NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
557467 | 2l9l | 17477 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET -5 H MET -5 10.107 26.237 -24.247 2 HA MET -5 HA MET -5 7.506 27.532 -24.526 3 HB3 MET -5 2HB MET -5 8.523 28.366 -26.481 4 HG3 MET -5 2HG MET -5 9.398 26.213 -28.001 5 HE1 MET -5 3HE MET -5 12.449 27.760 -29.256 6 HE2 MET -5 1HE MET -5 11.336 26.393 -29.200 7 HE3 MET -5 2HE MET -5 10.778 27.960 -29.786 8 H LYS -4 H LYS -4 8.366 25.230 -23.057 9 HA LYS -4 HA LYS -4 7.008 23.077 -24.543 10 HB3 LYS -4 2HB LYS -4 8.514 22.244 -22.184 11 HG3 LYS -4 2HG LYS -4 9.556 21.212 -24.628 12 HD3 LYS -4 2HD LYS -4 7.753 20.012 -22.524 13 HE3 LYS -4 2HE LYS -4 9.579 18.174 -23.727 14 HZ1 LYS -4 3HZ LYS -4 7.735 16.839 -23.836 15 HZ2 LYS -4 1HZ LYS -4 6.675 18.113 -24.176 16 HZ3 LYS -4 2HZ LYS -4 7.273 17.905 -22.608 17 H SER -3 H SER -3 6.080 21.395 -22.882 18 HA SER -3 HA SER -3 4.824 22.747 -20.611 19 HB3 SER -3 2HB SER -3 2.939 21.040 -22.062 20 HG SER -3 HG SER -3 1.627 22.892 -21.685 21 H GLY -2 H GLY -2 3.826 21.260 -19.083 22 HA2 GLY -2 2HA GLY -2 5.124 18.609 -19.183 23 HA3 GLY -2 3HA GLY -2 4.789 19.493 -17.702 24 H HIS -1 H HIS -1 3.545 17.354 -20.100 25 HA HIS -1 HA HIS -1 0.816 17.493 -19.157 26 HB3 HIS -1 2HB HIS -1 1.684 15.206 -20.831 27 HD1 HIS -1 1HD HIS -1 -0.936 15.144 -19.556 28 HD2 HIS -1 2HD HIS -1 -0.314 17.313 -23.044 29 HE1 HIS -1 1HE HIS -1 -3.211 15.418 -20.592 30 H GLY 0 H GLY 0 3.451 15.099 -19.074 31 HA2 GLY 0 2HA GLY 0 2.099 13.133 -17.607 32 HA3 GLY 0 3HA GLY 0 3.845 13.332 -17.665 33 H CYS 1 H CYS 1 1.450 13.009 -15.568 34 HA CYS 1 HA CYS 1 2.645 14.863 -13.612 35 HB3 CYS 1 2HB CYS 1 -0.172 13.771 -13.541 36 H SER 2 H SER 2 2.252 11.659 -14.487 37 HA SER 2 HA SER 2 2.504 10.691 -11.725 38 HB3 SER 2 2HB SER 2 0.845 9.388 -12.659 39 HG SER 2 HG SER 2 0.601 9.064 -14.772 40 H GLU 3 H GLU 3 4.628 10.955 -11.222 41 HA GLU 3 HA GLU 3 6.603 9.718 -13.023 42 HB3 GLU 3 2HB GLU 3 8.246 11.206 -12.196 43 HG3 GLU 3 2HG GLU 3 7.325 13.460 -12.431 44 HA PRO 4 HA PRO 4 7.529 6.634 -10.042 45 HB3 PRO 4 2HB PRO 4 8.930 5.711 -11.613 46 HG3 PRO 4 2HG PRO 4 10.189 7.052 -13.033 47 HD3 PRO 4 2HD PRO 4 8.114 8.015 -13.316 48 H LEU 5 H LEU 5 9.706 6.138 -8.561 49 HA LEU 5 HA LEU 5 10.137 8.592 -6.988 50 HB3 LEU 5 2HB LEU 5 8.700 7.362 -5.646 51 HG LEU 5 HG LEU 5 9.094 4.946 -5.028 52 HD11 LEU 5 1HD1 LEU 5 7.626 6.107 -7.078 53 HD12 LEU 5 2HD1 LEU 5 7.396 4.500 -6.389 54 HD13 LEU 5 3HD1 LEU 5 8.401 4.709 -7.823 55 HD21 LEU 5 3HD2 LEU 5 10.410 3.559 -6.377 56 HD22 LEU 5 1HD2 LEU 5 11.419 4.978 -6.095 57 HD23 LEU 5 2HD2 LEU 5 10.578 4.787 -7.633 58 H GLY 6 H GLY 6 11.584 6.310 -8.867 59 HA2 GLY 6 2HA GLY 6 14.208 7.123 -8.155 60 HA3 GLY 6 3HA GLY 6 13.881 5.518 -7.520 61 H LEU 7 H LEU 7 12.472 6.659 -10.505 62 HA LEU 7 HA LEU 7 14.380 5.037 -12.040 63 HB3 LEU 7 2HB LEU 7 12.488 4.175 -13.393 64 HG LEU 7 HG LEU 7 12.812 3.401 -10.560 65 HD11 LEU 7 1HD1 LEU 7 10.553 3.188 -10.351 66 HD12 LEU 7 2HD1 LEU 7 10.919 1.646 -11.126 67 HD13 LEU 7 3HD1 LEU 7 10.297 2.988 -12.085 68 HD21 LEU 7 3HD2 LEU 7 13.529 2.462 -13.143 69 HD22 LEU 7 1HD2 LEU 7 12.522 1.238 -12.370 70 HD23 LEU 7 2HD2 LEU 7 13.984 1.811 -11.567 71 H LYS 8 H LYS 8 13.905 7.957 -11.625 72 HA LYS 8 HA LYS 8 13.815 8.671 -14.462 73 HB3 LYS 8 2HB LYS 8 12.215 10.048 -12.297 74 HG3 LYS 8 2HG LYS 8 13.144 11.689 -13.873 75 HD3 LYS 8 2HD LYS 8 11.604 11.175 -16.169 76 HE3 LYS 8 2HE LYS 8 13.800 11.021 -17.271 77 HZ1 LYS 8 3HZ LYS 8 14.622 13.162 -16.616 78 HZ2 LYS 8 1HZ LYS 8 13.787 13.093 -15.145 79 HZ3 LYS 8 2HZ LYS 8 12.931 13.205 -16.600 80 H ASN 9 H ASN 9 13.900 10.589 -11.470 81 HA ASN 9 HA ASN 9 16.644 11.404 -12.151 82 HB3 ASN 9 2HB ASN 9 15.729 13.660 -10.997 83 HD21 ASN 9 1HD2 ASN 9 14.217 14.829 -13.165 84 HD22 ASN 9 2HD2 ASN 9 15.286 14.910 -14.520 85 H ASN 10 H ASN 10 14.169 11.059 -9.662 86 HA ASN 10 HA ASN 10 15.656 11.774 -7.424 87 HB3 ASN 10 2HB ASN 10 14.101 10.007 -6.274 88 HD21 ASN 10 1HD2 ASN 10 13.518 12.541 -8.669 89 HD22 ASN 10 2HD2 ASN 10 12.539 13.527 -7.645 90 H THR 11 H THR 11 15.380 8.635 -9.045 91 HA THR 11 HA THR 11 16.541 6.682 -8.807 92 HB THR 11 HB THR 11 18.923 6.857 -8.889 93 HG1 THR 11 1HG THR 11 18.765 9.586 -8.123 94 HG21 THR 11 3HG2 THR 11 19.249 8.682 -10.565 95 HG22 THR 11 1HG2 THR 11 17.614 9.236 -10.207 96 HG23 THR 11 2HG2 THR 11 17.870 7.636 -10.903 97 H ILE 12 H ILE 12 15.177 7.410 -6.470 98 HA ILE 12 HA ILE 12 16.598 7.479 -4.108 99 HB ILE 12 HB ILE 12 13.949 6.223 -4.773 100 HG13 ILE 12 2HG1 ILE 12 13.059 8.111 -3.523 101 HG21 ILE 12 1HG2 ILE 12 15.547 5.954 -2.311 102 HG22 ILE 12 2HG2 ILE 12 13.852 6.383 -2.090 103 HG23 ILE 12 3HG2 ILE 12 14.282 4.914 -2.965 104 HD11 ILE 12 3HD1 ILE 12 15.883 9.075 -3.159 105 HD12 ILE 12 1HD1 ILE 12 14.402 9.866 -2.623 106 HD13 ILE 12 2HD1 ILE 12 14.906 8.345 -1.885 107 HA PRO 13 HA PRO 13 18.750 3.606 -4.077 108 HB3 PRO 13 2HB PRO 13 20.332 4.682 -2.805 109 HG3 PRO 13 2HG PRO 13 19.736 6.386 -1.340 110 HD3 PRO 13 2HD PRO 13 18.662 7.109 -3.246 111 H ASP 14 H ASP 14 19.002 1.954 -1.946 112 HA ASP 14 HA ASP 14 16.360 0.794 -1.773 113 HB3 ASP 14 2HB ASP 14 18.058 -0.792 -2.174 114 H SER 15 H SER 15 16.171 3.117 -0.483 115 HA SER 15 HA SER 15 15.984 2.299 2.332 116 HB3 SER 15 2HB SER 15 16.427 5.076 2.358 117 HG SER 15 HG SER 15 18.654 3.942 3.036 118 H GLN 16 H GLN 16 14.130 2.632 -0.049 119 HA GLN 16 HA GLN 16 12.309 4.660 1.038 120 HB3 GLN 16 2HB GLN 16 12.651 5.022 -1.272 121 HG3 GLN 16 2HG GLN 16 12.012 2.128 -1.789 122 HE21 GLN 16 1HE2 GLN 16 12.798 1.578 -4.037 123 HE22 GLN 16 2HE2 GLN 16 12.385 2.691 -5.293 124 H MET 17 H MET 17 12.339 1.292 -0.099 125 HA MET 17 HA MET 17 9.769 0.839 1.227 126 HB3 MET 17 2HB MET 17 9.619 -1.195 -0.026 127 HG3 MET 17 2HG MET 17 10.942 0.479 -2.089 128 HE1 MET 17 3HE MET 17 7.758 -1.822 -0.902 129 HE2 MET 17 1HE MET 17 7.349 -0.113 -1.055 130 HE3 MET 17 2HE MET 17 6.709 -1.280 -2.214 131 H SER 18 H SER 18 9.499 -1.135 2.519 132 HA SER 18 HA SER 18 11.604 -2.665 3.526 133 HB3 SER 18 2HB SER 18 12.598 -0.865 4.631 134 HG SER 18 HG SER 18 11.528 0.855 5.370 135 H ALA 19 H ALA 19 10.720 -4.407 4.432 136 HA ALA 19 HA ALA 19 8.029 -4.156 5.611 137 HB1 ALA 19 1HB ALA 19 8.601 -5.493 3.294 138 HB2 ALA 19 2HB ALA 19 8.661 -6.781 4.499 139 HB3 ALA 19 3HB ALA 19 7.208 -5.797 4.332 140 H SER 20 H SER 20 7.490 -5.948 7.125 141 HA SER 20 HA SER 20 9.244 -6.094 9.243 142 HB3 SER 20 2HB SER 20 7.578 -8.489 9.031 143 HG SER 20 HG SER 20 7.497 -8.002 11.061 144 H SER 21 H SER 21 8.691 -8.566 6.742 145 HA SER 21 HA SER 21 11.436 -9.398 6.847 146 HB3 SER 21 2HB SER 21 10.965 -11.746 7.486 147 HG SER 21 HG SER 21 11.269 -9.789 9.068 148 H SER 22 H SER 22 12.026 -10.707 5.102 149 HA SER 22 HA SER 22 9.945 -10.973 3.033 150 HB3 SER 22 2HB SER 22 11.855 -10.886 1.405 151 HG SER 22 HG SER 22 11.933 -8.714 1.478 152 H TYR 23 H TYR 23 10.531 -12.718 1.370 153 HA TYR 23 HA TYR 23 10.465 -15.216 2.618 154 HB3 TYR 23 2HB TYR 23 11.108 -14.469 -0.239 155 HD1 TYR 23 1HD TYR 23 10.095 -17.314 1.959 156 HD2 TYR 23 2HD TYR 23 11.755 -16.088 -1.762 157 HE1 TYR 23 1HE TYR 23 10.557 -19.664 1.398 158 HE2 TYR 23 2HE TYR 23 12.221 -18.434 -2.333 159 HH TYR 23 HH TYR 23 12.564 -20.576 -1.181 160 H LYS 24 H LYS 24 13.104 -13.189 1.925 161 HA LYS 24 HA LYS 24 15.238 -14.707 1.300 162 HB3 LYS 24 2HB LYS 24 15.192 -12.730 3.588 163 HG3 LYS 24 2HG LYS 24 17.318 -14.253 2.772 164 HD3 LYS 24 2HD LYS 24 18.818 -12.501 1.721 165 HE3 LYS 24 2HE LYS 24 16.946 -12.916 -0.428 166 HZ1 LYS 24 3HZ LYS 24 18.710 -14.132 -1.346 167 HZ2 LYS 24 1HZ LYS 24 19.395 -14.470 0.164 168 HZ3 LYS 24 2HZ LYS 24 19.454 -12.899 -0.459 169 H THR 25 H THR 25 14.319 -14.222 4.715 170 HA THR 25 HA THR 25 14.295 -16.907 5.453 171 HB THR 25 HB THR 25 16.603 -17.132 4.977 172 HG1 THR 25 1HG THR 25 16.604 -16.527 7.751 173 HG21 THR 25 3HG2 THR 25 17.066 -14.679 4.856 174 HG22 THR 25 1HG2 THR 25 18.317 -15.604 5.687 175 HG23 THR 25 2HG2 THR 25 17.153 -14.658 6.616 176 H TRP 26 H TRP 26 15.440 -13.733 6.567 177 HA TRP 26 HA TRP 26 13.417 -13.356 8.443 178 HB3 TRP 26 2HB TRP 26 15.719 -13.787 10.167 179 HD1 TRP 26 HD TRP 26 12.363 -15.664 9.560 180 HE1 TRP 26 1HE TRP 26 10.979 -15.513 11.724 181 HE3 TRP 26 3HE TRP 26 15.565 -12.845 12.376 182 HZ2 TRP 26 2HZ TRP 26 11.213 -14.352 14.286 183 HZ3 TRP 26 3HZ TRP 26 14.910 -12.257 14.673 184 HH2 TRP 26 HH TRP 26 12.779 -12.995 15.607 185 H ASN 27 H ASN 27 14.682 -11.916 10.431 186 HA ASN 27 HA ASN 27 15.799 -9.699 8.871 187 HB3 ASN 27 2HB ASN 27 14.081 -8.751 10.052 188 HD21 ASN 27 1HD2 ASN 27 12.593 -10.478 10.320 189 HD22 ASN 27 2HD2 ASN 27 12.303 -11.154 11.884 190 H LEU 28 H LEU 28 16.230 -10.660 12.268 191 HA LEU 28 HA LEU 28 18.086 -10.701 13.591 192 HB3 LEU 28 2HB LEU 28 19.892 -12.064 12.820 193 HG LEU 28 HG LEU 28 17.357 -13.070 11.529 194 HD11 LEU 28 1HD1 LEU 28 20.072 -14.090 11.497 195 HD12 LEU 28 2HD1 LEU 28 18.657 -14.609 10.582 196 HD13 LEU 28 3HD1 LEU 28 18.933 -15.232 12.208 197 HD21 LEU 28 3HD2 LEU 28 18.582 -13.984 14.110 198 HD22 LEU 28 1HD2 LEU 28 16.941 -14.228 13.514 199 HD23 LEU 28 2HD2 LEU 28 17.455 -12.629 