MET 106 76.643 3.962 -10.360 587 3HE MET 106 HE3 MET 106 76.193 4.584 -8.774 588 H ASP 107 HN ASP 107 75.773 3.321 -7.107 589 HA ASP 107 HA ASP 107 73.815 5.204 -6.033 590 1HB ASP 107 HB2 ASP 107 74.448 5.169 -8.386 591 2HB ASP 107 HB1 ASP 107 73.951 3.482 -8.526 592 H LYS 108 HN LYS 108 73.904 2.948 -4.319 593 HA LYS 108 HA LYS 108 72.512 1.315 -3.337 594 1HB LYS 108 HB2 LYS 108 71.171 3.381 -3.187 595 2HB LYS 108 HB1 LYS 108 70.488 3.053 -4.787 596 1HG LYS 108 HG2 LYS 108 70.136 0.681 -3.297 597 2HG LYS 108 HG1 LYS 108 69.680 1.996 -2.215 598 1HD LYS 108 HD2 LYS 108 68.035 2.809 -3.724 599 2HD LYS 108 HD1 LYS 108 68.683 1.861 -5.064 600 1HE LYS 108 HE2 LYS 108 68.074 -0.228 -3.737 601 2HE LYS 108 HE1 LYS 108 67.187 0.838 -2.630 602 1HZ LYS 108 HZ1 LYS 108 65.757 0.048 -4.433 603 2HZ LYS 108 HZ2 LYS 108 66.822 0.704 -5.583 604 3HZ LYS 108 HZ3 LYS 108 65.973 1.728 -4.526 605 HA PRO 109 HA PRO 109 71.839 -0.653 -7.680 606 1HB PRO 109 HB2 PRO 109 74.025 -2.431 -7.120 607 2HB PRO 109 HB1 PRO 109 73.917 -1.215 -8.404 608 1HG PRO 109 HG2 PRO 109 75.520 -1.140 -6.012 609 2HG PRO 109 HG1 PRO 109 75.449 0.046 -7.315 610 1HD PRO 109 HD2 PRO 109 74.423 0.297 -4.641 611 2HD PRO 109 HD1 PRO 109 74.315 1.469 -5.980 612 H VAL 110 HN VAL 110 73.269 -2.279 -4.836 613 HA VAL 110 HA VAL 110 72.103 -4.764 -4.839 614 HB VAL 110 HB VAL 110 71.826 -4.221 -2.247 615 1HG1 VAL 110 HG11 VAL 110 73.873 -5.159 -3.888 616 2HG1 VAL 110 HG12 VAL 110 73.758 -5.309 -2.135 617 3HG1 VAL 110 HG13 VAL 110 74.640 -3.958 -2.847 618 1HG2 VAL 110 HG21 VAL 110 72.218 -1.680 -3.152 619 2HG2 VAL 110 HG22 VAL 110 73.861 -2.146 -2.705 620 3HG2 VAL 110 HG23 VAL 110 72.565 -2.221 -1.510 621 H PHE 111 HN PHE 111 70.310 -5.493 -3.302 622 HA PHE 111 HA PHE 111 67.769 -4.310 -4.130 623 1HB PHE 111 HB2 PHE 111 68.800 -6.614 -2.502 624 2HB PHE 111 HB1 PHE 111 67.086 -6.189 -2.402 625 HD1 PHE 111 HD1 PHE 111 69.711 -6.477 -5.077 626 HD2 PHE 111 HD2 PHE 111 65.691 -7.374 -3.856 627 HE1 PHE 111 HE1 PHE 111 69.315 -7.636 -7.233 628 HE2 PHE 111 HE2 PHE 111 65.297 -8.533 -6.013 629 HZ PHE 111 HZ PHE 111 67.108 -8.664 -7.702 630 H THR 112 HN THR 112 69.932 -4.245 -1.386 631 HA THR 112 HA THR 112 67.950 -3.032 0.436 632 HB THR 112 HB THR 112 69.863 -4.626 1.035 633 HG1 THR 112 HG1 THR 112 68.769 -3.267 2.550 634 1HG2 THR 112 HG21 THR 112 71.591 -3.561 -0.355 635 2HG2 THR 112 HG22 THR 112 72.082 -3.578 1.342 636 3HG2 THR 112 HG23 THR 112 71.471 -2.091 0.613 637 H ASP 113 HN ASP 113 69.749 -1.167 1.653 638 HA ASP 113 HA ASP 113 69.947 0.940 -0.474 639 1HB ASP 113 HB2 ASP 113 69.197 1.132 2.467 640 2HB ASP 113 HB1 ASP 113 69.335 2.508 1.374 641 HA PRO 114 HA PRO 114 74.232 0.939 0.520 642 1HB PRO 114 HB2 PRO 114 74.491 3.758 0.070 643 2HB PRO 114 HB1 PRO 114 74.941 2.428 -1.004 644 1HG PRO 114 HG2 PRO 114 72.671 4.216 -1.221 645 2HG PRO 114 HG1 PRO 114 73.225 2.994 -2.367 646 1HD PRO 114 HD2 PRO 114 70.887 2.873 -0.738 647 2HD PRO 114 HD1 PRO 114 71.566 1.556 -1.726 648 HA PRO 115 HA PRO 115 74.304 4.425 3.946 649 1HB PRO 115 HB2 PRO 115 71.560 5.215 4.313 650 2HB PRO 115 HB1 PRO 115 72.921 6.217 3.806 651 1HG PRO 115 HG2 PRO 115 70.718 5.225 2.212 652 2HG PRO 115 HG1 PRO 115 72.016 6.328 1.729 653 1HD PRO 115 HD2 PRO 115 71.680 3.608 0.912 654 2HD PRO 115 HD1 PRO 115 73.060 4.669 0.577 655 H VAL 116 HN VAL 116 74.351 1.944 4.634 656 HA VAL 116 HA VAL 116 71.916 1.085 6.071 657 HB VAL 116 HB VAL 116 73.020 -1.000 6.190 658 1HG1 VAL 116 HG11 VAL 116 72.974 -1.315 3.967 659 2HG1 VAL 116 HG12 VAL 116 74.539 -0.516 3.809 660 3HG1 VAL 116 HG13 VAL 116 73.056 0.432 3.740 661 1HG2 VAL 116 HG21 VAL 116 75.426 -1.303 5.992 662 2HG2 VAL 116 HG22 VAL 116 75.089 -0.108 7.246 663 3HG2 VAL 116 HG23 VAL 116 75.639 0.416 5.654 664 H LYS 117 HN LYS 117 71.807 0.957 8.345 665 HA LYS 117 HA LYS 117 73.855 2.563 9.783 666 1HB LYS 117 HB2 LYS 117 71.504 3.197 9.987 667 2HB LYS 117 HB1 LYS 117 71.087 1.554 10.496 668 1HG LYS 117 HG2 LYS 117 73.220 2.462 12.161 669 2HG LYS 117 HG1 LYS 117 71.994 3.741 12.116 670 1HD LYS 117 HD2 LYS 117 71.064 0.915 12.453 671 2HD LYS 117 HD1 LYS 117 71.810 1.717 13.844 672 1HE LYS 117 HE2 LYS 117 70.156 3.698 13.100 673 2HE LYS 117 HE1 LYS 117 69.227 2.327 12.464 674 1HZ LYS 117 HZ1 LYS 117 70.442 2.190 15.150 675 2HZ LYS 117 HZ2 LYS 117 69.108 1.335 14.538 676 3HZ LYS 117 HZ3 LYS 117 68.955 2.979 14.942 677 H THR 118 HN THR 118 75.063 1.696 11.465 678 HA THR 118 HA THR 118 74.522 -0.756 12.834 679 HB THR 118 HB THR 118 74.812 -1.785 10.659 680 HG1 THR 118 HG1 THR 118 77.176 -2.011 12.207 681 1HG2 THR 118 HG21 THR 118 76.235 -1.006 9.088 682 2HG2 THR 118 HG22 THR 118 77.593 -0.996 10.214 683 3HG2 THR 118 HG23 THR 118 76.481 0.373 10.161 684 H LYS 119 HN LYS 119 75.699 1.965 13.209 685 HA LYS 119 HA LYS 119 77.887 1.212 14.967 686 1HB LYS 119 HB2 LYS 119 78.516 1.469 12.288 687 2HB LYS 119 HB1 LYS 119 78.916 3.064 12.928 688 1HG LYS 119 HG2 LYS 119 80.169 1.854 14.796 689 2HG LYS 119 HG1 LYS 119 79.972 0.378 13.845 690 1HD LYS 119 HD2 LYS 119 80.912 2.080 11.937 691 2HD LYS 119 HD1 LYS 119 81.726 2.717 13.367 692 1HE LYS 119 HE2 LYS 119 81.885 -0.135 13.494 693 2HE LYS 119 HE1 LYS 119 82.393 0.366 11.870 694 1HZ LYS 119 HZ1 LYS 119 83.300 1.726 14.350 695 2HZ LYS 119 HZ2 LYS 119 83.920 1.913 12.780 696 3HZ LYS 119 HZ3 LYS 119 84.173 0.464 13.629 697 H PHE 120 HN PHE 120 77.201 4.135 12.994 698 HA PHE 120 HA PHE 120 76.232 5.555 15.408 699 1HB PHE 120 HB2 PHE 120 78.936 5.519 14.677 700 2HB PHE 120 HB1 PHE 120 78.337 7.074 14.080 701 HD1 PHE 120 HD1 PHE 120 77.123 8.619 15.674 702 HD2 PHE 120 HD2 PHE 120 79.237 5.124 17.003 703 HE1 PHE 120 HE1 PHE 120 77.155 9.517 17.985 704 HE2 PHE 120 HE2 PHE 120 79.269 6.022 19.315 705 HZ PHE 120 HZ PHE 120 78.227 8.219 19.806 706 H GLY 121 HN GLY 121 75.300 4.841 12.566 707 1HA GLY 121 HA2 GLY 121 73.602 6.871 11.944 708 2HA GLY 121 HA1 GLY 121 75.119 7.477 11.266 709 H TYR 122 HN TYR 122 74.383 7.310 9.101 710 HA TYR 122 HA TYR 122 73.719 4.572 8.101 711 1HB TYR 122 HB2 TYR 122 73.299 7.395 7.086 712 2HB TYR 122 HB1 TYR 122 72.972 5.976 6.093 713 HD1 TYR 122 HD1 TYR 122 70.775 5.237 6.073 714 HD2 TYR 122 HD2 TYR 122 72.312 7.110 9.619 715 HE1 TYR 122 HE1 TYR 122 68.564 4.977 7.167 716 HE2 TYR 122 HE2 TYR 122 70.103 6.850 10.714 717 HH TYR 122 HH TYR 122 68.110 5.541 10.545 718 H HIS 123 HN HIS 123 75.090 3.591 6.598 719 HA HIS 123 HA HIS 123 77.392 5.217 5.573 720 1HB HIS 123 HB2 HIS 123 77.929 2.389 6.270 721 2HB HIS 123 HB1 HIS 123 78.908 3.820 6.575 722 HD1 HIS 123 HD1 HIS 123 77.949 5.400 8.621 723 HD2 HIS 123 HD2 HIS 123 76.603 1.457 8.534 724 HE1 HIS 123 HE1 HIS 123 77.035 4.906 10.926 725 H ILE 124 HN ILE 124 77.911 4.757 3.404 726 HA ILE 124 HA ILE 124 76.072 2.925 1.983 727 HB ILE 124 HB ILE 124 78.297 4.699 0.929 728 1HG1 ILE 124 HG12 ILE 124 75.378 5.264 1.517 729 2HG1 ILE 124 HG11 ILE 124 76.789 6.144 2.117 730 1HG2 ILE 124 HG21 ILE 124 76.626 2.778 -0.301 731 2HG2 ILE 124 HG22 ILE 124 77.699 3.932 -1.093 732 3HG2 ILE 124 HG23 ILE 124 76.015 4.358 -0.791 733 1HD1 ILE 124 HD11 ILE 124 77.267 6.527 -0.452 734 2HD1 ILE 124 HD12 ILE 124 76.083 7.541 0.373 735 3HD1 ILE 124 HD13 ILE 124 75.545 6.191 -0.624 736 H ILE 125 HN ILE 125 76.743 0.798 2.268 737 HA ILE 125 HA ILE 125 79.607 0.095 2.051 738 HB ILE 125 HB ILE 125 77.000 -1.253 2.746 739 1HG1 ILE 125 HG12 ILE 125 79.637 -1.307 4.220 740 2HG1 ILE 125 HG11 ILE 125 78.504 0.043 4.388 741 1HG2 ILE 125 HG21 ILE 125 77.890 -3.014 1.511 742 2HG2 ILE 125 HG22 ILE 125 78.582 -3.322 3.104 743 3HG2 ILE 125 HG23 ILE 125 79.556 -2.548 1.854 744 1HD1 ILE 125 HD11 ILE 125 78.357 -2.660 5.508 745 2HD1 ILE 125 HD12 ILE 125 76.881 -2.199 4.657 746 3HD1 ILE 125 HD13 ILE 125 77.487 -1.202 5.982 747 H MET 126 HN MET 126 80.472 -0.510 0.101 748 HA MET 126 HA MET 126 78.621 -1.379 -2.043 749 1HB MET 126 HB2 MET 126 79.370 0.694 -2.796 750 2HB MET 126 HB1 MET 126 80.816 0.625 -1.786 751 1HG MET 126 HG2 MET 126 81.968 -0.725 -3.310 752 2HG MET 126 HG1 MET 126 80.498 -1.189 -4.173 753 1HE MET 126 HE1 MET 126 82.738 2.679 -3.968 754 2HE MET 126 HE2 MET 126 82.039 1.721 -2.659 755 3HE MET 126 HE3 MET 126 81.072 2.969 -3.441 756 H VAL 127 HN VAL 127 78.967 -3.625 -1.919 757 HA VAL 127 HA VAL 127 81.730 -4.665 -1.644 758 HB VAL 127 HB VAL 127 79.103 -6.123 -2.109 759 1HG1 VAL 127 HG11 VAL 127 81.821 -6.952 -1.806 760 2HG1 VAL 127 HG12 VAL 127 80.386 -7.966 -1.962 761 3HG1 VAL 127 HG13 VAL 127 80.936 -7.456 -0.366 762 1HG2 VAL 127 HG21 VAL 127 79.658 -4.436 0.031 763 2HG2 VAL 127 HG22 VAL 127 80.097 -6.031 0.641 764 3HG2 VAL 127 HG23 VAL 127 78.469 -5.738 0.028 765 H GLU 128 HN GLU 128 82.930 -4.926 -3.520 766 HA GLU 128 HA GLU 128 81.559 -5.735 -5.981 767 1HB GLU 128 HB2 GLU 128 82.414 -3.054 -5.289 768 2HB GLU 128 HB1 GLU 128 83.307 -3.635 -6.701 769 1HG GLU 128 HG2 GLU 128 80.298 -3.885 -6.459 770 2HG GLU 128 HG1 GLU 128 81.081 -2.477 -7.191 771 H GLY 129 HN GLY 129 82.809 -7.508 -6.270 772 1HA GLY 129 HA2 GLY 129 85.152 -7.813 -7.485 773 2HA GLY 129 HA1 GLY 129 85.725 -7.419 -5.860 774 H ARG 130 HN ARG 130 83.485 -8.738 -4.578 775 HA ARG 130 HA ARG 130 84.414 -11.105 -3.760 776 1HB ARG 130 HB2 ARG 130 82.417 -10.523 -2.840 777 2HB ARG 130 HB1 ARG 130 81.689 -10.083 -4.377 778 1HG ARG 130 HG2 ARG 130 82.343 -12.961 -3.755 779 2HG ARG 130 HG1 ARG 130 80.850 -12.238 -3.154 780 1HD ARG 130 HD2 ARG 130 80.939 -11.437 -5.830 781 2HD ARG 130 HD1 ARG 130 81.505 -13.118 -5.863 782 HE ARG 130 HE ARG 130 79.428 -13.512 -4.303 783 1HH1 ARG 130 HH21 ARG 130 78.949 -13.489 -7.306 784 2HH1 ARG 130 HH22 ARG 130 77.578 -12.438 -7.423 785 1HH2 ARG 130 HH11 ARG 130 77.962 -11.149 -4.226 786 2HH2 ARG 130 HH12 ARG 130 77.019 -11.112 -5.678 787 H LYS 131 HN LYS 131 84.241 -13.305 -4.334 788 HA LYS 131 HA LYS 131 84.120 -13.796 -7.290 789 1HB LYS 131 HB2 LYS 131 85.403 -15.383 -5.042 790 2HB LYS 131 HB1 LYS 131 85.602 -15.681 -6.768 791 1HG LYS 131 HG2 LYS 131 87.376 -14.286 -6.689 792 2HG LYS 131 HG1 LYS 131 86.223 -12.973 -6.455 793 1HD LYS 131 HD2 LYS 131 87.715 -12.791 -4.617 794 2HD LYS 131 HD1 LYS 131 86.294 -13.598 -3.954 795 1HE LYS 131 HE2 LYS 131 88.026 -14.975 -3.159 796 2HE LYS 131 HE1 LYS 131 87.609 -15.796 -4.683 797 1HZ LYS 131 HZ1 LYS 131 89.245 -14.014 -5.650 798 2HZ LYS 131 HZ2 LYS 131 89.846 -15.456 -4.985 799 3HZ LYS 131 HZ3 LYS 131 89.876 -14.021 -4.076 Start of MODEL 17 1 1H GLY 28 HT1 GLY 28 71.991 -11.701 -16.556 2 2H GLY 28 HT2 GLY 28 71.611 -10.057 -16.360 3 3H GLY 28 HT3 GLY 28 70.372 -11.218 -16.408 4 1HA GLY 28 HA2 GLY 28 72.462 -11.076 -14.305 5 2HA GLY 28 HA1 GLY 28 70.832 -10.423 -14.140 6 H SER 29 HN SER 29 72.576 -12.972 -13.199 7 HA SER 29 HA SER 29 70.272 -14.882 -13.445 8 1HB SER 29 HB2 SER 29 72.509 -15.317 -14.668 9 2HB SER 29 HB1 SER 29 73.181 -15.611 -13.064 10 HG SER 29 HG SER 29 72.033 -17.367 -14.488 11 H GLY 30 HN GLY 30 72.756 -13.481 -11.364 12 1HA GLY 30 HA2 GLY 30 73.042 -13.563 -9.035 13 2HA GLY 30 HA1 GLY 30 71.285 -13.696 -8.976 14 HA PRO 31 HA PRO 31 73.022 -18.232 -9.313 15 1HB PRO 31 HB2 PRO 31 75.768 -18.078 -8.458 16 2HB PRO 31 HB1 PRO 31 75.141 -18.611 -10.027 17 1HG PRO 31 HG2 PRO 31 76.544 -16.179 -9.421 18 2HG PRO 31 HG1 PRO 31 75.909 -16.704 -10.982 19 1HD PRO 31 HD2 PRO 31 74.902 -14.605 -9.270 20 2HD PRO 31 HD1 PRO 31 74.275 -15.121 -10.853 21 H LYS 32 HN LYS 32 74.623 -16.056 -6.968 22 HA LYS 32 HA LYS 32 74.781 -16.208 -4.606 23 1HB LYS 32 HB2 LYS 32 72.101 -16.366 -5.604 24 2HB LYS 32 HB1 LYS 32 72.210 -17.381 -4.166 25 1HG LYS 32 HG2 LYS 32 73.614 -15.181 -3.358 26 2HG LYS 32 HG1 LYS 32 72.418 -14.443 -4.423 27 1HD LYS 32 HD2 LYS 32 71.153 -14.499 -2.505 28 2HD LYS 32 HD1 LYS 32 70.805 -16.130 -3.081 29 1HE LYS 32 HE2 LYS 32 72.715 -16.980 -1.695 30 2HE LYS 32 HE1 LYS 32 72.922 -15.342 -1.046 31 1HZ LYS 32 HZ1 LYS 32 71.264 -17.130 0.029 32 2HZ LYS 32 HZ2 LYS 32 70.207 -16.393 -1.077 33 3HZ LYS 32 HZ3 LYS 32 70.992 -15.458 0.104 34 H GLY 33 HN GLY 33 76.388 -18.009 -4.734 35 1HA GLY 33 HA2 GLY 33 75.185 -20.604 -3.850 36 2HA GLY 33 HA1 GLY 33 76.615 -20.533 -4.881 37 H GLY 34 HN GLY 34 75.980 -18.370 -2.160 38 1HA GLY 34 HA2 GLY 34 77.010 -18.271 -0.030 39 2HA GLY 34 HA1 GLY 34 77.759 -19.832 -0.359 40 H GLY 35 HN GLY 35 78.122 -16.371 -0.633 41 1HA GLY 35 HA2 GLY 35 80.606 -16.535 -2.175 42 2HA GLY 35 HA1 GLY 35 79.927 -15.071 -1.448 43 H ASN 36 HN ASN 36 82.513 -15.161 -1.056 44 HA ASN 36 HA ASN 36 82.820 -16.034 1.784 45 1HB ASN 36 HB2 ASN 36 84.584 -16.638 -0.600 46 2HB ASN 36 HB1 ASN 36 85.157 -16.794 1.062 47 1HD2 ASN 36 HD21 ASN 36 84.619 -18.951 -1.014 48 2HD2 ASN 36 HD22 ASN 36 83.526 -20.013 -0.265 49 H ALA 37 HN ALA 37 84.323 -14.250 -0.910 50 HA ALA 37 HA ALA 37 85.087 -12.108 1.036 51 1HB ALA 37 HB1 ALA 37 86.744 -12.629 -1.387 52 2HB ALA 37 HB2 ALA 37 86.829 -13.831 -0.100 53 3HB ALA 37 HB3 ALA 37 87.251 -12.151 0.233 54 H VAL 38 HN VAL 38 84.909 -9.981 0.187 55 HA VAL 38 HA VAL 38 83.980 -9.594 -2.614 56 HB VAL 38 HB VAL 38 81.875 -8.705 -1.953 57 1HG1 VAL 38 HG11 VAL 38 82.128 -11.214 -1.605 58 2HG1 VAL 38 HG12 VAL 38 80.814 -10.456 -0.709 59 3HG1 VAL 38 HG13 VAL 38 82.318 -10.871 0.113 60 1HG2 VAL 38 HG21 VAL 38 81.313 -8.156 0.390 61 2HG2 VAL 38 HG22 VAL 38 82.736 -7.259 -0.139 62 3HG2 VAL 38 HG23 VAL 38 82.920 -8.674 0.899 63 H LYS 39 HN LYS 39 84.393 -7.261 -3.319 64 HA LYS 39 HA LYS 39 86.283 -5.971 -1.420 65 1HB LYS 39 HB2 LYS 39 86.589 -6.211 -3.906 66 2HB LYS 39 HB1 LYS 39 85.237 -5.098 -4.114 67 1HG LYS 39 HG2 LYS 39 87.532 -4.005 -4.199 68 2HG LYS 39 HG1 LYS 39 86.442 -3.327 -2.980 69 1HD LYS 39 HD2 LYS 39 87.731 -4.059 -1.254 70 2HD LYS 39 HD1 LYS 39 88.040 -5.619 -2.029 71 1HE LYS 39 HE2 LYS 39 89.336 -3.162 -3.180 72 2HE LYS 39 HE1 LYS 39 90.027 -3.897 -1.720 73 1HZ LYS 39 HZ1 LYS 39 89.980 -6.051 -2.854 74 2HZ LYS 39 HZ2 LYS 39 90.942 -4.936 -3.702 75 3HZ LYS 39 HZ3 LYS 39 89.381 -5.313 -4.259 76 H VAL 40 HN VAL 40 84.885 -5.238 0.271 77 HA VAL 40 HA VAL 40 82.524 -3.599 -0.374 78 HB VAL 40 HB VAL 40 82.697 -5.357 1.421 79 1HG1 VAL 40 HG11 VAL 40 85.028 -4.710 2.103 80 2HG1 VAL 40 HG12 VAL 40 83.908 -4.833 3.459 81 3HG1 VAL 40 HG13 VAL 40 84.359 -3.248 2.830 82 1HG2 VAL 40 HG21 VAL 40 80.883 -4.122 1.992 83 2HG2 VAL 40 HG22 VAL 40 81.722 -2.595 1.716 84 3HG2 VAL 40 HG23 VAL 40 81.930 -3.452 3.244 85 H ARG 41 HN ARG 41 82.279 -1.435 0.137 86 HA ARG 41 HA ARG 41 84.639 0.106 1.144 87 1HB ARG 41 HB2 ARG 41 82.904 1.003 -1.173 88 2HB ARG 41 HB1 ARG 41 84.512 1.575 -0.733 89 1HG ARG 41 HG2 ARG 41 85.406 -0.714 -1.278 90 2HG ARG 41 HG1 ARG 41 83.802 -1.150 -1.865 91 1HD ARG 41 HD2 ARG 41 84.143 1.127 -3.266 92 2HD ARG 41 HD1 ARG 41 85.844 0.645 -3.092 93 HE ARG 41 HE ARG 41 84.116 -1.581 -3.828 94 1HH1 ARG 41 HH11 ARG 41 86.937 -1.268 -4.768 95 2HH1 ARG 41 HH12 ARG 41 86.725 -0.843 -6.434 96 1HH2 ARG 41 HH21 ARG 41 83.391 0.016 -6.070 97 2HH2 ARG 41 HH22 ARG 41 84.721 -0.116 -7.168 98 H HIS 42 HN HIS 42 83.918 2.059 2.339 99 HA HIS 42 HA HIS 42 80.946 2.210 2.673 100 1HB HIS 42 HB2 HIS 42 81.146 1.908 4.960 101 2HB HIS 42 HB1 HIS 42 82.483 0.910 4.382 102 HD1 HIS 42 HD1 HIS 42 81.767 3.577 6.699 103 HD2 HIS 42 HD2 HIS 42 85.043 2.551 4.335 104 HE1 HIS 42 HE1 HIS 42 83.759 4.810 7.661 105 H ILE 43 HN ILE 43 80.065 4.212 3.002 106 HA ILE 43 HA ILE 43 81.875 6.597 3.264 107 HB ILE 43 HB ILE 43 79.642 5.948 1.337 108 1HG1 ILE 43 HG12 ILE 43 82.359 7.283 1.090 109 2HG1 ILE 43 HG11 ILE 43 81.936 5.647 0.561 110 1HG2 ILE 43 HG21 ILE 43 80.551 8.745 2.084 111 2HG2 ILE 43 HG22 ILE 43 78.979 8.050 2.474 112 3HG2 ILE 43 HG23 ILE 43 79.424 8.336 0.791 113 1HD1 ILE 43 HD11 ILE 43 81.614 6.712 -1.451 114 2HD1 ILE 43 HD12 ILE 43 81.301 8.274 -0.696 115 3HD1 ILE 43 HD13 ILE 43 80.031 7.052 -0.752 116 H LEU 44 HN LEU 44 81.145 8.008 4.949 117 HA LEU 44 HA LEU 44 78.395 7.403 6.048 118 1HB LEU 44 HB2 LEU 44 80.678 8.552 7.639 119 2HB LEU 44 HB1 LEU 44 79.276 7.639 8.209 120 HG LEU 44 HG LEU 44 81.601 6.570 6.607 121 1HD1 LEU 44 HD11 LEU 44 80.599 6.243 9.444 122 2HD1 LEU 44 HD12 LEU 44 82.203 6.768 8.919 123 3HD1 LEU 44 HD13 LEU 44 81.709 5.085 8.709 124 1HD2 LEU 44 HD21 LEU 44 79.909 4.518 7.542 125 2HD2 LEU 44 HD22 LEU 44 80.085 5.053 5.869 126 3HD2 LEU 44 HD23 LEU 44 78.830 5.760 6.899 127 H CYS 45 HN CYS 45 77.211 9.161 6.850 128 HA CYS 45 HA CYS 45 78.325 11.868 6.167 129 1HB CYS 45 HB2 CYS 45 75.633 10.625 5.631 130 2HB CYS 45 HB1 CYS 45 75.853 12.378 5.620 131 HG CYS 45 HG CYS 45 76.768 10.472 3.443 132 H GLU 46 HN GLU 46 76.981 9.873 8.561 133 HA GLU 46 HA GLU 46 76.482 10.294 10.831 134 1HB GLU 46 HB2 GLU 46 78.345 12.128 10.071 135 2HB GLU 46 HB1 GLU 46 77.015 13.199 10.508 136 1HG GLU 46 HG2 GLU 46 76.916 11.526 12.614 137 2HG GLU 46 HG1 GLU 46 78.630 11.378 12.227 138 H LYS 47 HN LYS 47 75.607 13.168 8.946 139 HA LYS 47 HA LYS 47 72.880 13.133 10.141 140 1HB LYS 47 HB2 LYS 47 72.839 15.442 9.392 141 2HB LYS 47 HB1 LYS 47 74.412 15.154 10.137 142 1HG LYS 47 HG2 LYS 47 74.964 14.439 7.579 143 2HG LYS 47 HG1 LYS 47 73.738 15.677 7.301 144 1HD LYS 47 HD2 LYS 47 75.807 16.857 7.360 145 2HD LYS 47 HD1 LYS 47 75.071 17.138 8.937 146 1HE LYS 47 HE2 LYS 47 76.498 14.772 9.308 147 2HE LYS 47 HE1 LYS 47 77.567 15.754 8.290 148 1HZ LYS 47 HZ1 LYS 47 77.576 17.474 9.809 149 2HZ LYS 47 HZ2 LYS 47 77.544 16.131 10.849 150 3HZ LYS 47 HZ3 LYS 47 76.117 17.000 10.533 151 H HIS 48 HN HIS 48 74.673 12.389 7.319 152 HA HIS 48 HA HIS 48 74.060 11.548 5.236 153 1HB HIS 48 HB2 HIS 48 71.852 10.987 7.118 154 2HB HIS 48 HB1 HIS 48 71.511 10.738 5.401 155 HD1 HIS 48 HD1 HIS 48 74.699 10.175 7.417 156 HD2 HIS 48 HD2 HIS 48 72.117 8.054 4.925 157 HE1 HIS 48 HE1 HIS 48 75.808 7.934 6.996 158 H GLY 49 HN GLY 49 73.582 14.423 5.950 159 1HA GLY 49 HA2 GLY 49 71.274 15.268 4.391 160 2HA GLY 49 HA1 GLY 49 72.584 16.323 4.958 161 H LYS 50 HN LYS 50 74.527 14.289 3.786 162 HA LYS 50 HA LYS 50 74.252 15.063 0.900 163 1HB LYS 50 HB2 LYS 50 76.576 15.528 0.875 164 2HB LYS 50 HB1 LYS 50 76.029 16.197 2.409 165 1HG LYS 50 HG2 LYS 50 76.959 13.356 2.397 166 2HG LYS 50 HG1 LYS 50 78.174 14.618 2.258 167 1HD LYS 50 HD2 LYS 50 76.514 15.559 4.272 168 2HD LYS 50 HD1 LYS 50 76.582 13.823 4.580 169 1HE LYS 50 HE2 LYS 50 79.127 14.014 4.330 170 2HE LYS 50 HE1 LYS 50 78.899 15.775 4.402 171 1HZ LYS 50 HZ1 LYS 50 78.990 15.360 6.622 172 2HZ LYS 50 HZ2 LYS 50 78.473 13.750 6.467 173 3HZ LYS 50 HZ3 LYS 50 77.344 15.018 6.406 174 H ILE 51 HN ILE 51 74.287 12.483 3.081 175 HA ILE 51 HA ILE 51 75.804 10.477 1.813 176 HB ILE 51 HB ILE 51 74.407 10.313 3.923 177 1HG1 ILE 51 HG12 ILE 51 73.490 7.939 3.237 178 2HG1 ILE 51 HG11 ILE 51 74.346 8.268 1.724 179 1HG2 ILE 51 HG21 ILE 51 72.060 9.947 3.792 180 2HG2 ILE 51 HG22 ILE 51 72.117 9.722 2.044 181 3HG2 ILE 51 HG23 ILE 51 72.366 11.325 2.735 182 1HD1 ILE 51 HD11 ILE 51 75.777 8.756 4.311 183 2HD1 ILE 51 HD12 ILE 51 76.429 8.267 2.747 184 3HD1 ILE 51 HD13 ILE 51 75.587 7.093 3.760 185 H MET 52 HN MET 52 72.711 11.939 0.928 186 HA MET 52 HA MET 52 72.254 10.172 -1.334 187 1HB MET 52 HB2 MET 52 70.834 12.069 0.172 188 2HB MET 52 HB1 MET 52 70.972 12.785 -1.434 189 1HG MET 52 HG2 MET 52 70.289 9.912 -1.401 190 2HG MET 52 HG1 MET 52 69.053 10.978 -0.736 191 1HE MET 52 HE1 MET 52 71.561 12.305 -3.706 192 2HE MET 52 HE2 MET 52 70.985 11.111 -4.866 193 3HE MET 52 HE3 MET 52 71.662 10.579 -3.329 194 H GLU 53 HN GLU 53 73.326 13.536 -0.938 195 HA GLU 53 HA GLU 53 73.935 14.136 -3.634 196 1HB GLU 53 HB2 GLU 53 74.233 15.325 -1.145 197 2HB GLU 53 HB1 GLU 53 75.906 15.009 -1.606 198 1HG GLU 53 HG2 GLU 53 75.345 16.068 -3.860 199 2HG GLU 53 HG1 GLU 53 73.835 16.606 -3.123 200 H ALA 54 HN ALA 54 75.407 12.182 -1.176 201 HA ALA 54 HA ALA 54 77.902 11.655 -2.631 202 1HB ALA 54 HB1 ALA 54 77.235 11.554 -0.058 203 2HB ALA 54 HB2 ALA 54 78.423 10.424 -0.707 204 3HB ALA 54 HB3 ALA 54 76.754 9.907 -0.470 205 H MET 55 HN MET 55 74.712 10.204 -2.230 206 HA MET 55 HA MET 55 75.395 7.747 -3.692 207 1HB MET 55 HB2 MET 55 72.900 9.095 -2.662 208 2HB MET 55 HB1 MET 55 72.786 7.658 -3.685 209 1HG MET 55 HG2 MET 55 73.534 6.279 -2.040 210 2HG MET 55 HG1 MET 55 74.749 7.441 -1.489 211 1HE MET 55 HE1 