14.051 200 H ARG 29 H ARG 29 20.764 -10.364 13.181 201 HA ARG 29 HA ARG 29 21.068 -7.600 13.125 202 HB3 ARG 29 2HB ARG 29 23.570 -8.405 12.516 203 HG3 ARG 29 2HG ARG 29 22.576 -7.464 14.720 204 HD3 ARG 29 2HD ARG 29 23.168 -10.111 15.868 205 HE ARG 29 HE ARG 29 22.001 -7.802 16.813 206 HH11 ARG 29 1HH1 ARG 29 21.201 -11.190 16.717 207 HH12 ARG 29 2HH1 ARG 29 20.276 -11.146 18.181 208 HH21 ARG 29 1HH2 ARG 29 20.786 -7.733 18.741 209 HH22 ARG 29 2HH2 ARG 29 20.039 -9.179 19.331 210 H ALA 30 H ALA 30 22.318 -6.282 11.607 211 HA ALA 30 HA ALA 30 22.711 -5.393 9.548 212 HB1 ALA 30 1HB ALA 30 22.554 -7.987 8.139 213 HB2 ALA 30 2HB ALA 30 23.768 -6.711 8.042 214 HB3 ALA 30 3HB ALA 30 23.781 -7.840 9.397 215 H PHE 31 H PHE 31 21.817 -5.930 7.034 216 HA PHE 31 HA PHE 31 19.192 -4.980 7.068 217 HB3 PHE 31 2HB PHE 31 19.246 -5.848 4.597 218 HD1 PHE 31 2HD PHE 31 18.425 -3.441 5.149 219 HD2 PHE 31 1HD PHE 31 22.509 -4.525 4.638 220 HE1 PHE 31 2HE PHE 31 18.985 -1.094 4.673 221 HE2 PHE 31 1HE PHE 31 23.076 -2.178 4.161 222 HZ PHE 31 HZ PHE 31 21.311 -0.460 4.177 223 H GLY 32 H GLY 32 20.064 -8.094 5.584 224 HA2 GLY 32 2HA GLY 32 19.149 -10.206 6.153 225 HA3 GLY 32 3HA GLY 32 17.882 -9.386 7.053 226 H TRP 33 H TRP 33 16.635 -7.779 5.427 227 HA TRP 33 HA TRP 33 15.452 -9.569 3.476 228 HB3 TRP 33 2HB TRP 33 13.589 -8.207 3.529 229 HD1 TRP 33 HD TRP 33 14.025 -10.026 5.869 230 HE1 TRP 33 1HE TRP 33 13.497 -9.359 8.298 231 HE3 TRP 33 3HE TRP 33 14.149 -4.941 5.361 232 HZ2 TRP 33 2HZ TRP 33 13.175 -6.992 9.801 233 HZ3 TRP 33 3HZ TRP 33 13.719 -3.546 7.342 234 HH2 TRP 33 HH TRP 33 13.242 -4.553 9.515 235 H TYR 34 H TYR 34 14.884 -8.732 1.297 236 HA TYR 34 HA TYR 34 16.885 -6.855 0.246 237 HB3 TYR 34 2HB TYR 34 17.671 -9.132 -0.218 238 HD1 TYR 34 2HD TYR 34 15.710 -10.571 0.838 239 HD2 TYR 34 1HD TYR 34 15.943 -9.425 -3.252 240 HE1 TYR 34 2HE TYR 34 14.216 -12.430 0.238 241 HE2 TYR 34 1HE TYR 34 14.448 -11.280 -3.864 242 HH TYR 34 HH TYR 34 13.787 -13.835 -1.887 243 HA PRO 35 HA PRO 35 12.464 -6.051 -1.166 244 HB3 PRO 35 2HB PRO 35 11.819 -5.031 0.788 245 HG3 PRO 35 2HG PRO 35 13.392 -4.129 2.245 246 HD3 PRO 35 2HD PRO 35 14.301 -6.223 1.925 247 H HIS 36 H HIS 36 11.878 -3.548 -2.003 248 HA HIS 36 HA HIS 36 12.238 -1.994 -3.629 249 HB3 HIS 36 2HB HIS 36 14.404 -1.066 -3.926 250 HD1 HIS 36 1HD HIS 36 16.005 -2.501 -1.065 251 HD2 HIS 36 2HD HIS 36 12.863 0.152 -1.658 252 HE1 HIS 36 1HE HIS 36 15.722 -1.293 1.122 253 H LEU 37 H LEU 37 11.433 -4.336 -4.558 254 HA LEU 37 HA LEU 37 13.178 -4.917 -6.860 255 HB3 LEU 37 2HB LEU 37 12.310 -7.115 -6.935 256 HG LEU 37 HG LEU 37 13.099 -6.268 -4.205 257 HD11 LEU 37 1HD1 LEU 37 12.067 -9.044 -4.742 258 HD12 LEU 37 2HD1 LEU 37 11.148 -7.803 -3.893 259 HD13 LEU 37 3HD1 LEU 37 12.667 -8.390 -3.218 260 HD21 LEU 37 3HD2 LEU 37 14.359 -8.629 -5.058 261 HD22 LEU 37 1HD2 LEU 37 15.028 -6.997 -5.022 262 HD23 LEU 37 2HD2 LEU 37 14.234 -7.592 -6.480 263 H GLY 38 H GLY 38 10.122 -3.748 -5.835 264 HA2 GLY 38 2HA GLY 38 8.441 -4.303 -7.955 265 HA3 GLY 38 3HA GLY 38 8.384 -2.819 -7.016 266 H ARG 39 H ARG 39 11.119 -2.062 -7.836 267 HA ARG 39 HA ARG 39 10.555 -0.370 -9.933 268 HB3 ARG 39 2HB ARG 39 12.547 -0.216 -8.457 269 HG3 ARG 39 2HG ARG 39 13.511 -2.510 -10.132 270 HD3 ARG 39 2HD ARG 39 15.076 -0.409 -9.924 271 HE ARG 39 HE ARG 39 14.812 -0.831 -7.258 272 HH11 ARG 39 1HH1 ARG 39 17.468 -1.095 -9.493 273 HH12 ARG 39 2HH1 ARG 39 18.672 -0.699 -8.311 274 HH21 ARG 39 1HH2 ARG 39 16.387 -0.308 -5.694 275 HH22 ARG 39 2HH2 ARG 39 18.056 -0.252 -6.151 276 H LEU 40 H LEU 40 10.813 -0.415 -12.146 277 HA LEU 40 HA LEU 40 10.452 -2.934 -13.416 278 HB3 LEU 40 2HB LEU 40 11.245 -0.675 -15.113 279 HG LEU 40 HG LEU 40 9.813 -2.827 -15.703 280 HD11 LEU 40 1HD1 LEU 40 7.440 -1.240 -15.698 281 HD12 LEU 40 2HD1 LEU 40 8.047 -1.384 -14.048 282 HD13 LEU 40 3HD1 LEU 40 7.714 -2.834 -14.995 283 HD21 LEU 40 3HD2 LEU 40 10.465 -1.400 -17.430 284 HD22 LEU 40 1HD2 LEU 40 9.578 -0.031 -16.761 285 HD23 LEU 40 2HD2 LEU 40 8.702 -1.370 -17.502 286 H ASP 41 H ASP 41 11.811 -3.278 -15.557 287 HA ASP 41 HA ASP 41 13.765 -4.130 -16.366 288 HB3 ASP 41 2HB ASP 41 15.254 -1.860 -15.101 289 H ASN 42 H ASN 42 12.979 -5.094 -13.799 290 HA ASN 42 HA ASN 42 14.924 -5.151 -11.842 291 HB3 ASN 42 2HB ASN 42 12.626 -6.179 -11.721 292 HD21 ASN 42 1HD2 ASN 42 11.767 -6.737 -13.771 293 HD22 ASN 42 2HD2 ASN 42 11.877 -8.358 -14.360 294 H GLN 43 H GLN 43 16.929 -5.917 -11.718 295 HA GLN 43 HA GLN 43 18.159 -7.171 -13.964 296 HB3 GLN 43 2HB GLN 43 19.458 -5.663 -12.611 297 HG3 GLN 43 2HG GLN 43 19.844 -7.372 -10.299 298 HE21 GLN 43 1HE2 GLN 43 17.849 -4.876 -9.500 299 HE22 GLN 43 2HE2 GLN 43 19.029 -3.652 -9.194 300 H GLY 44 H GLY 44 16.790 -8.293 -10.957 301 HA2 GLY 44 2HA GLY 44 17.959 -10.930 -11.165 302 HA3 GLY 44 3HA GLY 44 16.777 -10.400 -9.977 303 H LYS 45 H LYS 45 14.614 -10.714 -10.349 304 HA LYS 45 HA LYS 45 13.435 -11.315 -12.816 305 HB3 LYS 45 2HB LYS 45 14.794 -13.357 -12.704 306 HG3 LYS 45 2HG LYS 45 14.098 -15.117 -11.039 307 HD3 LYS 45 2HD LYS 45 15.347 -12.905 -9.499 308 HE3 LYS 45 2HE LYS 45 15.228 -15.512 -9.050 309 HZ1 LYS 45 3HZ LYS 45 17.832 -15.344 -10.430 310 HZ2 LYS 45 1HZ LYS 45 16.451 -15.879 -11.244 311 HZ3 LYS 45 2HZ LYS 45 17.009 -16.718 -9.886 312 H ILE 46 H ILE 46 13.433 -11.666 -9.338 313 HA ILE 46 HA ILE 46 10.769 -12.334 -8.890 314 HB ILE 46 HB ILE 46 12.333 -10.434 -7.152 315 HG13 ILE 46 2HG1 ILE 46 12.899 -13.203 -7.857 316 HG21 ILE 46 1HG2 ILE 46 10.992 -11.213 -5.378 317 HG22 ILE 46 2HG2 ILE 46 9.883 -10.920 -6.716 318 HG23 ILE 46 3HG2 ILE 46 10.382 -12.566 -6.329 319 HD11 ILE 46 3HD1 ILE 46 14.525 -11.262 -7.710 320 HD12 ILE 46 1HD1 ILE 46 14.442 -11.469 -5.961 321 HD13 ILE 46 2HD1 ILE 46 15.026 -12.786 -6.978 322 H ASN 47 H ASN 47 12.235 -9.088 -9.041 323 HA ASN 47 HA ASN 47 11.322 -7.021 -9.333 324 HB3 ASN 47 2HB ASN 47 9.307 -8.494 -11.041 325 HD21 ASN 47 1HD2 ASN 47 8.393 -7.245 -12.672 326 HD22 ASN 47 2HD2 ASN 47 8.380 -5.519 -12.605 327 H ALA 48 H ALA 48 10.415 -8.453 -7.032 328 HA ALA 48 HA ALA 48 8.321 -6.799 -6.188 329 HB1 ALA 48 1HB ALA 48 7.303 -8.721 -7.814 330 HB2 ALA 48 2HB ALA 48 7.141 -9.484 -6.231 331 HB3 ALA 48 3HB ALA 48 6.402 -7.911 -6.532 332 H TRP 49 H TRP 49 8.025 -6.915 -3.991 333 HA TRP 49 HA TRP 49 9.931 -8.532 -2.546 334 HB3 TRP 49 2HB TRP 49 8.224 -6.192 -1.970 335 HD1 TRP 49 HD TRP 49 10.229 -7.719 0.874 336 HE1 TRP 49 1HE TRP 49 8.655 -8.174 2.859 337 HE3 TRP 49 3HE TRP 49 5.752 -6.785 -1.410 338 HZ2 TRP 49 2HZ TRP 49 5.883 -8.143 3.387 339 HZ3 TRP 49 3HZ TRP 49 3.685 -7.021 -0.095 340 HH2 TRP 49 HH TRP 49 3.752 -7.686 2.254 341 H THR 50 H THR 50 9.525 -10.250 -1.252 342 HA THR 50 HA THR 50 6.753 -11.249 -1.216 343 HB THR 50 HB THR 50 8.987 -13.106 -0.605 344 HG1 THR 50 1HG THR 50 9.846 -13.026 -2.547 345 HG21 THR 50 3HG2 THR 50 6.862 -14.094 -0.593 346 HG22 THR 50 1HG2 THR 50 7.521 -14.526 -2.169 347 HG23 THR 50 2HG2 THR 50 6.346 -13.218 -2.033 348 H ALA 51 H ALA 51 6.329 -12.758 0.691 349 HA ALA 51 HA ALA 51 7.051 -11.324 3.118 350 HB1 ALA 51 1HB ALA 51 5.295 -12.670 4.180 351 HB2 ALA 51 2HB ALA 51 4.704 -11.821 2.751 352 HB3 ALA 51 3HB ALA 51 5.063 -13.546 2.667 353 H GLN 52 H GLN 52 7.427 -12.692 5.119 354 HA GLN 52 HA GLN 52 9.505 -14.652 4.492 355 HB3 GLN 52 2HB GLN 52 8.853 -13.082 6.982 356 HG3 GLN 52 2HG GLN 52 9.614 -15.035 7.965 357 HE21 GLN 52 1HE2 GLN 52 9.914 -17.076 7.484 358 HE22 GLN 52 2HE2 GLN 52 10.995 -17.700 6.289 359 H SER 53 H SER 53 6.918 -14.294 6.926 360 HA SER 53 HA SER 53 6.875 -17.144 7.390 361 HB3 SER 53 2HB SER 53 4.858 -15.164 8.440 362 HG SER 53 HG SER 53 4.357 -16.797 9.647 363 H ASN 54 H ASN 54 5.682 -15.282 4.985 364 HA ASN 54 HA ASN 54 4.003 -15.462 3.453 365 HB3 ASN 54 2HB ASN 54 3.747 -17.577 2.542 366 HD21 ASN 54 1HD2 ASN 54 5.504 -19.354 4.752 367 HD22 ASN 54 2HD2 ASN 54 7.078 -19.140 4.072 368 H SER 55 H SER 55 3.171 -14.738 6.080 369 HA SER 55 HA SER 55 0.440 -15.842 6.067 370 HB3 SER 55 2HB SER 55 1.707 -14.832 8.595 371 HG SER 55 HG SER 55 0.213 -16.906 9.019 372 H ALA 56 H ALA 56 -0.759 -14.198 7.864 373 HA ALA 56 HA ALA 56 -0.879 -11.710 6.376 374 HB1 ALA 56 1HB ALA 56 -2.646 -11.588 8.554 375 HB2 ALA 56 2HB ALA 56 -3.032 -11.923 6.865 376 HB3 ALA 56 3HB ALA 56 -2.692 -13.253 7.973 377 H LYS 57 H LYS 57 0.673 -12.875 9.150 378 HA LYS 57 HA LYS 57 0.662 -10.556 10.771 379 HB3 LYS 57 2HB LYS 57 2.804 -11.638 11.714 380 HG3 LYS 57 2HG LYS 57 0.061 -12.682 11.818 381 HD3 LYS 57 2HD LYS 57 1.790 -14.664 11.533 382 HE3 LYS 57 2HE LYS 57 1.932 -14.111 14.492 383 HZ1 LYS 57 3HZ LYS 57 2.061 -16.468 13.552 384 HZ2 LYS 57 1HZ LYS 57 3.281 -15.976 14.616 385 HZ3 LYS 57 2HZ LYS 57 3.576 -16.016 12.952 386 H GLU 58 H GLU 58 2.227 -11.283 7.840 387 HA GLU 58 HA GLU 58 4.494 -9.549 8.226 388 HB3 GLU 58 2HB GLU 58 4.023 -10.004 5.460 389 HG3 GLU 58 2HG GLU 58 6.233 -9.930 6.499 390 H TRP 59 H TRP 59 4.852 -7.546 7.231 391 HA TRP 59 HA TRP 59 2.647 -6.253 5.848 392 HB3 TRP 59 2HB TRP 59 2.019 -5.677 8.061 393 HD1 TRP 59 HD TRP 59 5.636 -4.242 8.111 394 HE1 TRP 59 1HE TRP 59 6.616 -4.668 10.453 395 HE3 TRP 59 3HE TRP 59 1.697 -6.747 