MET 55 70.509 6.703 -0.579 212 2HE MET 55 HE2 MET 55 71.630 5.763 0.402 213 3HE MET 55 HE3 MET 55 71.786 5.756 -1.353 214 H GLU 56 HN GLU 56 73.764 10.823 -4.431 215 HA GLU 56 HA GLU 56 73.036 10.186 -7.143 216 1HB GLU 56 HB2 GLU 56 72.782 12.287 -5.255 217 2HB GLU 56 HB1 GLU 56 73.561 12.991 -6.672 218 1HG GLU 56 HG2 GLU 56 71.368 11.179 -7.373 219 2HG GLU 56 HG1 GLU 56 70.838 12.541 -6.385 220 H LYS 57 HN LYS 57 75.637 12.340 -5.900 221 HA LYS 57 HA LYS 57 77.060 12.870 -8.217 222 1HB LYS 57 HB2 LYS 57 77.970 12.115 -5.426 223 2HB LYS 57 HB1 LYS 57 79.085 12.729 -6.647 224 1HG LYS 57 HG2 LYS 57 76.576 14.276 -6.212 225 2HG LYS 57 HG1 LYS 57 77.796 14.357 -4.939 226 1HD LYS 57 HD2 LYS 57 78.680 14.678 -7.779 227 2HD LYS 57 HD1 LYS 57 77.864 16.035 -7.001 228 1HE LYS 57 HE2 LYS 57 79.870 14.850 -5.238 229 2HE LYS 57 HE1 LYS 57 80.583 15.412 -6.763 230 1HZ LYS 57 HZ1 LYS 57 78.553 17.069 -5.423 231 2HZ LYS 57 HZ2 LYS 57 79.833 17.545 -6.433 232 3HZ LYS 57 HZ3 LYS 57 80.139 17.092 -4.824 233 H LEU 58 HN LEU 58 77.768 10.084 -6.090 234 HA LEU 58 HA LEU 58 79.508 8.628 -7.717 235 1HB LEU 58 HB2 LEU 58 77.221 7.739 -5.922 236 2HB LEU 58 HB1 LEU 58 78.504 6.666 -6.495 237 HG LEU 58 HG LEU 58 78.998 9.218 -4.935 238 1HD1 LEU 58 HD11 LEU 58 77.768 7.129 -3.831 239 2HD1 LEU 58 HD12 LEU 58 79.024 8.009 -2.961 240 3HD1 LEU 58 HD13 LEU 58 79.412 6.493 -3.774 241 1HD2 LEU 58 HD21 LEU 58 80.680 7.572 -6.486 242 2HD2 LEU 58 HD22 LEU 58 81.037 7.177 -4.803 243 3HD2 LEU 58 HD23 LEU 58 81.168 8.844 -5.365 244 H LYS 59 HN LYS 59 75.963 8.786 -7.855 245 HA LYS 59 HA LYS 59 75.684 6.796 -9.953 246 1HB LYS 59 HB2 LYS 59 73.705 6.939 -8.849 247 2HB LYS 59 HB1 LYS 59 74.107 8.508 -8.183 248 1HG LYS 59 HG2 LYS 59 73.085 9.649 -9.900 249 2HG LYS 59 HG1 LYS 59 73.335 8.352 -11.069 250 1HD LYS 59 HD2 LYS 59 71.688 6.997 -9.587 251 2HD LYS 59 HD1 LYS 59 71.251 8.560 -8.897 252 1HE LYS 59 HE2 LYS 59 70.919 9.345 -11.340 253 2HE LYS 59 HE1 LYS 59 70.934 7.621 -11.755 254 1HZ LYS 59 HZ1 LYS 59 69.210 7.232 -10.121 255 2HZ LYS 59 HZ2 LYS 59 68.685 8.423 -11.215 256 3HZ LYS 59 HZ3 LYS 59 69.219 8.865 -9.664 257 H SER 60 HN SER 60 74.792 10.245 -9.999 258 HA SER 60 HA SER 60 74.496 10.769 -12.664 259 1HB SER 60 HB2 SER 60 76.269 12.696 -11.299 260 2HB SER 60 HB1 SER 60 74.649 12.933 -11.953 261 HG SER 60 HG SER 60 75.384 11.781 -9.475 262 H GLY 61 HN GLY 61 77.649 10.580 -10.991 263 1HA GLY 61 HA2 GLY 61 79.358 9.306 -12.442 264 2HA GLY 61 HA1 GLY 61 78.951 10.502 -13.679 265 H MET 62 HN MET 62 79.147 11.399 -10.269 266 HA MET 62 HA MET 62 81.332 13.267 -10.956 267 1HB MET 62 HB2 MET 62 79.104 13.153 -9.182 268 2HB MET 62 HB1 MET 62 80.556 13.256 -8.184 269 1HG MET 62 HG2 MET 62 80.089 15.517 -8.619 270 2HG MET 62 HG1 MET 62 81.270 15.128 -9.868 271 1HE MET 62 HE1 MET 62 76.721 15.552 -10.336 272 2HE MET 62 HE2 MET 62 77.686 16.130 -8.981 273 3HE MET 62 HE3 MET 62 77.501 14.397 -9.246 274 H ARG 63 HN ARG 63 83.064 13.417 -9.070 275 HA ARG 63 HA ARG 63 84.825 11.295 -9.087 276 1HB ARG 63 HB2 ARG 63 84.089 13.040 -6.725 277 2HB ARG 63 HB1 ARG 63 85.629 12.197 -6.944 278 1HG ARG 63 HG2 ARG 63 86.417 13.857 -8.177 279 2HG ARG 63 HG1 ARG 63 85.033 13.777 -9.275 280 1HD ARG 63 HD2 ARG 63 83.856 15.428 -8.127 281 2HD ARG 63 HD1 ARG 63 84.608 15.021 -6.567 282 HE ARG 63 HE ARG 63 86.769 15.913 -7.935 283 1HH1 ARG 63 HH21 ARG 63 84.925 17.647 -6.103 284 2HH1 ARG 63 HH22 ARG 63 84.775 19.061 -7.093 285 1HH2 ARG 63 HH11 ARG 63 85.988 17.514 -9.948 286 2HH2 ARG 63 HH12 ARG 63 85.375 18.985 -9.270 287 H PHE 64 HN PHE 64 85.137 9.412 -7.798 288 HA PHE 64 HA PHE 64 82.725 8.447 -6.370 289 1HB PHE 64 HB2 PHE 64 85.050 7.343 -7.781 290 2HB PHE 64 HB1 PHE 64 84.775 6.545 -6.232 291 HD1 PHE 64 HD1 PHE 64 82.547 5.511 -5.737 292 HD2 PHE 64 HD2 PHE 64 83.552 7.045 -9.620 293 HE1 PHE 64 HE1 PHE 64 80.659 4.244 -6.725 294 HE2 PHE 64 HE2 PHE 64 81.664 5.779 -10.609 295 HZ PHE 64 HZ PHE 64 80.217 4.378 -9.160 296 H ASN 65 HN ASN 65 86.180 9.150 -5.860 297 HA ASN 65 HA ASN 65 85.895 8.660 -2.964 298 1HB ASN 65 HB2 ASN 65 88.247 8.699 -2.935 299 2HB ASN 65 HB1 ASN 65 87.813 7.932 -4.457 300 1HD2 ASN 65 HD21 ASN 65 90.267 9.593 -3.704 301 2HD2 ASN 65 HD22 ASN 65 90.330 10.818 -4.878 302 H GLU 66 HN GLU 66 86.425 11.534 -5.090 303 HA GLU 66 HA GLU 66 87.106 13.398 -3.075 304 1HB GLU 66 HB2 GLU 66 85.205 13.670 -5.425 305 2HB GLU 66 HB1 GLU 66 85.842 15.033 -4.521 306 1HG GLU 66 HG2 GLU 66 87.471 12.999 -6.072 307 2HG GLU 66 HG1 GLU 66 87.202 14.682 -6.523 308 H VAL 67 HN VAL 67 83.851 12.461 -4.165 309 HA VAL 67 HA VAL 67 82.300 13.689 -2.159 310 HB VAL 67 HB VAL 67 80.963 11.383 -2.498 311 1HG1 VAL 67 HG11 VAL 67 81.126 13.831 -3.959 312 2HG1 VAL 67 HG12 VAL 67 79.740 12.758 -3.764 313 3HG1 VAL 67 HG13 VAL 67 80.864 12.509 -5.100 314 1HG2 VAL 67 HG21 VAL 67 82.252 11.170 -5.072 315 2HG2 VAL 67 HG22 VAL 67 81.793 9.902 -3.942 316 3HG2 VAL 67 HG23 VAL 67 83.328 10.757 -3.747 317 H ALA 68 HN ALA 68 82.871 10.185 -2.093 318 HA ALA 68 HA ALA 68 82.577 9.500 0.499 319 1HB ALA 68 HB1 ALA 68 84.518 7.919 0.036 320 2HB ALA 68 HB2 ALA 68 84.752 8.793 -1.477 321 3HB ALA 68 HB3 ALA 68 83.243 7.931 -1.184 322 H ALA 69 HN ALA 69 85.323 11.295 -0.847 323 HA ALA 69 HA ALA 69 87.149 11.202 1.260 324 1HB ALA 69 HB1 ALA 69 86.519 13.880 0.102 325 2HB ALA 69 HB2 ALA 69 86.916 12.608 -1.049 326 3HB ALA 69 HB3 ALA 69 88.067 13.047 0.210 327 H GLN 70 HN GLN 70 84.904 13.985 0.937 328 HA GLN 70 HA GLN 70 84.778 13.881 3.872 329 1HB GLN 70 HB2 GLN 70 84.439 15.967 1.865 330 2HB GLN 70 HB1 GLN 70 83.230 16.029 3.141 331 1HG GLN 70 HG2 GLN 70 86.207 16.309 3.381 332 2HG GLN 70 HG1 GLN 70 84.937 17.305 4.101 333 1HE2 GLN 70 HE21 GLN 70 83.529 14.626 5.083 334 2HE2 GLN 70 HE22 GLN 70 84.479 14.119 6.396 335 H TYR 71 HN TYR 71 82.605 13.760 1.104 336 HA TYR 71 HA TYR 71 80.105 13.800 2.265 337 1HB TYR 71 HB2 TYR 71 81.267 11.917 0.199 338 2HB TYR 71 HB1 TYR 71 79.547 12.006 0.543 339 HD1 TYR 71 HD1 TYR 71 79.198 12.680 -1.829 340 HD2 TYR 71 HD2 TYR 71 81.481 15.142 0.881 341 HE1 TYR 71 HE1 TYR 71 78.949 14.613 -3.358 342 HE2 TYR 71 HE2 TYR 71 81.220 17.054 -0.656 343 HH TYR 71 HH TYR 71 80.332 17.796 -2.534 344 H SER 72 HN SER 72 82.611 11.404 2.579 345 HA SER 72 HA SER 72 80.947 9.553 4.116 346 1HB SER 72 HB2 SER 72 82.963 8.991 2.637 347 2HB SER 72 HB1 SER 72 83.968 9.702 3.900 348 HG SER 72 HG SER 72 83.862 7.621 4.465 349 H GLU 73 HN GLU 73 83.421 9.352 6.048 350 HA GLU 73 HA GLU 73 82.993 11.864 7.600 351 1HB GLU 73 HB2 GLU 73 82.237 9.041 8.297 352 2HB GLU 73 HB1 GLU 73 82.673 10.172 9.574 353 1HG GLU 73 HG2 GLU 73 80.657 10.936 7.470 354 2HG GLU 73 HG1 GLU 73 80.167 10.019 8.894 355 H ASP 74 HN ASP 74 85.187 10.196 6.175 356 HA ASP 74 HA ASP 74 87.471 10.915 7.616 357 1HB ASP 74 HB2 ASP 74 86.725 9.704 9.543 358 2HB ASP 74 HB1 ASP 74 86.190 8.339 8.568 359 H LYS 75 HN LYS 75 87.094 7.480 7.036 360 HA LYS 75 HA LYS 75 89.252 7.198 5.253 361 1HB LYS 75 HB2 LYS 75 88.025 5.435 6.549 362 2HB LYS 75 HB1 LYS 75 86.694 5.571 5.400 363 1HG LYS 75 HG2 LYS 75 87.876 3.832 4.431 364 2HG LYS 75 HG1 LYS 75 88.649 5.200 3.632 365 1HD LYS 75 HD2 LYS 75 90.496 5.153 5.181 366 2HD LYS 75 HD1 LYS 75 89.678 3.971 6.204 367 1HE LYS 75 HE2 LYS 75 89.802 2.297 4.397 368 2HE LYS 75 HE1 LYS 75 90.581 3.489 3.338 369 1HZ LYS 75 HZ1 LYS 75 91.990 1.887 4.877 370 2HZ LYS 75 HZ2 LYS 75 91.686 3.105 6.023 371 3HZ LYS 75 HZ3 LYS 75 92.484 3.480 4.570 372 H ALA 76 HN ALA 76 89.255 6.812 2.932 373 HA ALA 76 HA ALA 76 86.879 7.493 1.347 374 1HB ALA 76 HB1 ALA 76 87.792 9.549 0.457 375 2HB ALA 76 HB2 ALA 76 89.330 9.281 1.278 376 3HB ALA 76 HB3 ALA 76 87.883 9.653 2.216 377 H ARG 77 HN ARG 77 89.498 8.480 -0.451 378 HA ARG 77 HA ARG 77 90.950 7.420 -1.995 379 1HB ARG 77 HB2 ARG 77 91.228 6.046 0.252 380 2HB ARG 77 HB1 ARG 77 90.370 4.800 -0.652 381 1HG ARG 77 HG2 ARG 77 92.049 4.748 -2.354 382 2HG ARG 77 HG1 ARG 77 92.803 6.223 -1.749 383 1HD ARG 77 HD2 ARG 77 94.045 5.053 -0.246 384 2HD ARG 77 HD1 ARG 77 92.619 4.161 0.323 385 HE ARG 77 HE ARG 77 93.141 3.142 -2.229 386 1HH1 ARG 77 HH21 ARG 77 95.872 3.968 -0.717 387 2HH1 ARG 77 HH22 ARG 77 96.412 2.373 -0.311 388 1HH2 ARG 77 HH11 ARG 77 93.386 0.865 -1.081 389 2HH2 ARG 77 HH12 ARG 77 95.005 0.616 -0.518 390 H GLN 78 HN GLN 78 87.723 6.939 -1.714 391 HA GLN 78 HA GLN 78 87.027 6.342 -4.330 392 1HB GLN 78 HB2 GLN 78 88.249 4.311 -4.390 393 2HB GLN 78 HB1 GLN 78 87.825 3.911 -2.720 394 1HG GLN 78 HG2 GLN 78 85.623 4.162 -4.759 395 2HG GLN 78 HG1 GLN 78 86.603 2.689 -4.731 396 1HE2 GLN 78 HE21 GLN 78 83.747 3.783 -3.595 397 2HE2 GLN 78 HE22 GLN 78 83.659 2.966 -2.109 398 H GLY 79 HN GLY 79 86.403 4.855 -1.180 399 1HA GLY 79 HA2 GLY 79 84.044 6.224 -0.577 400 2HA GLY 79 HA1 GLY 79 83.564 4.783 -1.450 401 H GLY 80 HN GLY 80 86.378 5.059 0.659 402 1HA GLY 80 HA2 GLY 80 86.814 4.098 2.768 403 2HA GLY 80 HA1 GLY 80 85.089 3.769 2.926 404 H ASP 81 HN ASP 81 87.268 2.744 0.302 405 HA ASP 81 HA ASP 81 86.254 0.092 0.166 406 1HB ASP 81 HB2 ASP 81 87.806 1.616 -1.367 407 2HB ASP 81 HB1 ASP 81 89.095 0.735 -0.539 408 H LEU 82 HN LEU 82 86.266 -0.362 2.614 409 HA LEU 82 HA LEU 82 88.501 -0.631 4.254 410 1HB LEU 82 HB2 LEU 82 85.930 -2.109 3.857 411 2HB LEU 82 HB1 LEU 82 87.117 -2.809 4.959 412 HG LEU 82 HG LEU 82 87.253 -0.427 5.981 413 1HD1 LEU 82 HD11 LEU 82 84.993 -0.219 4.066 414 2HD1 LEU 82 HD12 LEU 82 86.072 1.035 4.677 415 3HD1 LEU 82 HD13 LEU 82 84.720 0.478 5.664 416 1HD2 LEU 82 HD21 LEU 82 84.891 -0.941 7.126 417 2HD2 LEU 82 HD22 LEU 82 86.306 -1.947 7.439 418 3HD2 LEU 82 HD23 LEU 82 85.092 -2.470 6.270 419 H GLY 83 HN GLY 83 87.706 -2.498 1.403 420 1HA GLY 83 HA2 GLY 83 89.500 -3.690 0.226 421 2HA GLY 83 HA1 GLY 83 90.227 -4.048 1.799 422 H TRP 84 HN TRP 84 89.890 -6.182 0.187 423 HA TRP 84 HA TRP 84 87.572 -7.639 -0.055 424 1HB TRP 84 HB2 TRP 84 90.398 -8.268 0.702 425 2HB TRP 84 HB1 TRP 84 89.225 -9.575 0.756 426 HD1 TRP 84 HD1 TRP 84 91.426 -7.797 -1.532 427 HE1 TRP 84 HE1 TRP 84 90.897 -8.384 -3.988 428 HE3 TRP 84 HE3 TRP 84 86.938 -10.131 -0.917 429 HZ2 TRP 84 HZ2 TRP 84 88.835 -9.684 -5.488 430 HZ3 TRP 84 HZ3 TRP 84 85.715 -11.035 -2.874 431 HH2 TRP 84 HH2 TRP 84 86.648 -10.815 -5.149 432 H MET 85 HN MET 85 86.301 -8.995 1.349 433 HA MET 85 HA MET 85 86.888 -8.889 4.269 434 1HB MET 85 HB2 MET 85 85.136 -7.136 2.937 435 2HB MET 85 HB1 MET 85 84.091 -8.330 3.709 436 1HG MET 85 HG2 MET 85 84.475 -6.531 5.288 437 2HG MET 85 HG1 MET 85 85.357 -7.952 5.850 438 1HE MET 85 HE1 MET 85 87.576 -5.590 7.214 439 2HE MET 85 HE2 MET 85 85.839 -5.883 7.176 440 3HE MET 85 HE3 MET 85 86.490 -4.392 6.497 441 H THR 86 HN THR 86 86.298 -10.821 5.240 442 HA THR 86 HA THR 86 84.445 -12.619 3.726 443 HB THR 86 HB THR 86 86.102 -14.369 4.868 444 HG1 THR 86 HG1 THR 86 88.237 -13.100 4.440 445 1HG2 THR 86 HG21 THR 86 86.064 -14.594 2.594 446 2HG2 THR 86 HG22 THR 86 87.638 -13.809 2.728 447 3HG2 THR 86 HG23 THR 86 86.211 -12.859 2.319 448 H ARG 87 HN ARG 87 83.119 -13.962 5.047 449 HA ARG 87 HA ARG 87 82.082 -12.967 7.436 450 1HB ARG 87 HB2 ARG 87 81.661 -15.107 5.784 451 2HB ARG 87 HB1 ARG 87 82.249 -15.913 7.238 452 1HG ARG 87 HG2 ARG 87 80.132 -13.777 7.424 453 2HG ARG 87 HG1 ARG 87 79.693 -15.440 7.033 454 1HD ARG 87 HD2 ARG 87 81.497 -15.591 9.220 455 2HD ARG 87 HD1 ARG 87 80.321 -14.323 9.615 456 HE ARG 87 HE ARG 87 78.525 -15.983 9.115 457 1HH1 ARG 87 HH11 ARG 87 81.139 -17.589 7.987 458 2HH1 ARG 87 HH12 ARG 87 80.970 -19.003 8.973 459 1HH2 ARG 87 HH21 ARG 87 78.564 -17.599 11.037 460 2HH2 ARG 87 HH22 ARG 87 79.512 -19.009 10.700 461 H GLY 88 HN GLY 88 83.479 -12.361 9.087 462 1HA GLY 88 HA2 GLY 88 84.396 -14.024 11.054 463 2HA GLY 88 HA1 GLY 88 85.723 -14.073 9.883 464 H SER 89 HN SER 89 86.223 -11.689 9.030 465 HA SER 89 HA SER 89 87.095 -10.163 11.351 466 1HB SER 89 HB2 SER 89 87.059 -9.118 8.534 467 2HB SER 89 HB1 SER 89 88.336 -8.997 9.753 468 HG SER 89 HG SER 89 88.918 -10.507 8.196 469 H MET 90 HN MET 90 84.281 -10.180 9.334 470 HA MET 90 HA MET 90 83.444 -7.461 9.502 471 1HB MET 90 HB2 MET 90 82.493 -9.998 8.625 472 2HB MET 90 HB1 MET 90 81.238 -9.304 9.653 473 1HG MET 90 HG2 MET 90 80.732 -8.415 7.532 474 2HG MET 90 HG1 MET 90 81.659 -7.121 8.291 475 1HE MET 90 HE1 MET 90 82.198 -8.174 4.296 476 2HE MET 90 HE2 MET 90 80.843 -8.014 5.412 477 3HE MET 90 HE3 MET 90 81.576 -9.595 5.149 478 H VAL 91 HN VAL 91 80.914 -7.611 10.790 479 HA VAL 91 HA VAL 91 81.697 -8.020 13.659 480 HB VAL 91 HB VAL 91 80.229 -5.979 14.040 481 1HG1 VAL 91 HG11 VAL 91 82.466 -5.313 12.140 482 2HG1 VAL 91 HG12 VAL 91 82.819 -6.061 13.698 483 3HG1 VAL 91 HG13 VAL 91 82.004 -4.499 13.634 484 1HG2 VAL 91 HG21 VAL 91 79.086 -6.282 11.769 485 2HG2 VAL 91 HG22 VAL 91 80.545 -5.597 11.055 486 3HG2 VAL 91 HG23 VAL 91 79.577 -4.637 12.174 487 H GLY 92 HN GLY 92 79.150 -8.140 11.219 488 1HA GLY 92 HA2 GLY 92 77.711 -10.287 11.902 489 2HA GLY 92 HA1 GLY 92 77.212 -9.189 13.198 490 HA PRO 93 HA PRO 93 74.192 -7.284 10.665 491 1HB PRO 93 HB2 PRO 93 75.084 -4.577 11.071 492 2HB PRO 93 HB1 PRO 93 73.759 -5.423 11.888 493 1HG PRO 93 HG2 PRO 93 76.318 -4.682 12.971 494 2HG PRO 93 HG1 PRO 93 74.995 -5.517 13.787 495 1HD PRO 93 HD2 PRO 93 77.525 -6.616 12.937 496 2HD PRO 93 HD1 PRO 93 76.186 -7.461 13.750 497 H PHE 94 HN PHE 94 77.514 -6.107 10.272 498 HA PHE 94 HA PHE 94 77.194 -4.853 7.709 499 1HB PHE 94 HB2 PHE 94 79.100 -4.796 9.481 500 2HB PHE 94 HB1 PHE 94 79.680 -6.265 8.682 501 HD1 PHE 94 HD1 PHE 94 79.988 -6.171 6.113 502 HD2 PHE 94 HD2 PHE 94 79.619 -2.680 8.592 503 HE1 PHE 94 HE1 PHE 94 81.019 -4.793 4.328 504 HE2 PHE 94 HE2 PHE 94 80.652 -1.305 6.805 505 HZ PHE 94 HZ PHE 94 81.352 -2.360 4.673 506 H GLN 95 HN GLN 95 78.565 -8.076 8.520 507 HA GLN 95 HA GLN 95 78.831 -9.055 5.881 508 1HB GLN 95 HB2 GLN 95 79.796 -10.185 7.773 509 2HB GLN 95 HB1 GLN 95 78.219 -10.370 8.541 510 1HG GLN 95 HG2 GLN 95 77.969 -11.533 5.981 511 2HG GLN 95 HG1 GLN 95 79.515 -12.097 6.617 512 1HE2 GLN 95 HE21 GLN 95 77.844 -14.148 6.489 513 2HE2 GLN 95 HE22 GLN 95 77.093 -14.502 7.970 514 H GLU 96 HN GLU 96 76.041 -9.322 8.108 515 HA GLU 96 HA GLU 96 74.269 -10.901 6.698 516 1HB GLU 96 HB2 GLU 96 74.191 -8.712 8.604 517 2HB GLU 96 HB1 GLU 96 72.781 -8.666 7.546 518 1HG GLU 96 HG2 GLU 96 72.241 -10.972 8.089 519 2HG GLU 96 HG1 GLU 96 73.728 -11.140 9.022 520 H ALA 97 HN ALA 97 74.606 -7.361 6.207 521 HA ALA 97 HA ALA 97 73.058 -7.501 3.704 522 1HB ALA 97 HB1 ALA 97 72.624 -5.399 4.406 523 2HB ALA 97 HB2 ALA 97 74.315 -4.977 4.130 524 3HB ALA 97 HB3 ALA 97 73.802 -5.584 5.705 525 H ALA 98 HN ALA 98 76.139 -5.859 4.371 526 HA ALA 98 HA ALA 98 77.245 -5.616 1.890 527 1HB ALA 98 HB1 ALA 98 78.396 -4.904 3.876 528 2HB ALA 98 HB2 ALA 98 79.456 -6.067 3.078 529 3HB ALA 98 HB3 ALA 98 78.503 -6.558 4.479 530 H PHE 99 HN PHE 99 78.097 -8.511 3.832 531 HA PHE 99 HA PHE 99 79.256 -10.082 1.871 532 1HB PHE 99 HB2 PHE 99 78.428 -10.389 4.451 533 2HB PHE 99 HB1 PHE 99 77.289 -11.458 3.617 534 HD1 PHE 99 HD1 PHE 99 77.970 -13.678 3.547 535 HD2 PHE 99 HD2 PHE 99 80.932 -10.580 3.263 536 HE1 PHE 99 HE1 PHE 99 79.745 -15.396 3.328 537 HE2 PHE 99 HE2 PHE 99 82.707 -12.297 3.044 538 HZ PHE 99 HZ PHE 99 82.113 -14.706 3.077 539 H ALA 100 HN ALA 100 75.857 -9.278 2.207 540 HA ALA 100 HA ALA 100 75.085 -11.225 0.093 541 1HB ALA 100 HB1 ALA 100 73.327 -9.261 1.573 542 2HB ALA 100 HB2 ALA 100 73.857 -10.766 2.325 543 3HB ALA 100 HB3 ALA 100 72.872 -10.810 0.863 544 H LEU 101 HN LEU 101 75.801 -7.864 0.544 545 HA LEU 101 HA LEU 101 74.258 -6.713 -1.569 546 1HB LEU 101 HB2 LEU 101 76.884 -6.025 -0.230 547 2HB LEU 101 HB1 LEU 101 76.103 -4.955 -1.401 548 HG LEU 101 HG LEU 101 75.054 -5.849 1.290 549 1HD1 LEU 101 HD11 LEU 101 74.749 -3.069 0.696 550 2HD1 LEU 101 HD12 LEU 101 76.401 -3.539 0.296 551 3HD1 LEU 101 HD13 LEU 101 75.774 -3.815 1.922 552 1HD2 LEU 101 HD21 LEU 101 73.132 -4.187 0.341 553 2HD2 LEU 101 HD22 LEU 101 73.034 -5.943 0.227 554 3HD2 LEU 101 HD23 LEU 101 73.603 -5.001 -1.150 555 HA PRO 102 HA PRO 102 76.519 -8.829 -4.878 556 1HB PRO 102 HB2 PRO 102 75.089 -7.164 -6.731 557 2HB PRO 102 HB1 PRO 102 74.802 -8.874 -6.372 558 1HG PRO 102 HG2 PRO 102 73.205 -6.581 -5.603 559 2HG PRO 102 HG1 PRO 102 72.858 -8.296 -5.345 560 1HD PRO 102 HD2 PRO 102 73.606 -6.369 -3.370 561 2HD PRO 102 HD1 PRO 102 73.417 -8.127 -3.138 562 H VAL 103 HN VAL 103 78.426 -8.055 -5.929 563 HA VAL 103 HA VAL 103 79.629 -5.647 -5.232 564 HB VAL 103 HB VAL 103 80.963 -7.226 -6.360 565 1HG1 VAL 103 HG11 VAL 103 79.873 -8.668 -7.672 566 2HG1 VAL 103 HG12 VAL 103 79.963 -7.450 -8.948 567 3HG1 VAL 103 HG13 VAL 103 78.549 -7.520 -7.900 568 1HG2 VAL 103 HG21 VAL 103 80.550 -5.531 -8.772 569 2HG2 VAL 103 HG22 VAL 103 82.043 -5.922 -7.921 570 3HG2 VAL 103 HG23 VAL 103 80.960 -4.682 -7.281 571 H SER 104 HN SER 104 79.634 -3.604 -6.059 572 HA SER 104 HA SER 104 78.625 -2.467 -8.371 573 1HB SER 104 HB2 SER 104 76.508 -3.447 -6.519 574 2HB SER 104 HB1 SER 104 76.248 -1.846 -7.221 575 HG SER 104 HG SER 104 76.136 -4.301 -8.387 576 H GLY 105 HN GLY 105 77.412 -1.755 -5.063 577 1HA GLY 105 HA2 GLY 105 78.160 -0.070 -3.571 578 2HA GLY 105 HA1 GLY 105 79.340 0.439 -4.771 579 H MET 106 HN MET 106 78.183 2.485 -3.634 580 HA MET 106 HA MET 106 77.118 4.494 -4.204 581 1HB MET 106 HB2 MET 106 77.761 3.583 -6.508 582 2HB MET 106 HB1 MET 106 76.093 3.033 -6.631 583 1HG MET 106 HG2 MET 106 76.176 5.771 -5.692 584 2HG MET 106 HG1 MET 106 77.084 5.615 -7.202 585 1HE MET 106 HE1 MET 106 74.763 3.156 -8.907 586 2HE MET 106 HE2 MET 106 76.387 3.808 -8.706 587 3HE MET 106 HE3 MET 106 75.256 4.602 -9.800 588 H ASP 107 HN ASP 107 74.456 3.181 -5.953 589 HA ASP 107 HA ASP 107 72.861 2.253 -3.738 590 1HB ASP 107 HB2 ASP 107 73.195 4.530 -2.964 591 2HB ASP 107 HB1 ASP 107 72.706 5.175 -4.530 592 H LYS 108 HN LYS 108 72.847 1.092 -6.164 593 HA LYS 108 HA LYS 108 70.130 1.612 -7.117 594 1HB LYS 108 HB2 LYS 108 71.056 3.229 -8.462 595 2HB LYS 108 HB1 LYS 108 72.612 2.413 -8.581 596 1HG LYS 108 HG2 LYS 108 71.417 0.634 -9.973 597 2HG LYS 108 HG1 LYS 108 70.032 1.722 -10.021 598 1HD LYS 108 HD2 LYS 108 72.831 2.314 -11.034 599 2HD LYS 108 HD1 LYS 108 71.392 2.063 -12.022 600 1HE LYS 108 HE2 LYS 108 71.529 4.257 -9.936 601 2HE LYS 108 HE1 LYS 108 72.046 4.511 -11.612 602 1HZ LYS 108 HZ1 LYS 108 69.754 5.020 -11.571 603 2HZ LYS 108 HZ2 LYS 108 69.379 3.660 -10.625 604 3HZ LYS 108 HZ3 LYS 108 69.848 3.467 -12.247 605 HA PRO 109 HA PRO 109 71.729 -2.294 -9.481 606 1HB PRO 109 HB2 PRO 109 74.401 -2.840 -8.581 607 2HB PRO 109 HB1 PRO 109 73.861 -2.470 -10.226 608 1HG PRO 109 HG2 PRO 109 75.339 -0.784 -8.403 609 2HG PRO 109 HG1 PRO 109 74.879 -0.453 -10.072 610 1HD PRO 109 HD2 PRO 109 73.812 0.759 -7.712 611 2HD PRO 109 HD1 PRO 109 73.256 0.970 -9.393 612 H VAL 110 HN VAL 110 73.363 -1.759 -6.339 613 HA VAL 110 HA VAL 110 73.174 -4.330 -5.232 614 HB VAL 110 HB VAL 110 74.193 -2.041 -4.445 615 1HG1 VAL 110 HG11 VAL 110 72.907 -0.766 -2.923 616 2HG1 VAL 110 HG12 VAL 110 71.687 -2.030 -2.768 617 3HG1 VAL 110 HG13 VAL 110 71.797 -1.089 -4.255 618 1HG2 VAL 110 HG21 VAL 110 73.656 -4.510 -3.189 619 2HG2 VAL 110 HG22 VAL 110 73.271 -3.268 -1.999 620 3HG2 VAL 110 HG23 VAL 110 74.876 -3.322 -2.730 621 H PHE 111 HN PHE 111 71.591 -4.147 -2.914 622 HA PHE 111 HA PHE 111 68.822 -4.182 -4.063 623 1HB PHE 111 HB2 PHE 111 70.303 -5.887 -2.062 624 2HB PHE 111 HB1 PHE 111 68.534 -5.888 -2.128 625 HD1 PHE 111 HD1 PHE 111 71.202 -7.740 -3.146 626 HD2 PHE 111 HD2 PHE 111 67.777 -5.780 -4.846 627 HE1 PHE 111 HE1 PHE 111 71.276 -9.288 -5.083 628 HE2 PHE 111 HE2 PHE 111 67.853 -7.329 -6.781 629 HZ PHE 111 HZ PHE 111 69.602 -9.083 -6.899 630 H THR 112 HN THR 112 69.929 -4.360 -0.693 631 HA THR 112 HA THR 112 67.873 -2.624 0.293 632 HB THR 112 HB THR 112 68.936 -4.236 1.723 633 HG1 THR 112 HG1 THR 112 68.426 -2.441 2.878 634 1HG2 THR 112 HG21 THR 112 71.406 -3.005 0.615 635 2HG2 THR 112 HG22 THR 112 71.056 -4.696 0.972 636 3HG2 THR 112 HG23 THR 112 71.481 -3.589 2.278 637 H ASP 113 HN ASP 113 68.793 -0.701 1.828 638 HA ASP 113 HA ASP 113 69.757 1.350 -0.024 639 1HB ASP 113 HB2 ASP 113 69.396 2.791 1.971 640 2HB ASP 113 HB1 ASP 113 68.009 1.741 1.675 641 HA PRO 114 HA PRO 114 74.054 0.727 0.785 642 1HB PRO 114 HB2 PRO 114 74.635 3.507 0.396 643 2HB PRO 114 HB1 PRO 114 74.887 2.164 -0.724 644 1HG PRO 114 HG2 PRO 114 72.861 4.225 -0.840 645 2HG PRO 114 HG1 PRO 114 73.191 2.940 -2.004 646 1HD PRO 114 HD2 PRO 114 70.946 3.138 -0.236 647 2HD PRO 114 HD1 PRO 114 71.351 1.778 -1.310 648 HA PRO 115 HA PRO 115 74.754 4.136 4.247 649 1HB PRO 115 HB2 PRO 115 72.141 5.200 4.816 650 2HB PRO 115 HB1 PRO 115 73.561 6.059 4.212 651 1HG PRO 115 HG2 PRO 115 71.154 5.307 2.777 652 2HG PRO 115 HG1 PRO 115 72.510 6.298 2.217 653 1HD PRO 115 HD2 PRO 115 71.870 3.654 1.378 654 2HD PRO 115 HD1 PRO 115 73.335 4.572 0.984 655 H VAL 116 HN VAL 116 74.596 1.643 4.865 656 HA VAL 116 HA VAL 116 72.227 0.952 6.488 657 HB VAL 116 HB VAL 116 73.186 -1.229 6.461 658 1HG1 VAL 116 HG11 VAL 116 74.414 -0.703 3.904 659 2HG1 VAL 116 HG12 VAL 116 72.957 0.274 4.077 660 3HG1 VAL 116 HG13 VAL 116 72.867 -1.480 4.245 661 1HG2 VAL 116 HG21 VAL 116 75.435 -0.484 7.254 662 2HG2 VAL 116 HG22 VAL 116 75.803 0.040 5.610 663 3HG2 VAL 116 HG23 VAL 116 75.527 -1.669 5.950 664 H LYS 117 HN LYS 117 72.371 0.577 8.783 665 HA LYS 117 HA LYS 117 74.615 2.044 10.073 666 1HB LYS 117 HB2 LYS 117 72.065 2.470 10.357 667 2HB LYS 117 HB1 LYS 117 72.112 1.048 11.410 668 1HG LYS 117 HG2 LYS 117 73.140 2.195 13.070 669 2HG LYS 117 HG1 LYS 117 74.305 2.913 11.946 670 1HD LYS 117 HD2 LYS 117 73.201 4.864 12.230 671 2HD LYS 117 HD1 LYS 117 71.869 4.143 11.315 672 1HE LYS 117 HE2 LYS 117 71.351 3.066 13.739 673 2HE LYS 117 HE1 LYS 117 72.131 4.574 14.253 674 1HZ LYS 117 HZ1 LYS 117 70.667 5.587 12.384 675 2HZ LYS 117 HZ2 LYS 117 69.966 5.255 13.895 676 3HZ LYS 117 HZ3 LYS 117 69.724 4.193 12.591 677 H THR 118 HN THR 118 75.959 1.070 11.566 678 HA THR 118 HA THR 118 75.504 -1.359 12.969 679 HB THR 118 HB THR 118 75.378 -2.458 10.848 680 HG1 THR 118 HG1 THR 118 77.730 -3.351 10.812 681 1HG2 THR 118 HG21 THR 118 77.369 -0.412 10.134 682 2HG2 THR 118 HG22 THR 118 76.148 -1.195 9.129 683 3HG2 THR 118 HG23 THR 118 77.688 -2.000 9.433 684 H LYS 119 HN LYS 119 76.933 1.283 13.130 685 HA LYS 119 HA LYS 119 79.254 0.427 14.590 686 1HB LYS 119 HB2 LYS 119 79.592 0.189 11.907 687 2HB LYS 119 HB1 LYS 119 80.146 1.847 12.143 688 1HG LYS 119 HG2 LYS 119 82.078 1.117 13.041 689 2HG LYS 119 HG1 LYS 119 81.196 0.164 14.240 690 1HD LYS 119 HD2 LYS 119 81.505 -1.763 13.087 691 2HD LYS 119 HD1 LYS 119 81.116 -1.000 11.545 692 1HE LYS 119 HE2 LYS 119 83.382 -0.068 11.397 693 2HE LYS 119 HE1 LYS 119 83.779 -0.737 12.991 694 1HZ LYS 119 HZ1 LYS 119 83.005 -2.939 12.019 695 2HZ LYS 119 HZ2 LYS 119 84.499 -2.351 11.461 696 3HZ LYS 119 HZ3 LYS 119 83.107 -2.196 10.497 697 H PHE 120 HN PHE 120 78.862 3.204 12.351 698 HA PHE 120 HA PHE 120 78.654 4.989 14.750 699 1HB PHE 120 HB2 PHE 120 80.809 4.643 12.853 700 2HB PHE 120 HB1 PHE 120 80.183 6.295 12.764 701 HD1 PHE 120 HD1 PHE 120 79.337 6.917 15.449 702 HD2 PHE 120 HD2 PHE 120 82.749 4.650 14.157 703 HE1 PHE 120 HE1 PHE 120 80.507 7.476 17.563 704 HE2 PHE 120 HE2 PHE 120 83.920 5.209 16.270 705 HZ PHE 120 HZ PHE 120 82.799 6.622 17.973 706 H GLY 121 HN GLY 121 76.529 4.152 12.885 707 1HA GLY 121 HA2 GLY 121 74.756 5.904 12.403 708 2HA GLY 121 HA1 GLY 121 76.021 6.784 11.542 709 H TYR 122 HN TYR 122 74.698 6.651 9.600 710 HA TYR 122 HA TYR 122 74.212 3.960 8.468 711 1HB TYR 122 HB2 TYR 122 73.567 6.818 7.808 712 2HB TYR 122 HB1 TYR 122 73.428 5.598 6.548 713 HD1 TYR 122 HD1 TYR 122 72.535 3.285 8.383 714 HD2 TYR 122 HD2 TYR 122 71.295 7.382 8.039 715 HE1 TYR 122 HE1 TYR 122 70.291 2.679 9.245 716 HE2 TYR 122 HE2 TYR 122 69.055 6.780 8.895 717 HH TYR 122 HH TYR 122 68.360 3.535 10.105 718 H HIS 123 HN HIS 123 75.521 3.090 6.851 719 HA HIS 123 HA HIS 123 77.719 4.828 5.772 720 1HB HIS 123 HB2 HIS 123 78.109 1.892 6.188 721 2HB HIS 123 HB1 HIS 123 79.276 3.194 6.345 722 HD1 HIS 123 HD1 HIS 123 78.391 4.929 8.532 723 HD2 HIS 123 HD2 HIS 123 77.543 0.854 8.662 724 HE1 HIS 123 HE1 HIS 123 78.067 4.348 10.965 725 H ILE 124 HN ILE 124 78.095 4.548 3.502 726 HA ILE 124 HA ILE 124 76.103 2.865 2.082 727 HB ILE 124 HB ILE 124 78.304 4.673 0.999 728 1HG1 ILE 124 HG12 ILE 124 75.373 5.245 1.587 729 2HG1 ILE 124 HG11 ILE 124 76.767 6.006 2.364 730 1HG2 ILE 124 HG21 ILE 124 77.620 4.013 -1.031 731 2HG2 ILE 124 HG22 ILE 124 75.944 4.393 -0.634 732 3HG2 ILE 124 HG23 ILE 124 76.603 2.803 -0.250 733 1HD1 ILE 124 HD11 ILE 124 75.459 7.081 0.212 734 2HD1 ILE 124 HD12 ILE 124 76.730 6.168 -0.602 735 3HD1 ILE 124 HD13 ILE 124 77.153 7.400 0.586 736 H ILE 125 HN ILE 125 76.723 0.720 2.084 737 HA ILE 125 HA ILE 125 79.573 0.004 1.912 738 HB ILE 125 HB ILE 125 76.941 -1.345 2.436 739 1HG1 ILE 125 HG12 ILE 125 79.607 -1.401 3.886 740 2HG1 ILE 125 HG11 ILE 125 78.303 -0.259 4.244 741 1HG2 ILE 125 HG21 ILE 125 78.152 -3.529 2.522 742 2HG2 ILE 125 HG22 ILE 125 79.549 -2.743 1.788 743 3HG2 ILE 125 HG23 ILE 125 78.039 -2.872 0.889 744 1HD1 ILE 125 HD11 ILE 125 77.636 -1.863 5.722 745 2HD1 ILE 125 HD12 ILE 125 78.528 -3.138 4.894 746 3HD1 ILE 125 HD13 ILE 125 76.949 -2.634 4.293 747 H MET 126 HN MET 126 80.555 -0.442 0.025 748 HA MET 126 HA MET 126 78.889 -1.143 -2.343 749 1HB MET 126 HB2 MET 126 79.704 0.899 -2.994 750 2HB MET 126 HB1 MET 126 80.912 0.901 -1.711 751 1HG MET 126 HG2 MET 126 82.508 -0.127 -3.005 752 2HG MET 126 HG1 MET 126 81.319 -0.955 -4.019 753 1HE MET 126 HE1 MET 126 81.974 3.525 -3.929 754 2HE MET 126 HE2 MET 126 81.459 2.419 -2.655 755 3HE MET 126 HE3 MET 126 80.285 2.998 -3.839 756 H VAL 127 HN VAL 127 79.292 -3.267 -2.858 757 HA VAL 127 HA VAL 127 81.831 -4.550 -2.044 758 HB VAL 127 HB VAL 127 79.249 -5.465 -3.343 759 1HG1 VAL 127 HG11 VAL 127 80.274 -7.782 -2.683 760 2HG1 VAL 127 HG12 VAL 127 81.815 -6.926 -2.775 761 3HG1 VAL 127 HG13 VAL 127 80.773 -7.023 -4.195 762 1HG2 VAL 127 HG21 VAL 127 79.144 -6.733 -1.110 763 2HG2 VAL 127 HG22 VAL 127 78.901 -4.988 -1.038 764 3HG2 VAL 127 HG23 VAL 127 80.456 -5.681 -0.580 765 H GLU 128 HN GLU 128 83.333 -5.423 -3.603 766 HA GLU 128 HA GLU 128 82.759 -4.890 -6.450 767 1HB GLU 128 HB2 GLU 128 84.093 -3.036 -4.978 768 2HB GLU 128 HB1 GLU 128 85.440 -4.017 -5.575 769 1HG GLU 128 HG2 GLU 128 83.734 -3.750 -7.780 770 2HG GLU 128 HG1 GLU 128 83.739 -2.150 -7.028 771 H GLY 129 HN GLY 129 82.767 -7.118 -6.670 772 1HA GLY 129 HA2 GLY 129 83.943 -8.958 -7.642 773 2HA GLY 129 HA1 GLY 129 85.441 -8.293 -6.977 774 H ARG 130 HN ARG 130 82.962 -10.576 -6.531 775 HA ARG 130 HA ARG 130 84.061 -11.131 -3.810 776 1HB ARG 130 HB2 ARG 130 81.932 -10.494 -3.281 777 2HB ARG 130 HB1 ARG 130 81.304 -10.863 -4.883 778 1HG ARG 130 HG2 ARG 130 81.481 -13.312 -4.299 779 2HG ARG 130 HG1 ARG 130 81.893 -12.832 -2.653 780 1HD ARG 130 HD2 ARG 130 79.736 -12.206 -2.172 781 2HD ARG 130 HD1 ARG 130 79.464 -11.551 -3.798 782 HE ARG 130 HE ARG 130 79.806 -14.413 -3.911 783 1HH1 ARG 130 HH11 ARG 130 77.607 -11.825 -3.338 784 2HH1 ARG 130 HH12 ARG 130 76.194 -12.816 -3.477 785 1HH2 ARG 130 HH21 ARG 130 77.976 -15.752 -3.956 786 2HH2 ARG 130 HH22 ARG 130 76.403 -15.039 -3.827 787 H LYS 131 HN LYS 131 83.678 -13.543 -3.225 788 HA LYS 131 HA LYS 131 83.585 -15.365 -5.562 789 1HB LYS 131 HB2 LYS 131 85.824 -16.324 -4.777 790 2HB LYS 131 HB1 LYS 131 85.899 -14.737 -5.541 791 1HG LYS 131 HG2 LYS 131 87.046 -14.113 -3.684 792 2HG LYS 131 HG1 LYS 131 85.470 -14.087 -2.893 793 1HD LYS 131 HD2 LYS 131 86.616 -15.511 -1.469 794 2HD LYS 131 HD1 LYS 131 85.947 -16.682 -2.606 795 1HE LYS 131 HE2 LYS 131 88.099 -17.372 -2.914 796 2HE LYS 131 HE1 LYS 131 88.328 -15.859 -3.824 797 1HZ LYS 131 HZ1 LYS 131 88.785 -16.349 -0.931 798 2HZ LYS 131 HZ2 LYS 131 88.646 -14.782 -1.574 799 3HZ LYS 131 HZ3 LYS 131 89.905 -15.804 -2.083 Start of MODEL 18 1 1H GLY 28 HT1 GLY 28 88.590 -20.852 6.932 2 2H GLY 28 HT2 GLY 28 88.380 -22.528 6.749 3 3H GLY 28 HT3 GLY 28 89.923 -21.838 6.573 4 1HA GLY 28 HA2 GLY 28 90.290 -22.304 8.698 5 2HA GLY 28 HA1 GLY 28 89.117 -21.040 9.064 6 H SER 29 HN SER 29 86.992 -21.649 9.648 7 HA SER 29 HA SER 29 86.709 -24.305 10.801 8 1HB SER 29 HB2 SER 29 85.708 -22.465 11.928 9 2HB SER 29 HB1 SER 29 84.964 -21.863 10.447 10 HG SER 29 HG SER 29 84.256 -24.071 12.036 11 H GLY 30 HN GLY 30 84.441 -22.663 8.576 12 1HA GLY 30 HA2 GLY 30 84.537 -24.802 6.615 13 2HA GLY 30 HA1 GLY 30 83.102 -24.905 7.634 14 HA PRO 31 HA PRO 31 82.985 -20.610 5.314 15 1HB PRO 31 HB2 PRO 31 84.562 -21.017 2.940 16 2HB PRO 31 HB1 PRO 31 84.824 -19.838 4.239 17 1HG PRO 31 HG2 PRO 31 86.357 -22.197 3.662 18 2HG PRO 31 HG1 PRO 31 86.610 -21.030 4.962 19 1HD PRO 31 HD2 PRO 31 85.615 -23.736 5.172 20 2HD PRO 31 HD1 PRO 31 85.888 -22.565 6.484 21 H LYS 32 HN LYS 32 83.802 -23.096 2.859 22 HA LYS 32 HA LYS 32 82.477 -23.942 1.082 23 1HB LYS 32 HB2 LYS 32 80.464 -23.920 3.353 24 2HB LYS 32 HB1 LYS 32 80.474 -25.013 1.969 25 1HG LYS 32 HG2 LYS 32 82.349 -26.183 2.743 26 2HG LYS 32 HG1 LYS 32 82.885 -24.846 3.760 27 1HD LYS 32 HD2 LYS 32 81.623 -25.535 5.509 28 2HD LYS 32 HD1 LYS 32 80.219 -25.830 4.482 29 1HE LYS 32 HE2 LYS 32 80.874 -27.982 5.347 30 2HE LYS 32 HE1 LYS 32 81.459 -27.942 3.673 31 1HZ LYS 32 HZ1 LYS 32 83.596 -27.149 4.470 32 2HZ LYS 32 HZ2 LYS 32 83.214 -28.623 5.224 33 3HZ LYS 32 HZ3 LYS 32 83.039 -27.160 6.072 34 H GLY 33 HN GLY 33 79.545 -23.641 0.955 35 1HA GLY 33 HA2 GLY 33 77.986 -22.179 -0.013 36 2HA GLY 33 HA1 GLY 33 78.715 -20.923 0.988 37 H GLY 34 HN GLY 34 78.145 -19.707 -1.131 38 1HA GLY 34 HA2 GLY 34 80.361 -20.032 -3.111 39 2HA GLY 34 HA1 GLY 34 78.795 -19.314 -3.487 40 H GLY 35 HN GLY 35 79.469 -18.193 -0.490 41 1HA GLY 35 HA2 GLY 35 80.744 -15.728 -1.601 42 2HA GLY 35 HA1 GLY 35 79.664 -15.750 -0.200 43 H ASN 36 HN ASN 36 82.150 -14.553 0.041 44 HA ASN 36 HA ASN 36 83.275 -15.865 2.317 45 1HB ASN 36 HB2 ASN 36 84.022 -17.534 0.746 46 2HB ASN 36 HB1 ASN 36 84.610 -16.299 -0.368 47 1HD2 ASN 36 HD21 ASN 36 86.845 -16.078 -0.266 48 2HD2 ASN 36 HD22 ASN 36 87.788 -16.299 1.128 49 H ALA 37 HN ALA 37 84.150 -13.901 -0.514 50 HA ALA 37 HA ALA 37 85.085 -11.740 1.301 51 1HB ALA 37 HB1 ALA 37 86.739 -12.327 -1.099 52 2HB ALA 37 HB2 ALA 37 86.824 -13.516 0.201 53 3HB ALA 37 HB3 ALA 37 87.246 -11.833 0.517 54 H VAL 38 HN VAL 38 84.907 -9.648 0.310 55 HA VAL 38 HA VAL 38 83.924 -9.473 -2.483 56 HB VAL 38 HB VAL 38 81.754 -9.264 -1.877 57 1HG1 VAL 38 HG11 VAL 38 81.024 -9.648 0.425 58 2HG1 VAL 38 HG12 VAL 38 82.654 -9.325 1.019 59 3HG1 VAL 38 HG13 VAL 38 82.341 -10.753 0.030 60 1HG2 VAL 38 HG21 VAL 38 82.776 -7.011 -0.142 61 2HG2 VAL 38 HG22 VAL 38 81.062 -7.376 -0.330 62 3HG2 VAL 38 HG23 VAL 38 82.020 -6.891 -1.729 63 H LYS 39 HN LYS 39 84.261 -7.217 -3.380 64 HA LYS 39 HA LYS 39 86.191 -5.735 -1.679 65 1HB LYS 39 HB2 LYS 39 85.714 -6.299 -4.405 66 2HB LYS 39 HB1 LYS 39 85.465 -4.556 -4.220 67 1HG LYS 39 HG2 LYS 39 87.884 -5.990 -3.093 68 2HG LYS 39 HG1 LYS 39 87.864 -5.274 -4.713 69 1HD LYS 39 HD2 LYS 39 87.092 -3.113 -3.586 70 2HD LYS 39 HD1 LYS 39 87.529 -3.876 -2.049 71 1HE LYS 39 HE2 LYS 39 89.781 -3.691 -2.458 72 2HE LYS 39 HE1 LYS 39 89.593 -4.048 -4.185 73 1HZ LYS 39 HZ1 LYS 39 88.325 -1.785 -4.153 74 2HZ LYS 39 HZ2 LYS 39 90.020 -1.803 -4.245 75 3HZ LYS 39 HZ3 LYS 39 89.250 -1.495 -2.762 76 H VAL 40 HN VAL 40 84.815 -4.867 -0.059 77 HA VAL 40 HA VAL 40 82.448 -3.302 -0.899 78 HB VAL 40 HB VAL 40 82.206 -3.230 1.688 79 1HG1 VAL 40 HG11 VAL 40 81.599 -5.190 -0.316 80 2HG1 VAL 40 HG12 VAL 40 80.682 -4.784 1.135 81 3HG1 VAL 40 HG13 VAL 40 81.941 -6.017 1.205 82 1HG2 VAL 40 HG21 VAL 40 84.745 -4.161 1.685 83 2HG2 VAL 40 HG22 VAL 40 83.863 -5.690 1.721 84 3HG2 VAL 40 HG23 VAL 40 83.601 -4.489 2.988 85 H ARG 41 HN ARG 41 82.097 -1.165 -0.330 86 HA ARG 41 HA ARG 41 84.430 0.436 0.663 87 1HB ARG 41 HB2 ARG 41 82.632 0.729 -1.745 88 2HB ARG 41 HB1 ARG 41 83.434 2.142 -1.061 89 1HG ARG 41 HG2 ARG 41 85.081 1.458 -2.548 90 2HG ARG 41 HG1 ARG 41 85.548 0.508 -1.142 91 1HD ARG 41 HD2 ARG 41 85.356 -1.317 -2.488 92 2HD ARG 41 HD1 ARG 41 83.599 -1.060 -2.408 93 HE ARG 41 HE ARG 41 84.159 0.668 -4.353 94 1HH1 ARG 41 HH21 ARG 41 84.062 -2.598 -4.411 95 2HH1 ARG 41 HH22 ARG 41 85.116 -2.827 -5.766 96 1HH2 ARG 41 HH11 ARG 41 86.189 0.470 -5.824 97 2HH2 ARG 41 HH12 ARG 41 86.320 -1.089 -6.566 98 H HIS 42 HN HIS 42 83.722 2.313 2.000 99 HA HIS 42 HA HIS 42 80.787 2.154 2.665 100 1HB HIS 42 HB2 HIS 42 81.379 2.190 4.955 101 2HB HIS 42 HB1 HIS 42 82.555 1.106 4.208 102 HD1 HIS 42 HD1 HIS 42 82.358 4.009 6.347 103 HD2 HIS 42 HD2 HIS 42 85.077 2.625 3.508 104 HE1 HIS 42 HE1 HIS 42 84.526 5.251 6.767 105 H ILE 43 HN ILE 43 79.684 4.057 2.538 106 HA ILE 43 HA ILE 43 81.210 6.601 2.843 107 HB ILE 43 HB ILE 43 80.023 5.621 0.529 108 1HG1 ILE 43 HG12 ILE 43 80.745 8.442 1.369 109 2HG1 ILE 43 HG11 ILE 43 81.801 7.265 0.578 110 1HG2 ILE 43 HG21 ILE 43 78.173 7.152 0.043 111 2HG2 ILE 43 HG22 ILE 43 78.289 7.829 1.668 112 3HG2 ILE 43 HG23 ILE 43 77.793 6.157 1.441 113 1HD1 ILE 43 HD11 ILE 43 79.770 9.039 -0.589 114 2HD1 ILE 43 HD12 ILE 43 79.620 7.366 -1.119 115 3HD1 ILE 43 HD13 ILE 43 81.136 8.236 -1.363 116 H LEU 44 HN LEU 44 80.507 7.505 4.797 117 HA LEU 44 HA LEU 44 77.758 6.965 5.797 118 1HB LEU 44 HB2 LEU 44 80.397 7.863 6.796 119 2HB LEU 44 HB1 LEU 44 79.029 8.689 7.540 120 HG LEU 44 HG LEU 44 79.743 5.794 7.636 121 1HD1 LEU 44 HD11 LEU 44 80.166 7.847 9.349 122 2HD1 LEU 44 HD12 LEU 44 79.935 6.183 9.889 123 3HD1 LEU 44 HD13 LEU 44 78.578 7.313 9.907 124 1HD2 LEU 44 HD21 LEU 44 77.441 5.560 8.796 125 2HD2 LEU 44 HD22 LEU 44 77.439 5.634 7.043 126 3HD2 LEU 44 HD23 LEU 44 77.016 7.061 7.975 127 H CYS 45 HN CYS 45 76.265 8.633 6.242 128 HA CYS 45 HA CYS 45 76.690 11.151 4.733 129 1HB CYS 45 HB2 CYS 45 74.276 11.460 5.291 130 2HB CYS 45 HB1 CYS 45 74.593 9.907 4.500 131 HG CYS 45 HG CYS 45 73.109 9.592 6.718 132 H GLU 46 HN GLU 46 76.743 9.891 7.970 133 HA GLU 46 HA GLU 46 77.330 10.919 10.013 134 1HB GLU 46 HB2 GLU 46 78.799 12.125 8.156 135 2HB GLU 46 HB1 GLU 46 77.746 13.492 8.523 136 1HG GLU 46 HG2 GLU 46 78.478 13.626 10.745 137 2HG GLU 46 HG1 GLU 46 79.049 11.957 10.758 138 H LYS 47 HN LYS 47 75.690 13.306 7.930 139 HA LYS 47 HA LYS 47 73.757 13.832 10.154 140 1HB LYS 47 HB2 LYS 47 73.712 16.089 9.362 141 2HB LYS 47 HB1 LYS 47 75.412 15.618 9.327 142 1HG LYS 47 HG2 LYS 47 74.953 14.899 6.880 143 2HG LYS 47 HG1 LYS 47 73.485 15.868 7.018 144 1HD LYS 47 HD2 LYS 47 74.675 17.748 6.682 145 2HD LYS 47 HD1 LYS 47 75.681 17.377 8.082 146 1HE LYS 47 HE2 LYS 47 77.181 16.025 6.709 147 2HE LYS 47 HE1 LYS 47 76.122 16.228 5.300 148 1HZ LYS 47 HZ1 LYS 47 77.059 18.599 6.774 149 2HZ LYS 47 HZ2 LYS 47 76.608 18.460 5.142 150 3HZ LYS 47 HZ3 LYS 47 78.108 17.856 5.667 151 H HIS 48 HN HIS 48 73.967 12.042 7.468 152 HA HIS 48 HA HIS 48 72.390 11.198 5.929 153 1HB HIS 48 HB2 HIS 48 70.675 12.480 8.061 154 2HB HIS 48 HB1 HIS 48 70.028 11.437 6.795 155 HD1 HIS 48 HD1 HIS 48 73.067 11.162 9.118 156 HD2 HIS 48 HD2 HIS 48 69.828 8.877 7.823 157 HE1 HIS 48 HE1 HIS 48 73.360 8.868 10.148 158 H GLY 49 HN GLY 49 73.448 13.993 5.694 159 1HA GLY 49 HA2 GLY 49 71.218 15.252 4.159 160 2HA GLY 49 HA1 GLY 49 72.624 16.125 4.786 161 H LYS 50 HN LYS 50 74.469 13.922 3.875 162 HA LYS 50 HA LYS 50 74.524 14.702 0.982 163 1HB LYS 50 HB2 LYS 50 76.880 14.540 1.150 164 2HB LYS 50 HB1 LYS 50 76.388 15.254 2.681 165 1HG LYS 50 HG2 LYS 50 76.458 12.302 2.687 166 2HG LYS 50 HG1 LYS 50 78.021 13.086 2.478 167 1HD LYS 50 HD2 LYS 50 76.794 14.604 4.450 168 2HD LYS 50 HD1 LYS 50 76.304 12.957 4.832 169 1HE LYS 50 HE2 LYS 50 78.355 12.734 5.815 170 2HE LYS 50 HE1 LYS 50 79.021 12.726 4.167 171 1HZ LYS 50 HZ1 LYS 50 78.270 15.306 5.339 172 2HZ LYS 50 HZ2 LYS 50 79.529 14.934 4.263 173 3HZ LYS 50 HZ3 LYS 50 79.688 14.578 5.916 174 H ILE 51 HN ILE 51 73.676 12.070 2.908 175 HA ILE 51 HA ILE 51 74.812 9.833 1.658 176 HB ILE 51 HB ILE 51 73.069 9.972 3.534 177 1HG1 ILE 51 HG12 ILE 51 72.202 7.770 3.041 178 2HG1 ILE 51 HG11 ILE 51 72.459 8.007 1.308 179 1HG2 ILE 51 HG21 ILE 51 71.429 11.367 2.385 180 2HG2 ILE 51 HG22 ILE 51 70.704 9.806 2.771 181 3HG2 ILE 51 HG23 ILE 51 71.239 10.147 1.125 182 1HD1 ILE 51 HD11 ILE 51 74.246 6.748 2.949 183 2HD1 ILE 51 HD12 ILE 51 74.860 8.400 3.001 184 3HD1 ILE 51 HD13 ILE 51 74.698 7.567 1.454 185 H MET 52 HN MET 52 72.396 12.103 0.489 186 HA MET 52 HA MET 52 71.871 10.598 -1.958 187 1HB MET 52 HB2 MET 52 70.721 12.727 -0.470 188 2HB MET 52 HB1 MET 52 71.134 13.386 -2.054 189 1HG MET 52 HG2 MET 52 69.867 10.707 -2.068 190 2HG MET 52 HG1 MET 52 68.830 12.038 -1.555 191 1HE MET 52 HE1 MET 52 71.830 12.891 -4.102 192 2HE MET 52 HE2 MET 52 71.279 11.849 -5.410 193 3HE MET 52 HE3 MET 52 71.634 11.154 -3.832 194 H GLU 53 HN GLU 53 73.579 13.595 -1.093 195 HA GLU 53 HA GLU 53 74.629 14.233 -3.625 196 1HB GLU 53 HB2 GLU 53 74.751 15.363 -1.225 197 2HB GLU 53 HB1 GLU 53 76.252 14.441 -1.101 198 1HG GLU 53 HG2 GLU 53 77.106 15.450 -3.125 199 2HG GLU 53 HG1 GLU 53 75.558 16.248 -3.414 200 H ALA 54 HN ALA 54 75.347 11.825 -1.220 201 HA ALA 54 HA ALA 54 77.862 10.926 -2.428 202 1HB ALA 54 HB1 ALA 54 77.904 9.784 -0.459 203 2HB ALA 54 HB2 ALA 54 76.413 8.943 -0.877 204 3HB ALA 54 HB3 ALA 54 76.344 10.510 -0.072 205 H MET 55 HN MET 55 74.434 10.176 -2.602 206 HA MET 55 HA MET 55 74.758 7.852 -4.370 207 1HB MET 55 HB2 MET 55 72.517 9.580 -3.337 208 2HB MET 55 HB1 MET 55 72.203 8.391 -4.605 209 1HG MET 55 HG2 MET 55 73.295 6.659 -3.106 210 2HG MET 55 HG1 MET 55 73.295 7.876 -1.823 211 1HE MET 55 HE1 MET 55 70.603 6.382 -0.129 212 2HE MET 55 HE2 MET 55 70.877 8.123 -0.169 213 3HE MET 55 HE3 MET 55 72.248 7.020 -0.267 214 H GLU 56 HN GLU 56 73.321 11.104 -4.878 215 HA GLU 56 HA GLU 56 73.024 11.033 -7.664 216 1HB GLU 56 HB2 GLU 56 73.040 12.933 -5.519 217 2HB GLU 56 HB1 GLU 56 73.941 13.620 -6.869 218 1HG GLU 56 HG2 GLU 56 72.092 13.335 -8.366 219 2HG GLU 56 HG1 GLU 56 71.223 12.331 -7.206 220 H LYS 57 HN LYS 57 75.756 12.717 -6.061 221 HA LYS 57 HA LYS 57 77.455 13.142 -8.175 222 1HB LYS 57 HB2 LYS 57 78.014 12.116 -5.384 223 2HB LYS 57 HB1 LYS 57 79.280 12.673 -6.471 224 1HG LYS 57 HG2 LYS 57 77.208 14.622 -6.533 225 2HG LYS 57 HG1 LYS 57 77.534 14.257 -4.841 226 1HD LYS 57 HD2 LYS 57 79.111 15.921 -5.294 227 2HD LYS 57 HD1 LYS 57 80.040 14.448 -5.551 228 1HE LYS 57 HE2 LYS 57 80.546 15.612 -7.512 229 2HE LYS 57 HE1 LYS 57 79.102 14.725 -8.042 230 1HZ LYS 57 HZ1 LYS 57 79.196 17.312 -8.273 231 2HZ LYS 57 HZ2 LYS 57 78.789 17.285 -6.623 232 3HZ LYS 57 HZ3 LYS 57 77.763 16.559 -7.766 233 H LEU 58 HN LEU 58 77.914 10.188 -6.176 234 HA LEU 58 HA LEU 58 79.499 8.686 -7.852 235 1HB LEU 58 HB2 LEU 58 77.438 8.233 -5.815 236 2HB LEU 58 HB1 LEU 58 77.628 6.862 -6.915 237 HG LEU 58 HG LEU 58 80.204 7.362 -6.500 238 1HD1 LEU 58 HD11 LEU 58 79.029 9.184 -4.744 239 2HD1 LEU 58 HD12 LEU 58 80.718 8.668 -4.742 240 3HD1 LEU 58 HD13 LEU 58 79.540 7.851 -3.714 241 1HD2 LEU 58 HD21 LEU 58 79.320 5.211 -6.005 242 2HD2 LEU 58 HD22 LEU 58 78.264 5.849 -4.744 243 3HD2 LEU 58 HD23 LEU 58 80.006 5.765 -4.478 244 H LYS 59 HN LYS 59 76.031 9.332 -8.297 245 HA LYS 59 HA LYS 59 75.773 7.420 -10.500 246 1HB LYS 59 HB2 LYS 59 73.544 7.811 -10.185 247 2HB LYS 59 HB1 LYS 59 74.084 8.556 -8.688 248 1HG LYS 59 HG2 LYS 59 72.853 10.313 -9.490 249 2HG LYS 59 HG1 LYS 59 74.347 10.669 -10.345 250 1HD LYS 59 HD2 LYS 59 72.888 10.685 -12.134 251 2HD LYS 59 HD1 LYS 59 73.313 8.973 -12.124 252 1HE LYS 59 HE2 LYS 59 71.176 9.338 -10.256 253 2HE LYS 59 HE1 LYS 59 70.720 10.135 -11.773 254 1HZ LYS 59 HZ1 LYS 59 70.233 7.720 -11.765 255 2HZ LYS 59 HZ2 LYS 59 71.893 7.406 -11.582 256 3HZ LYS 59 HZ3 LYS 59 71.319 8.166 -12.989 257 H SER 60 HN SER 60 76.445 10.835 -10.125 258 HA SER 60 HA SER 60 76.043 11.505 -12.944 259 1HB SER 60 HB2 SER 60 77.615 13.003 -10.831 260 2HB SER 60 HB1 SER 60 76.769 13.675 -12.224 261 HG SER 60 HG SER 60 75.613 12.404 -9.970 262 H GLY 61 HN GLY 61 78.854 11.018 -10.797 263 1HA GLY 61 HA2 GLY 61 80.692 9.623 -11.805 264 2HA GLY 61 HA1 GLY 61 80.507 10.612 -13.257 265 H MET 62 HN MET 62 80.527 11.717 -9.853 266 HA MET 62 HA MET 62 82.538 13.743 -10.552 267 1HB MET 62 HB2 MET 