10.195 396 HZ2 TRP 59 2HZ TRP 59 5.823 -5.903 12.865 397 HZ3 TRP 59 3HZ TRP 59 1.887 -7.516 12.523 398 HH2 TRP 59 HH TRP 59 3.909 -7.103 13.829 399 H LEU 60 H LEU 60 3.276 -4.536 4.559 400 HA LEU 60 HA LEU 60 6.183 -4.071 4.415 401 HB3 LEU 60 2HB LEU 60 4.091 -4.240 2.268 402 HG LEU 60 HG LEU 60 5.380 -2.332 1.573 403 HD11 LEU 60 1HD1 LEU 60 7.975 -3.285 1.208 404 HD12 LEU 60 2HD1 LEU 60 7.532 -3.760 2.848 405 HD13 LEU 60 3HD1 LEU 60 7.436 -2.067 2.365 406 HD21 LEU 60 3HD2 LEU 60 6.757 -4.368 -0.040 407 HD22 LEU 60 1HD2 LEU 60 5.682 -3.059 -0.534 408 HD23 LEU 60 2HD2 LEU 60 5.009 -4.564 0.091 409 H GLN 61 H GLN 61 6.859 -2.064 4.773 410 HA GLN 61 HA GLN 61 4.919 0.137 4.496 411 HB3 GLN 61 2HB GLN 61 5.429 -0.341 6.856 412 HG3 GLN 61 2HG GLN 61 7.832 0.580 7.489 413 HE21 GLN 61 1HE2 GLN 61 9.519 -1.232 7.860 414 HE22 GLN 61 2HE2 GLN 61 8.859 -2.764 8.307 415 H VAL 62 H VAL 62 5.821 2.226 3.963 416 HA VAL 62 HA VAL 62 8.432 2.070 2.609 417 HB VAL 62 HB VAL 62 6.129 3.697 1.549 418 HG11 VAL 62 1HG1 VAL 62 7.454 3.703 -0.505 419 HG12 VAL 62 2HG1 VAL 62 8.367 4.374 0.847 420 HG13 VAL 62 3HG1 VAL 62 8.695 2.733 0.288 421 HG21 VAL 62 3HG2 VAL 62 5.256 1.554 1.323 422 HG22 VAL 62 1HG2 VAL 62 6.073 1.812 -0.218 423 HG23 VAL 62 2HG2 VAL 62 6.837 0.832 1.034 424 H ASP 63 H ASP 63 9.802 3.412 3.561 425 HA ASP 63 HA ASP 63 8.777 5.803 4.907 426 HB3 ASP 63 2HB ASP 63 11.573 4.665 5.032 427 H LEU 64 H LEU 64 8.982 7.745 4.020 428 HA LEU 64 HA LEU 64 10.862 8.066 1.778 429 HB3 LEU 64 2HB LEU 64 9.311 10.173 1.442 430 HG LEU 64 HG LEU 64 9.451 8.325 -0.208 431 HD11 LEU 64 1HD1 LEU 64 8.818 6.507 1.333 432 HD12 LEU 64 2HD1 LEU 64 7.851 6.520 -0.141 433 HD13 LEU 64 3HD1 LEU 64 7.170 7.137 1.364 434 HD21 LEU 64 3HD2 LEU 64 6.560 8.984 0.068 435 HD22 LEU 64 1HD2 LEU 64 7.598 9.024 -1.357 436 HD23 LEU 64 2HD2 LEU 64 7.717 10.299 -0.144 437 H GLY 65 H GLY 65 9.361 10.037 4.354 438 HA2 GLY 65 2HA GLY 65 10.280 11.605 5.765 439 HA3 GLY 65 3HA GLY 65 11.857 10.945 5.359 440 H THR 66 H THR 66 10.193 11.816 2.581 441 HA THR 66 HA THR 66 11.717 14.329 2.423 442 HB THR 66 HB THR 66 12.301 12.602 0.741 443 HG1 THR 66 1HG THR 66 12.667 14.663 0.049 444 HG21 THR 66 3HG2 THR 66 9.521 12.271 0.577 445 HG22 THR 66 1HG2 THR 66 10.754 11.464 -0.392 446 HG23 THR 66 2HG2 THR 66 10.013 12.957 -0.971 447 H GLN 67 H GLN 67 8.600 13.112 2.730 448 HA GLN 67 HA GLN 67 6.508 13.986 2.496 449 HB3 GLN 67 2HB GLN 67 7.654 16.743 2.610 450 HG3 GLN 67 2HG GLN 67 5.241 15.358 3.595 451 HE21 GLN 67 1HE2 GLN 67 5.839 14.943 5.775 452 HE22 GLN 67 2HE2 GLN 67 5.847 16.217 6.942 453 H ARG 68 H ARG 68 6.367 13.293 0.284 454 HA ARG 68 HA ARG 68 6.468 15.533 -1.629 455 HB3 ARG 68 2HB ARG 68 6.558 13.469 -3.301 456 HG3 ARG 68 2HG ARG 68 9.055 13.494 -3.189 457 HD3 ARG 68 2HD ARG 68 7.546 16.099 -3.217 458 HE ARG 68 HE ARG 68 10.381 15.724 -3.491 459 HH11 ARG 68 1HH1 ARG 68 7.637 17.625 -4.480 460 HH12 ARG 68 2HH1 ARG 68 8.583 19.020 -4.879 461 HH21 ARG 68 1HH2 ARG 68 11.637 17.555 -4.012 462 HH22 ARG 68 2HH2 ARG 68 10.858 18.979 -4.613 463 H GLN 69 H GLN 69 4.793 15.684 -3.166 464 HA GLN 69 HA GLN 69 2.267 14.603 -2.220 465 HB3 GLN 69 2HB GLN 69 3.052 16.747 -4.162 466 HG3 GLN 69 2HG GLN 69 0.335 15.490 -3.921 467 HE21 GLN 69 1HE2 GLN 69 -0.017 17.021 -6.532 468 HE22 GLN 69 2HE2 GLN 69 -0.566 18.578 -6.022 469 H VAL 70 H VAL 70 1.497 12.756 -2.976 470 HA VAL 70 HA VAL 70 2.497 11.667 -5.481 471 HB VAL 70 HB VAL 70 1.325 9.620 -4.866 472 HG11 VAL 70 1HG1 VAL 70 2.765 10.681 -2.443 473 HG12 VAL 70 2HG1 VAL 70 2.650 9.006 -2.988 474 HG13 VAL 70 3HG1 VAL 70 3.583 10.177 -3.922 475 HG21 VAL 70 3HG2 VAL 70 0.484 10.033 -2.245 476 HG22 VAL 70 1HG2 VAL 70 -0.132 11.421 -3.140 477 HG23 VAL 70 2HG2 VAL 70 -0.540 9.785 -3.659 478 H THR 71 H THR 71 1.237 11.154 -7.255 479 HA THR 71 HA THR 71 -1.515 12.204 -7.253 480 HB THR 71 HB THR 71 -0.539 12.434 -9.885 481 HG1 THR 71 1HG THR 71 1.194 13.764 -8.060 482 HG21 THR 71 3HG2 THR 71 -2.192 13.835 -8.459 483 HG22 THR 71 1HG2 THR 71 -1.235 14.647 -9.696 484 HG23 THR 71 2HG2 THR 71 -0.760 14.755 -8.002 485 H GLY 72 H GLY 72 -0.075 9.459 -7.162 486 HA2 GLY 72 2HA GLY 72 -2.046 7.951 -8.415 487 HA3 GLY 72 3HA GLY 72 -0.732 8.112 -9.571 488 H ILE 73 H ILE 73 -1.262 5.627 -8.913 489 HA ILE 73 HA ILE 73 1.040 4.860 -7.292 490 HB ILE 73 HB ILE 73 -0.114 3.336 -5.907 491 HG13 ILE 73 2HG1 ILE 73 -2.220 3.607 -7.948 492 HG21 ILE 73 1HG2 ILE 73 -1.527 4.742 -4.598 493 HG22 ILE 73 2HG2 ILE 73 -0.266 5.756 -5.296 494 HG23 ILE 73 3HG2 ILE 73 -1.890 5.766 -5.986 495 HD11 ILE 73 3HD1 ILE 73 -1.160 1.469 -6.175 496 HD12 ILE 73 1HD1 ILE 73 -2.779 1.300 -6.855 497 HD13 ILE 73 2HD1 ILE 73 -1.388 1.479 -7.924 498 H ILE 74 H ILE 74 1.218 2.332 -7.373 499 HA ILE 74 HA ILE 74 0.170 1.058 -9.712 500 HB ILE 74 HB ILE 74 1.826 2.339 -10.874 501 HG13 ILE 74 2HG1 ILE 74 2.897 -0.454 -10.417 502 HG21 ILE 74 1HG2 ILE 74 4.304 1.524 -9.912 503 HG22 ILE 74 2HG2 ILE 74 3.567 3.116 -9.732 504 HG23 ILE 74 3HG2 ILE 74 3.362 1.901 -8.470 505 HD11 ILE 74 3HD1 ILE 74 1.074 -1.244 -11.376 506 HD12 ILE 74 1HD1 ILE 74 0.430 0.383 -11.587 507 HD13 ILE 74 2HD1 ILE 74 1.474 -0.318 -12.823 508 H THR 75 H THR 75 0.246 -1.114 -9.515 509 HA THR 75 HA THR 75 2.032 -2.253 -7.470 510 HB THR 75 HB THR 75 -0.053 -2.250 -6.368 511 HG1 THR 75 1HG THR 75 -0.163 -4.808 -7.557 512 HG21 THR 75 3HG2 THR 75 -1.492 -1.676 -8.234 513 HG22 THR 75 1HG2 THR 75 -2.130 -3.097 -7.410 514 HG23 THR 75 2HG2 THR 75 -1.265 -3.278 -8.936 515 H GLN 76 H GLN 76 2.663 -4.428 -7.795 516 HA GLN 76 HA GLN 76 1.888 -5.768 -10.245 517 HB3 GLN 76 2HB GLN 76 4.778 -5.743 -10.125 518 HG3 GLN 76 2HG GLN 76 2.768 -4.929 -12.203 519 HE21 GLN 76 1HE2 GLN 76 3.867 -2.941 -12.633 520 HE22 GLN 76 2HE2 GLN 76 5.341 -2.941 -13.534 521 H GLY 77 H GLY 77 1.998 -7.940 -10.057 522 HA2 GLY 77 2HA GLY 77 2.923 -8.992 -7.494 523 HA3 GLY 77 3HA GLY 77 1.922 -9.838 -8.665 524 H ALA 78 H ALA 78 3.872 -11.282 -7.612 525 HA ALA 78 HA ALA 78 5.802 -11.507 -9.815 526 HB1 ALA 78 1HB ALA 78 7.374 -12.337 -7.835 527 HB2 ALA 78 2HB ALA 78 7.296 -10.647 -8.337 528 HB3 ALA 78 3HB ALA 78 6.386 -11.191 -6.928 529 H ARG 79 H ARG 79 7.082 -13.706 -9.421 530 HA ARG 79 HA ARG 79 5.199 -15.780 -8.548 531 HB3 ARG 79 2HB ARG 79 4.848 -15.698 -10.907 532 HG3 ARG 79 2HG ARG 79 7.627 -15.009 -11.047 533 HD3 ARG 79 2HD ARG 79 6.721 -17.426 -12.568 534 HE ARG 79 HE ARG 79 9.086 -16.152 -13.589 535 HH11 ARG 79 1HH1 ARG 79 5.631 -16.438 -13.896 536 HH12 ARG 79 2HH1 ARG 79 5.606 -15.945 -15.556 537 HH21 ARG 79 1HH2 ARG 79 9.068 -15.502 -15.775 538 HH22 ARG 79 2HH2 ARG 79 7.562 -15.413 -16.625 539 H ASP 80 H ASP 80 6.385 -18.010 -8.704 540 HA ASP 80 HA ASP 80 9.051 -17.639 -7.507 541 HB3 ASP 80 2HB ASP 80 7.009 -19.825 -7.062 542 H PHE 81 H PHE 81 9.716 -17.596 -9.849 543 HA PHE 81 HA PHE 81 10.655 -18.568 -11.682 544 HB3 PHE 81 2HB PHE 81 12.084 -20.437 -11.264 545 HD1 PHE 81 1HD PHE 81 11.194 -19.698 -7.775 546 HD2 PHE 81 2HD PHE 81 13.744 -18.743 -11.048 547 HE1 PHE 81 1HE PHE 81 12.645 -18.407 -6.264 548 HE2 PHE 81 2HE PHE 81 15.199 -17.452 -9.542 549 HZ PHE 81 HZ PHE 81 14.651 -17.282 -7.147 550 H GLY 82 H GLY 82 7.793 -19.001 -11.248 551 HA2 GLY 82 2HA GLY 82 6.995 -20.417 -13.373 552 HA3 GLY 82 3HA GLY 82 7.290 -21.699 -12.208 553 H HIS 83 H HIS 83 6.299 -20.985 -9.919 554 HA HIS 83 HA HIS 83 3.483 -21.002 -10.323 555 HB3 HIS 83 2HB HIS 83 3.738 -20.531 -7.658 556 HD1 HIS 83 1HD HIS 83 2.846 -22.532 -6.393 557 HD2 HIS 83 2HD HIS 83 4.229 -23.494 -10.190 558 HE1 HIS 83 1HE HIS 83 2.104 -24.901 -6.798 559 H ILE 84 H ILE 84 2.229 -19.309 -10.699 560 HA ILE 84 HA ILE 84 3.176 -16.624 -10.332 561 HB ILE 84 HB ILE 84 0.449 -17.621 -11.162 562 HG13 ILE 84 2HG1 ILE 84 1.205 -16.977 -13.439 563 HG21 ILE 84 1HG2 ILE 84 0.301 -15.263 -12.123 564 HG22 ILE 84 2HG2 ILE 84 0.119 -15.438 -10.379 565 HG23 ILE 84 3HG2 ILE 84 1.647 -14.871 -11.052 566 HD11 ILE 84 3HD1 ILE 84 4.039 -17.103 -12.862 567 HD12 ILE 84 1HD1 ILE 84 3.141 -16.004 -13.910 568 HD13 ILE 84 2HD1 ILE 84 3.276 -15.665 -12.183 569 H GLN 85 H GLN 85 2.954 -15.400 -8.585 570 HA GLN 85 HA GLN 85 0.831 -16.073 -6.656 571 HB3 GLN 85 2HB GLN 85 2.319 -15.434 -4.842 572 HG3 GLN 85 2HG GLN 85 3.214 -17.538 -6.722 573 HE21 GLN 85 1HE2 GLN 85 4.536 -19.088 -4.845 574 HE22 GLN 85 2HE2 GLN 85 6.094 -18.404 -4.549 575 H TYR 86 H TYR 86 0.101 -14.271 -5.320 576 HA TYR 86 HA TYR 86 0.777 -11.598 -5.750 577 HB3 TYR 86 2HB TYR 86 -0.014 -11.662 -7.964 578 HD1 TYR 86 1HD TYR 86 -3.241 -12.528 -6.327 579 HD2 TYR 86 2HD TYR 86 -0.365 -13.555 -9.289 580 HE1 TYR 86 1HE TYR 86 -4.760 -14.259 -7.193 581 HE2 TYR 86 2HE TYR 86 -1.875 -15.289 -10.163 582 HH TYR 86 HH TYR 86 -3.865 -16.713 -9.077 583 H VAL 87 H VAL 87 -0.375 -10.214 -4.422 584 HA VAL 87 HA VAL 87 -2.047 -11.527 -2.444 585 HB VAL 87 HB VAL 87 -1.242 -8.623 -2.481 586 HG11 VAL 87 1HG1 VAL 87 -1.470 -8.905 -0.009 587 HG12 VAL 87 2HG1 VAL 87 -2.979 -9.089 -0.905 588 HG13 VAL 87 3HG1 VAL 87 -2.127 -10.513 -0.309 589 HG21 VAL 87 3HG2 VAL 87 0.877 -9.283 -2.272 590 HG22 VAL 87 1HG2 VAL 87 0.423 -9.929 -0.694 591 HG23 VAL 87 2HG2 VAL 87 0.409 -10.977 -2.113 592 