62 81.858 14.694 -8.532 268 2HB MET 62 HB1 MET 62 80.437 13.727 -8.913 269 1HG MET 62 HG2 MET 62 82.651 13.058 -6.958 270 2HG MET 62 HG1 MET 62 80.947 13.277 -6.624 271 1HE MET 62 HE1 MET 62 80.390 11.676 -5.510 272 2HE MET 62 HE2 MET 62 81.433 10.263 -5.404 273 3HE MET 62 HE3 MET 62 79.842 10.119 -6.118 274 H ARG 63 HN ARG 63 83.951 13.709 -8.060 275 HA ARG 63 HA ARG 63 86.023 11.754 -8.621 276 1HB ARG 63 HB2 ARG 63 85.699 13.068 -5.950 277 2HB ARG 63 HB1 ARG 63 87.169 12.823 -6.900 278 1HG ARG 63 HG2 ARG 63 86.962 15.013 -7.322 279 2HG ARG 63 HG1 ARG 63 85.795 14.496 -8.536 280 1HD ARG 63 HD2 ARG 63 84.076 15.480 -7.401 281 2HD ARG 63 HD1 ARG 63 84.560 14.716 -5.873 282 HE ARG 63 HE ARG 63 85.901 16.645 -5.398 283 1HH1 ARG 63 HH21 ARG 63 83.637 17.488 -7.586 284 2HH1 ARG 63 HH22 ARG 63 84.542 18.735 -8.378 285 1HH2 ARG 63 HH11 ARG 63 87.543 17.887 -6.862 286 2HH2 ARG 63 HH12 ARG 63 86.753 18.959 -7.969 287 H PHE 64 HN PHE 64 86.512 9.912 -7.324 288 HA PHE 64 HA PHE 64 84.194 8.741 -5.893 289 1HB PHE 64 HB2 PHE 64 86.711 7.862 -7.214 290 2HB PHE 64 HB1 PHE 64 86.246 6.926 -5.793 291 HD1 PHE 64 HD1 PHE 64 83.348 6.928 -5.839 292 HD2 PHE 64 HD2 PHE 64 86.111 6.643 -9.115 293 HE1 PHE 64 HE1 PHE 64 81.629 5.751 -7.186 294 HE2 PHE 64 HE2 PHE 64 84.393 5.466 -10.461 295 HZ PHE 64 HZ PHE 64 82.152 5.020 -9.497 296 H ASN 65 HN ASN 65 87.390 10.125 -5.367 297 HA ASN 65 HA ASN 65 87.452 9.234 -2.551 298 1HB ASN 65 HB2 ASN 65 89.303 10.842 -4.329 299 2HB ASN 65 HB1 ASN 65 89.673 10.438 -2.653 300 1HD2 ASN 65 HD21 ASN 65 91.451 9.394 -4.433 301 2HD2 ASN 65 HD22 ASN 65 91.185 7.737 -4.685 302 H GLU 66 HN GLU 66 87.027 12.348 -4.300 303 HA GLU 66 HA GLU 66 87.221 14.044 -2.033 304 1HB GLU 66 HB2 GLU 66 85.470 14.109 -4.499 305 2HB GLU 66 HB1 GLU 66 85.571 15.457 -3.375 306 1HG GLU 66 HG2 GLU 66 88.139 14.319 -4.385 307 2HG GLU 66 HG1 GLU 66 87.180 15.280 -5.510 308 H VAL 67 HN VAL 67 84.211 12.755 -3.473 309 HA VAL 67 HA VAL 67 82.453 13.260 -1.361 310 HB VAL 67 HB VAL 67 81.546 10.866 -2.157 311 1HG1 VAL 67 HG11 VAL 67 80.161 12.033 -3.534 312 2HG1 VAL 67 HG12 VAL 67 81.511 12.802 -4.382 313 3HG1 VAL 67 HG13 VAL 67 80.985 13.424 -2.819 314 1HG2 VAL 67 HG21 VAL 67 82.622 9.869 -3.838 315 2HG2 VAL 67 HG22 VAL 67 83.971 10.957 -3.514 316 3HG2 VAL 67 HG23 VAL 67 82.755 11.386 -4.720 317 H ALA 68 HN ALA 68 83.953 10.065 -1.918 318 HA ALA 68 HA ALA 68 83.579 8.800 0.477 319 1HB ALA 68 HB1 ALA 68 85.903 7.819 0.014 320 2HB ALA 68 HB2 ALA 68 86.023 8.984 -1.303 321 3HB ALA 68 HB3 ALA 68 84.760 7.753 -1.326 322 H ALA 69 HN ALA 69 86.162 11.198 -0.165 323 HA ALA 69 HA ALA 69 87.581 11.194 2.209 324 1HB ALA 69 HB1 ALA 69 88.104 13.447 1.665 325 2HB ALA 69 HB2 ALA 69 86.503 13.741 0.988 326 3HB ALA 69 HB3 ALA 69 87.658 12.733 0.117 327 H GLN 70 HN GLN 70 84.663 13.248 1.694 328 HA GLN 70 HA GLN 70 84.295 13.437 4.619 329 1HB GLN 70 HB2 GLN 70 83.959 15.477 3.488 330 2HB GLN 70 HB1 GLN 70 83.220 14.700 2.104 331 1HG GLN 70 HG2 GLN 70 81.548 15.897 3.491 332 2HG GLN 70 HG1 GLN 70 81.273 14.150 3.429 333 1HE2 GLN 70 HE21 GLN 70 81.417 12.961 5.452 334 2HE2 GLN 70 HE22 GLN 70 81.804 13.698 6.927 335 H TYR 71 HN TYR 71 82.403 12.661 1.763 336 HA TYR 71 HA TYR 71 80.038 11.759 2.810 337 1HB TYR 71 HB2 TYR 71 81.678 10.739 0.488 338 2HB TYR 71 HB1 TYR 71 80.018 10.256 0.772 339 HD1 TYR 71 HD1 TYR 71 79.302 11.180 -1.339 340 HD2 TYR 71 HD2 TYR 71 81.077 13.760 1.636 341 HE1 TYR 71 HE1 TYR 71 78.447 13.172 -2.533 342 HE2 TYR 71 HE2 TYR 71 80.219 15.721 0.426 343 HH TYR 71 HH TYR 71 79.351 16.430 -1.552 344 H SER 72 HN SER 72 83.121 10.064 2.901 345 HA SER 72 HA SER 72 81.943 7.536 3.717 346 1HB SER 72 HB2 SER 72 84.120 7.781 2.575 347 2HB SER 72 HB1 SER 72 84.753 8.592 4.009 348 HG SER 72 HG SER 72 84.546 6.742 5.159 349 H GLU 73 HN GLU 73 82.705 6.567 5.905 350 HA GLU 73 HA GLU 73 81.653 8.142 8.075 351 1HB GLU 73 HB2 GLU 73 81.316 5.904 8.452 352 2HB GLU 73 HB1 GLU 73 82.736 5.432 7.516 353 1HG GLU 73 HG2 GLU 73 82.792 4.931 10.018 354 2HG GLU 73 HG1 GLU 73 84.184 5.781 9.361 355 H ASP 74 HN ASP 74 83.181 9.855 7.308 356 HA ASP 74 HA ASP 74 85.037 11.260 7.814 357 1HB ASP 74 HB2 ASP 74 84.291 10.605 10.120 358 2HB ASP 74 HB1 ASP 74 85.393 9.230 10.049 359 H LYS 75 HN LYS 75 85.197 8.556 6.279 360 HA LYS 75 HA LYS 75 88.193 8.384 6.256 361 1HB LYS 75 HB2 LYS 75 87.282 6.460 7.412 362 2HB LYS 75 HB1 LYS 75 86.073 6.214 6.153 363 1HG LYS 75 HG2 LYS 75 87.599 4.698 5.373 364 2HG LYS 75 HG1 LYS 75 88.334 6.134 4.656 365 1HD LYS 75 HD2 LYS 75 90.067 6.163 6.161 366 2HD LYS 75 HD1 LYS 75 89.070 5.540 7.476 367 1HE LYS 75 HE2 LYS 75 89.283 3.295 6.719 368 2HE LYS 75 HE1 LYS 75 89.856 3.806 5.120 369 1HZ LYS 75 HZ1 LYS 75 91.759 4.881 6.286 370 2HZ LYS 75 HZ2 LYS 75 91.754 3.188 6.413 371 3HZ LYS 75 HZ3 LYS 75 91.251 4.142 7.726 372 H ALA 76 HN ALA 76 86.280 6.340 4.206 373 HA ALA 76 HA ALA 76 85.825 8.035 1.964 374 1HB ALA 76 HB1 ALA 76 88.548 6.771 2.245 375 2HB ALA 76 HB2 ALA 76 88.156 8.448 1.868 376 3HB ALA 76 HB3 ALA 76 87.896 7.189 0.660 377 H ARG 77 HN ARG 77 84.392 6.804 0.714 378 HA ARG 77 HA ARG 77 84.163 3.956 1.230 379 1HB ARG 77 HB2 ARG 77 82.357 4.066 -0.398 380 2HB ARG 77 HB1 ARG 77 82.263 5.470 0.657 381 1HG ARG 77 HG2 ARG 77 82.498 6.873 -1.092 382 2HG ARG 77 HG1 ARG 77 83.935 6.029 -1.646 383 1HD ARG 77 HD2 ARG 77 82.587 5.497 -3.436 384 2HD ARG 77 HD1 ARG 77 82.001 4.227 -2.348 385 HE ARG 77 HE ARG 77 80.703 6.911 -2.642 386 1HH1 ARG 77 HH21 ARG 77 80.701 3.853 -1.119 387 2HH1 ARG 77 HH22 ARG 77 78.986 3.666 -1.175 388 1HH2 ARG 77 HH11 ARG 77 78.449 6.542 -3.021 389 2HH2 ARG 77 HH12 ARG 77 77.714 5.180 -2.251 390 H GLN 78 HN GLN 78 85.694 5.923 -1.282 391 HA GLN 78 HA GLN 78 86.512 3.434 -2.717 392 1HB GLN 78 HB2 GLN 78 86.757 6.385 -3.412 393 2HB GLN 78 HB1 GLN 78 87.175 5.039 -4.481 394 1HG GLN 78 HG2 GLN 78 84.430 5.769 -3.425 395 2HG GLN 78 HG1 GLN 78 84.966 5.765 -5.101 396 1HE2 GLN 78 HE21 GLN 78 83.786 3.730 -2.486 397 2HE2 GLN 78 HE22 GLN 78 83.702 2.301 -3.392 398 H GLY 79 HN GLY 79 87.939 6.516 -1.560 399 1HA GLY 79 HA2 GLY 79 90.653 5.518 -1.670 400 2HA GLY 79 HA1 GLY 79 90.130 6.984 -0.832 401 H GLY 80 HN GLY 80 88.034 5.335 0.578 402 1HA GLY 80 HA1 GLY 80 89.823 4.231 2.694 403 2HA GLY 80 HA2 GLY 80 88.167 4.790 2.957 404 H ASP 81 HN ASP 81 88.283 3.139 0.055 405 HA ASP 81 HA ASP 81 86.506 1.125 0.538 406 1HB ASP 81 HB2 ASP 81 87.552 1.611 -1.627 407 2HB ASP 81 HB1 ASP 81 89.100 0.987 -1.040 408 H LEU 82 HN LEU 82 86.587 0.102 2.580 409 HA LEU 82 HA LEU 82 88.679 -0.776 4.118 410 1HB LEU 82 HB2 LEU 82 85.970 -1.829 3.430 411 2HB LEU 82 HB1 LEU 82 87.019 -2.860 4.405 412 HG LEU 82 HG LEU 82 87.404 -0.830 5.898 413 1HD1 LEU 82 HD11 LEU 82 86.712 1.067 4.772 414 2HD1 LEU 82 HD12 LEU 82 85.239 0.712 5.674 415 3HD1 LEU 82 HD13 LEU 82 85.371 0.232 3.983 416 1HD2 LEU 82 HD21 LEU 82 85.897 -1.868 7.207 417 2HD2 LEU 82 HD22 LEU 82 85.270 -2.701 5.784 418 3HD2 LEU 82 HD23 LEU 82 84.575 -1.158 6.280 419 H GLY 83 HN GLY 83 87.714 -2.099 1.006 420 1HA GLY 83 HA2 GLY 83 89.132 -3.362 -0.436 421 2HA GLY 83 HA1 GLY 83 90.217 -3.655 0.930 422 H TRP 84 HN TRP 84 89.859 -5.853 -0.396 423 HA TRP 84 HA TRP 84 87.668 -7.505 -0.306 424 1HB TRP 84 HB2 TRP 84 90.606 -7.871 0.183 425 2HB TRP 84 HB1 TRP 84 89.545 -9.264 0.343 426 HD1 TRP 84 HD1 TRP 84 91.327 -7.258 -2.146 427 HE1 TRP 84 HE1 TRP 84 90.615 -7.905 -4.542 428 HE3 TRP 84 HE3 TRP 84 87.248 -10.110 -1.085 429 HZ2 TRP 84 HZ2 TRP 84 88.572 -9.447 -5.828 430 HZ3 TRP 84 HZ3 TRP 84 85.934 -11.161 -2.902 431 HH2 TRP 84 HH2 TRP 84 86.584 -10.827 -5.272 432 H MET 85 HN MET 85 86.486 -8.597 1.285 433 HA MET 85 HA MET 85 87.480 -8.504 4.096 434 1HB MET 85 HB2 MET 85 85.102 -7.141 2.887 435 2HB MET 85 HB1 MET 85 84.957 -7.763 4.531 436 1HG MET 85 HG2 MET 85 87.444 -6.256 3.945 437 2HG MET 85 HG1 MET 85 85.958 -5.305 3.947 438 1HE MET 85 HE1 MET 85 88.705 -6.372 6.803 439 2HE MET 85 HE2 MET 85 88.068 -4.741 7.001 440 3HE MET 85 HE3 MET 85 88.512 -5.315 5.396 441 H THR 86 HN THR 86 87.031 -10.430 5.109 442 HA THR 86 HA THR 86 84.983 -12.204 3.839 443 HB THR 86 HB THR 86 86.570 -13.951 5.031 444 HG1 THR 86 HG1 THR 86 88.521 -13.214 5.485 445 1HG2 THR 86 HG21 THR 86 86.780 -14.351 2.830 446 2HG2 THR 86 HG22 THR 86 88.167 -13.261 2.853 447 3HG2 THR 86 HG23 THR 86 86.567 -12.647 2.434 448 H ARG 87 HN ARG 87 83.649 -13.411 5.258 449 HA ARG 87 HA ARG 87 82.713 -12.186 7.612 450 1HB ARG 87 HB2 ARG 87 82.069 -14.331 6.028 451 2HB ARG 87 HB1 ARG 87 82.567 -15.134 7.516 452 1HG ARG 87 HG2 ARG 87 80.934 -12.839 8.147 453 2HG ARG 87 HG1 ARG 87 80.088 -13.873 6.995 454 1HD ARG 87 HD2 ARG 87 79.546 -15.204 8.756 455 2HD ARG 87 HD1 ARG 87 81.262 -15.644 8.851 456 HE ARG 87 HE ARG 87 80.918 -13.088 10.076 457 1HH1 ARG 87 HH11 ARG 87 78.522 -14.297 11.282 458 2HH1 ARG 87 HH12 ARG 87 79.153 -15.127 12.664 459 1HH2 ARG 87 HH21 ARG 87 82.430 -15.072 11.533 460 2HH2 ARG 87 HH22 ARG 87 81.366 -15.568 12.805 461 H GLY 88 HN GLY 88 85.271 -14.618 7.213 462 1HA GLY 88 HA2 GLY 88 85.684 -15.450 9.839 463 2HA GLY 88 HA1 GLY 88 87.008 -15.199 8.694 464 H SER 89 HN SER 89 86.317 -12.302 8.437 465 HA SER 89 HA SER 89 86.839 -11.227 11.150 466 1HB SER 89 HB2 SER 89 88.866 -11.867 9.210 467 2HB SER 89 HB1 SER 89 88.813 -10.112 9.424 468 HG SER 89 HG SER 89 88.745 -11.828 11.648 469 H MET 90 HN MET 90 84.982 -9.902 10.943 470 HA MET 90 HA MET 90 85.270 -7.595 9.102 471 1HB MET 90 HB2 MET 90 83.332 -9.832 8.877 472 2HB MET 90 HB1 MET 90 82.652 -8.216 8.684 473 1HG MET 90 HG2 MET 90 85.075 -8.232 7.223 474 2HG MET 90 HG1 MET 90 84.248 -9.737 6.821 475 1HE MET 90 HE1 MET 90 83.580 -9.263 4.327 476 2HE MET 90 HE2 MET 90 81.862 -8.871 4.298 477 3HE MET 90 HE3 MET 90 82.467 -10.061 5.449 478 H VAL 91 HN VAL 91 82.341 -8.755 10.720 479 HA VAL 91 HA VAL 91 82.589 -7.346 13.174 480 HB VAL 91 HB VAL 91 82.764 -5.288 12.088 481 1HG1 VAL 91 HG11 VAL 91 80.847 -5.027 10.114 482 2HG1 VAL 91 HG12 VAL 91 81.355 -6.707 9.941 483 3HG1 VAL 91 HG13 VAL 91 82.547 -5.411 9.838 484 1HG2 VAL 91 HG21 VAL 91 79.848 -5.072 11.876 485 2HG2 VAL 91 HG22 VAL 91 80.967 -4.206 12.931 486 3HG2 VAL 91 HG23 VAL 91 80.380 -5.804 13.390 487 H GLY 92 HN GLY 92 79.789 -6.913 11.025 488 1HA GLY 92 HA2 GLY 92 78.390 -9.281 11.861 489 2HA GLY 92 HA1 GLY 92 77.891 -7.899 12.848 490 HA PRO 93 HA PRO 93 75.003 -6.673 9.791 491 1HB PRO 93 HB2 PRO 93 75.690 -3.881 9.952 492 2HB PRO 93 HB1 PRO 93 74.327 -4.716 10.716 493 1HG PRO 93 HG2 PRO 93 76.703 -3.683 11.972 494 2HG PRO 93 HG1 PRO 93 75.334 -4.496 12.735 495 1HD PRO 93 HD2 PRO 93 77.995 -5.526 12.331 496 2HD PRO 93 HD1 PRO 93 76.607 -6.359 13.069 497 H PHE 94 HN PHE 94 77.986 -4.679 9.544 498 HA PHE 94 HA PHE 94 77.967 -4.011 6.856 499 1HB PHE 94 HB2 PHE 94 79.711 -3.799 8.884 500 2HB PHE 94 HB1 PHE 94 80.496 -5.118 8.004 501 HD1 PHE 94 HD1 PHE 94 79.468 -1.581 7.882 502 HD2 PHE 94 HD2 PHE 94 81.385 -4.781 5.752 503 HE1 PHE 94 HE1 PHE 94 80.371 0.049 6.245 504 HE2 PHE 94 HE2 PHE 94 82.287 -3.152 4.115 505 HZ PHE 94 HZ PHE 94 81.780 -0.736 4.361 506 H GLN 95 HN GLN 95 79.161 -7.097 8.231 507 HA GLN 95 HA GLN 95 79.783 -8.295 5.679 508 1HB GLN 95 HB2 GLN 95 80.773 -9.015 7.791 509 2HB GLN 95 HB1 GLN 95 79.182 -9.417 8.434 510 1HG GLN 95 HG2 GLN 95 79.775 -10.707 5.858 511 2HG GLN 95 HG1 GLN 95 80.859 -11.194 7.160 512 1HE2 GLN 95 HE21 GLN 95 78.108 -12.218 5.729 513 2HE2 GLN 95 HE22 GLN 95 77.293 -12.885 7.059 514 H GLU 96 HN GLU 96 77.164 -9.144 7.980 515 HA GLU 96 HA GLU 96 75.630 -10.801 6.350 516 1HB GLU 96 HB2 GLU 96 75.141 -8.906 8.600 517 2HB GLU 96 HB1 GLU 96 73.720 -9.519 7.753 518 1HG GLU 96 HG2 GLU 96 75.894 -11.403 8.650 519 2HG GLU 96 HG1 GLU 96 74.640 -10.882 9.776 520 H ALA 97 HN ALA 97 75.878 -7.280 6.233 521 HA ALA 97 HA ALA 97 73.569 -6.829 4.554 522 1HB ALA 97 HB1 ALA 97 74.429 -5.018 5.826 523 2HB ALA 97 HB2 ALA 97 74.897 -4.641 4.168 524 3HB ALA 97 HB3 ALA 97 76.080 -5.321 5.286 525 H ALA 98 HN ALA 98 76.927 -6.180 3.623 526 HA ALA 98 HA ALA 98 76.385 -6.598 0.805 527 1HB ALA 98 HB1 ALA 98 79.159 -6.666 1.306 528 2HB ALA 98 HB2 ALA 98 78.475 -5.635 2.563 529 3HB ALA 98 HB3 ALA 98 78.199 -5.255 0.863 530 H PHE 99 HN PHE 99 78.532 -8.377 3.072 531 HA PHE 99 HA PHE 99 79.445 -10.466 1.593 532 1HB PHE 99 HB2 PHE 99 79.305 -9.882 4.203 533 2HB PHE 99 HB1 PHE 99 78.103 -11.180 4.158 534 HD1 PHE 99 HD1 PHE 99 78.828 -13.394 4.303 535 HD2 PHE 99 HD2 PHE 99 81.537 -10.370 2.915 536 HE1 PHE 99 HE1 PHE 99 80.650 -15.074 4.216 537 HE2 PHE 99 HE2 PHE 99 83.367 -12.050 2.826 538 HZ PHE 99 HZ PHE 99 82.919 -14.403 3.477 539 H ALA 100 HN ALA 100 76.238 -10.582 3.170 540 HA ALA 100 HA ALA 100 75.496 -12.984 1.658 541 1HB ALA 100 HB1 ALA 100 74.908 -12.219 4.083 542 2HB ALA 100 HB2 ALA 100 73.654 -13.003 3.123 543 3HB ALA 100 HB3 ALA 100 73.661 -11.248 3.300 544 H LEU 101 HN LEU 101 75.762 -9.919 0.590 545 HA LEU 101 HA LEU 101 73.248 -10.081 -1.023 546 1HB LEU 101 HB2 LEU 101 74.774 -7.832 0.265 547 2HB LEU 101 HB1 LEU 101 73.699 -7.514 -1.100 548 HG LEU 101 HG LEU 101 72.943 -8.843 1.519 549 1HD1 LEU 101 HD11 LEU 101 71.333 -6.599 0.843 550 2HD1 LEU 101 HD12 LEU 101 73.018 -6.116 0.641 551 3HD1 LEU 101 HD13 LEU 101 72.463 -6.756 2.188 552 1HD2 LEU 101 HD21 LEU 101 71.610 -8.666 -1.137 553 2HD2 LEU 101 HD22 LEU 101 70.596 -8.394 0.280 554 3HD2 LEU 101 HD23 LEU 101 71.480 -9.910 0.106 555 HA PRO 102 HA PRO 102 75.744 -10.289 -4.654 556 1HB PRO 102 HB2 PRO 102 73.885 -8.674 -6.151 557 2HB PRO 102 HB1 PRO 102 74.061 -10.436 -6.160 558 1HG PRO 102 HG2 PRO 102 71.927 -8.889 -5.035 559 2HG PRO 102 HG1 PRO 102 72.132 -10.643 -4.989 560 1HD PRO 102 HD2 PRO 102 72.440 -8.756 -2.812 561 2HD PRO 102 HD1 PRO 102 72.564 -10.531 -2.762 562 H VAL 103 HN VAL 103 77.168 -8.964 -5.883 563 HA VAL 103 HA VAL 103 78.207 -6.607 -4.773 564 HB VAL 103 HB VAL 103 78.239 -8.003 -7.424 565 1HG1 VAL 103 HG11 VAL 103 79.035 -5.173 -6.975 566 2HG1 VAL 103 HG12 VAL 103 78.530 -5.977 -8.457 567 3HG1 VAL 103 HG13 VAL 103 80.176 -6.182 -7.859 568 1HG2 VAL 103 HG21 VAL 103 79.624 -8.829 -5.593 569 2HG2 VAL 103 HG22 VAL 103 80.343 -7.232 -5.383 570 3HG2 VAL 103 HG23 VAL 103 80.658 -8.155 -6.854 571 H SER 104 HN SER 104 78.089 -4.355 -5.556 572 HA SER 104 HA SER 104 76.361 -3.286 -7.495 573 1HB SER 104 HB2 SER 104 75.023 -4.295 -5.047 574 2HB SER 104 HB1 SER 104 74.496 -2.700 -5.600 575 HG SER 104 HG SER 104 73.474 -4.712 -6.511 576 H GLY 105 HN GLY 105 75.616 -2.020 -4.325 577 1HA GLY 105 HA2 GLY 105 76.482 -0.188 -3.123 578 2HA GLY 105 HA1 GLY 105 77.933 -0.293 -4.116 579 H MET 106 HN MET 106 77.497 2.158 -3.815 580 HA MET 106 HA MET 106 77.157 4.176 -4.968 581 1HB MET 106 HB2 MET 106 77.714 2.402 -6.783 582 2HB MET 106 HB1 MET 106 75.999 2.476 -7.161 583 1HG MET 106 HG2 MET 106 76.677 5.151 -7.044 584 2HG MET 106 HG1 MET 106 78.146 4.425 -7.698 585 1HE MET 106 HE1 MET 106 74.017 3.410 -9.368 586 2HE MET 106 HE2 MET 106 74.142 4.929 -8.486 587 3HE MET 106 HE3 MET 106 74.568 3.421 -7.690 588 H ASP 107 HN ASP 107 74.997 4.991 -6.592 589 HA ASP 107 HA ASP 107 72.869 5.231 -4.633 590 1HB ASP 107 HB2 ASP 107 73.652 6.977 -6.255 591 2HB ASP 107 HB1 ASP 107 72.960 6.014 -7.560 592 H LYS 108 HN LYS 108 73.557 2.615 -6.426 593 HA LYS 108 HA LYS 108 70.698 1.811 -6.601 594 1HB LYS 108 HB2 LYS 108 71.476 2.614 -8.825 595 2HB LYS 108 HB1 LYS 108 72.812 1.456 -8.760 596 1HG LYS 108 HG2 LYS 108 70.588 -0.114 -8.221 597 2HG LYS 108 HG1 LYS 108 69.995 1.015 -9.439 598 1HD LYS 108 HD2 LYS 108 72.226 0.460 -10.682 599 2HD LYS 108 HD1 LYS 108 72.256 -0.963 -9.639 600 1HE LYS 108 HE2 LYS 108 71.080 -1.725 -11.552 601 2HE LYS 108 HE1 LYS 108 69.771 -1.278 -10.441 602 1HZ LYS 108 HZ1 LYS 108 69.830 0.973 -11.431 603 2HZ LYS 108 HZ2 LYS 108 69.393 -0.220 -12.558 604 3HZ LYS 108 HZ3 LYS 108 70.964 0.429 -12.568 605 HA PRO 109 HA PRO 109 73.947 -1.157 -4.791 606 1HB PRO 109 HB2 PRO 109 72.520 -1.070 -2.294 607 2HB PRO 109 HB1 PRO 109 74.168 -0.519 -2.633 608 1HG PRO 109 HG2 PRO 109 71.899 1.101 -2.069 609 2HG PRO 109 HG1 PRO 109 73.503 1.647 -2.571 610 1HD PRO 109 HD2 PRO 109 71.036 1.603 -4.127 611 2HD PRO 109 HD1 PRO 109 72.604 2.349 -4.505 612 H VAL 110 HN VAL 110 73.165 -3.215 -3.361 613 HA VAL 110 HA VAL 110 71.191 -4.584 -4.960 614 HB VAL 110 HB VAL 110 73.335 -5.340 -3.648 615 1HG1 VAL 110 HG11 VAL 110 71.868 -4.542 -1.483 616 2HG1 VAL 110 HG12 VAL 110 73.180 -5.717 -1.408 617 3HG1 VAL 110 HG13 VAL 110 71.508 -6.267 -1.520 618 1HG2 VAL 110 HG21 VAL 110 72.665 -7.434 -4.151 619 2HG2 VAL 110 HG22 VAL 110 71.221 -6.643 -4.787 620 3HG2 VAL 110 HG23 VAL 110 71.217 -7.308 -3.154 621 H PHE 111 HN PHE 111 69.782 -6.081 -3.060 622 HA PHE 111 HA PHE 111 67.415 -4.777 -2.579 623 1HB PHE 111 HB2 PHE 111 68.898 -6.761 -0.835 624 2HB PHE 111 HB1 PHE 111 67.172 -6.410 -0.690 625 HD1 PHE 111 HD1 PHE 111 69.728 -8.200 -2.534 626 HD2 PHE 111 HD2 PHE 111 65.654 -6.849 -2.673 627 HE1 PHE 111 HE1 PHE 111 69.269 -9.792 -4.378 628 HE2 PHE 111 HE2 PHE 111 65.189 -8.447 -4.512 629 HZ PHE 111 HZ PHE 111 66.995 -9.917 -5.366 630 H THR 112 HN THR 112 70.283 -4.688 -0.515 631 HA THR 112 HA THR 112 69.069 -3.087 1.574 632 HB THR 112 HB THR 112 71.668 -2.693 1.951 633 HG1 THR 112 HG1 THR 112 72.716 -3.501 0.329 634 1HG2 THR 112 HG21 THR 112 70.313 -4.069 3.380 635 2HG2 THR 112 HG22 THR 112 71.758 -4.986 2.948 636 3HG2 THR 112 HG23 THR 112 70.219 -5.332 2.148 637 H ASP 113 HN ASP 113 69.006 -0.872 1.799 638 HA ASP 113 HA ASP 113 69.532 0.793 -0.552 639 1HB ASP 113 HB2 ASP 113 68.996 1.808 2.239 640 2HB ASP 113 HB1 ASP 113 68.427 2.456 0.704 641 HA PRO 114 HA PRO 114 73.640 1.947 0.309 642 1HB PRO 114 HB2 PRO 114 73.230 4.786 0.072 643 2HB PRO 114 HB1 PRO 114 73.922 3.665 -1.116 644 1HG PRO 114 HG2 PRO 114 71.359 4.942 -1.194 645 2HG PRO 114 HG1 PRO 114 72.011 3.771 -2.338 646 1HD PRO 114 HD2 PRO 114 69.914 3.386 -0.366 647 2HD PRO 114 HD1 PRO 114 70.501 2.235 -1.588 648 HA PRO 115 HA PRO 115 73.274 4.953 4.076 649 1HB PRO 115 HB2 PRO 115 70.469 5.263 4.670 650 2HB PRO 115 HB1 PRO 115 71.630 6.505 4.193 651 1HG PRO 115 HG2 PRO 115 69.469 5.459 2.646 652 2HG PRO 115 HG1 PRO 115 70.701 6.619 2.121 653 1HD PRO 115 HD2 PRO 115 70.420 3.808 1.385 654 2HD PRO 115 HD1 PRO 115 71.550 5.014 0.740 655 H VAL 116 HN VAL 116 73.709 2.399 4.458 656 HA VAL 116 HA VAL 116 71.591 1.128 6.086 657 HB VAL 116 HB VAL 116 73.133 -0.764 6.069 658 1HG1 VAL 116 HG11 VAL 116 72.511 -1.281 3.962 659 2HG1 VAL 116 HG12 VAL 116 73.581 -0.046 3.290 660 3HG1 VAL 116 HG13 VAL 116 71.954 0.387 3.814 661 1HG2 VAL 116 HG21 VAL 116 75.137 0.593 4.383 662 2HG2 VAL 116 HG22 VAL 116 75.353 -0.620 5.645 663 3HG2 VAL 116 HG23 VAL 116 75.109 1.070 6.080 664 H LYS 117 HN LYS 117 71.914 0.645 8.322 665 HA LYS 117 HA LYS 117 73.999 2.340 9.645 666 1HB LYS 117 HB2 LYS 117 71.494 2.793 9.868 667 2HB LYS 117 HB1 LYS 117 71.412 1.298 10.813 668 1HG LYS 117 HG2 LYS 117 73.597 3.075 11.651 669 2HG LYS 117 HG1 LYS 117 71.997 3.808 11.836 670 1HD LYS 117 HD2 LYS 117 72.850 1.099 12.914 671 2HD LYS 117 HD1 LYS 117 72.609 2.567 13.872 672 1HE LYS 117 HE2 LYS 117 70.211 2.493 12.658 673 2HE LYS 117 HE1 LYS 117 70.578 0.757 12.631 674 1HZ LYS 117 HZ1 LYS 117 69.532 1.842 14.753 675 2HZ LYS 117 HZ2 LYS 117 71.135 2.312 15.067 676 3HZ LYS 117 HZ3 LYS 117 70.745 0.666 14.909 677 H THR 118 HN THR 118 75.208 1.422 11.341 678 HA THR 118 HA THR 118 74.750 -1.442 12.024 679 HB THR 118 HB THR 118 77.090 -1.946 11.438 680 HG1 THR 118 HG1 THR 118 78.388 -0.322 11.328 681 1HG2 THR 118 HG21 THR 118 76.869 -1.847 9.039 682 2HG2 THR 118 HG22 THR 118 75.759 -0.481 9.149 683 3HG2 THR 118 HG23 THR 118 75.254 -2.075 9.709 684 H LYS 119 HN LYS 119 77.302 1.033 12.476 685 HA LYS 119 HA LYS 119 76.725 1.154 15.376 686 1HB LYS 119 HB2 LYS 119 78.150 -0.840 15.061 687 2HB LYS 119 HB1 LYS 119 79.339 0.141 14.203 688 1HG LYS 119 HG2 LYS 119 80.283 0.699 16.169 689 2HG LYS 119 HG1 LYS 119 78.764 1.445 16.677 690 1HD LYS 119 HD2 LYS 119 79.026 -0.179 18.324 691 2HD LYS 119 HD1 LYS 119 78.056 -1.061 17.144 692 1HE LYS 119 HE2 LYS 119 79.756 -2.612 17.416 693 2HE LYS 119 HE1 LYS 119 80.530 -1.606 16.179 694 1HZ LYS 119 