H ALA 88 H ALA 88 -4.147 -10.912 -1.906 593 HA ALA 88 HA ALA 88 -5.582 -9.501 -4.052 594 HB1 ALA 88 1HB ALA 88 -7.465 -10.749 -2.423 595 HB2 ALA 88 2HB ALA 88 -6.906 -11.285 -4.008 596 HB3 ALA 88 3HB ALA 88 -6.133 -11.898 -2.546 597 H SER 89 H SER 89 -6.420 -10.099 -0.652 598 HA SER 89 HA SER 89 -7.328 -7.345 -0.418 599 HB3 SER 89 2HB SER 89 -7.497 -9.052 1.971 600 HG SER 89 HG SER 89 -9.839 -8.313 0.922 601 H TYR 90 H TYR 90 -6.143 -5.784 0.445 602 HA TYR 90 HA TYR 90 -4.303 -6.325 2.613 603 HB3 TYR 90 2HB TYR 90 -2.822 -6.779 0.785 604 HD1 TYR 90 1HD TYR 90 -3.882 -7.006 -1.403 605 HD2 TYR 90 2HD TYR 90 -2.769 -3.189 0.113 606 HE1 TYR 90 1HE TYR 90 -4.127 -6.046 -3.654 607 HE2 TYR 90 2HE TYR 90 -3.014 -2.218 -2.133 608 HH TYR 90 HH TYR 90 -3.663 -4.233 -4.943 609 H LYS 91 H LYS 91 -4.126 -4.625 3.961 610 HA LYS 91 HA LYS 91 -5.619 -2.213 3.273 611 HB3 LYS 91 2HB LYS 91 -4.471 -2.253 5.939 612 HG3 LYS 91 2HG LYS 91 -7.201 -2.600 6.172 613 HD3 LYS 91 2HD LYS 91 -5.899 0.075 5.748 614 HE3 LYS 91 2HE LYS 91 -8.361 -0.907 6.909 615 HZ1 LYS 91 3HZ LYS 91 -7.743 -0.664 9.048 616 HZ2 LYS 91 1HZ LYS 91 -7.989 0.980 8.731 617 HZ3 LYS 91 2HZ LYS 91 -6.427 0.335 8.688 618 H VAL 92 H VAL 92 -4.465 -0.719 2.229 619 HA VAL 92 HA VAL 92 -1.732 -0.151 3.177 620 HB VAL 92 HB VAL 92 -1.683 -0.884 0.884 621 HG11 VAL 92 1HG1 VAL 92 -4.074 -0.322 0.408 622 HG12 VAL 92 2HG1 VAL 92 -3.576 1.360 0.205 623 HG13 VAL 92 3HG1 VAL 92 -2.948 0.116 -0.876 624 HG21 VAL 92 3HG2 VAL 92 -0.317 0.762 0.077 625 HG22 VAL 92 1HG2 VAL 92 -1.428 2.055 0.526 626 HG23 VAL 92 2HG2 VAL 92 -0.436 1.279 1.759 627 H ALA 93 H ALA 93 -1.520 1.675 4.274 628 HA ALA 93 HA ALA 93 -3.318 3.923 3.638 629 HB1 ALA 93 1HB ALA 93 -3.341 2.546 5.991 630 HB2 ALA 93 2HB ALA 93 -2.250 3.882 6.363 631 HB3 ALA 93 3HB ALA 93 -3.883 4.212 5.787 632 H HIS 94 H HIS 94 -2.440 5.985 3.653 633 HA HIS 94 HA HIS 94 0.503 6.081 3.693 634 HB3 HIS 94 2HB HIS 94 0.238 8.088 2.209 635 HD1 HIS 94 1HD HIS 94 0.885 7.578 -0.156 636 HD2 HIS 94 2HD HIS 94 -1.307 4.512 1.592 637 HE1 HIS 94 1HE HIS 94 0.968 5.673 -1.795 638 H SER 95 H SER 95 1.551 7.648 4.851 639 HA SER 95 HA SER 95 -0.127 9.465 6.451 640 HB3 SER 95 2HB SER 95 2.425 8.322 7.547 641 HG SER 95 HG SER 95 0.791 10.050 8.446 642 H ASP 96 H ASP 96 0.443 11.541 6.383 643 HA ASP 96 HA ASP 96 2.855 12.266 4.913 644 HB3 ASP 96 2HB ASP 96 0.666 13.289 4.311 645 H ASP 97 H ASP 97 1.351 12.755 8.069 646 HA ASP 97 HA ASP 97 3.709 14.206 9.008 647 HB3 ASP 97 2HB ASP 97 1.358 13.581 10.755 648 H GLY 98 H GLY 98 2.333 11.073 9.053 649 HA2 GLY 98 2HA GLY 98 3.725 9.214 9.704 650 HA3 GLY 98 3HA GLY 98 4.405 10.225 10.969 651 H VAL 99 H VAL 99 1.617 11.213 11.587 652 HA VAL 99 HA VAL 99 0.893 8.953 13.310 653 HB VAL 99 HB VAL 99 1.324 11.072 14.452 654 HG11 VAL 99 1HG1 VAL 99 -1.007 12.149 12.869 655 HG12 VAL 99 2HG1 VAL 99 -0.117 13.003 14.131 656 HG13 VAL 99 3HG1 VAL 99 0.685 12.575 12.620 657 HG21 VAL 99 3HG2 VAL 99 -0.258 10.629 15.972 658 HG22 VAL 99 1HG2 VAL 99 -1.565 10.989 14.842 659 HG23 VAL 99 2HG2 VAL 99 -0.815 9.394 14.843 660 H GLN 100 H GLN 100 -0.400 11.120 10.867 661 HA GLN 100 HA GLN 100 -3.056 9.970 11.061 662 HB3 GLN 100 2HB GLN 100 -3.611 11.535 9.229 663 HG3 GLN 100 2HG GLN 100 -1.988 13.078 11.217 664 HE21 GLN 100 1HE2 GLN 100 -2.035 14.824 9.803 665 HE22 GLN 100 2HE2 GLN 100 -3.492 15.685 9.455 666 H TRP 101 H TRP 101 -3.094 7.903 10.357 667 HA TRP 101 HA TRP 101 -1.764 7.223 7.845 668 HB3 TRP 101 2HB TRP 101 -2.004 4.950 8.457 669 HD1 TRP 101 HD TRP 101 0.107 7.163 9.495 670 HE1 TRP 101 1HE TRP 101 1.351 6.728 11.706 671 HE3 TRP 101 3HE TRP 101 -3.099 3.766 11.576 672 HZ2 TRP 101 2HZ TRP 101 1.018 5.153 14.025 673 HZ3 TRP 101 3HZ TRP 101 -2.563 2.844 13.792 674 HH2 TRP 101 HH TRP 101 -0.546 3.523 14.991 675 H THR 102 H THR 102 -2.987 7.906 6.170 676 HA THR 102 HA THR 102 -5.861 7.675 6.189 677 HB THR 102 HB THR 102 -4.006 8.455 3.930 678 HG1 THR 102 1HG THR 102 -3.822 10.115 5.285 679 HG21 THR 102 3HG2 THR 102 -6.243 7.662 3.204 680 HG22 THR 102 1HG2 THR 102 -5.971 9.369 2.856 681 HG23 THR 102 2HG2 THR 102 -6.980 8.898 4.224 682 H VAL 103 H VAL 103 -6.540 5.589 6.160 683 HA VAL 103 HA VAL 103 -5.315 3.614 4.455 684 HB VAL 103 HB VAL 103 -7.144 2.127 5.272 685 HG11 VAL 103 1HG1 VAL 103 -5.302 3.578 7.118 686 HG12 VAL 103 2HG1 VAL 103 -6.420 2.377 7.768 687 HG13 VAL 103 3HG1 VAL 103 -5.237 1.912 6.545 688 HG21 VAL 103 3HG2 VAL 103 -8.022 3.803 7.435 689 HG22 VAL 103 1HG2 VAL 103 -8.391 4.560 5.885 690 HG23 VAL 103 2HG2 VAL 103 -8.978 2.934 6.235 691 H TYR 104 H TYR 104 -7.514 6.059 3.947 692 HA TYR 104 HA TYR 104 -8.934 6.589 2.253 693 HB3 TYR 104 2HB TYR 104 -8.571 5.507 0.075 694 HD1 TYR 104 2HD TYR 104 -7.734 8.010 0.767 695 HD2 TYR 104 1HD TYR 104 -5.316 4.513 0.600 696 HE1 TYR 104 2HE TYR 104 -5.737 9.413 0.459 697 HE2 TYR 104 1HE TYR 104 -3.312 5.906 0.292 698 HH TYR 104 HH TYR 104 -3.303 8.924 -0.688 699 H GLU 105 H GLU 105 -10.603 5.803 3.774 700 HA GLU 105 HA GLU 105 -11.713 3.209 3.538 701 HB3 GLU 105 2HB GLU 105 -13.461 3.980 4.934 702 HG3 GLU 105 2HG GLU 105 -10.922 4.375 5.727 703 H GLU 106 H GLU 106 -14.181 3.050 2.982 704 HA GLU 106 HA GLU 106 -15.111 4.671 0.819 705 HB3 GLU 106 2HB GLU 106 -14.429 1.817 0.117 706 HG3 GLU 106 2HG GLU 106 -16.195 3.267 -1.157 707 H GLN 107 H GLN 107 -15.390 1.328 2.035 708 HA GLN 107 HA GLN 107 -18.080 0.941 1.552 709 HB3 GLN 107 2HB GLN 107 -16.400 -0.756 2.385 710 HG3 GLN 107 2HG GLN 107 -17.210 0.286 5.089 711 HE21 GLN 107 1HE2 GLN 107 -17.909 -2.207 4.711 712 HE22 GLN 107 2HE2 GLN 107 -16.767 -3.318 5.379 713 H GLY 108 H GLY 108 -16.537 2.786 4.078 714 HA2 GLY 108 2HA GLY 108 -18.183 4.613 4.814 715 HA3 GLY 108 3HA GLY 108 -19.155 3.249 5.348 716 H SER 109 H SER 109 -16.485 1.887 6.027 717 HA SER 109 HA SER 109 -16.067 3.291 8.586 718 HB3 SER 109 2HB SER 109 -16.679 1.402 9.621 719 HG SER 109 HG SER 109 -17.768 0.007 8.472 720 H SER 110 H SER 110 -14.480 0.812 6.565 721 HA SER 110 HA SER 110 -12.169 2.280 6.024 722 HB3 SER 110 2HB SER 110 -11.422 2.289 8.222 723 HG SER 110 HG SER 110 -12.584 -0.285 8.437 724 H LYS 111 H LYS 111 -13.246 0.996 4.197 725 HA LYS 111 HA LYS 111 -12.841 -1.797 4.006 726 HB3 LYS 111 2HB LYS 111 -13.013 0.122 1.684 727 HG3 LYS 111 2HG LYS 111 -12.607 -2.212 1.079 728 HD3 LYS 111 2HD LYS 111 -14.686 -2.660 3.082 729 HE3 LYS 111 2HE LYS 111 -14.814 -4.573 0.819 730 HZ1 LYS 111 3HZ LYS 111 -16.065 -4.391 3.181 731 HZ2 LYS 111 1HZ LYS 111 -16.673 -5.235 1.847 732 HZ3 LYS 111 2HZ LYS 111 -17.202 -3.660 2.165 733 H VAL 112 H VAL 112 -11.153 -2.987 3.307 734 HA VAL 112 HA VAL 112 -8.587 -1.698 3.075 735 HB VAL 112 HB VAL 112 -7.641 -3.907 2.993 736 HG11 VAL 112 1HG1 VAL 112 -9.809 -4.457 4.917 737 HG12 VAL 112 2HG1 VAL 112 -8.059 -4.423 5.152 738 HG13 VAL 112 3HG1 VAL 112 -8.974 -2.915 5.110 739 HG21 VAL 112 3HG2 VAL 112 -8.688 -5.544 1.914 740 HG22 VAL 112 1HG2 VAL 112 -9.857 -5.630 3.232 741 HG23 VAL 112 2HG2 VAL 112 -10.170 -4.592 1.842 742 H PHE 113 H PHE 113 -7.066 -2.550 1.301 743 HA PHE 113 HA PHE 113 -8.347 -1.983 -1.253 744 HB3 PHE 113 2HB PHE 113 -5.705 -2.273 -1.845 745 HD1 PHE 113 2HD PHE 113 -7.852 0.080 0.075 746 HD2 PHE 113 1HD PHE 113 -5.031 -0.434 -3.070 747 HE1 PHE 113 2HE PHE 113 -8.169 2.427 -0.587 748 HE2 PHE 113 1HE PHE 113 -5.343 1.914 -3.738 749 HZ PHE 113 HZ PHE 113 -6.914 3.348 -2.497 750 H GLN 114 H GLN 114 -9.324 -3.775 -2.032 751 HA GLN 114 HA GLN 114 -7.865 -6.312 -2.016 752 HB3 GLN 114 2HB GLN 114 -10.184 -6.342 -1.217 753 HG3 GLN 114 2HG GLN 114 -10.895 -4.507 -2.921 754 HE21 GLN 114 1HE2 GLN 114 -11.070 -4.084 -4.991 755 HE22 GLN 114 2HE2 GLN 114 -11.354 -5.231 -6.251 756 H GLY 115 H GLY 115 -7.513 -7.520 -3.912 757 HA2 GLY 115 2HA GLY 115 -8.190 -7.314 -6.444 758 HA3 GLY 115 3HA GLY 115 -7.238 -5.845 -6.297 759 H ASN 116 H ASN 116 -7.072 -8.855 -7.423 760 HA ASN 116 HA ASN 116 -4.447 -9.579 -6.438 761 HB3 ASN 116 2HB ASN 116 -4.770 -11.366 -8.344 762 HD21 ASN 116 1HD2 ASN 116 -7.116 -12.847 -7.554 763 HD22 ASN 116 2HD2 ASN 116 -6.854 -13.357 -5.924 764 H LEU 117 H LEU 117 -5.816 -8.895 -9.663 765 HA LEU 117 HA LEU 117 -4.920 -7.943 -11.523 766 HB3 LEU 117 2HB LEU 117 -3.351 -6.205 -11.289 767 HG LEU 117 HG LEU 117 -4.993 -6.392 -8.786 768 HD11 LEU 117 1HD1 LEU 117 -4.161 -3.808 -8.832 769 HD12 LEU 117 2HD1 LEU 117 -2.691 -4.654 -9.313 770 HD13 LEU 117 3HD1 LEU 117 -3.484 -5.064 -7.793 771 HD21 LEU 117 3HD2 LEU 117 -5.125 -4.967 -11.395 772 HD22 LEU 117 1HD2 LEU 117 -5.824 -4.195 -9.970 773 HD23 LEU 117 2HD2 LEU 117 -6.399 -5.780 -10.485 774 H ASP 118 H ASP 118 -3.862 -10.538 -10.227 775 HA ASP 118 HA ASP 118 -2.301 -12.143 -10.658 776 HB3 ASP 118 2HB ASP 118 -1.826 -12.527 -12.943 777 H ASN 119 H ASN 119 0.021 -12.253 -12.084 778 HA ASN 119 HA ASN 119 1.699 -10.317 -10.643 779 HB3 ASN 119 2HB ASN 119 1.868 -12.967 -10.464 780 HD21 ASN 119 1HD2 ASN 119 1.251 -13.479 -12.844 781 HD22 ASN 119 2HD2 ASN 119 2.560 -14.036 -13.826 782 H ASN 120 H ASN 120 0.840 -11.496 -13.785 783 HA ASN 120 HA ASN 120 3.012 -9.996 -15.048 784 HB3 ASN 120 2HB ASN 120 1.110 -11.374 -16.808 785 HD21 ASN 120 1HD2 ASN 120 4.335 -12.046 -15.496 786 HD22 ASN 120 2HD2 ASN 120 5.173 -11.849 -16.994 787 H SER 121 H SER 121 0.493 -8.901 -13.726 788 HA SER 121 HA SER 121 -0.207 -7.095 -15.925 789 HB3 SER 121 2HB SER 121 -1.988 -9.005 -14.676 790 HG SER 121 HG SER 121 -2.760 -7.466 -13.341 791 H HIS 122 H HIS 122 0.476 -5.175 -15.255 792 HA HIS 122 HA HIS 122 0.576 -4.508 -12.442 793 HB3 HIS 122 2HB HIS 122 2.329 -3.867 -14.197 794 HD1 HIS 122 1HD HIS 122 -0.067 -3.637 -16.181 795 HD2 HIS 122 2HD HIS 122 2.130 -0.434 -14.707 796 HE1 HIS 122 1HE HIS 122 -0.360 -1.790 -17.862 797 H LYS 123 H LYS 123 -0.478 -2.725 -11.477 798 HA LYS 123 HA LYS 123 -2.764 -1.622 -12.951 799 HB3 LYS 123 2HB LYS 123 -2.984 -2.600 -10.105 800 HG3 LYS 123 2HG LYS 123 -5.461 -2.703 -11.320 801 HD3 LYS 123 2HD LYS 123 -4.800 -0.228 -9.853 802 HE3 LYS 123 2HE LYS 123 -7.028 -1.866 -10.263 803 HZ1 LYS 123 3HZ LYS 123 -5.909 -3.008 -8.179 804 HZ2 LYS 123 1HZ LYS 123 -7.587 -2.837 -8.311 805 HZ3 LYS 123 2HZ LYS 123 -6.698 -1.752 -7.366 806 H LYS 124 H LYS 124 -2.621 0.512 -12.916 807 HA LYS 124 HA LYS 124 -1.405 1.806 -10.564 808 HB3 LYS 124 2HB LYS 124 -0.092 2.114 -12.609 809 HG3 LYS 124 2HG LYS 124 -2.393 3.664 -13.758 810 HD3 LYS 124 2HD LYS 124 -0.296 2.532 -15.468 811 HE3 LYS 124 2HE LYS 124 -0.366 5.202 -15.924 812 HZ1 LYS 124 3HZ LYS 124 -1.316 2.938 -17.165 813 HZ2 LYS 124 1HZ LYS 124 -1.173 4.482 -17.842 814 HZ3 LYS 124 2HZ LYS 124 -2.634 4.000 -17.138 815 H ASN 125 H ASN 125 -2.260 3.904 -9.962 816 HA ASN 125 HA ASN 125 -5.092 4.232 -10.710 817 HB3 ASN 125 2HB ASN 125 -5.519 5.022 -8.418 818 HD21 ASN 125 1HD2 ASN 125 -6.675 3.558 -7.392 819 HD22 ASN 125 2HD2 ASN 125 -6.354 1.860 -7.349 820 H ILE 126 H ILE 126 -5.731 6.207 -11.348 821 HA ILE 126 HA ILE 126 -3.808 8.195 -11.948 822 HB ILE 126 HB ILE 126 -6.200 7.692 -12.976 823 HG13 ILE 126 2HG1 ILE 126 -4.273 9.713 -13.219 824 HG21 ILE 126 1HG2 ILE 126 -7.179 8.499 -10.711 825 HG22 ILE 126 2HG2 ILE 126 -6.892 10.111 -11.364 826 HG23 ILE 126 3HG2 ILE 126 -7.955 8.991 -12.216 827 HD11 ILE 126 3HD1 ILE 126 -5.786 10.216 -15.356 828 HD12 ILE 126 1HD1 ILE 126 -4.719 8.817 -15.237 829 HD13 ILE 126 2HD1 ILE 126 -6.443 8.643 -14.904 830 H PHE 127 H PHE 127 -4.536 10.603 -11.340 831 HA PHE 127 HA PHE 127 -4.028 10.822 -8.526 832 HB3 PHE 127 2HB PHE 127 -2.937 12.446 -9.833 833 HD1 PHE 127 2HD PHE 127 -6.205 14.035 -10.331 834 HD2 PHE 127 1HD PHE 127 -2.901 12.112 -12.201 835 HE1 PHE 127 2HE PHE 127 -7.011 14.794 -12.528 836 HE2 PHE 127 1HE PHE 127 -3.700 12.868 -14.400 837 HZ PHE 127 HZ PHE 127 -5.759 14.210 -14.567 838 H GLU 128 H GLU 128 -6.310 9.509 -8.545 839 HA GLU 128 HA GLU 128 -8.693 10.979 -8.689 840 HB3 GLU 128 2HB GLU 128 -8.393 8.773 -6.695 841 HG3 GLU 128 2HG GLU 128 -10.435 9.104 -8.870 842 H LYS 129 H LYS 129 -6.204 10.910 -6.310 843 HA LYS 129 HA LYS 129 -7.298 13.108 -4.896 844 HB3 LYS 129 2HB LYS 129 -7.190 11.483 -2.698 845 HG3 LYS 129 2HG LYS 129 -9.815 11.594 -4.063 846 HD3 LYS 129 2HD LYS 129 -8.707 12.049 -1.320 847 HE3 LYS 129 2HE LYS 129 -11.511 12.479 -1.323 848 HZ1 LYS 129 3HZ LYS 129 -9.467 13.350 0.097 849 HZ2 LYS 129 1HZ LYS 129 -10.961 14.143 0.081 850 HZ3 LYS 129 2HZ LYS 129 -9.691 14.712 -0.881 851 HA PRO 130 HA PRO 130 -2.723 12.479 -4.616 852 HB3 PRO 130 2HB PRO 130 -2.388 13.762 -6.492 853 HG3 PRO 130 2HG PRO 130 -3.972 15.319 -7.179 854 HD3 PRO 130 2HD PRO 130 -5.326 13.475 -6.899 855 H PHE 131 H PHE 131 -1.195 13.504 -3.173 856 HA PHE 131 HA PHE 131 -1.714 15.627 -1.467 857 HB3 PHE 131 2HB PHE 131 -2.014 13.663 0.520 858 HD1 PHE 131 2HD PHE 131 -1.992 16.468 0.704 859 HD2 PHE 131 1HD PHE 131 -5.275 13.926 -0.232 860 HE1 PHE 131 2HE PHE 131 -3.552 18.183 1.531 861 HE2 PHE 131 1HE PHE 131 -6.839 15.637 0.592 862 HZ PHE 131 HZ PHE 131 -5.979 17.769 1.476 863 H MET 132 H MET 132 -0.195 15.741 0.362 864 HA MET 132 HA MET 132 2.357 14.715 -0.388 865 HB3 MET 132 2HB MET 132 2.151 16.915 0.634 866 HG3 MET 132 2HG MET 132 1.770 15.932 3.364 867 HE1 MET 132 3HE MET 132 0.340 18.036 0.452 868 HE2 MET 132 1HE MET 132 -1.047 18.062 1.542 869 HE3 MET 132 2HE MET 132 -0.140 19.543 1.234 870 H ALA 133 H ALA 133 3.681 13.253 0.706 871 HA ALA 133 HA ALA 133 2.531 11.728 2.913 872 HB1 ALA 133 1HB ALA 133 3.633 10.228 0.564 873 HB2 ALA 133 2HB ALA 133 2.623 9.639 1.886 874 HB3 ALA 133 3HB ALA 133 1.930 10.682 0.644 875 H ARG 134 H ARG 134 4.048 10.693 4.209 876 HA ARG 134 HA ARG 134 6.868 11.227 3.545 877 HB3 ARG 134 2HB ARG 134 5.864 11.173 6.373 878 HG3 ARG 134 2HG ARG 134 7.820 13.146 5.953 879 HD3 ARG 134 2HD ARG 134 7.325 11.570 7.924 880 HE ARG 134 HE ARG 134 8.404 9.642 6.212 881 HH11 ARG 134 1HH1 ARG 134 8.769 10.783 9.480 882 HH12 ARG 134 2HH1 ARG 134 9.286 9.248 10.096 883 HH21 ARG 134 1HH2 ARG 134 9.083 7.616 7.010 884 HH22 ARG 134 2HH2 ARG 134 9.465 7.448 8.690 885 H TYR 135 H TYR 135 4.507 9.051 4.878 886 HA TYR 135 HA TYR 135 6.250 6.809 4.500 887 HB3 TYR 135 2HB TYR 135 5.582 7.747 7.283 888 HD1 TYR 135 1HD TYR 135 4.008 6.019 7.988 889 HD2 TYR 135 2HD TYR 135 7.852 5.001 6.474 890 HE1 TYR 135 1HE TYR 135 3.751 3.742 8.884 891 HE2 TYR 135 2HE TYR 135 7.606 2.722 7.365 892 HH TYR 135 HH TYR 135 6.219 1.649 9.318 893 H VAL 136 H VAL 136 5.066 5.094 3.944 894 HA VAL 136 HA VAL 136 2.204 5.099 4.657 895 HB VAL 136 HB VAL 136 1.649 4.122 2.578 896 HG11 VAL 136 1HG1 VAL 136 3.734 6.252 2.119 897 HG12 VAL 136 2HG1 VAL 136 2.542 5.730 0.927 898 HG13 VAL 136 3HG1 VAL 136 2.016 6.505 2.422 899 HG21 VAL 136 3HG2 VAL 136 3.059 2.543 1.845 900 HG22 VAL 136 1HG2 VAL 136 3.874 3.863 1.007 901 HG23 VAL 136 2HG2 VAL 136 4.460 3.321 2.579 902 H ARG 137 H ARG 137 1.219 3.107 5.126 903 HA ARG 137 HA ARG 137 3.075 0.879 5.639 904 HB3 ARG 137 2HB ARG 137 0.700 1.322 7.400 905 HG3 ARG 137 2HG ARG 137 3.458 0.229 7.918 906 HD3 ARG 137 2HD ARG 137 1.092 0.739 9.680 907 HE ARG 137 HE ARG 137 2.556 -1.664 9.767 908 HH11 ARG 137 1HH1 ARG 137 1.435 0.894 11.845 909 HH12 ARG 137 2HH1 ARG 137 1.351 -0.110 13.255 910 HH21 ARG 137 1HH2 ARG 137 2.449 -2.997 11.616 911 HH22 ARG 137 2HH2 ARG 137 1.929 -2.323 13.122 912 H VAL 138 H VAL 138 2.380 -1.142 5.115 913 HA VAL 138 HA VAL 138 -0.382 -1.425 4.138 914 HB VAL 138 HB VAL 138 2.025 -2.638 2.777 915 HG11 VAL 138 1HG1 VAL 138 -0.919 -2.617 2.163 916 HG12 VAL 138 2HG1 VAL 138 0.305 -3.014 0.955 917 HG13 VAL 138 3HG1 VAL 138 0.138 -4.007 2.404 918 HG21 VAL 138 3HG2 VAL 138 2.337 -0.690 1.753 919 HG22 VAL 138 1HG2 VAL 138 0.719 -0.828 1.067 920 HG23 VAL 138 2HG2 VAL 138 0.959 0.016 2.597 921 H LEU 139 H LEU 139 -1.409 -3.255 4.732 922 HA LEU 139 HA LEU 139 0.168 -5.436 5.903 923 HB3 LEU 139 2HB LEU 139 -2.367 -4.368 7.130 924 HG LEU 139 HG LEU 139 -0.704 -6.670 7.773 925 HD11 LEU 139 1HD1 LEU 139 -0.834 -6.297 10.230 926 HD12 LEU 139 2HD1 LEU 139 -1.252 -4.615 9.906 927 HD13 LEU 139 3HD1 LEU 139 0.316 -5.246 9.402 928 HD21 LEU 139 3HD2 LEU 139 -3.384 -6.024 7.627 929 HD22 LEU 139 1HD2 LEU 139 -3.090 -6.194 9.358 930 HD23 LEU 139 2HD2 LEU 139 -2.703 -7.522 8.265 931 HA PRO 140 HA PRO 140 -2.645 -7.319 2.882 932 HB3 PRO 140 2HB PRO 140 -0.794 -8.023 1.716 933 HG3 PRO 140 2HG PRO 140 1.243 -8.352 2.787 934 HD3 PRO 140 2HD PRO 140 0.725 -6.244 3.563 935 H VAL 141 H VAL 141 -4.223 -8.825 3.168 936 HA VAL 141 HA VAL 141 -4.082 -10.472 5.610 937 HB VAL 141 HB VAL 141 -6.578 -9.293 4.384 938 HG11 VAL 141 1HG1 VAL 141 -6.081 -10.972 6.828 939 HG12 VAL 141 2HG1 VAL 141 -7.550 -10.018 6.610 940 HG13 VAL 141 3HG1 VAL 141 -7.156 -11.307 5.472 941 HG21 VAL 141 3HG2 VAL 141 -5.331 -7.501 5.340 942 HG22 VAL 141 1HG2 VAL 141 -6.610 -7.914 6.482 943 HG23 VAL 141 2HG2 VAL 141 -4.955 -8.448 6.779 944 H SER 142 H SER 142 -5.620 -10.230 2.408 945 HA SER 142 HA SER 142 -5.707 -13.173 2.324 946 HB3 SER 142 2HB SER 142 -7.675 -13.092 1.095 947 HG SER 142 HG SER 142 -9.014 -11.611 2.126 948 H TRP 143 H TRP 143 -4.078 -13.962 1.173 949 HA TRP 143 HA TRP 143 -3.263 -12.528 -1.270 950 HB3 TRP 143 2HB TRP 143 -1.462 -12.516 0.341 951 HD1 TRP 143 HD TRP 143 -0.832 -16.199 -0.387 952 HE1 TRP 143 1HE TRP 143 -0.671 -17.474 1.843 953 HE3 TRP 143 3HE TRP 143 -2.315 -12.474 2.786 954 HZ2 TRP 143 2HZ TRP 143 -1.114 -16.967 4.585 955 HZ3 TRP 143 3HZ TRP 143 -2.420 -12.952 5.197 956 HH2 TRP 143 HH TRP 143 -1.832 -15.153 6.076 957 H HIS 144 H HIS 144 -2.120 -14.094 -2.853 958 HA HIS 144 HA HIS 144 -3.602 -16.635 -2.965 959 HB3 HIS 144 2HB HIS 144 -3.008 -15.646 -5.606 960 HD1 HIS 144 1HD HIS 144 -6.356 -14.982 -4.117 961 HD2 HIS 144 2HD HIS 144 -4.409 -18.022 -6.172 962 HE1 HIS 144 1HE HIS 144 -8.164 -16.581 -4.824 963 H ASN 145 H ASN 145 -2.305 -18.337 -3.087 964 HA ASN 145 HA ASN 145 -0.554 -19.689 -3.655 965 HB3 ASN 145 2HB ASN 145 0.798 -19.202 -5.506 966 HD21 ASN 145 1HD2 ASN 145 -1.335 -20.237 -6.031 967 HD22 ASN 145 2HD2 ASN 145 -2.379 -19.373 -7.102 968 H ARG 146 H ARG 146 0.783 -16.384 -3.454 969 HA ARG 146 HA ARG 146 2.016 -16.883 -0.926 970 HB3 ARG 146 2HB ARG 146 4.217 -16.217 -2.654 971 HG3 ARG 146 2HG ARG 146 4.782 -18.700 -1.710 972 HD3 ARG 146 2HD ARG 146 5.171 -16.862 0.430 973 HE ARG 146 HE ARG 146 7.073 -18.084 0.039 974 HH11 ARG 146 1HH1 ARG 146 6.141 -16.422 -2.874 975 HH12 ARG 146 2HH1 ARG 146 7.603 -16.810 -3.719 976 HH21 ARG 146 1HH2 ARG 146 9.004 -18.601 -1.063 977 HH22 ARG 146 2HH2 ARG 146 9.230 -18.050 -2.688 978 H ILE 147 H ILE 147 2.829 -15.009 0.028 979 HA ILE 147 HA ILE 147 1.751 -12.569 -0.963 980 HB ILE 147 HB ILE 147 3.695 -13.029 1.304 981 HG13 ILE 147 2HG1 ILE 147 0.734 -13.169 1.049 982 HG21 ILE 147 1HG2 ILE 147 2.304 -10.749 1.885 983 HG22 ILE 147 2HG2 ILE 147 3.932 -10.806 1.210 984 HG23 ILE 147 3HG2 ILE 147 2.541 -10.609 0.143 985 HD11 ILE 147 3HD1 ILE 147 1.061 -15.169 1.915 986 HD12 ILE 147 1HD1 ILE 147 2.793 -14.852 2.008 987 HD13 ILE 147 2HD1 ILE 147 1.747 -14.440 3.366 988 H THR 148 H THR 148 2.825 -12.533 -3.058 989 HA THR 148 HA THR 148 5.481 -11.279 -2.868 990 HB THR 148 HB THR 148 4.927 -12.780 -5.354 991 HG1 THR 148 1HG THR 148 4.243 -14.357 -3.937 992 HG21 THR 148 3HG2 THR 148 7.413 -13.394 -4.103 993 HG22 THR 148 1HG2 THR 148 7.140 -11.657 -3.980 994 HG23 THR 148 2HG2 THR 148 7.119 -12.443 -5.558 995 H LEU 149 H LEU 149 4.806 -9.199 -3.162 996 HA LEU 149 HA LEU 149 3.866 -8.521 -5.832 997 HB3 LEU 149 2HB LEU 149 2.500 -7.045 -3.675 998 HG LEU 149 HG LEU 149 2.075 -7.001 -6.302 999 HD11 LEU 149 1HD1 LEU 149 1.337 -9.558 -5.835 1000 HD12 LEU 149 2HD1 LEU 149 0.703 -8.566 -7.149 1001 HD13 LEU 149 3HD1 LEU 149 -0.210 -8.731 -5.649 1002 HD21 LEU 149 3HD2 LEU 149 0.990 -5.471 -4.873 1003 HD22 LEU 149 1HD2 LEU 149 0.074 -6.748 -4.071 1004 HD23 LEU 149 2HD2 LEU 149 -0.298 -6.310 -5.738 1005 H ARG 150 H ARG 150 3.607 -5.923 -5.802 1006 HA ARG 150 HA ARG 150 5.733 -4.699 -4.229 1007 HB3 ARG 150 2HB ARG 150 6.776 -5.583 -6.332 1008 HG3 ARG 150 2HG ARG 150 4.579 -4.682 -7.642 1009 HD3 ARG 150 2HD ARG 150 6.508 -2.486 -7.503 1010 HE ARG 150 HE ARG 150 6.364 -3.653 -9.994 1011 HH11 ARG 150 1HH1 ARG 150 5.539 -0.580 -8.584 1012 HH12 ARG 150 2HH1 ARG 150 5.811 0.311 -10.045 1013 HH21 ARG 150 1HH2 ARG 150 6.725 -2.492 -11.924 1014 HH22 ARG 150 2HH2 ARG 150 6.485 -0.778 -11.944 1015 H LEU 151 H LEU 151 5.135 -2.745 -3.559 1016 HA LEU 151 HA LEU 151 2.920 -1.414 -4.969 1017 HB3 LEU 151 2HB LEU 151 2.276 -2.047 -2.754 1018 HG LEU 151 HG LEU 151 4.815 -1.809 -1.879 1019 HD11 LEU 151 1HD1 LEU 151 4.080 0.221 -0.112 1020 HD12 LEU 151 2HD1 LEU 151 3.693 0.837 -1.718 1021 HD13 LEU 151 3HD1 LEU 151 5.329 0.285 -1.356 1022 HD21 LEU 151 3HD2 LEU 151 3.699 -1.780 0.457 1023 HD22 LEU 151 1HD2 LEU 151 3.354 -3.114 -0.643 1024 HD23 LEU 151 2HD2 LEU 151 2.186 -1.807 -0.449 1025 H GLU 152 H GLU 152 3.315 0.475 -5.913 1026 HA GLU 152 HA GLU 152 5.586 2.085 -4.969 1027 HB3 GLU 152 2HB GLU 152 5.764 2.679 -7.538 1028 HG3 GLU 152 2HG GLU 152 7.230 0.528 -7.817 1029 H LEU 153 H LEU 153 5.327 4.295 -5.068 1030 HA LEU 153 HA LEU 153 2.622 5.218 -5.779 1031 HB3 LEU 153 2HB LEU 153 3.094 5.416 -3.412 1032 HG LEU 153 HG LEU 153 5.683 5.906 -3.881 1033 HD11 LEU 153 1HD1 LEU 153 5.164 8.589 -2.941 1034 HD12 LEU 153 2HD1 LEU 153 4.528 8.334 -4.565 1035 HD13 LEU 153 3HD1 LEU 153 6.233 8.030 -4.229 1036 HD21 LEU 153 3HD2 LEU 153 3.899 6.578 -1.585 1037 HD22 LEU 153 1HD2 LEU 153 5.609 7.003 -1.510 1038 HD23 LEU 153 2HD2 LEU 153 5.127 5.320 -1.727 1039 H LEU 154 H LEU 154 2.367 6.945 -7.114 1040 HA LEU 154 HA LEU 154 4.820 8.023 -8.332 1041 HB3 LEU 154 2HB LEU 154 3.695 8.256 -10.347 1042 HG LEU 154 HG LEU 154 2.490 5.799 -9.087 1043 HD11 LEU 154 1HD1 LEU 154 1.054 6.608 -10.906 1044 HD12 LEU 154 2HD1 LEU 154 1.861 5.095 -11.319 1045 HD13 LEU 154 3HD1 LEU 154 2.447 6.618 -11.988 1046 HD21 LEU 154 3HD2 LEU 154 4.202 5.003 -11.041 1047 HD22 LEU 154 1HD2 LEU 154 4.622 5.145 -9.334 1048 HD23 LEU 154 2HD2 LEU 154 5.002 6.459 -10.447 1049 H GLY 155 H GLY 155 5.002 10.245 -8.736 1050 HA2 GLY 155 2HA GLY 155 2.997 11.943 -7.390 1051 HA3 GLY 155 3HA GLY 155 4.716 12.166 -7.097 1052 H CYS 156 H CYS 156 3.573 14.361 -7.875 1053 HA CYS 156 HA CYS 156 3.860 14.552 -10.794 1054 HB3 CYS 156 2HB CYS 156 2.838 16.856 -9.225 1055 H LEU 157 H LEU 157 5.355 15.374 -7.837 1056 HA LEU 157 HA LEU 157 7.273 16.483 -7.325 1057 HB3 LEU 157 2HB LEU 157 8.346 17.150 -9.855 1058 HG LEU 157 HG LEU 157 10.032 15.514 -9.467 1059 HD11 LEU 157 1HD1 LEU 157 9.394 16.260 -6.661 1060 HD12 LEU 157 2HD1 LEU 157 9.647 17.548 -7.838 1061 HD13 LEU 157 3HD1 LEU 157 10.919 16.363 -7.542 1062 HD21 LEU 157 3HD2 LEU 157 9.859 13.764 -7.824 1063 HD22 LEU 157 1HD2 LEU 157 8.488 13.651 -8.928 1064 HD23 LEU 157 2HD2 LEU 157 8.270 14.340 -7.319 1065 H GLU 158 H GLU 158 4.719 17.891 -8.121 1066 HA GLU 158 HA GLU 158 5.913 20.564 -8.409 1067 HB3 GLU 158 2HB GLU 158 3.307 19.695 -9.667 1068 HG3 GLU 158 2HG GLU 158 4.365 21.935 -10.961 Start of MODEL 2 1 H1 MET -5 H MET -5 19.978 17.874 -23.101 2 HA MET -5 HA MET -5 18.742 15.803 -22.885 3 HB3 MET -5 2HB MET -5 19.153 14.491 -20.748 4 HG3 MET -5 2HG MET -5 21.581 14.641 -22.512 5 HE1 MET -5 3HE MET -5 23.245 11.950 -22.370 6 HE2 MET -5 1HE MET -5 23.293 13.658 -21.932 7 HE3 MET -5 2HE MET -5 23.546 12.424 -20.698 8 H LYS -4 H LYS -4 17.140 17.422 -22.729 9 HA LYS -4 HA LYS -4 16.529 18.410 -20.038 10 HB3 LYS -4 2HB LYS -4 14.775 19.319 -22.185 11 HG3 LYS -4 2HG LYS -4 16.327 20.492 -19.969 12 HD3 LYS -4 2HD LYS -4 15.308 22.480 -21.883 13 HE3 LYS -4 2HE LYS -4 17.877 22.257 -20.317 14 HZ1 LYS -4 3HZ LYS -4 17.748 24.754 -20.596 15 HZ2 LYS -4 1HZ LYS -4 16.630 24.469 -21.833 16 HZ3 LYS -4 2HZ LYS -4 18.205 23.866 -21.961 17 H SER -3 H SER -3 13.984 18.696 -19.801 18 HA SER -3 HA SER -3 12.328 16.663 -20.878 19 HB3 SER -3 2HB SER -3 13.522 15.105 -19.527 20 HG SER -3 HG SER -3 14.605 16.346 -18.076 21 H GLY -2 H GLY -2 10.455 17.702 -20.952 22 HA2 GLY -2 2HA GLY -2 9.741 19.465 -18.694 23 HA3 GLY -2 3HA GLY -2 9.202 19.703 -20.350 24 H HIS -1 H HIS -1 9.257 16.649 -18.582 25 HA HIS -1 HA HIS -1 6.653 15.935 -19.342 26 HB3 HIS -1 2HB HIS -1 7.081 14.440 -17.091 27 HD1 HIS -1 1HD HIS -1 6.306 12.334 -18.104 28 HD2 HIS -1 2HD HIS -1 9.113 14.247 -20.498 29 HE1 HIS -1 1HE HIS -1 6.654 10.815 -20.079 30 H GLY 0 H GLY 0 4.933 15.328 -17.648 31 HA2 GLY 0 2HA GLY 0 4.425 17.748 -16.062 32 HA3 GLY 0 3HA GLY 0 3.210 16.596 -16.597 33 H CYS 1 H CYS 1 2.337 15.550 -14.952 34 HA CYS 1 HA CYS 1 3.881 15.149 -12.508 35 HB3 CYS 1 2HB CYS 1 1.768 14.611 -11.455 36 H SER 2 H SER 2 2.727 12.925 -11.435 37 HA SER 2 HA SER 2 2.863 10.654 -11.366 38 HB3 SER 2 2HB SER 2 2.019 9.459 -13.155 39 HG SER 2 HG SER 2 0.618 10.865 -14.334 40 H GLU 3 H GLU 3 5.161 11.489 -10.799 41 HA GLU 3 HA GLU 3 7.089 10.231 -12.640 42 HB3 GLU 3 2HB GLU 3 8.744 11.784 -11.975 43 HG3 GLU 3 2HG GLU 3 7.756 14.021 -12.275 44 HA PRO 4 HA PRO 4 8.179 7.347 -9.516 45 HB3 PRO 4 2HB PRO 4 9.527 6.344 -11.084 46 HG3 PRO 4 2HG PRO 4 10.710 7.611 -12.635 47 HD3 PRO 4 2HD PRO 4 8.611 8.530 -12.891 48 H LEU 5 H LEU 5 10.281 6.943 -8.006 49 HA LEU 5 HA LEU 5 10.793 9.503 -6.640 50 HB3 LEU 5 2HB LEU 5 9.479 8.438 -5.106 51 HG LEU 5 HG LEU 5 9.063 6.317 -6.208 52 HD11 LEU 5 1HD1 LEU 5 10.961 5.397 -7.033 53 HD12 LEU 5 2HD1 LEU 5 10.896 4.509 -5.512 54 HD13 LEU 5 3HD1 LEU 5 11.944 5.919 -5.665 55 HD21 LEU 5 3HD2 LEU 5 8.325 6.274 -4.001 56 HD22 LEU 5 1HD2 LEU 5 9.964 6.264 -3.350 57 HD23 LEU 5 2HD2 LEU 5 9.316 4.819 -4.128 58 H GLY 6 H GLY 6 12.154 6.846 -8.213 59 HA2 GLY 6 2HA GLY 6 14.808 7.812 -7.809 60 HA3 GLY 6 3HA GLY 6 14.526 6.334 -6.901 61 H LEU 7 H LEU 7 13.374 7.324 -10.112 62 HA LEU 7 HA LEU 7 14.816 5.014 -11.238 63 HB3 LEU 7 2HB LEU 7 12.999 4.507 -12.656 64 HG LEU 7 HG LEU 7 11.722 5.197 -10.009 65 HD11 LEU 7 1HD1 LEU 7 9.819 4.348 -10.774 66 HD12 LEU 7 2HD1 LEU 7 10.641 2.932 -11.428 67 HD13 LEU 7 3HD1 LEU 7 10.521 4.404 -12.392 68 HD21 LEU 7 3HD2 LEU 7 13.421 3.718 -9.462 69 HD22 LEU 7 1HD2 LEU 7 13.293 2.845 -10.990 70 HD23 LEU 7 2HD2 LEU 7 12.054 2.642 -9.751 71 H LYS 8 H LYS 8 14.595 8.291 -11.194 72 HA LYS 8 HA LYS 8 15.422 8.562 -14.008 73 HB3 LYS 8 2HB LYS 8 14.199 10.550 -12.094 74 HG3 LYS 8 2HG LYS 8 15.920 11.090 -14.341 75 HD3 LYS 8 2HD LYS 8 13.091 12.134 -14.472 76 HE3 LYS 8 2HE LYS 8 14.593 12.952 -16.699 77 HZ1 LYS 8 3HZ LYS 8 14.209 15.191 -15.702 78 HZ2 LYS 8 1HZ LYS 8 13.558 14.424 -14.341 79 HZ3 LYS 8 2HZ LYS 8 12.816 14.243 -15.850 80 H ASN 9 H ASN 9 15.981 10.581 -11.137 81 HA ASN 9 HA ASN 9 18.875 10.323 -11.625 82 HB3 ASN 9 2HB ASN 9 18.510 12.781 -10.363 83 HD21 ASN 9 1HD2 ASN 9 17.676 13.542 -13.417 84 HD22 ASN 9 2HD2 ASN 9 19.238 13.592 -14.153 85 H ASN 10 H ASN 10 16.284 10.645 -9.295 86 HA ASN 10 HA ASN 10 17.777 10.895 -6.949 87 HB3 ASN 10 2HB ASN 10 15.719 9.643 -5.938 88 HD21 ASN 10 1HD2 ASN 10 16.013 12.243 -8.315 89 HD22 ASN 10 2HD2 ASN 10 15.286 13.462 -7.330 90 H THR 11 H THR 11 16.875 8.045 -8.812 91 HA THR 11 HA THR 11 17.307 5.805 -8.459 92 HB THR 11 HB THR 11 19.311 6.576 -9.608 93 HG1 THR 11 1HG THR 11 19.679 4.504 -9.224 94 HG21 THR 11 3HG2 THR 11 20.378 7.117 -6.836 95 HG22 THR 11 1HG2 THR 11 20.045 8.313 -8.087 96 HG23 THR 11 2HG2 THR 11 21.345 7.142 -8.311 97 H ILE 12 H ILE 12 16.229 6.806 -6.131 98 HA ILE 12 HA ILE 12 17.677 6.558 -3.789 99 HB ILE 12 HB ILE 12 14.804 5.725 -4.208 100 HG13 ILE 12 2HG1 ILE 12 14.278 8.024 -3.441 101 HG21 ILE 12 1HG2 ILE 12 16.201 6.604 -1.685 102 