HZ1 LYS 119 82.043 -0.953 17.659 695 2HZ LYS 119 HZ2 LYS 119 81.376 -2.016 18.804 696 3HZ LYS 119 HZ3 LYS 119 80.840 -0.406 18.721 697 H PHE 120 HN PHE 120 76.751 3.039 13.065 698 HA PHE 120 HA PHE 120 78.379 5.150 14.313 699 1HB PHE 120 HB2 PHE 120 79.355 3.504 12.183 700 2HB PHE 120 HB1 PHE 120 79.093 5.132 11.542 701 HD1 PHE 120 HD1 PHE 120 79.940 7.102 13.079 702 HD2 PHE 120 HD2 PHE 120 81.335 3.048 13.334 703 HE1 PHE 120 HE1 PHE 120 82.001 7.883 14.217 704 HE2 PHE 120 HE2 PHE 120 83.395 3.829 14.473 705 HZ PHE 120 HZ PHE 120 83.727 6.246 14.914 706 H GLY 121 HN GLY 121 76.814 4.395 11.169 707 1HA GLY 121 HA2 GLY 121 74.619 6.193 11.563 708 2HA GLY 121 HA1 GLY 121 75.881 7.012 10.631 709 H TYR 122 HN TYR 122 74.400 7.030 8.788 710 HA TYR 122 HA TYR 122 73.659 4.409 7.620 711 1HB TYR 122 HB2 TYR 122 73.106 7.319 7.027 712 2HB TYR 122 HB1 TYR 122 72.648 6.056 5.889 713 HD1 TYR 122 HD1 TYR 122 72.647 4.939 9.302 714 HD2 TYR 122 HD2 TYR 122 70.286 6.990 6.358 715 HE1 TYR 122 HE1 TYR 122 70.599 4.482 10.626 716 HE2 TYR 122 HE2 TYR 122 68.239 6.534 7.680 717 HH TYR 122 HH TYR 122 68.416 4.857 10.819 718 H HIS 123 HN HIS 123 75.700 3.562 6.904 719 HA HIS 123 HA HIS 123 77.302 5.245 5.062 720 1HB HIS 123 HB2 HIS 123 78.978 3.450 5.369 721 2HB HIS 123 HB1 HIS 123 78.408 4.063 6.919 722 HD1 HIS 123 HD1 HIS 123 78.647 0.996 4.908 723 HD2 HIS 123 HD2 HIS 123 76.442 2.286 8.202 724 HE1 HIS 123 HE1 HIS 123 77.685 -1.082 5.986 725 H ILE 124 HN ILE 124 77.724 4.581 2.885 726 HA ILE 124 HA ILE 124 75.667 2.789 1.748 727 HB ILE 124 HB ILE 124 77.804 4.561 0.520 728 1HG1 ILE 124 HG12 ILE 124 74.802 4.832 0.883 729 2HG1 ILE 124 HG11 ILE 124 76.042 5.857 1.601 730 1HG2 ILE 124 HG21 ILE 124 76.345 4.168 -1.562 731 2HG2 ILE 124 HG22 ILE 124 75.643 2.814 -0.682 732 3HG2 ILE 124 HG23 ILE 124 77.364 2.821 -1.059 733 1HD1 ILE 124 HD11 ILE 124 75.313 7.125 -0.261 734 2HD1 ILE 124 HD12 ILE 124 75.165 5.696 -1.285 735 3HD1 ILE 124 HD13 ILE 124 76.761 6.318 -0.868 736 H ILE 125 HN ILE 125 76.120 0.652 1.681 737 HA ILE 125 HA ILE 125 78.915 -0.286 1.681 738 HB ILE 125 HB ILE 125 76.157 -1.501 1.931 739 1HG1 ILE 125 HG12 ILE 125 78.584 -1.349 3.750 740 2HG1 ILE 125 HG11 ILE 125 77.065 -0.462 3.943 741 1HG2 ILE 125 HG21 ILE 125 77.949 -3.532 2.498 742 2HG2 ILE 125 HG22 ILE 125 78.634 -2.782 1.056 743 3HG2 ILE 125 HG23 ILE 125 76.981 -3.394 1.032 744 1HD1 ILE 125 HD11 ILE 125 77.716 -3.120 4.838 745 2HD1 ILE 125 HD12 ILE 125 76.391 -3.210 3.678 746 3HD1 ILE 125 HD13 ILE 125 76.238 -2.198 5.115 747 H MET 126 HN MET 126 79.911 -0.542 -0.234 748 HA MET 126 HA MET 126 78.269 -1.237 -2.613 749 1HB MET 126 HB2 MET 126 79.230 0.710 -3.322 750 2HB MET 126 HB1 MET 126 80.358 0.705 -1.965 751 1HG MET 126 HG2 MET 126 81.960 -0.543 -3.129 752 2HG MET 126 HG1 MET 126 80.778 -1.161 -4.292 753 1HE MET 126 HE1 MET 126 81.751 3.277 -3.941 754 2HE MET 126 HE2 MET 126 81.199 2.141 -2.712 755 3HE MET 126 HE3 MET 126 80.058 2.758 -3.908 756 H VAL 127 HN VAL 127 78.409 -3.477 -2.565 757 HA VAL 127 HA VAL 127 81.020 -4.788 -2.080 758 HB VAL 127 HB VAL 127 79.157 -5.898 -1.093 759 1HG1 VAL 127 HG11 VAL 127 77.789 -5.112 -3.630 760 2HG1 VAL 127 HG12 VAL 127 77.210 -5.017 -1.967 761 3HG1 VAL 127 HG13 VAL 127 77.225 -6.567 -2.808 762 1HG2 VAL 127 HG21 VAL 127 79.742 -7.934 -1.858 763 2HG2 VAL 127 HG22 VAL 127 80.587 -7.138 -3.187 764 3HG2 VAL 127 HG23 VAL 127 78.909 -7.644 -3.384 765 H GLU 128 HN GLU 128 82.390 -5.071 -3.781 766 HA GLU 128 HA GLU 128 81.290 -5.771 -6.419 767 1HB GLU 128 HB2 GLU 128 81.717 -3.166 -5.819 768 2HB GLU 128 HB1 GLU 128 83.348 -3.613 -6.341 769 1HG GLU 128 HG2 GLU 128 81.082 -4.547 -8.043 770 2HG GLU 128 HG1 GLU 128 81.449 -2.817 -8.078 771 H GLY 129 HN GLY 129 82.412 -7.702 -6.349 772 1HA GLY 129 HA2 GLY 129 84.547 -8.646 -7.262 773 2HA GLY 129 HA1 GLY 129 85.377 -7.569 -6.130 774 H ARG 130 HN ARG 130 83.242 -10.377 -6.329 775 HA ARG 130 HA ARG 130 84.202 -11.104 -3.596 776 1HB ARG 130 HB2 ARG 130 81.958 -10.598 -3.279 777 2HB ARG 130 HB1 ARG 130 81.504 -11.113 -4.900 778 1HG ARG 130 HG2 ARG 130 81.913 -13.479 -4.219 779 2HG ARG 130 HG1 ARG 130 82.259 -12.921 -2.582 780 1HD ARG 130 HD2 ARG 130 80.038 -12.935 -2.128 781 2HD ARG 130 HD1 ARG 130 79.770 -11.758 -3.427 782 HE ARG 130 HE ARG 130 80.205 -14.264 -4.667 783 1HH1 ARG 130 HH11 ARG 130 78.182 -13.388 -2.068 784 2HH1 ARG 130 HH12 ARG 130 76.745 -14.068 -2.758 785 1HH2 ARG 130 HH21 ARG 130 78.257 -14.880 -5.771 786 2HH2 ARG 130 HH22 ARG 130 76.789 -14.911 -4.854 787 H LYS 131 HN LYS 131 83.892 -13.560 -3.235 788 HA LYS 131 HA LYS 131 85.160 -14.970 -5.514 789 1HB LYS 131 HB2 LYS 131 84.509 -16.023 -2.755 790 2HB LYS 131 HB1 LYS 131 85.795 -16.548 -3.840 791 1HG LYS 131 HG2 LYS 131 85.611 -13.837 -2.489 792 2HG LYS 131 HG1 LYS 131 86.710 -15.140 -2.038 793 1HD LYS 131 HD2 LYS 131 87.029 -14.737 -4.828 794 2HD LYS 131 HD1 LYS 131 87.038 -13.139 -4.082 795 1HE LYS 131 HE2 LYS 131 88.593 -14.680 -2.346 796 2HE LYS 131 HE1 LYS 131 89.075 -15.231 -3.968 797 1HZ LYS 131 HZ1 LYS 131 88.726 -12.363 -3.289 798 2HZ LYS 131 HZ2 LYS 131 89.504 -13.030 -4.644 799 3HZ LYS 131 HZ3 LYS 131 90.216 -13.152 -3.107 Start of MODEL 19 1 1H GLY 28 HT1 GLY 28 95.582 -7.768 5.207 2 2H GLY 28 HT2 GLY 28 95.961 -6.748 3.902 3 3H GLY 28 HT3 GLY 28 94.772 -7.948 3.728 4 1HA GLY 28 HA2 GLY 28 94.396 -5.310 4.468 5 2HA GLY 28 HA1 GLY 28 93.193 -6.599 4.451 6 H SER 29 HN SER 29 96.085 -6.403 6.505 7 HA SER 29 HA SER 29 96.249 -6.554 8.864 8 1HB SER 29 HB2 SER 29 94.200 -4.491 8.145 9 2HB SER 29 HB1 SER 29 94.409 -4.894 9.850 10 HG SER 29 HG SER 29 96.420 -4.046 8.041 11 H GLY 30 HN GLY 30 95.386 -8.871 8.587 12 1HA GLY 30 HA2 GLY 30 93.730 -9.732 10.561 13 2HA GLY 30 HA1 GLY 30 92.566 -9.274 9.318 14 HA PRO 31 HA PRO 31 95.404 -12.825 7.525 15 1HB PRO 31 HB2 PRO 31 96.294 -14.277 9.846 16 2HB PRO 31 HB1 PRO 31 97.281 -13.452 8.627 17 1HG PRO 31 HG2 PRO 31 96.814 -12.661 11.347 18 2HG PRO 31 HG1 PRO 31 97.781 -11.829 10.128 19 1HD PRO 31 HD2 PRO 31 95.210 -11.049 11.199 20 2HD PRO 31 HD1 PRO 31 96.199 -10.193 9.993 21 H LYS 32 HN LYS 32 95.237 -15.477 8.345 22 HA LYS 32 HA LYS 32 93.696 -17.226 8.755 23 1HB LYS 32 HB2 LYS 32 93.520 -15.439 10.818 24 2HB LYS 32 HB1 LYS 32 91.857 -15.437 10.233 25 1HG LYS 32 HG2 LYS 32 93.452 -17.915 10.955 26 2HG LYS 32 HG1 LYS 32 92.211 -17.174 11.967 27 1HD LYS 32 HD2 LYS 32 90.976 -17.458 9.480 28 2HD LYS 32 HD1 LYS 32 91.906 -18.944 9.668 29 1HE LYS 32 HE2 LYS 32 90.899 -19.174 11.987 30 2HE LYS 32 HE1 LYS 32 89.820 -17.828 11.570 31 1HZ LYS 32 HZ1 LYS 32 89.502 -19.228 9.403 32 2HZ LYS 32 HZ2 LYS 32 88.611 -19.611 10.799 33 3HZ LYS 32 HZ3 LYS 32 89.987 -20.520 10.389 34 H GLY 33 HN GLY 33 92.460 -17.825 7.018 35 1HA GLY 33 HA2 GLY 33 89.875 -17.112 6.450 36 2HA GLY 33 HA1 GLY 33 90.799 -15.870 5.605 37 H GLY 34 HN GLY 34 90.970 -16.397 3.483 38 1HA GLY 34 HA1 GLY 34 91.983 -17.758 1.745 39 2HA GLY 34 HA2 GLY 34 91.812 -19.167 2.792 40 H GLY 35 HN GLY 35 89.186 -16.890 2.415 41 1HA GLY 35 HA1 GLY 35 87.824 -18.028 0.210 42 2HA GLY 35 HA2 GLY 35 87.324 -18.926 1.651 43 H ASN 36 HN ASN 36 85.469 -17.424 0.234 44 HA ASN 36 HA ASN 36 83.834 -15.755 0.541 45 1HB ASN 36 HB2 ASN 36 84.942 -15.694 3.350 46 2HB ASN 36 HB1 ASN 36 83.294 -15.349 2.830 47 1HD2 ASN 36 HD21 ASN 36 84.726 -17.616 4.561 48 2HD2 ASN 36 HD22 ASN 36 83.977 -19.027 3.986 49 H ALA 37 HN ALA 37 84.733 -14.121 -0.709 50 HA ALA 37 HA ALA 37 85.953 -11.868 0.791 51 1HB ALA 37 HB1 ALA 37 87.988 -12.152 -0.160 52 2HB ALA 37 HB2 ALA 37 87.269 -12.266 -1.767 53 3HB ALA 37 HB3 ALA 37 87.416 -13.708 -0.762 54 H VAL 38 HN VAL 38 85.462 -9.850 -0.184 55 HA VAL 38 HA VAL 38 84.064 -9.785 -2.808 56 HB VAL 38 HB VAL 38 82.099 -8.729 -1.776 57 1HG1 VAL 38 HG11 VAL 38 82.746 -11.205 -0.169 58 2HG1 VAL 38 HG12 VAL 38 82.374 -11.277 -1.890 59 3HG1 VAL 38 HG13 VAL 38 81.170 -10.672 -0.753 60 1HG2 VAL 38 HG21 VAL 38 83.927 -8.356 0.388 61 2HG2 VAL 38 HG22 VAL 38 82.570 -9.313 0.982 62 3HG2 VAL 38 HG23 VAL 38 82.281 -7.741 0.239 63 H LYS 39 HN LYS 39 84.147 -7.506 -3.759 64 HA LYS 39 HA LYS 39 86.199 -5.893 -2.355 65 1HB LYS 39 HB2 LYS 39 85.860 -6.433 -4.886 66 2HB LYS 39 HB1 LYS 39 84.640 -5.160 -4.822 67 1HG LYS 39 HG2 LYS 39 86.905 -4.312 -5.500 68 2HG LYS 39 HG1 LYS 39 86.307 -3.559 -4.012 69 1HD LYS 39 HD2 LYS 39 88.032 -4.390 -2.824 70 2HD LYS 39 HD1 LYS 39 87.715 -6.023 -3.430 71 1HE LYS 39 HE2 LYS 39 89.118 -3.940 -5.131 72 2HE LYS 39 HE1 LYS 39 90.009 -5.022 -4.044 73 1HZ LYS 39 HZ1 LYS 39 88.250 -5.734 -6.320 74 2HZ LYS 39 HZ2 LYS 39 88.620 -6.859 -5.102 75 3HZ LYS 39 HZ3 LYS 39 89.860 -6.196 -6.057 76 H VAL 40 HN VAL 40 85.317 -4.773 -0.621 77 HA VAL 40 HA VAL 40 82.632 -3.533 -0.934 78 HB VAL 40 HB VAL 40 82.890 -3.356 1.580 79 1HG1 VAL 40 HG11 VAL 40 81.672 -5.240 1.334 80 2HG1 VAL 40 HG12 VAL 40 83.185 -6.128 1.514 81 3HG1 VAL 40 HG13 VAL 40 82.588 -5.720 -0.096 82 1HG2 VAL 40 HG21 VAL 40 84.768 -4.121 2.658 83 2HG2 VAL 40 HG22 VAL 40 85.529 -3.630 1.144 84 3HG2 VAL 40 HG23 VAL 40 85.115 -5.323 1.415 85 H ARG 41 HN ARG 41 82.279 -1.378 -0.540 86 HA ARG 41 HA ARG 41 84.588 0.441 0.012 87 1HB ARG 41 HB2 ARG 41 82.505 0.713 -2.193 88 2HB ARG 41 HB1 ARG 41 83.821 1.842 -1.877 89 1HG ARG 41 HG2 ARG 41 85.344 -0.280 -2.152 90 2HG ARG 41 HG1 ARG 41 83.947 -0.949 -2.994 91 1HD ARG 41 HD2 ARG 41 84.257 1.662 -4.025 92 2HD ARG 41 HD1 ARG 41 85.892 0.969 -3.962 93 HE ARG 41 HE ARG 41 83.751 0.072 -5.700 94 1HH1 ARG 41 HH11 ARG 41 86.963 -0.310 -5.141 95 2HH1 ARG 41 HH12 ARG 41 87.032 -2.011 -5.462 96 1HH2 ARG 41 HH21 ARG 41 83.591 -2.408 -5.534 97 2HH2 ARG 41 HH22 ARG 41 85.125 -3.196 -5.687 98 H HIS 42 HN HIS 42 83.788 2.423 1.187 99 HA HIS 42 HA HIS 42 80.848 2.407 1.680 100 1HB HIS 42 HB2 HIS 42 82.255 2.692 4.186 101 2HB HIS 42 HB1 HIS 42 81.002 1.531 3.738 102 HD1 HIS 42 HD1 HIS 42 81.778 -0.788 2.850 103 HD2 HIS 42 HD2 HIS 42 84.920 1.723 3.947 104 HE1 HIS 42 HE1 HIS 42 83.857 -2.233 2.924 105 H ILE 43 HN ILE 43 79.987 4.330 1.953 106 HA ILE 43 HA ILE 43 81.660 6.700 2.715 107 HB ILE 43 HB ILE 43 79.404 6.442 0.689 108 1HG1 ILE 43 HG12 ILE 43 82.379 6.928 0.320 109 2HG1 ILE 43 HG11 ILE 43 81.498 5.458 -0.117 110 1HG2 ILE 43 HG21 ILE 43 80.088 8.682 2.138 111 2HG2 ILE 43 HG22 ILE 43 79.308 8.699 0.559 112 3HG2 ILE 43 HG23 ILE 43 81.057 8.873 0.678 113 1HD1 ILE 43 HD11 ILE 43 81.930 7.195 -1.988 114 2HD1 ILE 43 HD12 ILE 43 80.678 8.153 -1.199 115 3HD1 ILE 43 HD13 ILE 43 80.296 6.551 -1.829 116 H LEU 44 HN LEU 44 80.835 7.178 4.836 117 HA LEU 44 HA LEU 44 77.871 6.893 5.220 118 1HB LEU 44 HB2 LEU 44 78.706 5.540 6.860 119 2HB LEU 44 HB1 LEU 44 80.325 6.243 6.722 120 HG LEU 44 HG LEU 44 79.569 8.202 8.034 121 1HD1 LEU 44 HD11 LEU 44 77.367 8.593 8.330 122 2HD1 LEU 44 HD12 LEU 44 77.204 7.070 9.203 123 3HD1 LEU 44 HD13 LEU 44 76.997 7.108 7.452 124 1HD2 LEU 44 HD21 LEU 44 80.092 5.601 8.957 125 2HD2 LEU 44 HD22 LEU 44 78.715 6.158 9.910 126 3HD2 LEU 44 HD23 LEU 44 80.210 7.094 9.890 127 H CYS 45 HN CYS 45 76.757 8.650 6.284 128 HA CYS 45 HA CYS 45 78.376 11.162 6.594 129 1HB CYS 45 HB2 CYS 45 76.499 10.671 4.656 130 2HB CYS 45 HB1 CYS 45 75.515 11.427 5.919 131 HG CYS 45 HG CYS 45 76.794 13.582 5.663 132 H GLU 46 HN GLU 46 78.417 11.572 8.774 133 HA GLU 46 HA GLU 46 76.535 10.527 10.672 134 1HB GLU 46 HB2 GLU 46 78.852 11.195 11.171 135 2HB GLU 46 HB1 GLU 46 78.457 12.873 10.797 136 1HG GLU 46 HG2 GLU 46 77.551 13.199 12.842 137 2HG GLU 46 HG1 GLU 46 76.588 11.726 12.719 138 H LYS 47 HN LYS 47 76.511 13.390 8.667 139 HA LYS 47 HA LYS 47 74.244 14.544 10.238 140 1HB LYS 47 HB2 LYS 47 74.748 16.535 8.763 141 2HB LYS 47 HB1 LYS 47 76.101 16.036 9.777 142 1HG LYS 47 HG2 LYS 47 76.030 14.638 7.201 143 2HG LYS 47 HG1 LYS 47 76.195 16.385 7.027 144 1HD LYS 47 HD2 LYS 47 77.963 14.545 8.665 145 2HD LYS 47 HD1 LYS 47 78.417 15.426 7.208 146 1HE LYS 47 HE2 LYS 47 79.032 17.174 8.513 147 2HE LYS 47 HE1 LYS 47 77.348 17.330 9.051 148 1HZ LYS 47 HZ1 LYS 47 78.530 16.835 10.996 149 2HZ LYS 47 HZ2 LYS 47 79.521 15.691 10.223 150 3HZ LYS 47 HZ3 LYS 47 77.887 15.336 10.528 151 H HIS 48 HN HIS 48 74.841 12.577 7.569 152 HA HIS 48 HA HIS 48 73.473 11.820 5.811 153 1HB HIS 48 HB2 HIS 48 71.464 13.117 7.671 154 2HB HIS 48 HB1 HIS 48 71.021 12.087 6.308 155 HD1 HIS 48 HD1 HIS 48 73.995 10.593 7.277 156 HD2 HIS 48 HD2 HIS 48 70.241 10.701 9.084 157 HE1 HIS 48 HE1 HIS 48 73.920 8.631 8.879 158 H GLY 49 HN GLY 49 74.407 14.842 6.084 159 1HA GLY 49 HA2 GLY 49 72.481 16.185 4.314 160 2HA GLY 49 HA1 GLY 49 73.991 16.879 4.923 161 H LYS 50 HN LYS 50 75.616 14.603 4.098 162 HA LYS 50 HA LYS 50 75.679 15.121 1.147 163 1HB LYS 50 HB2 LYS 50 77.865 14.109 2.988 164 2HB LYS 50 HB1 LYS 50 78.057 14.721 1.347 165 1HG LYS 50 HG2 LYS 50 78.515 16.699 2.377 166 2HG LYS 50 HG1 LYS 50 76.765 16.812 2.553 167 1HD LYS 50 HD2 LYS 50 77.503 17.136 4.752 168 2HD LYS 50 HD1 LYS 50 77.153 15.406 4.728 169 1HE LYS 50 HE2 LYS 50 79.294 15.131 5.466 170 2HE LYS 50 HE1 LYS 50 79.791 15.560 3.814 171 1HZ LYS 50 HZ1 LYS 50 79.851 17.854 4.403 172 2HZ LYS 50 HZ2 LYS 50 80.735 17.024 5.593 173 3HZ LYS 50 HZ3 LYS 50 79.156 17.558 5.923 174 H ILE 51 HN ILE 51 75.198 12.681 3.557 175 HA ILE 51 HA ILE 51 76.034 10.320 2.310 176 HB ILE 51 HB ILE 51 74.448 11.067 4.440 177 1HG1 ILE 51 HG12 ILE 51 75.957 9.026 4.054 178 2HG1 ILE 51 HG11 ILE 51 74.540 8.784 5.084 179 1HG2 ILE 51 HG21 ILE 51 72.455 11.152 2.921 180 2HG2 ILE 51 HG22 ILE 51 72.290 9.989 4.237 181 3HG2 ILE 51 HG23 ILE 51 72.678 9.429 2.609 182 1HD1 ILE 51 HD11 ILE 51 74.711 8.117 2.128 183 2HD1 ILE 51 HD12 ILE 51 73.301 7.868 3.158 184 3HD1 ILE 51 HD13 ILE 51 74.780 6.952 3.450 185 H MET 52 HN MET 52 73.385 12.487 1.488 186 HA MET 52 HA MET 52 72.257 10.778 -0.560 187 1HB MET 52 HB2 MET 52 71.385 12.862 0.927 188 2HB MET 52 HB1 MET 52 71.862 13.725 -0.537 189 1HG MET 52 HG2 MET 52 70.450 11.308 -1.214 190 2HG MET 52 HG1 MET 52 69.488 12.283 -0.109 191 1HE MET 52 HE1 MET 52 71.828 12.403 -3.146 192 2HE MET 52 HE2 MET 52 72.227 13.933 -2.371 193 3HE MET 52 HE3 MET 52 71.435 13.931 -3.945 194 H GLU 53 HN GLU 53 74.173 13.770 -0.596 195 HA GLU 53 HA GLU 53 74.554 13.891 -3.408 196 1HB GLU 53 HB2 GLU 53 75.366 15.295 -1.124 197 2HB GLU 53 HB1 GLU 53 76.871 14.649 -1.768 198 1HG GLU 53 HG2 GLU 53 76.475 15.683 -3.923 199 2HG GLU 53 HG1 GLU 53 74.837 16.141 -3.443 200 H ALA 54 HN ALA 54 75.889 12.006 -0.784 201 HA ALA 54 HA ALA 54 78.165 10.894 -2.154 202 1HB ALA 54 HB1 ALA 54 78.209 10.165 0.016 203 2HB ALA 54 HB2 ALA 54 77.126 8.890 -0.535 204 3HB ALA 54 HB3 ALA 54 76.464 10.352 0.192 205 H MET 55 HN MET 55 74.722 10.314 -2.172 206 HA MET 55 HA MET 55 74.882 7.929 -3.916 207 1HB MET 55 HB2 MET 55 72.874 9.535 -2.437 208 2HB MET 55 HB1 MET 55 72.283 8.819 -3.943 209 1HG MET 55 HG2 MET 55 73.659 6.713 -2.894 210 2HG MET 55 HG1 MET 55 73.105 7.509 -1.414 211 1HE MET 55 HE1 MET 55 70.215 7.087 -0.612 212 2HE MET 55 HE2 MET 55 71.811 6.364 -0.423 213 3HE MET 55 HE3 MET 55 70.452 5.363 -0.928 214 H GLU 56 HN GLU 56 73.796 11.335 -4.213 215 HA GLU 56 HA GLU 56 73.290 11.205 -7.052 216 1HB GLU 56 HB2 GLU 56 73.447 13.202 -4.864 217 2HB GLU 56 HB1 GLU 56 73.731 13.836 -6.484 218 1HG GLU 56 HG2 GLU 56 71.327 13.915 -5.865 219 2HG GLU 56 HG1 GLU 56 71.614 12.875 -7.259 220 H LYS 57 HN LYS 57 75.916 12.932 -5.277 221 HA LYS 57 HA LYS 57 77.557 13.614 -7.370 222 1HB LYS 57 HB2 LYS 57 77.744 13.468 -4.610 223 2HB LYS 57 HB1 LYS 57 79.025 12.386 -5.149 224 1HG LYS 57 HG2 LYS 57 80.277 14.081 -5.941 225 2HG LYS 57 HG1 LYS 57 78.884 14.897 -6.631 226 1HD LYS 57 HD2 LYS 57 78.256 15.590 -4.287 227 2HD LYS 57 HD1 LYS 57 79.837 15.006 -3.784 228 1HE LYS 57 HE2 LYS 57 80.980 16.631 -5.092 229 2HE LYS 57 HE1 LYS 57 79.527 16.998 -6.042 230 1HZ LYS 57 HZ1 LYS 57 79.948 17.507 -3.141 231 2HZ LYS 57 HZ2 LYS 57 78.457 17.694 -3.932 232 3HZ LYS 57 HZ3 LYS 57 79.777 18.674 -4.359 233 H LEU 58 HN LEU 58 77.967 10.537 -5.566 234 HA LEU 58 HA LEU 58 79.769 9.253 -7.278 235 1HB LEU 58 HB2 LEU 58 77.395 8.219 -5.700 236 2HB LEU 58 HB1 LEU 58 78.648 7.174 -6.380 237 HG LEU 58 HG LEU 58 79.095 9.418 -4.387 238 1HD1 LEU 58 HD11 LEU 58 78.212 6.784 -3.996 239 2HD1 LEU 58 HD12 LEU 58 78.881 7.859 -2.769 240 3HD1 LEU 58 HD13 LEU 58 79.935 6.743 -3.632 241 1HD2 LEU 58 HD21 LEU 58 81.076 9.350 -5.623 242 2HD2 LEU 58 HD22 LEU 58 80.922 7.626 -5.961 243 3HD2 LEU 58 HD23 LEU 58 81.407 8.169 -4.355 244 H LYS 59 HN LYS 59 76.222 9.442 -7.596 245 HA LYS 59 HA LYS 59 76.031 7.672 -9.870 246 1HB LYS 59 HB2 LYS 59 74.357 9.389 -8.215 247 2HB LYS 59 HB1 LYS 59 73.873 9.453 -9.908 248 1HG LYS 59 HG2 LYS 59 73.869 6.950 -9.946 249 2HG LYS 59 HG1 LYS 59 74.194 6.960 -8.213 250 1HD LYS 59 HD2 LYS 59 71.952 7.037 -7.929 251 2HD LYS 59 HD1 LYS 59 72.043 8.707 -8.490 252 1HE LYS 59 HE2 LYS 59 72.103 6.910 -10.761 253 2HE LYS 59 HE1 LYS 59 70.682 6.575 -9.752 254 1HZ LYS 59 HZ1 LYS 59 69.994 8.364 -11.047 255 2HZ LYS 59 HZ2 LYS 59 71.514 9.122 -11.004 256 3HZ LYS 59 HZ3 LYS 59 70.519 9.128 -9.627 257 H SER 60 HN SER 60 75.113 11.096 -9.943 258 HA SER 60 HA SER 60 75.177 11.733 -12.570 259 1HB SER 60 HB2 SER 60 76.764 13.706 -11.182 260 2HB SER 60 HB1 SER 60 75.063 13.786 -11.640 261 HG SER 60 HG SER 60 76.116 12.512 -9.331 262 H GLY 61 HN GLY 61 78.078 11.076 -10.648 263 1HA GLY 61 HA2 GLY 61 79.944 10.012 -11.992 264 2HA GLY 61 HA1 GLY 61 79.689 11.316 -13.162 265 H MET 62 HN MET 62 79.202 12.501 -10.066 266 HA MET 62 HA MET 62 81.321 14.322 -10.059 267 1HB MET 62 HB2 MET 62 79.743 13.015 -7.823 268 2HB MET 62 HB1 MET 62 80.588 14.547 -7.684 269 1HG MET 62 HG2 MET 62 78.256 13.904 -9.516 270 2HG MET 62 HG1 MET 62 78.247 15.035 -8.181 271 1HE MET 62 HE1 MET 62 80.154 16.737 -7.933 272 2HE MET 62 HE2 MET 62 81.061 17.468 -9.264 273 3HE MET 62 HE3 MET 62 81.406 15.808 -8.773 274 H ARG 63 HN ARG 63 82.724 14.115 -7.747 275 HA ARG 63 HA ARG 63 84.771 12.170 -8.341 276 1HB ARG 63 HB2 ARG 63 84.185 13.772 -5.846 277 2HB ARG 63 HB1 ARG 63 85.753 13.081 -6.294 278 1HG ARG 63 HG2 ARG 63 86.219 14.810 -7.636 279 2HG ARG 63 HG1 ARG 63 84.640 14.727 -8.420 280 1HD ARG 63 HD2 ARG 63 83.824 16.433 -7.146 281 2HD ARG 63 HD1 ARG 63 84.457 15.708 -5.653 282 HE ARG 63 HE ARG 63 86.749 16.590 -6.862 283 1HH1 ARG 63 HH21 ARG 63 85.624 18.103 -4.547 284 2HH1 ARG 63 HH22 ARG 63 85.397 19.685 -5.215 285 1HH2 ARG 63 HH11 ARG 63 85.611 18.614 -8.508 286 2HH2 ARG 63 HH12 ARG 63 85.387 19.974 -7.459 287 H PHE 64 HN PHE 64 85.073 10.125 -7.451 288 HA PHE 64 HA PHE 64 82.985 9.114 -5.615 289 1HB PHE 64 HB2 PHE 64 85.315 7.897 -7.142 290 2HB PHE 64 HB1 PHE 64 84.279 6.962 -6.064 291 HD1 PHE 64 HD1 PHE 64 82.190 6.143 -6.797 292 HD2 PHE 64 HD2 PHE 64 84.214 9.166 -9.078 293 HE1 PHE 64 HE1 PHE 64 80.523 5.886 -8.616 294 HE2 PHE 64 HE2 PHE 64 82.548 8.911 -10.896 295 HZ PHE 64 HZ PHE 64 80.702 7.271 -10.665 296 H ASN 65 HN ASN 65 86.396 9.983 -5.789 297 HA ASN 65 HA ASN 65 86.978 9.007 -3.072 298 1HB ASN 65 HB2 ASN 65 88.572 8.853 -4.963 299 2HB ASN 65 HB1 ASN 65 88.592 10.613 -5.076 300 1HD2 ASN 65 HD21 ASN 65 91.033 10.112 -4.609 301 2HD2 ASN 65 HD22 ASN 65 91.490 10.051 -2.975 302 H GLU 66 HN GLU 66 86.382 12.148 -4.677 303 HA GLU 66 HA GLU 66 87.199 13.723 -2.378 304 1HB GLU 66 HB2 GLU 66 85.240 14.424 -4.576 305 2HB GLU 66 HB1 GLU 66 86.174 15.547 -3.601 306 1HG GLU 66 HG2 GLU 66 87.560 13.452 -5.267 307 2HG GLU 66 HG1 GLU 66 87.047 14.978 -5.986 308 H VAL 67 HN VAL 67 84.042 12.554 -3.620 309 HA VAL 67 HA VAL 67 82.548 13.597 -1.381 310 HB VAL 67 HB VAL 67 80.781 12.179 -2.269 311 1HG1 VAL 67 HG11 VAL 67 80.705 12.876 -4.592 312 2HG1 VAL 67 HG12 VAL 67 82.457 13.107 -4.593 313 3HG1 VAL 67 HG13 VAL 67 81.435 14.160 -3.622 314 1HG2 VAL 67 HG21 VAL 67 82.973 10.792 -3.777 315 2HG2 VAL 67 HG22 VAL 67 81.252 10.541 -4.072 316 3HG2 VAL 67 HG23 VAL 67 81.953 10.107 -2.512 317 H ALA 68 HN ALA 68 83.840 10.339 -2.217 318 HA ALA 68 HA ALA 68 83.154 9.032 0.192 319 1HB ALA 68 HB1 ALA 68 83.990 7.824 -1.727 320 2HB ALA 68 HB2 ALA 68 85.157 7.596 -0.425 321 3HB ALA 68 HB3 ALA 68 85.491 8.749 -1.718 322 H ALA 69 HN ALA 69 85.716 11.283 -0.640 323 HA ALA 69 HA ALA 69 