HG22 ILE 12 2HG2 ILE 12 14.521 6.096 -1.843 103 HG23 ILE 12 3HG2 ILE 12 15.821 4.932 -2.098 104 HD11 ILE 12 3HD1 ILE 12 15.970 9.756 -3.483 105 HD12 ILE 12 1HD1 ILE 12 16.339 8.554 -2.247 106 HD13 ILE 12 2HD1 ILE 12 17.222 8.549 -3.773 107 HA PRO 13 HA PRO 13 18.802 2.284 -3.673 108 HB3 PRO 13 2HB PRO 13 20.542 2.946 -2.327 109 HG3 PRO 13 2HG PRO 13 20.311 4.740 -0.864 110 HD3 PRO 13 2HD PRO 13 19.518 5.704 -2.802 111 H ASP 14 H ASP 14 18.546 0.556 -1.656 112 HA ASP 14 HA ASP 14 15.677 0.166 -1.506 113 HB3 ASP 14 2HB ASP 14 17.107 -1.726 -2.116 114 H SER 15 H SER 15 16.193 2.338 -0.043 115 HA SER 15 HA SER 15 16.125 1.394 2.749 116 HB3 SER 15 2HB SER 15 16.904 4.164 1.813 117 HG SER 15 HG SER 15 17.969 3.627 4.107 118 H GLN 16 H GLN 16 14.459 3.027 0.244 119 HA GLN 16 HA GLN 16 12.688 4.587 1.816 120 HB3 GLN 16 2HB GLN 16 12.979 5.108 -0.517 121 HG3 GLN 16 2HG GLN 16 11.448 2.796 -1.511 122 HE21 GLN 16 1HE2 GLN 16 11.632 5.358 -2.482 123 HE22 GLN 16 2HE2 GLN 16 12.595 5.362 -3.916 124 H MET 17 H MET 17 12.413 1.360 0.360 125 HA MET 17 HA MET 17 9.879 0.940 1.755 126 HB3 MET 17 2HB MET 17 10.244 -1.370 0.439 127 HG3 MET 17 2HG MET 17 9.191 1.232 -0.578 128 HE1 MET 17 3HE MET 17 8.967 -2.468 -1.158 129 HE2 MET 17 1HE MET 17 7.539 -2.153 -2.144 130 HE3 MET 17 2HE MET 17 9.033 -2.698 -2.907 131 H SER 18 H SER 18 9.582 -0.559 3.352 132 HA SER 18 HA SER 18 11.629 -2.444 4.071 133 HB3 SER 18 2HB SER 18 12.612 -0.505 5.123 134 HG SER 18 HG SER 18 10.797 0.140 6.946 135 H ALA 19 H ALA 19 10.619 -4.200 4.769 136 HA ALA 19 HA ALA 19 7.978 -3.889 6.043 137 HB1 ALA 19 1HB ALA 19 8.960 -6.161 4.317 138 HB2 ALA 19 2HB ALA 19 7.387 -6.077 5.110 139 HB3 ALA 19 3HB ALA 19 7.800 -4.919 3.845 140 H SER 20 H SER 20 7.391 -5.879 7.390 141 HA SER 20 HA SER 20 9.041 -6.066 9.587 142 HB3 SER 20 2HB SER 20 6.939 -7.970 8.549 143 HG SER 20 HG SER 20 7.904 -9.294 9.918 144 H SER 21 H SER 21 8.733 -8.431 6.943 145 HA SER 21 HA SER 21 11.512 -9.093 7.072 146 HB3 SER 21 2HB SER 21 11.091 -11.540 7.593 147 HG SER 21 HG SER 21 10.459 -10.724 9.962 148 H SER 22 H SER 22 12.210 -10.141 5.243 149 HA SER 22 HA SER 22 10.167 -10.540 3.171 150 HB3 SER 22 2HB SER 22 12.270 -8.948 2.972 151 HG SER 22 HG SER 22 13.850 -10.291 1.698 152 H TYR 23 H TYR 23 10.482 -12.310 1.642 153 HA TYR 23 HA TYR 23 10.620 -14.792 2.825 154 HB3 TYR 23 2HB TYR 23 11.080 -13.966 -0.041 155 HD1 TYR 23 2HD TYR 23 10.668 -16.921 2.183 156 HD2 TYR 23 1HD TYR 23 11.586 -15.507 -1.724 157 HE1 TYR 23 2HE TYR 23 11.316 -19.198 1.518 158 HE2 TYR 23 1HE TYR 23 12.235 -17.780 -2.400 159 HH TYR 23 HH TYR 23 12.864 -19.853 -1.527 160 H LYS 24 H LYS 24 13.069 -13.796 0.448 161 HA LYS 24 HA LYS 24 15.003 -15.632 1.155 162 HB3 LYS 24 2HB LYS 24 16.584 -13.654 0.301 163 HG3 LYS 24 2HG LYS 24 14.683 -15.338 -1.276 164 HD3 LYS 24 2HD LYS 24 16.141 -14.601 -3.266 165 HE3 LYS 24 2HE LYS 24 13.753 -13.423 -2.107 166 HZ1 LYS 24 3HZ LYS 24 14.676 -11.317 -2.366 167 HZ2 LYS 24 1HZ LYS 24 13.830 -11.553 -3.813 168 HZ3 LYS 24 2HZ LYS 24 15.512 -11.735 -3.777 169 H THR 25 H THR 25 17.063 -15.331 2.259 170 HA THR 25 HA THR 25 18.336 -14.816 4.076 171 HB THR 25 HB THR 25 16.850 -12.237 4.450 172 HG1 THR 25 1HG THR 25 18.958 -12.449 2.585 173 HG21 THR 25 3HG2 THR 25 18.545 -12.466 6.036 174 HG22 THR 25 1HG2 THR 25 19.311 -11.511 4.769 175 HG23 THR 25 2HG2 THR 25 19.643 -13.238 4.893 176 H TRP 26 H TRP 26 16.961 -16.578 5.015 177 HA TRP 26 HA TRP 26 14.732 -16.196 6.598 178 HB3 TRP 26 2HB TRP 26 15.530 -18.218 7.870 179 HD1 TRP 26 HD TRP 26 16.697 -18.405 4.181 180 HE1 TRP 26 1HE TRP 26 15.063 -19.933 2.908 181 HE3 TRP 26 3HE TRP 26 13.334 -19.293 7.926 182 HZ2 TRP 26 2HZ TRP 26 12.664 -21.329 3.424 183 HZ3 TRP 26 3HZ TRP 26 11.397 -20.736 7.455 184 HH2 TRP 26 HH TRP 26 11.071 -21.731 5.249 185 H ASN 27 H ASN 27 14.557 -16.219 8.975 186 HA ASN 27 HA ASN 27 16.418 -14.282 10.125 187 HB3 ASN 27 2HB ASN 27 13.940 -13.881 10.196 188 HD21 ASN 27 1HD2 ASN 27 12.710 -14.241 12.744 189 HD22 ASN 27 2HD2 ASN 27 12.032 -15.829 12.766 190 H LEU 28 H LEU 28 17.046 -17.161 9.791 191 HA LEU 28 HA LEU 28 17.198 -18.069 12.569 192 HB3 LEU 28 2HB LEU 28 18.141 -20.159 11.471 193 HG LEU 28 HG LEU 28 15.321 -19.304 10.879 194 HD11 LEU 28 1HD1 LEU 28 15.336 -20.833 9.236 195 HD12 LEU 28 2HD1 LEU 28 15.277 -21.993 10.564 196 HD13 LEU 28 3HD1 LEU 28 16.821 -21.593 9.812 197 HD21 LEU 28 3HD2 LEU 28 16.669 -20.371 13.129 198 HD22 LEU 28 1HD2 LEU 28 15.591 -21.621 12.507 199 HD23 LEU 28 2HD2 LEU 28 14.948 -20.037 12.938 200 H ARG 29 H ARG 29 18.821 -15.852 11.421 201 HA ARG 29 HA ARG 29 21.243 -16.384 12.708 202 HB3 ARG 29 2HB ARG 29 22.142 -16.108 9.982 203 HG3 ARG 29 2HG ARG 29 22.626 -18.033 12.215 204 HD3 ARG 29 2HD ARG 29 22.565 -19.135 9.859 205 HE ARG 29 HE ARG 29 24.633 -17.253 9.411 206 HH11 ARG 29 1HH1 ARG 29 23.773 -20.579 8.845 207 HH12 ARG 29 2HH1 ARG 29 24.739 -20.720 7.414 208 HH21 ARG 29 1HH2 ARG 29 25.909 -17.427 7.529 209 HH22 ARG 29 2HH2 ARG 29 25.954 -18.927 6.667 210 H ALA 30 H ALA 30 19.591 -14.602 10.166 211 HA ALA 30 HA ALA 30 20.335 -12.098 11.352 212 HB1 ALA 30 1HB ALA 30 21.271 -12.468 8.526 213 HB2 ALA 30 2HB ALA 30 21.680 -11.191 9.672 214 HB3 ALA 30 3HB ALA 30 22.320 -12.818 9.899 215 H PHE 31 H PHE 31 19.536 -10.236 9.866 216 HA PHE 31 HA PHE 31 17.087 -11.084 8.471 217 HB3 PHE 31 2HB PHE 31 16.276 -10.259 10.531 218 HD1 PHE 31 1HD PHE 31 18.066 -10.172 12.212 219 HD2 PHE 31 2HD PHE 31 17.247 -6.884 9.636 220 HE1 PHE 31 1HE PHE 31 19.348 -8.690 13.702 221 HE2 PHE 31 2HE PHE 31 18.528 -5.397 11.121 222 HZ PHE 31 HZ PHE 31 19.581 -6.300 13.156 223 H GLY 32 H GLY 32 19.127 -10.762 6.887 224 HA2 GLY 32 2HA GLY 32 19.500 -8.010 6.076 225 HA3 GLY 32 3HA GLY 32 20.196 -9.430 5.309 226 H TRP 33 H TRP 33 17.146 -7.661 5.699 227 HA TRP 33 HA TRP 33 15.861 -8.954 3.510 228 HB3 TRP 33 2HB TRP 33 14.074 -7.416 3.846 229 HD1 TRP 33 HD TRP 33 14.548 -10.019 5.425 230 HE1 TRP 33 1HE TRP 33 13.914 -10.218 7.912 231 HE3 TRP 33 3HE TRP 33 14.507 -5.056 6.652 232 HZ2 TRP 33 2HZ TRP 33 13.456 -8.498 10.102 233 HZ3 TRP 33 3HZ TRP 33 13.960 -4.417 8.965 234 HH2 TRP 33 HH TRP 33 13.446 -6.104 10.653 235 H TYR 34 H TYR 34 15.014 -7.678 1.612 236 HA TYR 34 HA TYR 34 16.712 -5.511 0.701 237 HB3 TYR 34 2HB TYR 34 16.511 -7.841 -1.162 238 HD1 TYR 34 2HD TYR 34 16.481 -5.290 -2.282 239 HD2 TYR 34 1HD TYR 34 19.823 -7.323 -0.607 240 HE1 TYR 34 2HE TYR 34 17.994 -3.931 -3.665 241 HE2 TYR 34 1HE TYR 34 21.345 -5.969 -1.985 242 HH TYR 34 HH TYR 34 20.855 -3.314 -3.200 243 HA PRO 35 HA PRO 35 12.253 -5.436 -0.686 244 HB3 PRO 35 2HB PRO 35 11.542 -4.437 1.257 245 HG3 PRO 35 2HG PRO 35 13.020 -3.256 2.608 246 HD3 PRO 35 2HD PRO 35 14.215 -5.206 2.326 247 H HIS 36 H HIS 36 11.237 -3.206 -1.684 248 HA HIS 36 HA HIS 36 11.246 -1.840 -3.505 249 HB3 HIS 36 2HB HIS 36 14.144 -1.372 -2.777 250 HD1 HIS 36 1HD HIS 36 11.162 0.640 -4.046 251 HD2 HIS 36 2HD HIS 36 15.228 0.126 -4.733 252 HE1 HIS 36 1HE HIS 36 11.744 2.257 -5.882 253 H LEU 37 H LEU 37 11.152 -4.113 -4.534 254 HA LEU 37 HA LEU 37 13.445 -4.457 -6.349 255 HB3 LEU 37 2HB LEU 37 12.231 -6.765 -6.678 256 HG LEU 37 HG LEU 37 14.306 -7.155 -5.824 257 HD11 LEU 37 1HD1 LEU 37 13.635 -5.223 -3.614 258 HD12 LEU 37 2HD1 LEU 37 14.752 -4.976 -4.956 259 HD13 LEU 37 3HD1 LEU 37 15.133 -6.151 -3.698 260 HD21 LEU 37 3HD2 LEU 37 14.120 -8.296 -3.637 261 HD22 LEU 37 1HD2 LEU 37 12.849 -8.759 -4.768 262 HD23 LEU 37 2HD2 LEU 37 12.495 -7.631 -3.459 263 H GLY 38 H GLY 38 10.140 -3.636 -6.132 264 HA2 GLY 38 2HA GLY 38 9.401 -4.384 -8.806 265 HA3 GLY 38 3HA GLY 38 8.475 -3.365 -7.713 266 H ARG 39 H ARG 39 11.470 -2.063 -7.733 267 HA ARG 39 HA ARG 39 10.803 0.297 -8.981 268 HB3 ARG 39 2HB ARG 39 12.829 -0.184 -7.539 269 HG3 ARG 39 2HG ARG 39 14.063 -0.970 -10.171 270 HD3 ARG 39 2HD ARG 39 15.528 -1.322 -7.654 271 HE ARG 39 HE ARG 39 16.249 -1.222 -10.277 272 HH11 ARG 39 1HH1 ARG 39 17.157 0.555 -7.425 273 HH12 ARG 39 2HH1 ARG 39 18.768 0.873 -7.976 274 HH21 ARG 39 1HH2 ARG 39 18.368 -0.810 -11.015 275 HH22 ARG 39 2HH2 ARG 39 19.455 0.097 -10.019 276 H LEU 40 H LEU 40 11.535 1.242 -11.002 277 HA LEU 40 HA LEU 40 10.767 -0.171 -13.249 278 HB3 LEU 40 2HB LEU 40 12.531 2.235 -12.912 279 HG LEU 40 HG LEU 40 13.143 1.291 -15.092 280 HD11 LEU 40 1HD1 LEU 40 10.188 1.466 -15.667 281 HD12 LEU 40 2HD1 LEU 40 11.149 -0.007 -15.543 282 HD13 LEU 40 3HD1 LEU 40 11.445 1.129 -16.859 283 HD21 LEU 40 3HD2 LEU 40 13.010 3.734 -14.757 284 HD22 LEU 40 1HD2 LEU 40 11.347 3.702 -15.346 285 HD23 LEU 40 2HD2 LEU 40 12.673 3.253 -16.421 286 H ASP 41 H ASP 41 14.089 0.514 -12.158 287 HA ASP 41 HA ASP 41 15.214 -1.223 -14.169 288 HB3 ASP 41 2HB ASP 41 17.342 -0.544 -13.354 289 H ASN 42 H ASN 42 13.598 -2.881 -13.028 290 HA ASN 42 HA ASN 42 14.753 -4.205 -10.734 291 HB3 ASN 42 2HB ASN 42 12.357 -4.176 -10.853 292 HD21 ASN 42 1HD2 ASN 42 11.581 -2.985 -12.621 293 HD22 ASN 42 2HD2 ASN 42 11.002 -3.769 -14.048 294 H GLN 43 H GLN 43 16.204 -5.786 -10.792 295 HA GLN 43 HA GLN 43 16.620 -7.209 -13.338 296 HB3 GLN 43 2HB GLN 43 18.570 -5.959 -13.069 297 HG3 GLN 43 2HG GLN 43 19.820 -6.220 -10.753 298 HE21 GLN 43 