87.466 10.939 1.538 324 1HB ALA 69 HB1 ALA 69 88.323 12.816 0.584 325 2HB ALA 69 HB2 ALA 69 86.881 13.736 1.011 326 3HB ALA 69 HB3 ALA 69 86.933 12.830 -0.500 327 H GLN 70 HN GLN 70 85.020 13.556 1.483 328 HA GLN 70 HA GLN 70 84.760 13.252 4.376 329 1HB GLN 70 HB2 GLN 70 84.749 15.365 2.577 330 2HB GLN 70 HB1 GLN 70 83.092 15.262 3.172 331 1HG GLN 70 HG2 GLN 70 85.519 15.111 4.943 332 2HG GLN 70 HG1 GLN 70 84.649 16.624 4.645 333 1HE2 GLN 70 HE21 GLN 70 83.927 13.195 5.785 334 2HE2 GLN 70 HE22 GLN 70 82.707 13.683 6.850 335 H TYR 71 HN TYR 71 82.551 13.214 1.546 336 HA TYR 71 HA TYR 71 80.125 12.955 2.882 337 1HB TYR 71 HB2 TYR 71 81.114 11.515 0.391 338 2HB TYR 71 HB1 TYR 71 79.438 11.542 0.901 339 HD1 TYR 71 HD1 TYR 71 78.949 12.583 -1.318 340 HD2 TYR 71 HD2 TYR 71 81.359 14.585 1.626 341 HE1 TYR 71 HE1 TYR 71 78.583 14.739 -2.474 342 HE2 TYR 71 HE2 TYR 71 80.987 16.731 0.469 343 HH TYR 71 HH TYR 71 80.068 17.747 -1.264 344 H SER 72 HN SER 72 82.705 10.603 2.544 345 HA SER 72 HA SER 72 81.246 8.316 3.525 346 1HB SER 72 HB2 SER 72 84.184 9.028 3.586 347 2HB SER 72 HB1 SER 72 83.541 7.423 3.916 348 HG SER 72 HG SER 72 82.443 8.152 1.679 349 H GLU 73 HN GLU 73 82.302 11.148 5.049 350 HA GLU 73 HA GLU 73 82.820 11.705 7.305 351 1HB GLU 73 HB2 GLU 73 80.243 11.359 6.629 352 2HB GLU 73 HB1 GLU 73 80.353 10.182 7.943 353 1HG GLU 73 HG2 GLU 73 81.572 12.870 8.371 354 2HG GLU 73 HG1 GLU 73 79.811 12.761 8.406 355 H ASP 74 HN ASP 74 84.279 9.425 6.706 356 HA ASP 74 HA ASP 74 84.933 8.338 9.234 357 1HB ASP 74 HB2 ASP 74 82.497 7.342 8.095 358 2HB ASP 74 HB1 ASP 74 83.676 6.031 8.098 359 H LYS 75 HN LYS 75 84.312 6.678 6.133 360 HA LYS 75 HA LYS 75 87.275 6.347 5.800 361 1HB LYS 75 HB2 LYS 75 85.724 4.359 6.561 362 2HB LYS 75 HB1 LYS 75 85.240 4.334 4.866 363 1HG LYS 75 HG2 LYS 75 87.054 2.876 4.818 364 2HG LYS 75 HG1 LYS 75 87.851 4.405 4.447 365 1HD LYS 75 HD2 LYS 75 89.019 4.375 6.384 366 2HD LYS 75 HD1 LYS 75 87.588 3.951 7.325 367 1HE LYS 75 HE2 LYS 75 87.844 1.594 6.742 368 2HE LYS 75 HE1 LYS 75 89.193 1.979 5.656 369 1HZ LYS 75 HZ1 LYS 75 90.043 1.329 7.814 370 2HZ LYS 75 HZ2 LYS 75 89.078 2.493 8.587 371 3HZ LYS 75 HZ3 LYS 75 90.347 2.980 7.567 372 H ALA 76 HN ALA 76 86.184 4.794 3.254 373 HA ALA 76 HA ALA 76 85.032 6.909 1.614 374 1HB ALA 76 HB1 ALA 76 87.976 6.421 1.780 375 2HB ALA 76 HB2 ALA 76 87.104 7.928 1.505 376 3HB ALA 76 HB3 ALA 76 87.301 6.771 0.188 377 H ARG 77 HN ARG 77 84.171 5.999 -0.263 378 HA ARG 77 HA ARG 77 83.993 3.145 -0.537 379 1HB ARG 77 HB2 ARG 77 82.924 5.554 -1.665 380 2HB ARG 77 HB1 ARG 77 83.436 4.506 -2.986 381 1HG ARG 77 HG2 ARG 77 82.135 2.648 -2.028 382 2HG ARG 77 HG1 ARG 77 81.612 3.690 -0.711 383 1HD ARG 77 HD2 ARG 77 80.252 3.343 -3.113 384 2HD ARG 77 HD1 ARG 77 80.024 4.706 -2.009 385 HE ARG 77 HE ARG 77 81.734 5.941 -3.346 386 1HH1 ARG 77 HH21 ARG 77 79.535 5.614 -5.255 387 2HH1 ARG 77 HH22 ARG 77 80.305 4.880 -6.623 388 1HH2 ARG 77 HH11 ARG 77 83.118 3.899 -4.855 389 2HH2 ARG 77 HH12 ARG 77 82.329 3.910 -6.397 390 H GLN 78 HN GLN 78 86.114 5.563 -1.984 391 HA GLN 78 HA GLN 78 87.484 3.391 -3.537 392 1HB GLN 78 HB2 GLN 78 87.704 6.352 -4.109 393 2HB GLN 78 HB1 GLN 78 87.923 4.998 -5.220 394 1HG GLN 78 HG2 GLN 78 85.831 5.968 -5.816 395 2HG GLN 78 HG1 GLN 78 85.407 4.532 -4.893 396 1HE2 GLN 78 HE21 GLN 78 83.315 5.910 -4.540 397 2HE2 GLN 78 HE22 GLN 78 83.319 6.960 -3.208 398 H GLY 79 HN GLY 79 88.255 6.656 -2.290 399 1HA GLY 79 HA2 GLY 79 91.013 6.125 -1.832 400 2HA GLY 79 HA1 GLY 79 90.092 7.415 -1.053 401 H GLY 80 HN GLY 80 88.194 5.111 -0.167 402 1HA GLY 80 HA1 GLY 80 89.866 4.190 2.138 403 2HA GLY 80 HA2 GLY 80 88.176 4.664 2.319 404 H ASP 81 HN ASP 81 88.433 3.152 -0.622 405 HA ASP 81 HA ASP 81 86.781 0.998 -0.195 406 1HB ASP 81 HB2 ASP 81 87.701 1.706 -2.366 407 2HB ASP 81 HB1 ASP 81 89.298 1.108 -1.894 408 H LEU 82 HN LEU 82 87.071 -0.077 1.818 409 HA LEU 82 HA LEU 82 89.334 -0.949 3.126 410 1HB LEU 82 HB2 LEU 82 86.597 -2.073 2.658 411 2HB LEU 82 HB1 LEU 82 87.767 -3.066 3.529 412 HG LEU 82 HG LEU 82 86.951 -0.236 4.257 413 1HD1 LEU 82 HD11 LEU 82 85.479 -2.449 4.684 414 2HD1 LEU 82 HD12 LEU 82 85.560 -1.132 5.855 415 3HD1 LEU 82 HD13 LEU 82 86.562 -2.568 6.070 416 1HD2 LEU 82 HD21 LEU 82 89.189 -1.980 5.054 417 2HD2 LEU 82 HD22 LEU 82 88.277 -1.309 6.407 418 3HD2 LEU 82 HD23 LEU 82 89.010 -0.233 5.218 419 H GLY 83 HN GLY 83 88.024 -2.250 0.121 420 1HA GLY 83 HA2 GLY 83 89.251 -3.496 -1.502 421 2HA GLY 83 HA1 GLY 83 90.537 -3.731 -0.309 422 H TRP 84 HN TRP 84 90.239 -6.009 -1.333 423 HA TRP 84 HA TRP 84 88.127 -7.754 -1.050 424 1HB TRP 84 HB2 TRP 84 91.095 -7.934 -0.684 425 2HB TRP 84 HB1 TRP 84 90.131 -9.354 -0.293 426 HD1 TRP 84 HD1 TRP 84 91.867 -7.889 -3.075 427 HE1 TRP 84 HE1 TRP 84 90.995 -8.777 -5.336 428 HE3 TRP 84 HE3 TRP 84 87.516 -10.050 -1.538 429 HZ2 TRP 84 HZ2 TRP 84 88.735 -10.221 -6.353 430 HZ3 TRP 84 HZ3 TRP 84 86.030 -11.173 -3.162 431 HH2 TRP 84 HH2 TRP 84 86.620 -11.263 -5.564 432 H MET 85 HN MET 85 86.994 -8.688 0.671 433 HA MET 85 HA MET 85 88.135 -8.449 3.417 434 1HB MET 85 HB2 MET 85 86.602 -6.477 2.546 435 2HB MET 85 HB1 MET 85 85.300 -7.609 2.907 436 1HG MET 85 HG2 MET 85 85.546 -6.469 4.941 437 2HG MET 85 HG1 MET 85 86.539 -7.906 5.194 438 1HE MET 85 HE1 MET 85 86.761 -6.158 6.993 439 2HE MET 85 HE2 MET 85 87.843 -4.769 6.975 440 3HE MET 85 HE3 MET 85 88.505 -6.391 7.160 441 H THR 86 HN THR 86 87.277 -10.000 4.872 442 HA THR 86 HA THR 86 85.264 -11.910 3.766 443 HB THR 86 HB THR 86 87.420 -12.898 3.417 444 HG1 THR 86 HG1 THR 86 86.854 -14.726 4.286 445 1HG2 THR 86 HG21 THR 86 87.881 -12.272 6.330 446 2HG2 THR 86 HG22 THR 86 88.714 -11.521 4.968 447 3HG2 THR 86 HG23 THR 86 88.976 -13.228 5.332 448 H ARG 87 HN ARG 87 84.078 -12.976 5.286 449 HA ARG 87 HA ARG 87 83.152 -11.607 7.554 450 1HB ARG 87 HB2 ARG 87 82.402 -13.783 6.205 451 2HB ARG 87 HB1 ARG 87 83.206 -14.601 7.545 452 1HG ARG 87 HG2 ARG 87 81.703 -13.784 9.122 453 2HG ARG 87 HG1 ARG 87 81.285 -12.376 8.145 454 1HD ARG 87 HD2 ARG 87 79.385 -13.869 8.052 455 2HD ARG 87 HD1 ARG 87 80.213 -14.023 6.490 456 HE ARG 87 HE ARG 87 81.052 -16.167 7.189 457 1HH1 ARG 87 HH11 ARG 87 78.230 -15.695 8.653 458 2HH1 ARG 87 HH12 ARG 87 78.574 -16.532 10.130 459 1HH2 ARG 87 HH21 ARG 87 81.983 -16.737 9.531 460 2HH2 ARG 87 HH22 ARG 87 80.698 -17.122 10.627 461 H GLY 88 HN GLY 88 83.383 -12.323 9.887 462 1HA GLY 88 HA2 GLY 88 84.730 -13.407 11.620 463 2HA GLY 88 HA1 GLY 88 86.092 -13.419 10.491 464 H SER 89 HN SER 89 86.710 -11.085 9.737 465 HA SER 89 HA SER 89 87.238 -9.514 12.163 466 1HB SER 89 HB2 SER 89 88.411 -10.005 9.635 467 2HB SER 89 HB1 SER 89 88.022 -8.278 9.669 468 HG SER 89 HG SER 89 90.027 -9.503 10.850 469 H MET 90 HN MET 90 84.905 -9.501 9.611 470 HA MET 90 HA MET 90 84.299 -6.682 9.541 471 1HB MET 90 HB2 MET 90 83.534 -9.059 8.265 472 2HB MET 90 HB1 MET 90 82.059 -8.479 9.040 473 1HG MET 90 HG2 MET 90 82.325 -6.291 7.980 474 2HG MET 90 HG1 MET 90 83.858 -6.797 7.268 475 1HE MET 90 HE1 MET 90 82.242 -6.424 4.254 476 2HE MET 90 HE2 MET 90 83.447 -7.710 4.274 477 3HE MET 90 HE3 MET 90 83.642 -6.314 5.330 478 H VAL 91 HN VAL 91 81.389 -7.026 9.999 479 HA VAL 91 HA VAL 91 81.373 -7.226 12.990 480 HB VAL 91 HB VAL 91 81.365 -4.908 11.793 481 1HG1 VAL 91 HG11 VAL 91 79.267 -6.038 10.416 482 2HG1 VAL 91 HG12 VAL 91 79.582 -4.308 10.538 483 3HG1 VAL 91 HG13 VAL 91 78.435 -5.074 11.636 484 1HG2 VAL 91 HG21 VAL 91 80.807 -4.384 13.907 485 2HG2 VAL 91 HG22 VAL 91 79.977 -5.925 14.122 486 3HG2 VAL 91 HG23 VAL 91 79.114 -4.546 13.441 487 H GLY 92 HN GLY 92 78.426 -6.519 12.807 488 1HA GLY 92 HA2 GLY 92 77.508 -9.260 12.120 489 2HA GLY 92 HA1 GLY 92 76.641 -8.121 13.158 490 HA PRO 93 HA PRO 93 74.064 -6.731 9.927 491 1HB PRO 93 HB2 PRO 93 74.737 -3.935 10.083 492 2HB PRO 93 HB1 PRO 93 73.328 -4.765 10.765 493 1HG PRO 93 HG2 PRO 93 75.618 -3.711 12.158 494 2HG PRO 93 HG1 PRO 93 74.198 -4.506 12.841 495 1HD PRO 93 HD2 PRO 93 76.870 -5.546 12.649 496 2HD PRO 93 HD1 PRO 93 75.428 -6.374 13.283 497 H PHE 94 HN PHE 94 77.084 -4.775 9.786 498 HA PHE 94 HA PHE 94 77.155 -4.110 7.099 499 1HB PHE 94 HB2 PHE 94 78.810 -3.656 8.991 500 2HB PHE 94 HB1 PHE 94 79.522 -5.232 8.618 501 HD1 PHE 94 HD1 PHE 94 80.561 -5.644 6.400 502 HD2 PHE 94 HD2 PHE 94 79.092 -1.767 7.527 503 HE1 PHE 94 HE1 PHE 94 81.836 -4.618 4.536 504 HE2 PHE 94 HE2 PHE 94 80.366 -0.743 5.663 505 HZ PHE 94 HZ PHE 94 81.739 -2.168 4.168 506 H GLN 95 HN GLN 95 78.195 -7.236 8.502 507 HA GLN 95 HA GLN 95 78.821 -8.393 5.895 508 1HB GLN 95 HB2 GLN 95 80.026 -9.206 7.771 509 2HB GLN 95 HB1 GLN 95 78.564 -9.360 8.745 510 1HG GLN 95 HG2 GLN 95 78.436 -10.940 6.287 511 2HG GLN 95 HG1 GLN 95 79.788 -11.409 7.317 512 1HE2 GLN 95 HE21 GLN 95 77.516 -13.129 6.948 513 2HE2 GLN 95 HE22 GLN 95 76.689 -13.243 8.426 514 H GLU 96 HN GLU 96 76.076 -8.453 8.139 515 HA GLU 96 HA GLU 96 74.562 -10.543 6.923 516 1HB GLU 96 HB2 GLU 96 74.167 -8.243 8.749 517 2HB GLU 96 HB1 GLU 96 72.707 -8.815 7.941 518 1HG GLU 96 HG2 GLU 96 73.824 -11.186 8.673 519 2HG GLU 96 HG1 GLU 96 74.384 -10.151 9.986 520 H ALA 97 HN ALA 97 74.979 -7.147 6.069 521 HA ALA 97 HA ALA 97 72.795 -7.201 4.089 522 1HB ALA 97 HB1 ALA 97 74.242 -4.881 3.737 523 2HB ALA 97 HB2 ALA 97 74.575 -5.276 5.423 524 3HB ALA 97 HB3 ALA 97 72.911 -5.070 4.878 525 H ALA 98 HN ALA 98 76.154 -6.093 3.704 526 HA ALA 98 HA ALA 98 76.276 -6.582 0.903 527 1HB ALA 98 HB1 ALA 98 78.122 -5.984 3.153 528 2HB ALA 98 HB2 ALA 98 77.914 -5.143 1.616 529 3HB ALA 98 HB3 ALA 98 78.866 -6.626 1.689 530 H PHE 99 HN PHE 99 78.223 -8.365 3.317 531 HA PHE 99 HA PHE 99 79.049 -10.505 1.791 532 1HB PHE 99 HB2 PHE 99 78.937 -9.794 4.481 533 2HB PHE 99 HB1 PHE 99 78.099 -11.352 4.422 534 HD1 PHE 99 HD1 PHE 99 79.241 -13.329 3.348 535 HD2 PHE 99 HD2 PHE 99 81.294 -9.648 4.177 536 HE1 PHE 99 HE1 PHE 99 81.419 -14.491 3.113 537 HE2 PHE 99 HE2 PHE 99 83.472 -10.811 3.942 538 HZ PHE 99 HZ PHE 99 83.534 -13.233 3.409 539 H ALA 100 HN ALA 100 75.803 -10.021 3.092 540 HA ALA 100 HA ALA 100 74.919 -12.731 2.386 541 1HB ALA 100 HB1 ALA 100 72.896 -12.039 3.410 542 2HB ALA 100 HB2 ALA 100 73.197 -10.340 3.048 543 3HB ALA 100 HB3 ALA 100 74.141 -11.157 4.294 544 H LEU 101 HN LEU 101 74.341 -9.422 1.143 545 HA LEU 101 HA LEU 101 72.795 -10.462 -1.135 546 1HB LEU 101 HB2 LEU 101 73.793 -7.666 -0.516 547 2HB LEU 101 HB1 LEU 101 72.437 -8.110 -1.560 548 HG LEU 101 HG LEU 101 72.530 -8.835 1.377 549 1HD1 LEU 101 HD11 LEU 101 70.657 -6.754 0.870 550 2HD1 LEU 101 HD12 LEU 101 72.202 -6.238 0.197 551 3HD1 LEU 101 HD13 LEU 101 72.088 -6.692 1.898 552 1HD2 LEU 101 HD21 LEU 101 70.953 -9.818 -0.583 553 2HD2 LEU 101 HD22 LEU 101 70.017 -8.387 -0.150 554 3HD2 LEU 101 HD23 LEU 101 70.389 -9.602 1.074 555 HA PRO 102 HA PRO 102 76.011 -10.701 -4.124 556 1HB PRO 102 HB2 PRO 102 74.628 -9.150 -6.114 557 2HB PRO 102 HB1 PRO 102 74.732 -10.912 -5.984 558 1HG PRO 102 HG2 PRO 102 72.449 -9.243 -5.493 559 2HG PRO 102 HG1 PRO 102 72.563 -11.003 -5.340 560 1HD PRO 102 HD2 PRO 102 72.392 -9.029 -3.221 561 2HD PRO 102 HD1 PRO 102 72.446 -10.802 -3.073 562 H VAL 103 HN VAL 103 77.277 -9.128 -5.752 563 HA VAL 103 HA VAL 103 78.411 -7.000 -4.306 564 HB VAL 103 HB VAL 103 79.274 -6.491 -6.624 565 1HG1 VAL 103 HG11 VAL 103 79.357 -9.201 -5.367 566 2HG1 VAL 103 HG12 VAL 103 80.585 -7.939 -5.344 567 3HG1 VAL 103 HG13 VAL 103 80.290 -8.859 -6.823 568 1HG2 VAL 103 HG21 VAL 103 78.452 -8.838 -7.914 569 2HG2 VAL 103 HG22 VAL 103 78.066 -7.174 -8.363 570 3HG2 VAL 103 HG23 VAL 103 76.988 -8.069 -7.294 571 H SER 104 HN SER 104 78.334 -4.693 -4.949 572 HA SER 104 HA SER 104 76.411 -3.393 -6.546 573 1HB SER 104 HB2 SER 104 75.216 -4.904 -4.431 574 2HB SER 104 HB1 SER 104 74.971 -3.208 -4.053 575 HG SER 104 HG SER 104 74.525 -4.173 -6.655 576 H GLY 105 HN GLY 105 75.316 -1.580 -4.539 577 1HA GLY 105 HA2 GLY 105 75.816 0.228 -3.142 578 2HA GLY 105 HA1 GLY 105 77.472 -0.337 -3.044 579 H MET 106 HN MET 106 77.417 2.253 -3.330 580 HA MET 106 HA MET 106 78.397 3.910 -4.620 581 1HB MET 106 HB2 MET 106 79.739 3.078 -6.216 582 2HB MET 106 HB1 MET 106 79.116 1.512 -5.730 583 1HG MET 106 HG2 MET 106 77.169 2.297 -7.483 584 2HG MET 106 HG1 MET 106 78.592 3.054 -8.201 585 1HE MET 106 HE1 MET 106 77.070 -1.007 -7.805 586 2HE MET 106 HE2 MET 106 76.837 -0.211 -9.359 587 3HE MET 106 HE3 MET 106 76.370 0.616 -7.873 588 H ASP 107 HN ASP 107 75.590 2.243 -5.937 589 HA ASP 107 HA ASP 107 74.118 4.639 -6.347 590 1HB ASP 107 HB2 ASP 107 75.673 5.276 -8.019 591 2HB ASP 107 HB1 ASP 107 75.815 3.630 -8.634 592 H LYS 108 HN LYS 108 72.331 3.466 -5.748 593 HA LYS 108 HA LYS 108 70.489 2.002 -5.998 594 1HB LYS 108 HB2 LYS 108 70.572 3.060 -8.269 595 2HB LYS 108 HB1 LYS 108 71.641 1.756 -8.797 596 1HG LYS 108 HG2 LYS 108 69.336 1.231 -9.434 597 2HG LYS 108 HG1 LYS 108 69.874 0.106 -8.185 598 1HD LYS 108 HD2 LYS 108 68.654 1.262 -6.486 599 2HD LYS 108 HD1 LYS 108 68.367 2.648 -7.537 600 1HE LYS 108 HE2 LYS 108 66.318 1.548 -7.745 601 2HE LYS 108 HE1 LYS 108 67.211 0.767 -9.065 602 1HZ LYS 108 HZ1 LYS 108 67.212 -0.215 -6.258 603 2HZ LYS 108 HZ2 LYS 108 67.839 -1.007 -7.625 604 3HZ LYS 108 HZ3 LYS 108 66.160 -0.810 -7.448 605 HA PRO 109 HA PRO 109 73.733 -1.367 -5.483 606 1HB PRO 109 HB2 PRO 109 72.633 -1.702 -2.832 607 2HB PRO 109 HB1 PRO 109 74.260 -1.182 -3.279 608 1HG PRO 109 HG2 PRO 109 72.231 0.417 -2.135 609 2HG PRO 109 HG1 PRO 109 73.782 0.961 -2.788 610 1HD PRO 109 HD2 PRO 109 71.112 1.312 -3.925 611 2HD PRO 109 HD1 PRO 109 72.655 2.051 -4.428 612 H VAL 110 HN VAL 110 72.731 -3.434 -3.755 613 HA VAL 110 HA VAL 110 70.579 -4.500 -5.503 614 HB VAL 110 HB VAL 110 72.595 -5.810 -5.325 615 1HG1 VAL 110 HG11 VAL 110 73.674 -5.005 -3.384 616 2HG1 VAL 110 HG12 VAL 110 73.193 -6.639 -2.927 617 3HG1 VAL 110 HG13 VAL 110 72.244 -5.255 -2.381 618 1HG2 VAL 110 HG21 VAL 110 71.719 -7.869 -4.444 619 2HG2 VAL 110 HG22 VAL 110 70.369 -6.981 -5.146 620 3HG2 VAL 110 HG23 VAL 110 70.600 -6.997 -3.396 621 H PHE 111 HN PHE 111 69.010 -5.976 -4.348 622 HA PHE 111 HA PHE 111 67.004 -5.710 -3.005 623 1HB PHE 111 HB2 PHE 111 69.319 -6.691 -1.313 624 2HB PHE 111 HB1 PHE 111 67.611 -6.979 -0.949 625 HD1 PHE 111 HD1 PHE 111 70.281 -8.690 -2.055 626 HD2 PHE 111 HD2 PHE 111 66.388 -7.576 -3.487 627 HE1 PHE 111 HE1 PHE 111 70.288 -10.641 -3.584 628 HE2 PHE 111 HE2 PHE 111 66.394 -9.528 -5.017 629 HZ PHE 111 HZ PHE 111 68.343 -11.060 -5.066 630 H THR 112 HN THR 112 69.367 -5.024 -0.472 631 HA THR 112 HA THR 112 67.672 -3.028 0.756 632 HB THR 112 HB THR 112 69.249 -4.452 1.984 633 HG1 THR 112 HG1 THR 112 69.763 -2.899 3.336 634 1HG2 THR 112 HG21 THR 112 71.490 -4.594 1.527 635 2HG2 THR 112 HG22 THR 112 71.603 -2.905 1.037 636 3HG2 THR 112 HG23 THR 112 70.948 -4.104 -0.078 637 H ASP 113 HN ASP 113 69.233 -0.942 1.464 638 HA ASP 113 HA ASP 113 69.771 0.461 -1.131 639 1HB ASP 113 HB2 ASP 113 68.746 1.258 1.590 640 2HB ASP 113 HB1 ASP 113 69.426 2.476 0.510 641 HA PRO 114 HA PRO 114 73.983 1.093 -0.196 642 1HB PRO 114 HB2 PRO 114 73.998 3.961 -0.336 643 2HB PRO 114 HB1 PRO 114 74.510 2.799 -1.571 644 1HG PRO 114 HG2 PRO 114 72.129 4.428 -1.546 645 2HG PRO 114 HG1 PRO 114 72.664 3.299 -2.792 646 1HD PRO 114 HD2 PRO 114 70.465 2.981 -0.958 647 2HD PRO 114 HD1 PRO 114 71.035 1.821 -2.176 648 HA PRO 115 HA PRO 115 73.964 4.147 3.593 649 1HB PRO 115 HB2 PRO 115 71.207 4.707 4.185 650 2HB PRO 115 HB1 PRO 115 72.470 5.849 3.707 651 1HG PRO 115 HG2 PRO 115 70.233 4.902 2.149 652 2HG PRO 115 HG1 PRO 115 71.461 6.092 1.692 653 1HD PRO 115 HD2 PRO 115 71.176 3.405 0.704 654 2HD PRO 115 HD1 PRO 115 72.439 4.585 0.303 655 H VAL 116 HN VAL 116 74.352 1.799 4.237 656 HA VAL 116 HA VAL 116 72.059 0.387 5.450 657 HB VAL 116 HB VAL 116 73.596 -1.438 5.553 658 1HG1 VAL 116 HG11 VAL 116 73.031 -0.219 3.212 659 2HG1 VAL 116 HG12 VAL 116 73.990 -1.696 3.312 660 3HG1 VAL 116 HG13 VAL 116 74.792 -0.132 3.172 661 1HG2 VAL 116 HG21 VAL 116 75.421 -0.104 6.643 662 2HG2 VAL 116 HG22 VAL 116 75.838 0.532 5.051 663 3HG2 VAL 116 HG23 VAL 116 75.999 -1.194 5.381 664 H LYS 117 HN LYS 117 71.947 -0.089 7.707 665 HA LYS 117 HA LYS 117 73.482 1.797 9.437 666 1HB LYS 117 HB2 LYS 117 70.799 1.120 9.184 667 2HB LYS 117 HB1 LYS 117 71.309 0.220 10.620 668 1HG LYS 117 HG2 LYS 117 72.484 2.542 11.210 669 2HG LYS 117 HG1 LYS 117 71.210 3.177 10.160 670 1HD LYS 117 HD2 LYS 117 69.705 2.945 11.817 671 2HD LYS 117 HD1 LYS 117 70.059 1.213 11.911 672 1HE LYS 117 HE2 LYS 117 71.674 1.514 13.599 673 2HE LYS 117 HE1 LYS 117 71.915 3.223 13.195 674 1HZ LYS 117 HZ1 LYS 117 70.465 3.505 14.900 675 2HZ LYS 117 HZ2 LYS 117 69.787 1.955 14.738 676 3HZ LYS 117 HZ3 LYS 117 69.310 3.208 13.694 677 H THR 118 HN THR 118 74.782 1.010 11.110 678 HA THR 118 HA THR 118 74.825 -1.938 11.595 679 HB THR 118 HB THR 118 77.180 -2.022 11.180 680 HG1 THR 118 HG1 THR 118 77.258 0.742 10.691 681 1HG2 THR 118 HG21 THR 118 76.120 -0.119 9.081 682 2HG2 THR 118 HG22 THR 118 75.659 -1.820 9.158 683 3HG2 THR 118 HG23 THR 118 77.342 -1.374 8.877 684 H LYS 119 HN LYS 119 76.635 1.004 12.571 685 HA LYS 119 HA LYS 119 75.644 0.849 15.318 686 1HB LYS 119 HB2 LYS 119 77.721 -0.847 14.575 687 2HB LYS 119 HB1 LYS 119 78.554 0.512 15.328 688 1HG LYS 119 HG2 LYS 119 77.776 -0.013 17.394 689 2HG LYS 119 HG1 LYS 119 76.150 -0.349 16.788 690 1HD LYS 119 HD2 LYS 119 77.806 -2.386 15.747 691 2HD LYS 119 HD1 LYS 119 78.264 -2.212 17.442 692 1HE LYS 119 HE2 LYS 119 76.461 -3.675 17.664 693 2HE LYS 119 HE1 LYS 119 75.594 -2.129 17.749 694 1HZ LYS 119 HZ1 LYS 119 76.062 -3.804 15.335 695 2HZ LYS 119 HZ2 LYS 119 75.435 -2.226 15.280 696 3HZ LYS 119 HZ3 LYS 119 74.568 -3.460 16.061 697 H PHE 120 HN PHE 120 75.854 2.881 13.220 698 HA PHE 120 HA PHE 120 77.126 5.005 14.800 699 1HB PHE 120 HB2 PHE 120 78.547 3.573 12.769 700 2HB PHE 120 HB1 PHE 120 78.250 5.213 12.172 701 HD1 PHE 120 HD1 PHE 120 79.845 3.192 14.819 702 HD2 PHE 120 HD2 PHE 120 79.200 7.155 13.292 703 HE1 PHE 120 HE1 PHE 120 81.633 4.055 16.305 704 HE2 PHE 120 HE2 PHE 120 80.987 8.019 14.778 705 HZ PHE 120 HZ PHE 120 82.204 6.469 16.284 706 H GLY 121 HN GLY 121 75.970 4.234 11.489 707 1HA GLY 121 HA2 GLY 121 73.697 5.968 11.656 708 2HA GLY 121 HA1 GLY 121 75.016 6.816 10.835 709 H TYR 122 HN TYR 122 74.574 6.727 8.678 710 HA TYR 122 HA TYR 122 73.653 4.109 7.535 711 1HB TYR 122 HB2 TYR 122 73.172 7.010 6.847 712 2HB TYR 122 HB1 TYR 122 72.844 5.729 5.680 713 HD1 TYR 122 HD1 TYR 122 71.224 7.745 7.892 714 HD2 TYR 122 HD2 TYR 122 71.714 3.555 7.080 715 HE1 TYR 122 HE1 TYR 122 69.063 7.274 9.015 716 HE2 TYR 122 HE2 TYR 122 69.553 3.085 8.203 717 HH TYR 122 HH TYR 122 67.766 3.956 9.186 718 H HIS 123 HN HIS 123 75.379 3.101 6.564 719 HA HIS 123 HA HIS 123 77.466 4.792 5.240 720 1HB HIS 123 HB2 HIS 123 77.626 1.839 5.856 721 2HB HIS 123 HB1 HIS 123 78.946 2.995 5.688 722 HD1 HIS 123 HD1 HIS 123 79.713 4.191 7.776 723 HD2 HIS 123 HD2 HIS 123 76.101 2.190 8.343 724 HE1 HIS 123 HE1 HIS 123 79.205 4.318 10.254 725 H ILE 124 HN ILE 124 77.845 4.522 3.022 726 HA ILE 124 HA ILE 124 75.852 2.935 1.511 727 HB ILE 124 HB ILE 124 78.082 4.833 0.691 728 1HG1 ILE 124 HG12 ILE 124 75.075 5.236 0.846 729 2HG1 ILE 124 HG11 ILE 124 76.231 5.829 2.048 730 1HG2 ILE 124 HG21 ILE 124 75.767 4.264 -1.083 731 2HG2 ILE 124 HG22 ILE 124 76.952 2.968 -0.918 732 3HG2 ILE 124 HG23 ILE 124 77.457 4.555 -1.496 733 1HD1 ILE 124 HD11 ILE 124 76.633 6.505 -0.852 734 2HD1 ILE 124 HD12 ILE 124 77.151 7.391 0.581 735 3HD1 ILE 124 HD13 ILE 124 75.456 7.414 0.096 736 H ILE 125 HN ILE 125 76.499 0.762 1.697 737 HA ILE 125 HA ILE 125 79.324 0.027 1.303 738 HB ILE 125 HB ILE 125 76.737 -1.319 2.055 739 1HG1 ILE 125 HG12 ILE 125 79.464 -1.079 3.370 740 2HG1 ILE 125 HG11 ILE 125 78.024 -0.140 3.791 741 1HG2 ILE 125 HG21 ILE 125 79.228 -2.573 0.984 742 2HG2 ILE 125 HG22 ILE 125 77.552 -3.096 0.832 743 3HG2 ILE 125 HG23 ILE 125 78.424 -3.361 2.341 744 1HD1 ILE 125 HD11 ILE 125 78.579 -3.063 4.236 745 2HD1 ILE 125 HD12 ILE 125 76.913 -2.503 4.089 746 3HD1 ILE 125 HD13 ILE 125 77.949 -1.866 5.369 747 H MET 126 HN MET 126 80.051 -1.264 -0.399 748 HA MET 126 HA MET 126 78.246 -1.905 -2.633 749 1HB MET 126 HB2 MET 126 79.032 -0.152 -3.865 750 2HB MET 126 HB1 MET 126 80.018 0.353 -2.491 751 1HG MET 126 HG2 MET 126 81.919 -0.783 -3.283 752 2HG MET 126 HG1 MET 126 80.965 -1.852 -4.320 753 1HE MET 126 HE1 MET 126 82.518 2.171 -4.481 754 2HE MET 126 HE2 MET 126 81.318 1.601 -3.322 755 3HE MET 126 HE3 MET 126 80.805 2.553 -4.708 756 H VAL 127 HN VAL 127 78.593 -4.109 -2.656 757 HA VAL 127 HA VAL 127 81.311 -5.193 -2.166 758 HB VAL 127 HB VAL 127 78.520 -6.300 -2.589 759 1HG1 VAL 127 HG11 VAL 127 80.239 -8.397 -1.815 760 2HG1 VAL 127 HG12 VAL 127 81.038 -7.597 -3.169 761 3HG1 VAL 127 HG13 VAL 127 79.403 -8.227 -3.356 762 1HG2 VAL 127 HG21 VAL 127 78.866 -7.161 -0.309 763 2HG2 VAL 127 HG22 VAL 127 79.115 -5.415 -0.356 764 3HG2 VAL 127 HG23 VAL 127 80.503 -6.502 -0.302 765 H GLU 128 HN GLU 128 82.640 -5.821 -3.949 766 HA GLU 128 HA GLU 128 81.291 -6.139 -6.565 767 1HB GLU 128 HB2 GLU 128 81.875 -3.710 -6.070 768 2HB GLU 128 HB1 GLU 128 83.574 -4.199 -6.141 769 1HG GLU 128 HG2 GLU 128 82.881 -3.361 -8.330 770 2HG GLU 128 HG1 GLU 128 83.176 -5.102 -8.435 771 H GLY 129 HN GLY 129 82.117 -8.287 -6.534 772 1HA GLY 129 HA2 GLY 129 83.828 -9.573 -7.742 773 2HA GLY 129 HA1 GLY 129 85.032 -8.477 -7.049 774 H ARG 130 HN ARG 130 83.090 -11.303 -6.497 775 HA ARG 130 HA ARG 130 84.389 -11.530 -3.826 776 1HB ARG 130 HB2 ARG 130 81.931 -12.999 -4.762 777 2HB ARG 130 HB1 ARG 130 82.446 -12.708 -3.104 778 1HG ARG 130 HG2 ARG 130 82.094 -10.264 -3.467 779 2HG ARG 130 HG1 ARG 130 81.478 -10.620 -5.081 780 1HD ARG 130 HD2 ARG 130 80.260 -12.072 -2.754 781 2HD ARG 130 HD1 ARG 130 79.793 -10.384 -3.041 782 HE ARG 130 HE ARG 130 79.013 -11.038 -5.265 783 1HH1 ARG 130 HH11 ARG 130 77.916 -13.137 -3.255 784 2HH1 ARG 130 HH12 ARG 130 78.143 -14.587 -4.176 785 1HH2 ARG 130 HH21 ARG 130 80.276 -13.106 -6.475 786 2HH2 ARG 130 HH22 ARG 130 79.480 -14.568 -5.999 787 H LYS 131 HN LYS 131 84.720 -13.937 -3.193 788 HA LYS 131 HA LYS 131 85.109 -15.808 -5.433 789 1HB LYS 131 HB2 LYS 131 87.601 -15.941 -4.830 790 2HB LYS 131 HB1 LYS 131 87.090 -14.489 -5.691 791 1HG LYS 131 HG2 LYS 131 87.777 -13.200 -3.978 792 2HG LYS 131 HG1 LYS 131 86.730 -14.082 -2.866 793 1HD LYS 131 HD2 LYS 131 88.907 -14.417 -1.997 794 2HD LYS 131 HD1 LYS 131 88.565 -15.902 -2.884 795 1HE LYS 131 HE2 LYS 131 90.170 -15.468 -4.461 796 2HE LYS 131 HE1 LYS 131 89.801 -13.727 -4.489 797 1HZ LYS 131 HZ1 LYS 131 90.839 -13.528 -2.302 798 2HZ LYS 131 HZ2 LYS 131 91.947 -14.140 -3.435 799 3HZ LYS 131 HZ3 LYS 131 91.218 -15.182 -2.307 Start of MODEL 20 1 1H GLY 28 HT1 GLY 28 81.361 -23.041 -5.223 2 2H GLY 28 HT2 GLY 28 81.019 -23.660 -3.678 3 3H GLY 28 HT3 GLY 28 82.314 -24.288 -4.581 4 1HA GLY 28 HA2 GLY 28 82.189 -21.463 -3.700 5 2HA GLY 28 HA1 GLY 28 82.957 -22.732 -2.746 6 H SER 29 HN SER 29 84.147 -20.367 -4.161 7 HA SER 29 HA SER 29 85.638 -21.366 -6.448 8 1HB SER 29 HB2 SER 29 86.739 -19.204 -6.271 9 2HB SER 29 HB1 SER 29 85.025 -18.977 -5.920 10 HG SER 29 HG SER 29 87.137 -19.238 -4.049 11 H GLY 30 HN GLY 30 86.218 -23.402 -4.965 12 1HA GLY 30 HA2 GLY 30 88.120 -24.592 -4.206 13 2HA GLY 30 HA1 GLY 30 89.032 -23.083 -4.235 14 HA PRO 31 HA PRO 31 88.394 -24.201 0.201 15 1HB PRO 31 HB2 PRO 31 90.829 -22.735 0.670 16 2HB PRO 31 HB1 PRO 31 90.563 -24.484 0.797 17 1HG PRO 31 HG2 PRO 31 92.041 -23.061 -1.218 18 2HG PRO 31 HG1 PRO 31 91.776 -24.802 -1.091 19 1HD PRO 31 HD2 PRO 31 90.619 -22.969 -2.998 20 2HD PRO 31 HD1 PRO 31 90.351 -24.723 -2.869 21 H LYS 32 HN LYS 32 86.831 -22.789 0.960 22 HA LYS 32 HA LYS 32 87.549 -20.086 1.741 23 1HB LYS 32 HB2 LYS 32 85.656 -19.192 0.110 24 2HB LYS 32 HB1 LYS 32 87.302 -19.411 -0.475 25 1HG LYS 32 HG2 LYS 32 86.698 -21.080 -1.881 26 2HG LYS 32 HG1 LYS 32 85.695 -21.859 -0.660 27 1HD LYS 32 HD2 LYS 32 84.936 -19.520 -2.429 28 2HD LYS 32 HD1 LYS 32 84.246 -21.141 -2.456 29 1HE LYS 32 HE2 LYS 32 82.688 -20.406 -0.977 30 2HE LYS 32 HE1 LYS 32 83.990 -20.238 0.218 31 1HZ LYS 32 HZ1 LYS 32 83.414 -18.059 0.053 32 2HZ LYS 32 HZ2 LYS 32 82.772 -18.223 -1.511 33 3HZ LYS 32 HZ3 LYS 32 84.452 -18.108 -1.287 34 H GLY 33 HN GLY 33 84.829 -22.261 0.918 35 1HA GLY 33 HA2 GLY 33 82.978 -22.875 2.234 36 2HA GLY 33 HA1 GLY 33 83.745 -22.060 3.595 37 H GLY 34 HN GLY 34 81.462 -21.733 0.989 38 1HA GLY 34 HA2 GLY 34 79.864 -20.078 0.536 39 2HA GLY 34 HA1 GLY 34 80.012 -19.641 2.238 40 H GLY 35 HN GLY 35 79.707 -17.830 -0.053 41 1HA GLY 35 HA1 GLY 35 82.089 -16.596 -0.905 42 2HA GLY 35 HA2 GLY 35 80.560 -15.734 -0.681 43 H ASN 36 HN ASN 36 83.543 -15.201 0.067 44 HA ASN 36 HA ASN 36 82.902 -14.146 2.780 45 1HB ASN 36 HB2 ASN 36 85.321 -15.808 2.010 46 2HB ASN 36 HB1 ASN 36 85.077 -15.047 3.582 47 1HD2 ASN 36 HD21 ASN 36 85.120 -18.020 2.630 48 2HD2 ASN 36 HD22 ASN 36 83.710 -18.669 3.319 49 H ALA 37 HN ALA 37 85.226 -14.215 0.081 50 HA ALA 37 HA ALA 37 86.360 -11.616 0.886 51 1HB ALA 37 HB1 ALA 37 87.551 -12.224 -1.442 52 2HB ALA 37 HB2 ALA 37 86.927 -13.824 -1.043 53 3HB ALA 37 HB3 ALA 37 88.022 -13.002 0.069 54 H VAL 38 HN VAL 38 85.665 -9.714 0.027 55 HA VAL 38 HA VAL 38 84.335 -9.645 -2.632 56 HB VAL 38 HB VAL 38 82.274 -8.848 -1.790 57 1HG1 VAL 38 HG11 VAL 38 82.738 -11.251 -1.142 58 2HG1 VAL 38 HG12 VAL 38 81.540 -10.440 -0.138 59 3HG1 VAL 38 HG13 VAL 38 83.185 -10.662 0.458 60 1HG2 VAL 38 HG21 VAL 38 83.204 -7.089 -0.347 61 2HG2 VAL 38 HG22 VAL 38 83.701 -8.303 0.833 62 3HG2 VAL 38 HG23 VAL 38 81.987 -8.017 0.531 63 H LYS 39 HN LYS 39 84.488 -7.388 -3.597 64 HA LYS 39 HA LYS 39 86.540 -5.804 -2.140 65 1HB LYS 39 HB2 LYS 39 86.478 -6.308 -4.623 66 2HB LYS 39 HB1 LYS 39 85.069 -5.252 -4.724 67 1HG LYS 39 HG2 LYS 39 87.267 -4.109 -5.262 68 2HG LYS 39 HG1 LYS 39 86.371 -3.355 -3.934 69 1HD LYS 39 HD2 LYS 39 87.991 -3.851 -2.431 70 2HD LYS 39 HD1 LYS 39 88.139 -5.510 -3.027 71 1HE LYS 39 HE2 LYS 39 90.251 -4.284 -3.396 72 2HE LYS 39 HE1 LYS 39 89.492 -4.655 -4.955 73 1HZ LYS 39 HZ1 LYS 39 88.524 -2.226 -3.743 74 2HZ LYS 39 HZ2 LYS 39 89.053 -2.503 -5.333 75 3HZ LYS 39 HZ3 LYS 39 90.179 -2.165 -4.108 76 H VAL 40 HN VAL 40 85.380 -4.953 -0.350 77 HA VAL 40 HA VAL 40 82.819 -3.565 -0.792 78 HB VAL 40 HB VAL 40 83.305 -5.111 1.105 79 1HG1 VAL 40 HG11 VAL 40 84.769 -3.085 2.635 80 2HG1 VAL 40 HG12 VAL 40 85.683 -3.687 1.252 81 3HG1 VAL 40 HG13 VAL 40 85.087 -4.812 2.473 82 1HG2 VAL 40 HG21 VAL 40 81.689 -3.964 2.174 83 2HG2 VAL 40 HG22 VAL 40 82.027 -2.574 1.143 84 3HG2 VAL 40 HG23 VAL 40 82.861 -2.750 2.687 85 H ARG 41 HN ARG 41 82.429 -1.438 -0.341 86 HA ARG 41 HA ARG 41 84.726 0.447 0.055 87 1HB ARG 41 HB2 ARG 41 82.637 0.180 -2.073 88 2HB ARG 41 HB1 ARG 41 83.080 1.811 -1.597 89 1HG ARG 41 HG2 ARG 41 85.059 1.659 -2.700 90 2HG ARG 41 HG1 ARG 41 85.435 0.131 -1.907 91 1HD ARG 41 HD2 ARG 41 83.858 -0.998 -3.555 92 2HD ARG 41 HD1 ARG 41 83.803 0.547 -4.434 93 HE ARG 41 HE ARG 41 86.503 -0.458 -3.780 94 1HH1 ARG 41 HH21 ARG 41 83.912 -0.933 -5.947 95 2HH1 ARG 41 HH22 ARG 41 84.899 -0.904 -7.370 96 1HH2 ARG 41 HH11 ARG 41 87.805 -0.099 -5.657 97 2HH2 ARG 41 HH12 ARG 41 87.105 -0.432 -7.206 98 H HIS 42 HN HIS 42 83.976 2.381 1.431 99 HA HIS 42 HA HIS 42 81.116 2.037 2.285 100 1HB HIS 42 HB2 HIS 42 81.765 1.771 4.548 101 2HB HIS 42 HB1 HIS 42 82.711 0.633 3.591 102 HD1 HIS 42 HD1 HIS 42 83.202 2.759 6.316 103 HD2 HIS 42 HD2 HIS 42 85.293 2.267 2.742 104 HE1 HIS 42 HE1 HIS 42 85.520 3.700 6.707 105 H ILE 43 HN ILE 43 80.227 3.994 1.993 106 HA ILE 43 HA ILE 43 81.648 6.477 2.915 107 HB ILE 43 HB ILE 43 79.893 5.812 0.692 108 1HG1 ILE 43 HG12 ILE 43 81.035 8.541 1.351 109 2HG1 ILE 43 HG11 ILE 43 82.043 7.230 0.743 110 1HG2 ILE 43 HG21 ILE 43 78.367 7.742 0.792 111 2HG2 ILE 43 HG22 ILE 43 78.930 8.095 2.425 112 3HG2 ILE 43 HG23 ILE 43 78.053 6.603 2.099 113 1HD1 ILE 43 HD11 ILE 43 80.237 8.963 -0.707 114 2HD1 ILE 43 HD12 ILE 43 79.778 7.275 -0.930 115 3HD1 ILE 43 HD13 ILE 43 81.409 7.807 -1.339 116 H LEU 44 HN LEU 44 81.009 7.256 4.952 117 HA LEU 44 HA LEU 44 78.274 6.465 5.900 118 1HB LEU 44 HB2 LEU 44 79.583 5.423 7.480 119 2HB LEU 44 HB1 LEU 44 81.006 6.379 7.054 120 HG LEU 44 HG LEU 44 80.169 8.268 8.340 121 1HD1 LEU 44 HD11 LEU 44 77.995 7.028 9.751 122 2HD1 LEU 44 HD12 LEU 44 77.677 6.922 8.020 123 3HD1 LEU 44 HD13 LEU 44 77.967 8.493 8.769 124 1HD2 LEU 44 HD21 LEU 44 81.252 7.222 10.026 125 2HD2 LEU 44 HD22 LEU 44 80.684 5.640 9.491 126 3HD2 LEU 44 HD23 LEU 44 79.676 6.627 10.551 127 H CYS 45 HN CYS 45 77.024 8.192 6.773 128 HA CYS 45 HA CYS 45 78.296 10.907 6.628 129 1HB CYS 45 HB2 CYS 45 75.455 10.058 5.972 130 2HB CYS 45 HB1 CYS 45 76.120 11.690 5.795 131 HG CYS 45 HG CYS 45 77.874 9.869 4.228 132 H GLU 46 HN GLU 46 78.162 12.042 8.530 133 HA GLU 46 HA GLU 46 76.753 10.882 10.823 134 1HB GLU 46 HB2 GLU 46 78.938 12.589 10.313 135 2HB GLU 46 HB1 GLU 46 77.753 13.596 11.144 136 1HG GLU 46 HG2 GLU 46 77.872 12.367 13.087 137 2HG GLU 46 HG1 GLU 46 78.200 10.858 12.234 138 H LYS 47 HN LYS 47 76.395 13.694 8.682 139 HA LYS 47 HA LYS 47 73.953 14.602 10.078 140 1HB LYS 47 HB2 LYS 47 75.551 15.514 7.666 141 2HB LYS 47 HB1 LYS 47 74.099 16.343 8.229 142 1HG LYS 47 HG2 LYS 47 75.233 16.476 10.516 143 2HG LYS 47 HG1 LYS 47 76.712 15.965 9.706 144 1HD LYS 47 HD2 LYS 47 75.556 18.055 8.147 145 2HD LYS 47 HD1 LYS 47 75.577 18.592 9.827 146 1HE LYS 47 HE2 LYS 47 78.062 17.355 9.493 147 2HE LYS 47 HE1 LYS 47 77.815 18.248 7.981 148 1HZ LYS 47 HZ1 LYS 47 77.131 19.476 10.579 149 2HZ LYS 47 HZ2 LYS 47 77.512 20.236 9.108 150 3HZ LYS 47 HZ3 LYS 47 78.736 19.503 10.032 151 H HIS 48 HN HIS 48 74.761 12.334 7.700 152 HA HIS 48 HA HIS 48 73.466 11.104 6.164 153 1HB HIS 48 HB2 HIS 48 71.426 12.298 8.049 154 2HB HIS 48 HB1 HIS 48 70.986 11.137 6.796 155 HD1 HIS 48 HD1 HIS 48 74.338 10.576 8.165 156 HD2 HIS 48 HD2 HIS 48 70.471 9.338 9.095 157 HE1 HIS 48 HE1 HIS 48 74.586 8.583 9.713 158 H GLY 49 HN GLY 49 73.895 14.226 5.931 159 1HA GLY 49 HA2 GLY 49 71.693 14.874 4.060 160 2HA GLY 49 HA1 GLY 49 72.946 15.996 4.611 161 H LYS 50 HN LYS 50 75.238 14.489 4.063 162 HA LYS 50 HA LYS 50 75.440 14.815 1.158 163 1HB LYS 50 HB2 LYS 50 77.796 14.327 1.599 164 2HB LYS 50 HB1 LYS 50 77.196 15.439 2.829 165 1HG LYS 50 HG2 LYS 50 76.796 12.626 3.541 166 2HG LYS 50 HG1 LYS 50 78.494 13.045 3.325 167 1HD LYS 50 HD2 LYS 50 77.004 15.088 4.803 168 2HD LYS 50 HD1 LYS 50 76.998 13.520 5.612 169 1HE LYS 50 HE2 LYS 50 79.170 13.771 6.218 170 2HE LYS 50 HE1 LYS 50 79.641 14.126 4.541 171 1HZ LYS 50 HZ1 LYS 50 78.798 16.376 4.823 172 2HZ LYS 50 HZ2 LYS 50 79.986 16.051 5.993 173 3HZ LYS 50 HZ3 LYS 50 78.342 16.038 6.420 174 H ILE 51 HN ILE 51 74.716 12.191 3.312 175 HA ILE 51 HA ILE 51 75.740 9.954 1.971 176 HB ILE 51 HB ILE 51 74.390 9.942 4.065 177 1HG1 ILE 51 HG12 ILE 51 72.819 8.002 3.318 178 2HG1 ILE 51 HG11 ILE 51 73.561 8.229 1.728 179 1HG2 ILE 51 HG21 ILE 51 72.673 11.581 2.857 180 2HG2 ILE 51 HG22 ILE 51 72.148 10.497 4.147 181 3HG2 ILE 51 HG23 ILE 51 71.871 10.060 2.460 182 1HD1 ILE 51 HD11 ILE 51 74.628 6.553 3.491 183 2HD1 ILE 51 HD12 ILE 51 75.347 8.031 4.127 184 3HD1 ILE 51 HD13 ILE 51 75.656 7.547 2.460 185 H MET 52 HN MET 52 73.051 12.068 1.083 186 HA MET 52 HA MET 52 72.341 10.460 -1.254 187 1HB MET 52 HB2 MET 52 71.190 12.472 0.347 188 2HB MET 52 HB1 MET 52 71.413 13.211 -1.239 189 1HG MET 52 HG2 MET 52 70.361 10.453 -1.284 190 2HG MET 52 HG1 MET 52 69.278 11.650 -0.574 191 1HE MET 52 HE1 MET 52 71.200 11.676 -4.713 192 2HE MET 52 HE2 MET 52 71.799 10.993 -3.205 193 3HE MET 52 HE3 MET 52 71.936 12.725 -3.494 194 H GLU 53 HN GLU 53 73.937 13.542 -0.602 195 HA GLU 53 HA GLU 53 74.602 14.294 -3.249 196 1HB GLU 53 HB2 GLU 53 75.119 15.139 -0.636 197 2HB GLU 53 HB1 GLU 53 76.716 14.707 -1.248 198 1HG GLU 53 HG2 GLU 53 76.086 16.078 -3.338 199 2HG GLU 53 HG1 GLU 53 74.763 16.722 -2.366 200 H ALA 54 HN ALA 54 75.791 11.893 -1.026 201 HA ALA 54 HA ALA 54 78.160 11.164 -2.615 202 1HB ALA 54 HB1 ALA 54 77.648 10.907 -0.060 203 2HB ALA 54 HB2 ALA 54 78.475 9.581 -0.878 204 3HB ALA 54 HB3 ALA 54 76.746 9.472 -0.549 205 H MET 55 HN MET 55 74.785 10.264 -2.327 206 HA MET 55 HA MET 55 75.003 7.822 -3.934 207 1HB MET 55 HB2 MET 55 72.882 9.546 -2.725 208 2HB MET 55 HB1 MET 55 72.397 8.452 -4.025 209 1HG MET 55 HG2 MET 55 73.911 6.762 -2.547 210 2HG MET 55 HG1 MET 55 73.323 7.834 -1.267 211 1HE MET 55 HE1 MET 55 70.630 7.218 -0.168 212 2HE MET 55 HE2 MET 55 72.265 6.575 -0.034 213 3HE MET 55 HE3 MET 55 70.914 5.477 -0.308 214 H GLU 56 HN GLU 56 73.915 11.175 -4.528 215 HA GLU 56 HA GLU 56 73.272 10.782 -7.314 216 1HB GLU 56 HB2 GLU 56 73.253 12.831 -5.306 217 2HB GLU 56 HB1 GLU 56 74.041 13.475 -6.747 218 1HG GLU 56 HG2 GLU 56 71.965 12.214 -7.918 219 2HG GLU 56 HG1 GLU 56 71.227 12.585 -6.360 220 H LYS 57 HN LYS 57 76.025 12.565 -5.838 221 HA LYS 57 HA LYS 57 77.589 13.024 -8.079 222 1HB LYS 57 HB2 LYS 57 78.260 12.188 -5.251 223 2HB LYS 57 HB1 LYS 57 79.521 12.631 -6.402 224 1HG LYS 57 HG2 LYS 57 77.705 14.680 -6.715 225 2HG LYS 57 HG1 LYS 57 77.585 14.342 -4.989 226 1HD LYS 57 HD2 LYS 57 79.758 14.979 -4.573 227 2HD LYS 57 HD1 LYS 57 80.323 14.473 -6.165 228 1HE LYS 57 HE2 LYS 57 80.318 16.715 -6.636 229 2HE LYS 57 HE1 LYS 57 78.561 16.522 -6.778 230 1HZ LYS 57 HZ1 LYS 57 80.127 17.295 -4.376 231 2HZ LYS 57 HZ2 LYS 57 78.510 16.782 -4.285 232 3HZ LYS 57 HZ3 LYS 57 78.911 18.188 -5.150 233 H LEU 58 HN LEU 58 78.205 10.174 -5.987 234 HA LEU 58 HA LEU 58 79.809 8.661 -7.668 235 1HB LEU 58 HB2 LEU 58 77.696 8.093 -5.634 236 2HB LEU 58 HB1 LEU 58 78.264 6.726 -6.600 237 HG LEU 58 HG LEU 58 80.643 7.842 -5.972 238 1HD1 LEU 58 HD11 LEU 58 79.298 9.570 -4.595 239 2HD1 LEU 58 HD12 LEU 58 80.666 8.790 -3.801 240 3HD1 LEU 58 HD13 LEU 58 79.023 8.251 -3.457 241 1HD2 LEU 58 HD21 LEU 58 79.674 5.488 -5.557 242 2HD2 LEU 58 HD22 LEU 58 79.200 6.096 -3.971 243 3HD2 LEU 58 HD23 LEU 58 80.903 6.057 -4.427 244 H LYS 59 HN LYS 59 76.295 9.095 -7.875 245 HA LYS 59 HA LYS 59 75.900 7.142 -9.999 246 1HB LYS 59 HB2 LYS 59 74.379 9.125 -8.421 247 2HB LYS 59 HB1 LYS 59 73.752 8.849 -10.046 248 1HG LYS 59 HG2 LYS 59 74.495 6.343 -8.793 249 2HG LYS 59 HG1 LYS 59 73.346 7.225 -7.788 250 1HD LYS 59 HD2 LYS 59 72.840 7.049 -10.738 251 2HD LYS 59 HD1 LYS 59 72.488 5.642 -9.734 252 1HE LYS 59 HE2 LYS 59 71.038 7.031 -8.285 253 2HE LYS 59 HE1 LYS 59 71.394 8.447 -9.293 254 1HZ LYS 59 HZ1 LYS 59 70.130 5.900 -10.172 255 2HZ LYS 59 HZ2 LYS 59 70.608 7.142 -11.227 256 3HZ LYS 59 HZ3 LYS 59 69.381 7.419 -10.085 257 H SER 60 HN SER 60 75.108 10.606 -10.175 258 HA SER 60 HA SER 60 75.121 11.027 -12.886 259 1HB SER 60 HB2 SER 60 76.556 13.200 -11.788 260 2HB SER 60 HB1 SER 60 74.808 13.072 -11.976 261 HG SER 60 HG SER 60 76.258 12.020 -9.780 262 H GLY 61 HN GLY 61 78.008 10.768 -10.826 263 1HA GLY 61 HA2 GLY 61 79.992 9.659 -11.863 264 2HA GLY 61 HA1 GLY 61 79.637 10.583 -13.329 265 H MET 62 HN MET 62 79.383 11.981 -10.100 266 HA MET 62 HA MET 62 81.238 14.113 -10.842 267 1HB MET 62 HB2 MET 62 79.126 13.647 -9.028 268 2HB MET 62 HB1 MET 62 80.548 13.942 -8.028 269 1HG MET 62 HG2 MET 62 79.711 16.109 -8.417 270 2HG MET 62 HG1 MET 62 80.975 15.947 -9.634 271 1HE MET 62 HE1 MET 62 77.088 14.727 -9.355 272 2HE MET 62 HE2 MET 62 76.482 16.216 -10.076 273 3HE MET 62 HE3 MET 62 77.501 16.292 -8.641 274 H ARG 63 HN ARG 63 82.371 14.316 -8.103 275 HA ARG 63 HA ARG 63 84.809 12.838 -8.505 276 1HB ARG 63 HB2 ARG 63 83.588 14.202 -6.087 277 2HB ARG 63 HB1 ARG 63 85.271 13.669 -6.201 278 1HG ARG 63 HG2 ARG 63 85.828 15.296 -7.732 279 2HG ARG 63 HG1 ARG 63 84.177 15.448 -8.343 280 1HD ARG 63 HD2 ARG 63 83.722 17.105 -6.854 281 2HD ARG 63 HD1 ARG 63 84.297 16.104 -5.499 282 HE ARG 63 HE ARG 63 86.656 16.789 -6.347 283 1HH1 ARG 63 HH21 ARG 63 84.022 18.791 -5.709 284 2HH1 ARG 63 HH22 ARG 63 84.770 20.242 -6.289 285 1HH2 ARG 63 HH11 ARG 63 87.548 18.614 -7.574 286 2HH2 ARG 63 HH12 ARG 63 86.766 20.143 -7.344 287 H PHE 64 HN PHE 64 85.181 10.702 -7.983 288 HA PHE 64 HA PHE 64 83.192 9.272 -6.315 289 1HB PHE 64 HB2 PHE 64 85.226 8.684 -8.362 290 2HB PHE 64 HB1 PHE 64 85.221 7.518 -7.039 291 HD1 PHE 64 HD1 PHE 64 82.578 7.116 -6.205 292 HD2 PHE 64 HD2 PHE 64 83.953 7.986 -10.180 293 HE1 PHE 64 HE1 PHE 64 80.538 6.061 -7.141 294 HE2 PHE 64 HE2 PHE 64 81.913 6.930 -11.117 295 HZ PHE 64 HZ PHE 64 80.206 5.967 -9.597 296 H ASN 65 HN ASN 65 86.533 10.423 -6.246 297 HA ASN 65 HA ASN 65 87.055 9.101 -3.654 298 1HB ASN 65 HB2 ASN 65 88.916 9.049 -5.072 299 2HB ASN 65 HB1 ASN 65 88.588 10.654 -5.720 300 1HD2 ASN 65 HD21 ASN 65 90.538 8.956 -3.500 301 2HD2 ASN 65 HD22 ASN 65 91.105 10.285 -2.610 302 H GLU 66 HN GLU 66 86.406 12.359 -4.931 303 HA GLU 66 HA GLU 66 87.074 13.764 -2.502 304 1HB GLU 66 HB2 GLU 66 85.021 14.524 -4.596 305 2HB GLU 66 HB1 GLU 66 85.948 15.610 -3.568 306 1HG GLU 66 HG2 GLU 66 87.596 13.771 -5.187 307 2HG GLU 66 HG1 GLU 66 86.667 14.937 -6.124 308 H VAL 67 HN VAL 67 83.919 12.716 -3.870 309 HA VAL 67 HA VAL 67 82.395 13.378 -1.561 310 HB VAL 67 HB VAL 67 80.821 11.663 -2.508 311 1HG1 VAL 67 HG11 VAL 67 82.125 13.564 -4.438 312 2HG1 VAL 67 HG12 VAL 67 80.700 13.861 -3.441 313 3HG1 VAL 67 HG13 VAL 67 80.616 12.713 -4.782 314 1HG2 VAL 67 HG21 VAL 67 83.229 11.041 -4.160 315 2HG2 VAL 67 HG22 VAL 67 81.606 10.727 -4.778 316 3HG2 VAL 67 HG23 VAL 67 82.156 9.938 -3.300 317 H ALA 68 HN ALA 68 83.837 10.264 -2.592 318 HA ALA 68 HA ALA 68 83.284 8.692 -0.362 319 1HB ALA 68 HB1 ALA 68 84.295 7.667 -2.230 320 2HB ALA 68 HB2 ALA 68 85.615 7.704 -1.060 321 3HB ALA 68 HB3 ALA 68 85.542 8.909 -2.347 322 H ALA 69 HN ALA 69 85.884 11.043 -0.924 323 HA ALA 69 HA ALA 69 87.404 10.641 1.403 324 1HB ALA 69 HB1 ALA 69 88.158 12.901 1.029 325 2HB ALA 69 HB2 ALA 69 86.664 13.322 0.196 326 3HB ALA 69 HB3 ALA 69 87.811 12.216 -0.556 327 H GLN 70 HN GLN 70 85.038 13.351 1.138 328 HA GLN 70 HA GLN 70 84.692 13.082 4.050 329 1HB GLN 70 HB2 GLN 70 84.386 15.202 2.075 330 2HB GLN 70 HB1 GLN 70 83.062 15.160 3.231 331 1HG GLN 70 HG2 GLN 70 86.001 15.530 3.780 332 2HG GLN 70 HG1 GLN 70 84.647 16.539 4.300 333 1HE2 GLN 70 HE21 GLN 70 83.128 13.904 5.110 334 2HE2 GLN 70 HE22 GLN 70 83.856 13.437 6.567 335 H TYR 71 HN TYR 71 82.545 13.002 1.190 336 HA TYR 71 HA TYR 71 80.115 12.865 2.537 337 1HB TYR 71 HB2 TYR 71 81.079 11.399 0.068 338 2HB TYR 71 HB1 TYR 71 79.403 11.394 0.587 339 HD1 TYR 71 HD1 TYR 71 78.781 12.494 -1.542 340 HD2 TYR 71 HD2 TYR 71 81.396 14.430 1.280 341 HE1 TYR 71 HE1 TYR 71 78.395 14.667 -2.663 342 HE2 TYR 71 HE2 TYR 71 81.001 16.589 0.152 343 HH TYR 71 HH TYR 71 79.154 17.603 -1.292 344 H SER 72 HN SER 72 82.646 10.475 2.314 345 HA SER 72 HA SER 72 81.122 8.267 3.449 346 1HB SER 72 HB2 SER 72 83.152 8.013 2.048 347 2HB SER 72 HB1 SER 72 84.096 8.846 3.284 348 HG SER 72 HG SER 72 84.346 6.949 4.105 349 H GLU 73 HN GLU 73 82.151 11.167 4.753 350 HA GLU 73 HA GLU 73 82.938 11.842 6.913 351 1HB GLU 73 HB2 GLU 73 80.294 11.317 6.502 352 2HB GLU 73 HB1 GLU 73 80.613 10.340 7.938 353 1HG GLU 73 HG2 GLU 73 81.404 13.253 7.678 354 2HG GLU 73 HG1 GLU 73 79.900 12.719 8.428 355 H ASP 74 HN ASP 74 84.449 9.619 6.311 356 HA ASP 74 HA ASP 74 85.425 8.638 8.735 357 1HB ASP 74 HB2 ASP 74 83.385 7.654 9.363 358 2HB ASP 74 HB1 ASP 74 82.991 7.188 7.710 359 H LYS 75 HN LYS 75 87.404 7.939 8.036 360 HA LYS 75 HA LYS 75 89.060 7.112 6.535 361 1HB LYS 75 HB2 LYS 75 88.087 5.191 7.802 362 2HB LYS 75 HB1 LYS 75 86.943 4.937 6.485 363 1HG LYS 75 HG2 LYS 75 88.504 3.605 5.541 364 2HG LYS 75 HG1 LYS 75 89.425 5.073 5.212 365 1HD LYS 75 HD2 LYS 75 90.691 4.846 7.225 366 2HD LYS 75 HD1 LYS 75 89.595 3.619 7.860 367 1HE LYS 75 HE2 LYS 75 90.485 1.941 6.516 368 2HE LYS 75 HE1 LYS 75 90.981 3.079 5.250 369 1HZ LYS 75 HZ1 LYS 75 92.704 3.919 6.639 370 2HZ LYS 75 HZ2 LYS 75 92.841 2.226 6.676 371 3HZ LYS 75 HZ3 LYS 75 92.144 3.054 7.986 372 H ALA 76 HN ALA 76 87.087 8.822 5.169 373 HA ALA 76 HA ALA 76 86.197 9.216 3.005 374 1HB ALA 76 HB1 ALA 76 87.981 8.719 1.299 375 2HB ALA 76 HB2 ALA 76 88.846 7.817 2.544 376 3HB ALA 76 HB3 ALA 76 88.586 9.551 2.731 377 H ARG 77 HN ARG 77 86.626 7.602 0.611 378 HA ARG 77 HA ARG 77 85.385 5.006 1.377 379 1HB ARG 77 HB2 ARG 77 83.975 7.221 0.483 380 2HB ARG 77 HB1 ARG 77 84.090 6.193 -0.938 381 1HG ARG 77 HG2 ARG 77 83.579 4.331 0.960 382 2HG ARG 77 HG1 ARG 77 82.741 5.720 1.639 383 1HD ARG 77 HD2 ARG 77 81.079 4.734 0.292 384 2HD ARG 77 HD1 ARG 77 81.752 5.951 -0.802 385 HE ARG 77 HE ARG 77 81.865 3.168 -1.253 386 1HH1 ARG 77 HH21 ARG 77 82.870 5.614 -2.891 387 2HH1 ARG 77 HH22 ARG 77 84.495 5.110 -3.189 388 1HH2 ARG 77 HH11 ARG 77 84.443 2.676 -0.698 389 2HH2 ARG 77 HH12 ARG 77 85.396 3.418 -1.924 390 H GLN 78 HN GLN 78 85.418 6.095 -2.001 391 HA GLN 78 HA GLN 78 86.749 3.796 -2.937 392 1HB GLN 78 HB2 GLN 78 86.004 6.458 -3.870 393 2HB GLN 78 HB1 GLN 78 87.477 5.880 -4.646 394 1HG GLN 78 HG2 GLN 78 84.822 5.264 -5.384 395 2HG GLN 78 HG1 GLN 78 86.289 4.527 -6.014 396 1HE2 GLN 78 HE21 GLN 78 83.362 3.851 -4.412 397 2HE2 GLN 78 HE22 GLN 78 83.742 2.310 -3.819 398 H GLY 79 HN GLY 79 88.216 7.014 -2.357 399 1HA GLY 79 HA2 GLY 79 90.902 6.207 -2.720 400 2HA GLY 79 HA1 GLY 79 90.400 7.501 -1.622 401 H GLY 80 HN GLY 80 88.583 5.556 -0.252 402 1HA GLY 80 HA1 GLY 80 90.501 4.495 1.702 403 2HA GLY 80 HA2 GLY 80 88.735 4.518 1.864 404 H ASP 81 HN ASP 81 87.862 3.211 -0.349 405 HA ASP 81 HA ASP 81 87.309 0.935 -0.804 406 1HB ASP 81 HB2 ASP 81 89.135 1.890 -2.357 407 2HB ASP 81 HB1 ASP 81 90.266 0.895 -1.430 408 H LEU 82 HN LEU 82 87.016 0.239 1.540 409 HA LEU 82 HA LEU 82 88.853 -0.608 3.373 410 1HB LEU 82 HB2 LEU 82 86.185 -1.350 2.530 411 2HB LEU 82 HB1 LEU 82 87.044 -2.755 3.166 412 HG LEU 82 HG LEU 82 87.754 -0.724 4.911 413 1HD1 LEU 82 HD11 LEU 82 86.176 0.864 4.928 414 2HD1 LEU 82 HD12 LEU 82 84.939 -0.359 5.228 415 3HD1 LEU 82 HD13 LEU 82 85.370 0.075 3.573 416 1HD2 LEU 82 HD21 LEU 82 86.498 -1.973 6.523 417 2HD2 LEU 82 HD22 LEU 82 87.051 -3.143 5.325 418 3HD2 LEU 82 HD23 LEU 82 85.384 -2.567 5.292 419 H GLY 83 HN GLY 83 88.283 -2.131 0.246 420 1HA GLY 83 HA2 GLY 83 89.862 -3.482 -0.923 421 2HA GLY 83 HA1 GLY 83 90.781 -3.660 0.578 422 H TRP 84 HN TRP 84 90.602 -5.949 -0.603 423 HA TRP 84 HA TRP 84 88.347 -7.585 -0.571 424 1HB TRP 84 HB2 TRP 84 91.285 -7.922 -0.089 425 2HB TRP 84 HB1 TRP 84 90.239 -9.316 0.158 426 HD1 TRP 84 HD1 TRP 84 92.049 -7.544 -2.449 427 HE1 TRP 84 HE1 TRP 84 91.278 -8.283 -4.799 428 HE3 TRP 84 HE3 TRP 84 87.815 -10.082 -1.201 429 HZ2 TRP 84 HZ2 TRP 84 89.130 -9.767 -5.985 430 HZ3 TRP 84 HZ3 TRP 84 86.430 -11.148 -2.944 431 HH2 TRP 84 HH2 TRP 84 87.071 -10.995 -5.337 432 H MET 85 HN MET 85 87.101 -8.536 1.038 433 HA MET 85 HA MET 85 88.093 -8.363 3.860 434 1HB MET 85 HB2 MET 85 85.888 -6.961 2.538 435 2HB MET 85 HB1 MET 85 85.361 -7.842 3.972 436 1HG MET 85 HG2 MET 85 87.765 -5.999 3.943 437 2HG MET 85 HG1 MET 85 86.149 -5.474 4.415 438 1HE MET 85 HE1 MET 85 87.848 -5.176 7.404 439 2HE MET 85 HE2 MET 85 88.491 -5.054 5.768 440 3HE MET 85 HE3 MET 85 89.186 -6.215 6.896 441 H THR 86 HN THR 86 87.484 -10.124 5.124 442 HA THR 86 HA THR 86 85.783 -12.209 3.797 443 HB THR 86 HB THR 86 87.326 -13.583 5.549 444 HG1 THR 86 HG1 THR 86 89.196 -12.606 5.884 445 1HG2 THR 86 HG21 THR 86 88.007 -14.503 3.613 446 2HG2 THR 86 HG22 THR 86 88.895 -13.042 3.178 447 3HG2 THR 86 HG23 THR 86 87.186 -13.190 2.768 448 H ARG 87 HN ARG 87 84.218 -13.231 5.108 449 HA ARG 87 HA ARG 87 83.120 -11.769 7.308 450 1HB ARG 87 HB2 ARG 87 82.546 -14.037 5.677 451 2HB ARG 87 HB1 ARG 87 82.374 -14.540 7.359 452 1HG ARG 87 HG2 ARG 87 81.055 -12.301 7.634 453 2HG ARG 87 HG1 ARG 87 80.907 -12.367 5.879 454 1HD ARG 87 HD2 ARG 87 78.996 -13.557 6.511 455 2HD ARG 87 HD1 ARG 87 80.166 -14.885 6.399 456 HE ARG 87 HE ARG 87 79.940 -13.471 9.004 457 1HH1 ARG 87 HH11 ARG 87 78.190 -15.768 7.313 458 2HH1 ARG 87 HH12 ARG 87 78.350 -17.025 8.495 459 1HH2 ARG 87 HH21 ARG 87 80.651 -15.285 10.420 460 2HH2 ARG 87 HH22 ARG 87 79.743 -16.751 10.254 461 H GLY 88 HN GLY 88 85.307 -11.614 8.510 462 1HA GLY 88 HA2 GLY 88 85.349 -13.736 10.579 463 2HA GLY 88 HA1 GLY 88 86.865 -13.417 9.721 464 H SER 89 HN SER 89 86.959 -10.730 9.487 465 HA SER 89 HA SER 89 87.060 -9.819 12.330 466 1HB SER 89 HB2 SER 89 88.714 -9.623 9.954 467 2HB SER 89 HB1 SER 89 88.365 -8.012 10.599 468 HG SER 89 HG SER 89 90.076 -9.801 11.518 469 H MET 90 HN MET 90 85.055 -9.571 9.675 470 HA MET 90 HA MET 90 84.445 -6.765 9.573 471 1HB MET 90 HB2 MET 90 83.642 -9.229 8.398 472 2HB MET 90 HB1 MET 90 82.181 -8.445 8.999 473 1HG MET 90 HG2 MET 90 83.199 -6.300 7.882 474 2HG MET 90 HG1 MET 90 84.155 -7.459 6.957 475 1HE MET 90 HE1 MET 90 83.663 -7.869 4.924 476 2HE MET 90 HE2 MET 90 82.787 -6.368 4.641 477 3HE MET 90 HE3 MET 90 82.113 -7.893 4.073 478 H VAL 91 HN VAL 91 81.643 -6.737 9.973 479 HA VAL 91 HA VAL 91 81.482 -6.991 12.959 480 HB VAL 91 HB VAL 91 79.782 -5.172 11.254 481 1HG1 VAL 91 HG11 VAL 91 79.110 -4.458 13.279 482 2HG1 VAL 91 HG12 VAL 91 80.773 -4.061 13.710 483 3HG1 VAL 91 HG13 VAL 91 80.141 -5.675 14.031 484 1HG2 VAL 91 HG21 VAL 91 81.628 -4.087 10.529 485 2HG2 VAL 91 HG22 VAL 91 82.683 -5.050 11.563 486 3HG2 VAL 91 HG23 VAL 91 81.893 -3.610 12.205 487 H GLY 92 HN GLY 92 78.735 -6.696 13.255 488 1HA GLY 92 HA2 GLY 92 77.786 -9.308 12.310 489 2HA GLY 92 HA1 GLY 92 76.926 -8.226 13.413 490 HA PRO 93 HA PRO 93 74.292 -6.740 10.260 491 1HB PRO 93 HB2 PRO 93 74.872 -3.941 10.594 492 2HB PRO 93 HB1 PRO 93 73.498 -4.857 11.235 493 1HG PRO 93 HG2 PRO 93 75.748 -3.804 12.680 494 2HG PRO 93 HG1 PRO 93 74.380 -4.719 13.318 495 1HD PRO 93 HD2 PRO 93 77.110 -5.604 12.993 496 2HD PRO 93 HD1 PRO 93 75.732 -6.525 13.641 497 H PHE 94 HN PHE 94 77.317 -4.811 10.295 498 HA PHE 94 HA PHE 94 77.451 -3.822 7.730 499 1HB PHE 94 HB2 PHE 94 79.135 -3.928 9.750 500 2HB PHE 94 HB1 PHE 94 79.801 -5.313 8.873 501 HD1 PHE 94 HD1 PHE 94 80.549 -5.008 6.475 502 HD2 PHE 94 HD2 PHE 94 79.541 -1.698 9.022 503 HE1 PHE 94 HE1 PHE 94 81.747 -3.467 4.946 504 HE2 PHE 94 HE2 PHE 94 80.740 -0.157 7.494 505 HZ PHE 94 HZ PHE 94 81.843 -1.042 5.456 506 H GLN 95 HN GLN 95 78.088 -7.199 8.684 507 HA GLN 95 HA GLN 95 78.627 -7.975 5.882 508 1HB GLN 95 HB2 GLN 95 79.996 -8.954 7.586 509 2HB GLN 95 HB1 GLN 95 78.592 -9.367 8.570 510 1HG GLN 95 HG2 GLN 95 78.193 -10.557 6.021 511 2HG GLN 95 HG1 GLN 95 79.849 -10.922 6.503 512 1HE2 GLN 95 HE21 GLN 95 76.744 -12.107 6.760 513 2HE2 GLN 95 HE22 GLN 95 76.900 -12.985 8.204 514 H GLU 96 HN GLU 96 76.231 -8.753 8.427 515 HA GLU 96 HA GLU 96 74.582 -10.595 7.249 516 1HB GLU 96 HB2 GLU 96 74.268 -8.263 9.026 517 2HB GLU 96 HB1 GLU 96 72.772 -8.789 8.256 518 1HG GLU 96 HG2 GLU 96 74.051 -11.159 9.051 519 2HG GLU 96 HG1 GLU 96 74.266 -10.049 10.404 520 H ALA 97 HN ALA 97 74.932 -7.229 6.230 521 HA ALA 97 HA ALA 97 72.671 -7.430 4.336 522 1HB ALA 97 HB1 ALA 97 72.706 -5.251 4.949 523 2HB ALA 97 HB2 ALA 97 74.105 -5.077 3.890 524 3HB ALA 97 HB3 ALA 97 74.335 -5.398 5.609 525 H ALA 98 HN ALA 98 75.814 -5.978 3.652 526 HA ALA 98 HA ALA 98 76.068 -6.417 0.974 527 1HB ALA 98 HB1 ALA 98 78.590 -7.092 2.001 528 2HB ALA 98 HB2 ALA 98 77.830 -6.132 3.270 529 3HB ALA 98 HB3 ALA 98 78.005 -5.466 1.647 530 H PHE 99 HN PHE 99 77.599 -8.769 3.203 531 HA PHE 99 HA PHE 99 78.165 -10.831 1.472 532 1HB PHE 99 HB2 PHE 99 77.469 -10.511 4.301 533 2HB PHE 99 HB1 PHE 99 77.131 -12.135 3.688 534 HD1 PHE 99 HD1 PHE 99 78.869 -13.688 3.649 535 HD2 PHE 99 HD2 PHE 99 79.802 -9.496 3.529 536 HE1 PHE 99 HE1 PHE 99 81.289 -14.223 3.737 537 HE2 PHE 99 HE2 PHE 99 82.221 -10.032 3.617 538 HZ PHE 99 HZ PHE 99 82.965 -12.395 3.721 539 H ALA 100 HN ALA 100 75.116 -10.836 3.331 540 HA ALA 100 HA ALA 100 73.840 -12.826 1.715 541 1HB ALA 100 HB1 ALA 100 73.334 -11.964 4.089 542 2HB ALA 100 HB2 ALA 100 71.941 -12.303 3.061 543 3HB ALA 100 HB3 ALA 100 72.477 -10.640 3.300 544 H LEU 101 HN LEU 101 74.394 -9.460 1.173 545 HA LEU 101 HA LEU 101 72.181 -9.260 -0.807 546 1HB LEU 101 HB2 LEU 101 74.079 -7.389 0.594 547 2HB LEU 101 HB1 LEU 101 73.230 -6.852 -0.863 548 HG LEU 101 HG LEU 101 71.809 -8.091 1.508 549 1HD1 LEU 101 HD11 LEU 101 72.784 -5.324 1.038 550 2HD1 LEU 101 HD12 LEU 101 72.451 -6.157 2.557 551 3HD1 LEU 101 HD13 LEU 101 71.124 -5.475 1.615 552 1HD2 LEU 101 HD21 LEU 101 70.918 -7.803 -1.012 553 2HD2 LEU 101 HD22 LEU 101 70.554 -6.186 -0.410 554 3HD2 LEU 101 HD23 LEU 101 69.861 -7.599 0.385 555 HA PRO 102 HA PRO 102 74.723 -9.992 -4.316 556 1HB PRO 102 HB2 PRO 102 73.676 -7.762 -5.802 557 2HB PRO 102 HB1 PRO 102 73.224 -9.469 -5.931 558 1HG PRO 102 HG2 PRO 102 71.688 -7.313 -4.809 559 2HG PRO 102 HG1 PRO 102 71.240 -9.022 -4.929 560 1HD PRO 102 HD2 PRO 102 71.970 -7.535 -2.558 561 2HD PRO 102 HD1 PRO 102 71.501 -9.250 -2.677 562 H VAL 103 HN VAL 103 76.657 -9.195 -5.271 563 HA VAL 103 HA VAL 103 78.259 -7.340 -3.907 564 HB VAL 103 HB VAL 103 78.142 -8.440 -6.712 565 1HG1 VAL 103 HG11 VAL 103 79.110 -6.174 -6.923 566 2HG1 VAL 103 HG12 VAL 103 80.331 -7.418 -7.187 567 3HG1 VAL 103 HG13 VAL 103 80.271 -6.557 -5.650 568 1HG2 VAL 103 HG21 VAL 103 80.577 -9.029 -5.500 569 2HG2 VAL 103 HG22 VAL 103 79.176 -10.097 -5.577 570 3HG2 VAL 103 HG23 VAL 103 79.426 -9.071 -4.165 571 H SER 104 HN SER 104 79.099 -5.208 -5.015 572 HA SER 104 HA SER 104 78.671 -3.059 -5.921 573 1HB SER 104 HB2 SER 104 75.995 -4.133 -6.822 574 2HB SER 104 HB1 SER 104 76.990 -2.887 -7.579 575 HG SER 104 HG SER 104 76.970 -5.206 -8.415 576 H GLY 105 HN GLY 105 77.123 -1.211 -5.568 577 1HA GLY 105 HA2 GLY 105 74.887 -1.394 -3.794 578 2HA GLY 105 HA1 GLY 105 76.328 -0.976 -2.866 579 H MET 106 HN MET 106 77.110 1.123 -2.999 580 HA MET 106 HA MET 106 77.083 3.428 -3.505 581 1HB MET 106 HB2 MET 106 77.966 2.508 -5.592 582 2HB MET 106 HB1 MET 106 76.328 2.186 -6.170 583 1HG MET 106 HG2 MET 106 75.822 4.588 -6.137 584 2HG MET 106 HG1 MET 106 77.436 4.933 -5.500 585 1HE MET 106 HE1 MET 106 76.100 2.678 -8.874 586 2HE MET 106 HE2 MET 106 75.886 4.282 -9.569 587 3HE MET 106 HE3 MET 106 75.158 3.902 -8.011 588 H ASP 107 HN ASP 107 74.661 3.009 -5.979 589 HA ASP 107 HA ASP 107 72.389 3.588 -4.200 590 1HB ASP 107 HB2 ASP 107 73.481 5.754 -4.318 591 2HB ASP 107 HB1 ASP 107 73.608 5.638 -6.074 592 H LYS 108 HN LYS 108 72.723 1.468 -6.003 593 HA LYS 108 HA LYS 108 70.384 1.709 -7.648 594 1HB LYS 108 HB2 LYS 108 72.880 2.714 -8.666 595 2HB LYS 108 HB1 LYS 108 72.376 1.318 -9.623 596 1HG LYS 108 HG2 LYS 108 70.018 2.761 -9.219 597 2HG LYS 108 HG1 LYS 108 71.234 4.000 -9.525 598 1HD LYS 108 HD2 LYS 108 71.636 3.270 -11.675 599 2HD LYS 108 HD1 LYS 108 71.249 1.593 -11.291 600 1HE LYS 108 HE2 LYS 108 68.814 2.713 -10.885 601 2HE LYS 108 HE1 LYS 108 69.442 3.803 -12.134 602 1HZ LYS 108 HZ1 LYS 108 68.816 2.140 -13.510 603 2HZ LYS 108 HZ2 LYS 108 68.827 0.964 -12.285 604 3HZ LYS 108 HZ3 LYS 108 70.279 1.428 -13.034 605 HA PRO 109 HA PRO 109 72.679 -2.446 -8.729 606 1HB PRO 109 HB2 PRO 109 74.986 -2.571 -7.011 607 2HB PRO 109 HB1 PRO 109 74.944 -2.571 -8.782 608 1HG PRO 109 HG2 PRO 109 75.756 -0.439 -7.002 609 2HG PRO 109 HG1 PRO 109 75.820 -0.480 -8.765 610 1HD PRO 109 HD2 PRO 109 74.058 1.072 -7.145 611 2HD PRO 109 HD1 PRO 109 74.010 0.889 -8.916 612 H VAL 110 HN VAL 110 73.834 -4.129 -6.675 613 HA VAL 110 HA VAL 110 72.903 -5.442 -4.919 614 HB VAL 110 HB VAL 110 74.337 -3.455 -4.075 615 1HG1 VAL 110 HG11 VAL 110 71.544 -2.509 -3.401 616 2HG1 VAL 110 HG12 VAL 110 72.798 -1.644 -4.289 617 3HG1 VAL 110 HG13 VAL 110 72.980 -1.930 -2.560 618 1HG2 VAL 110 HG21 VAL 110 72.902 -5.499 -2.750 619 2HG2 VAL 110 HG22 VAL 110 72.749 -4.057 -1.748 620 3HG2 VAL 110 HG23 VAL 110 74.347 -4.662 -2.182 621 H PHE 111 HN PHE 111 71.059 -4.592 -2.856 622 HA PHE 111 HA PHE 111 68.600 -4.018 -4.469 623 1HB PHE 111 HB2 PHE 111 69.380 -6.273 -2.713 624 2HB PHE 111 HB1 PHE 111 67.727 -5.679 -2.502 625 HD1 PHE 111 HD1 PHE 111 69.494 -8.104 -4.140 626 HD2 PHE 111 HD2 PHE 111 66.715 -4.948 -5.012 627 HE1 PHE 111 HE1 PHE 111 68.806 -9.283 -6.211 628 HE2 PHE 111 HE2 PHE 111 66.026 -6.126 -7.082 629 HZ PHE 111 HZ PHE 111 67.072 -8.293 -7.682 630 H THR 112 HN THR 112 69.462 -4.467 -1.030 631 HA THR 112 HA THR 112 67.524 -2.749 0.071 632 HB THR 112 HB THR 112 69.116 -4.377 1.199 633 HG1 THR 112 HG1 THR 112 68.589 -3.390 2.967 634 1HG2 THR 112 HG21 THR 112 71.203 -3.581 0.215 635 2HG2 THR 112 HG22 THR 112 71.275 -3.397 1.967 636 3HG2 THR 112 HG23 THR 112 70.967 -1.993 0.945 637 H ASP 113 HN ASP 113 68.830 -0.834 1.576 638 HA ASP 113 HA ASP 113 69.432 1.228 -0.484 639 1HB ASP 113 HB2 ASP 113 68.847 1.369 2.494 640 2HB ASP 113 HB1 ASP 113 68.999 2.762 1.423 641 HA PRO 114 HA PRO 114 73.739 1.066 0.340 642 1HB PRO 114 HB2 PRO 114 74.062 3.891 -0.043 643 2HB PRO 114 HB1 PRO 114 74.439 2.575 -1.164 644 1HG PRO 114 HG2 PRO 114 72.279 4.455 -1.330 645 2HG PRO 114 HG1 PRO 114 72.638 3.120 -2.426 646 1HD PRO 114 HD2 PRO 114 70.475 3.321 -0.514 647 2HD PRO 114 HD1 PRO 114 70.815 1.996 -1.651 648 HA PRO 115 HA PRO 115 74.099 4.357 3.881 649 1HB PRO 115 HB2 PRO 115 71.436 5.303 4.437 650 2HB PRO 115 HB1 PRO 115 72.830 6.233 3.875 651 1HG PRO 115 HG2 PRO 115 70.480 5.536 2.395 652 2HG PRO 115 HG1 PRO 115 71.906 6.413 1.814 653 1HD PRO 115 HD2 PRO 115 71.092 3.689 1.202 654 2HD PRO 115 HD1 PRO 115 72.470 4.595 0.550 655 H VAL 116 HN VAL 116 74.116 1.924 4.500 656 HA VAL 116 HA VAL 116 71.764 1.011 6.035 657 HB VAL 116 HB VAL 116 72.924 -1.075 6.020 658 1HG1 VAL 116 HG11 VAL 116 72.595 -1.310 3.807 659 2HG1 VAL 116 HG12 VAL 116 74.100 -0.452 3.476 660 3HG1 VAL 116 HG13 VAL 116 72.592 0.446 3.646 661 1HG2 VAL 116 HG21 VAL 116 75.088 -0.127 6.823 662 2HG2 VAL 116 HG22 VAL 116 75.408 0.437 5.182 663 3HG2 VAL 116 HG23 VAL 116 75.293 -1.292 5.513 664 H LYS 117 HN LYS 117 71.861 0.590 8.304 665 HA LYS 117 HA LYS 117 73.948 2.155 9.754 666 1HB LYS 117 HB2 LYS 117 71.353 2.398 9.915 667 2HB LYS 117 HB1 LYS 117 71.446 0.944 10.919 668 1HG LYS 117 HG2 LYS 117 73.490 2.563 11.906 669 2HG LYS 117 HG1 LYS 117 72.176 3.701 11.571 670 1HD LYS 117 HD2 LYS 117 70.899 1.504 12.737 671 2HD LYS 117 HD1 LYS 117 72.389 1.686 13.673 672 1HE LYS 117 HE2 LYS 117 71.733 3.706 14.551 673 2HE LYS 117 HE1 LYS 117 70.931 4.208 13.051 674 1HZ LYS 117 HZ1 LYS 117 69.869 1.909 14.546 675 2HZ LYS 117 HZ2 LYS 117 69.050 3.012 13.546 676 3HZ LYS 117 HZ3 LYS 117 69.522 3.469 15.113 677 H THR 118 HN THR 118 75.271 1.146 11.292 678 HA THR 118 HA THR 118 74.871 -1.789 11.741 679 HB THR 118 HB THR 118 77.270 -2.092 11.332 680 HG1 THR 118 HG1 THR 118 77.179 0.717 11.011 681 1HG2 THR 118 HG21 THR 118 75.852 -0.494 9.184 682 2HG2 THR 118 HG22 THR 118 75.846 -2.247 9.375 683 3HG2 THR 118 HG23 THR 118 77.332 -1.415 8.918 684 H LYS 119 HN LYS 119 76.434 1.228 12.806 685 HA LYS 119 HA LYS 119 75.891 0.670 15.601 686 1HB LYS 119 HB2 LYS 119 77.691 -0.943 15.202 687 2HB LYS 119 HB1 LYS 119 78.707 0.326 14.518 688 1HG LYS 119 HG2 LYS 119 78.454 1.537 16.759 689 2HG LYS 119 HG1 LYS 119 77.779 0.028 17.383 690 1HD LYS 119 HD2 LYS 119 80.495 0.288 16.054 691 2HD LYS 119 HD1 LYS 119 80.232 0.218 17.796 692 1HE LYS 119 HE2 LYS 119 79.974 -2.042 17.748 693 2HE LYS 119 HE1 LYS 119 78.876 -1.956 16.357 694 1HZ LYS 119 HZ1 LYS 119 81.845 -1.745 16.310 695 2HZ LYS 119 HZ2 LYS 119 80.847 -1.463 14.964 696 3HZ LYS 119 HZ3 LYS 119 80.912 -3.008 15.668 697 H PHE 120 HN PHE 120 77.795 2.456 13.200 698 HA PHE 120 HA PHE 120 78.091 4.769 15.033 699 1HB PHE 120 HB2 PHE 120 79.445 3.619 12.781 700 2HB PHE 120 HB1 PHE 120 78.985 5.277 12.366 701 HD1 PHE 120 HD1 PHE 120 80.500 3.287 15.162 702 HD2 PHE 120 HD2 PHE 120 80.318 7.053 13.104 703 HE1 PHE 120 HE1 PHE 120 82.346 4.148 16.576 704 HE2 PHE 120 HE2 PHE 120 82.165 7.914 14.518 705 HZ PHE 120 HZ PHE 120 83.179 6.462 16.254 706 H GLY 121 HN GLY 121 76.818 4.205 11.724 707 1HA GLY 121 HA2 GLY 121 74.385 5.654 12.178 708 2HA GLY 121 HA1 GLY 121 75.563 6.712 11.387 709 H TYR 122 HN TYR 122 74.251 6.740 9.449 710 HA TYR 122 HA TYR 122 73.807 4.173 8.036 711 1HB TYR 122 HB2 TYR 122 73.204 7.071 7.354 712 2HB TYR 122 HB1 TYR 122 72.642 5.679 6.430 713 HD1 TYR 122 HD1 TYR 122 72.430 4.079 9.266 714 HD2 TYR 122 HD2 TYR 122 70.771 7.682 7.617 715 HE1 TYR 122 HE1 TYR 122 70.474 3.868 10.773 716 HE2 TYR 122 HE2 TYR 122 68.816 7.471 9.124 717 HH TYR 122 HH TYR 122 68.405 4.639 11.218 718 H HIS 123 HN HIS 123 75.114 3.464 6.369 719 HA HIS 123 HA HIS 123 76.986 5.403 5.097 720 1HB HIS 123 HB2 HIS 123 78.850 3.808 5.520 721 2HB HIS 123 HB1 HIS 123 78.139 4.402 7.019 722 HD1 HIS 123 HD1 HIS 123 78.397 1.328 4.882 723 HD2 HIS 123 HD2 HIS 123 76.727 2.456 8.531 724 HE1 HIS 123 HE1 HIS 123 77.713 -0.811 6.051 725 H ILE 124 HN ILE 124 77.637 4.738 2.973 726 HA ILE 124 HA ILE 124 75.818 2.777 1.717 727 HB ILE 124 HB ILE 124 77.983 4.553 0.548 728 1HG1 ILE 124 HG12 ILE 124 75.025 5.079 1.000 729 2HG1 ILE 124 HG11 ILE 124 76.366 5.905 1.803 730 1HG2 ILE 124 HG21 ILE 124 76.347 2.543 -0.587 731 2HG2 ILE 124 HG22 ILE 124 77.364 3.705 -1.440 732 3HG2 ILE 124 HG23 ILE 124 75.673 4.085 -1.112 733 1HD1 ILE 124 HD11 ILE 124 75.484 6.084 -1.074 734 2HD1 ILE 124 HD12 ILE 124 77.148 6.464 -0.631 735 3HD1 ILE 124 HD13 ILE 124 75.817 7.391 0.063 736 H ILE 125 HN ILE 125 76.440 0.729 1.171 737 HA ILE 125 HA ILE 125 79.339 0.022 1.402 738 HB ILE 125 HB ILE 125 76.712 -1.309 1.989 739 1HG1 ILE 125 HG12 ILE 125 79.396 -1.158 3.399 740 2HG1 ILE 125 HG11 ILE 125 77.941 -0.236 3.809 741 1HG2 ILE 125 HG21 ILE 125 77.417 -3.181 0.911 742 2HG2 ILE 125 HG22 ILE 125 78.484 -3.370 2.302 743 3HG2 ILE 125 HG23 ILE 125 79.086 -2.619 0.824 744 1HD1 ILE 125 HD11 ILE 125 77.936 -3.258 3.747 745 2HD1 ILE 125 HD12 ILE 125 76.786 -2.178 4.536 746 3HD1 ILE 125 HD13 ILE 125 78.413 -2.366 5.192 747 H MET 126 HN MET 126 80.322 -0.436 -0.535 748 HA MET 126 HA MET 126 78.610 -1.450 -2.772 749 1HB MET 126 HB2 MET 126 79.205 0.545 -3.700 750 2HB MET 126 HB1 MET 126 80.450 0.824 -2.477 751 1HG MET 126 HG2 MET 126 82.049 -0.490 -3.683 752 2HG MET 126 HG1 MET 126 80.813 -1.097 -4.792 753 1HE MET 126 HE1 MET 126 81.585 3.418 -4.496 754 2HE MET 126 HE2 MET 126 81.969 2.248 -3.235 755 3HE MET 126 HE3 MET 126 80.289 2.525 -3.686 756 H VAL 127 HN VAL 127 79.126 -3.615 -2.900 757 HA VAL 127 HA VAL 127 81.860 -4.558 -2.271 758 HB VAL 127 HB VAL 127 79.206 -5.837 -2.975 759 1HG1 VAL 127 HG11 VAL 127 80.407 -8.007 -2.414 760 2HG1 VAL 127 HG12 VAL 127 81.920 -7.112 -2.560 761 3HG1 VAL 127 HG13 VAL 127 80.858 -7.280 -3.957 762 1HG2 VAL 127 HG21 VAL 127 79.499 -4.916 -0.687 763 2HG2 VAL 127 HG22 VAL 127 80.935 -5.918 -0.483 764 3HG2 VAL 127 HG23 VAL 127 79.353 -6.674 -0.670 765 H GLU 128 HN GLU 128 83.200 -5.626 -3.887 766 HA GLU 128 HA GLU 128 82.208 -5.510 -6.675 767 1HB GLU 128 HB2 GLU 128 83.797 -3.523 -5.455 768 2HB GLU 128 HB1 GLU 128 84.879 -4.422 -6.529 769 1HG GLU 128 HG2 GLU 128 82.543 -4.142 -8.023 770 2HG GLU 128 HG1 GLU 128 82.701 -2.586 -7.195 771 H GLY 129 HN GLY 129 82.386 -7.768 -6.608 772 1HA GLY 129 HA2 GLY 129 83.556 -9.631 -7.530 773 2HA GLY 129 HA1 GLY 129 85.071 -8.766 -7.246 774 H ARG 130 HN ARG 130 83.422 -11.410 -6.324 775 HA ARG 130 HA ARG 130 84.833 -11.428 -3.712 776 1HB ARG 130 HB2 ARG 130 82.698 -12.840 -3.017 777 2HB ARG 130 HB1 ARG 130 82.659 -11.081 -2.965 778 1HG ARG 130 HG2 ARG 130 81.418 -10.930 -4.964 779 2HG ARG 130 HG1 ARG 130 81.861 -12.561 -5.467 780 1HD ARG 130 HD2 ARG 130 80.558 -12.868 -2.977 781 2HD ARG 130 HD1 ARG 130 79.575 -11.719 -3.905 782 HE ARG 130 HE ARG 130 80.498 -13.958 -5.526 783 1HH1 ARG 130 HH11 ARG 130 78.803 -14.350 -2.767 784 2HH1 ARG 130 HH12 ARG 130 77.297 -14.803 -3.493 785 1HH2 ARG 130 HH21 ARG 130 78.266 -13.899 -6.698 786 2HH2 ARG 130 HH22 ARG 130 76.993 -14.548 -5.719 787 H LYS 131 HN LYS 131 84.818 -13.837 -2.861 788 HA LYS 131 HA LYS 131 85.357 -15.639 -5.202 789 1HB LYS 131 HB2 LYS 131 86.695 -15.263 -2.512 790 2HB LYS 131 HB1 LYS 131 87.016 -16.663 -3.536 791 1HG LYS 131 HG2 LYS 131 88.214 -15.441 -5.048 792 2HG LYS 131 HG1 LYS 131 87.156 -14.038 -4.901 793 1HD LYS 131 HD2 LYS 131 88.882 -13.117 -3.742 794 2HD LYS 131 HD1 LYS 131 88.318 -14.128 -2.411 795 1HE LYS 131 HE2 LYS 131 89.866 -15.927 -3.107 796 2HE LYS 131 HE1 LYS 131 90.433 -14.913 -4.455 797 1HZ LYS 131 HZ1 LYS 131 90.835 -13.158 -2.684 798 2HZ LYS 131 HZ2 LYS 131 91.909 -14.475 -2.692 799 3HZ LYS 131 HZ3 LYS 131 90.662 -14.398 -1.541
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