1HE2 GLN 43 18.083 -4.461 -9.086 299 HE22 GLN 43 2HE2 GLN 43 18.130 -2.922 -9.869 300 H GLY 44 H GLY 44 18.128 -9.269 -12.723 301 HA2 GLY 44 2HA GLY 44 18.321 -11.259 -11.542 302 HA3 GLY 44 3HA GLY 44 17.287 -10.583 -10.292 303 H LYS 45 H LYS 45 15.091 -10.930 -10.357 304 HA LYS 45 HA LYS 45 13.635 -11.877 -12.548 305 HB3 LYS 45 2HB LYS 45 15.043 -13.880 -12.315 306 HG3 LYS 45 2HG LYS 45 14.563 -15.395 -10.358 307 HD3 LYS 45 2HD LYS 45 15.943 -13.002 -9.274 308 HE3 LYS 45 2HE LYS 45 16.676 -15.910 -9.605 309 HZ1 LYS 45 3HZ LYS 45 18.110 -13.777 -8.116 310 HZ2 LYS 45 1HZ LYS 45 18.629 -14.459 -9.577 311 HZ3 LYS 45 2HZ LYS 45 18.538 -15.413 -8.183 312 H ILE 46 H ILE 46 14.066 -11.665 -9.098 313 HA ILE 46 HA ILE 46 11.438 -12.258 -8.287 314 HB ILE 46 HB ILE 46 13.272 -10.311 -6.899 315 HG13 ILE 46 2HG1 ILE 46 13.634 -13.148 -7.428 316 HG21 ILE 46 1HG2 ILE 46 11.930 -10.502 -5.106 317 HG22 ILE 46 2HG2 ILE 46 10.730 -11.015 -6.292 318 HG23 ILE 46 3HG2 ILE 46 11.639 -12.220 -5.378 319 HD11 ILE 46 3HD1 ILE 46 15.331 -11.066 -6.081 320 HD12 ILE 46 1HD1 ILE 46 15.848 -12.724 -6.384 321 HD13 ILE 46 2HD1 ILE 46 15.466 -11.658 -7.737 322 H ASN 47 H ASN 47 13.007 -9.087 -8.754 323 HA ASN 47 HA ASN 47 12.082 -6.987 -8.896 324 HB3 ASN 47 2HB ASN 47 12.006 -7.760 -11.205 325 HD21 ASN 47 1HD2 ASN 47 11.602 -9.535 -12.290 326 HD22 ASN 47 2HD2 ASN 47 10.110 -10.407 -12.304 327 H ALA 48 H ALA 48 10.998 -8.331 -6.713 328 HA ALA 48 HA ALA 48 8.717 -6.799 -6.167 329 HB1 ALA 48 1HB ALA 48 6.933 -8.052 -6.675 330 HB2 ALA 48 2HB ALA 48 8.026 -8.896 -7.772 331 HB3 ALA 48 3HB ALA 48 7.718 -9.547 -6.162 332 H TRP 49 H TRP 49 8.247 -6.807 -4.007 333 HA TRP 49 HA TRP 49 10.088 -8.227 -2.301 334 HB3 TRP 49 2HB TRP 49 7.968 -6.145 -1.845 335 HD1 TRP 49 HD TRP 49 10.687 -6.815 0.716 336 HE1 TRP 49 1HE TRP 49 9.593 -7.461 2.954 337 HE3 TRP 49 3HE TRP 49 5.849 -7.316 -0.859 338 HZ2 TRP 49 2HZ TRP 49 7.021 -8.099 3.924 339 HZ3 TRP 49 3HZ TRP 49 4.133 -7.946 0.788 340 HH2 TRP 49 HH TRP 49 4.708 -8.331 3.129 341 H THR 50 H THR 50 9.703 -10.003 -1.126 342 HA THR 50 HA THR 50 6.964 -11.088 -1.155 343 HB THR 50 HB THR 50 9.283 -12.861 -0.564 344 HG1 THR 50 1HG THR 50 10.075 -12.750 -2.532 345 HG21 THR 50 3HG2 THR 50 7.865 -14.398 -1.997 346 HG22 THR 50 1HG2 THR 50 6.641 -13.129 -1.989 347 HG23 THR 50 2HG2 THR 50 7.142 -13.880 -0.474 348 H ALA 51 H ALA 51 6.437 -12.515 0.721 349 HA ALA 51 HA ALA 51 7.146 -11.143 3.178 350 HB1 ALA 51 1HB ALA 51 5.202 -13.407 2.738 351 HB2 ALA 51 2HB ALA 51 5.355 -12.420 4.193 352 HB3 ALA 51 3HB ALA 51 4.798 -11.691 2.687 353 H GLN 52 H GLN 52 7.649 -12.403 5.145 354 HA GLN 52 HA GLN 52 9.711 -14.364 4.549 355 HB3 GLN 52 2HB GLN 52 8.925 -13.064 7.163 356 HG3 GLN 52 2HG GLN 52 10.384 -15.335 6.949 357 HE21 GLN 52 1HE2 GLN 52 12.042 -15.673 5.591 358 HE22 GLN 52 2HE2 GLN 52 13.538 -14.809 5.632 359 H SER 53 H SER 53 6.982 -14.134 6.836 360 HA SER 53 HA SER 53 7.022 -16.986 7.281 361 HB3 SER 53 2HB SER 53 5.169 -16.566 8.823 362 HG SER 53 HG SER 53 7.302 -16.018 9.519 363 H ASN 54 H ASN 54 5.708 -14.962 4.958 364 HA ASN 54 HA ASN 54 4.252 -15.288 3.240 365 HB3 ASN 54 2HB ASN 54 4.015 -17.436 2.380 366 HD21 ASN 54 1HD2 ASN 54 5.651 -19.285 4.533 367 HD22 ASN 54 2HD2 ASN 54 7.266 -19.020 3.979 368 H SER 55 H SER 55 3.254 -14.496 5.792 369 HA SER 55 HA SER 55 0.512 -15.552 5.597 370 HB3 SER 55 2HB SER 55 0.394 -16.014 7.805 371 HG SER 55 HG SER 55 2.799 -15.947 8.690 372 H ALA 56 H ALA 56 -0.926 -13.959 7.077 373 HA ALA 56 HA ALA 56 -0.706 -11.391 5.753 374 HB1 ALA 56 1HB ALA 56 -2.883 -11.143 7.340 375 HB2 ALA 56 2HB ALA 56 -2.908 -11.845 5.722 376 HB3 ALA 56 3HB ALA 56 -2.818 -12.894 7.138 377 H LYS 57 H LYS 57 0.201 -12.749 8.731 378 HA LYS 57 HA LYS 57 -0.099 -10.567 10.472 379 HB3 LYS 57 2HB LYS 57 2.051 -11.747 11.528 380 HG3 LYS 57 2HG LYS 57 -0.795 -12.331 11.645 381 HD3 LYS 57 2HD LYS 57 0.858 -14.444 12.910 382 HE3 LYS 57 2HE LYS 57 -1.309 -15.666 11.929 383 HZ1 LYS 57 3HZ LYS 57 -1.162 -13.990 14.371 384 HZ2 LYS 57 1HZ LYS 57 -0.856 -15.649 14.240 385 HZ3 LYS 57 2HZ LYS 57 -2.432 -15.062 14.056 386 H GLU 58 H GLU 58 1.994 -11.037 7.823 387 HA GLU 58 HA GLU 58 4.080 -9.274 8.740 388 HB3 GLU 58 2HB GLU 58 4.249 -9.511 5.947 389 HG3 GLU 58 2HG GLU 58 6.167 -9.667 7.406 390 H TRP 59 H TRP 59 4.647 -7.275 7.642 391 HA TRP 59 HA TRP 59 2.575 -5.941 6.119 392 HB3 TRP 59 2HB TRP 59 1.723 -5.382 8.250 393 HD1 TRP 59 HD TRP 59 5.298 -3.951 8.780 394 HE1 TRP 59 1HE TRP 59 6.012 -4.496 11.193 395 HE3 TRP 59 3HE TRP 59 1.195 -6.619 10.259 396 HZ2 TRP 59 2HZ TRP 59 4.974 -5.875 13.426 397 HZ3 TRP 59 3HZ TRP 59 1.135 -7.517 12.548 398 HH2 TRP 59 HH TRP 59 2.985 -7.152 14.097 399 H LEU 60 H LEU 60 3.362 -4.333 4.829 400 HA LEU 60 HA LEU 60 6.246 -3.771 5.061 401 HB3 LEU 60 2HB LEU 60 4.469 -4.123 2.669 402 HG LEU 60 HG LEU 60 6.709 -2.314 2.770 403 HD11 LEU 60 1HD1 LEU 60 7.057 -4.862 1.258 404 HD12 LEU 60 2HD1 LEU 60 8.243 -3.912 2.153 405 HD13 LEU 60 3HD1 LEU 60 7.672 -3.353 0.581 406 HD21 LEU 60 3HD2 LEU 60 5.797 -1.523 0.805 407 HD22 LEU 60 1HD2 LEU 60 4.393 -2.251 1.583 408 HD23 LEU 60 2HD2 LEU 60 5.235 -3.116 0.297 409 H GLN 61 H GLN 61 6.807 -1.731 5.426 410 HA GLN 61 HA GLN 61 4.870 0.392 4.779 411 HB3 GLN 61 2HB GLN 61 4.974 0.094 7.186 412 HG3 GLN 61 2HG GLN 61 7.393 0.988 8.056 413 HE21 GLN 61 1HE2 GLN 61 7.828 -2.205 7.008 414 HE22 GLN 61 2HE2 GLN 61 7.253 -3.005 8.427 415 H VAL 62 H VAL 62 5.753 2.455 4.219 416 HA VAL 62 HA VAL 62 8.516 2.297 3.200 417 HB VAL 62 HB VAL 62 6.193 3.821 2.012 418 HG11 VAL 62 1HG1 VAL 62 8.325 4.994 1.745 419 HG12 VAL 62 2HG1 VAL 62 9.033 3.543 1.033 420 HG13 VAL 62 3HG1 VAL 62 7.723 4.385 0.203 421 HG21 VAL 62 3HG2 VAL 62 6.607 2.247 0.078 422 HG22 VAL 62 1HG2 VAL 62 7.610 1.301 1.178 423 HG23 VAL 62 2HG2 VAL 62 5.895 1.523 1.519 424 H ASP 63 H ASP 63 9.903 3.847 3.801 425 HA ASP 63 HA ASP 63 8.818 6.207 5.191 426 HB3 ASP 63 2HB ASP 63 10.434 6.072 6.851 427 H LEU 64 H LEU 64 9.335 8.091 4.306 428 HA LEU 64 HA LEU 64 11.781 8.264 2.679 429 HB3 LEU 64 2HB LEU 64 10.086 8.195 1.068 430 HG LEU 64 HG LEU 64 8.448 9.886 2.903 431 HD11 LEU 64 1HD1 LEU 64 7.117 9.868 0.457 432 HD12 LEU 64 2HD1 LEU 64 8.765 10.368 0.080 433 HD13 LEU 64 3HD1 LEU 64 7.825 11.260 1.276 434 HD21 LEU 64 3HD2 LEU 64 8.099 7.389 1.290 435 HD22 LEU 64 1HD2 LEU 64 6.698 8.312 1.832 436 HD23 LEU 64 2HD2 LEU 64 7.829 7.654 3.014 437 H GLY 65 H GLY 65 9.398 9.942 4.665 438 HA2 GLY 65 2HA GLY 65 9.523 11.882 5.888 439 HA3 GLY 65 3HA GLY 65 11.230 11.497 6.050 440 H THR 66 H THR 66 9.908 12.000 2.893 441 HA THR 66 HA THR 66 11.410 14.522 2.719 442 HB THR 66 HB THR 66 12.088 12.680 1.175 443 HG1 THR 66 1HG THR 66 10.985 14.789 -0.354 444 HG21 THR 66 3HG2 THR 66 10.053 12.982 -0.786 445 HG22 THR 66 1HG2 THR 66 9.283 12.532 0.734 446 HG23 THR 66 2HG2 THR 66 10.556 11.517 0.056 447 H GLN 67 H GLN 67 8.293 13.356 2.955 448 HA GLN 67 HA GLN 67 6.219 14.211 2.558 449 HB3 GLN 67 2HB GLN 67 7.406 16.955 2.450 450 HG3 GLN 67 2HG GLN 67 4.909 15.720 3.440 451 HE21 GLN 67 1HE2 GLN 67 5.894 15.637 5.686 452 HE22 GLN 67 2HE2 GLN 67 5.659 17.032 6.676 453 H ARG 68 H ARG 68 6.317 13.256 0.392 454 HA ARG 68 HA ARG 68 6.486 15.294 -1.728 455 HB3 ARG 68 2HB ARG 68 6.518 12.979 -3.111 456 HG3 ARG 68 2HG ARG 68 8.981 13.085 -3.143 457 HD3 ARG 68 2HD ARG 68 7.209 15.392 -3.587 458 HE ARG 68 HE ARG 68 9.983 15.870 -2.996 459 HH11 ARG 68 1HH1 ARG 68 7.223 16.905 -4.848 460 HH12 ARG 68 2HH1 ARG 68 7.800 18.528 -5.045 461 HH21 ARG 68 1HH2 ARG 68 10.754 18.001 -3.249 462 HH22 ARG 68 2HH2 ARG 68 9.809 19.149 -4.137 463 H GLN 69 H GLN 69 4.808 15.539 -3.157 464 HA GLN 69 HA GLN 69 2.244 14.546 -2.274 465 HB3 GLN 69 2HB GLN 69 3.179 16.566 -4.267 466 HG3 GLN 69 2HG GLN 69 0.488 15.253 -4.278 467 HE21 GLN 69 1HE2 GLN 69 1.950 17.944 -6.045 468 HE22 GLN 69 2HE2 GLN 69 0.625 19.032 -5.836 469 H VAL 70 H VAL 70 1.444 12.671 -2.923 470 HA VAL 70 HA VAL 70 2.488 11.359 -5.290 471 HB VAL 70 HB VAL 70 1.111 9.446 -4.606 472 HG11 VAL 70 1HG1 VAL 70 2.314 8.879 -2.613 473 HG12 VAL 70 2HG1 VAL 70 3.378 9.837 -3.644 474 HG13 VAL 70 3HG1 VAL 70 2.603 10.579 -2.244 475 HG21 VAL 70 3HG2 VAL 70 -0.172 11.485 -2.959 476 HG22 VAL 70 1HG2 VAL 70 -0.787 9.933 -3.528 477 HG23 VAL 70 2HG2 VAL 70 0.210 10.007 -2.075 478 H THR 71 H THR 71 1.454 11.091 -7.187 479 HA THR 71 HA THR 71 -1.321 12.061 -7.391 480 HB THR 71 HB THR 71 0.419 12.348 -9.776 481 HG1 THR 71 1HG THR 71 1.696 13.803 -8.917 482 HG21 THR 71 3HG2 THR 71 -0.971 14.687 -9.335 483 HG22 THR 71 1HG2 THR 71 -2.047 13.452 -8.681 484 HG23 THR 71 2HG2 THR 71 -1.500 13.349 -10.354 485 H GLY 72 H GLY 72 0.132 9.342 -7.260 486 HA2 GLY 72 2HA GLY 72 -1.621 7.746 -8.561 487 HA3 GLY 72 3HA GLY 72 -0.471 8.155 -9.826 488 H ILE 73 H ILE 73 -1.036 5.547 -8.689 489 HA ILE 73 HA ILE 73 1.704 4.831 -7.996 490 HB ILE 73 HB ILE 73 1.183 3.583 -6.068 491 HG13 ILE 73 2HG1 ILE 73 -1.107 3.247 -5.238 492 HG21 ILE 73 1HG2 ILE 73 1.384 5.926 -5.586 493 HG22 ILE 73 2HG2 ILE 73 -0.313 6.196 -5.977 494 HG23 ILE 73 3HG2 ILE 73 0.124 5.247 -4.557 495 HD11 ILE 73 3HD1 ILE 73 -2.014 5.329 -6.445 496 HD12 ILE 73 1HD1 ILE 73 -2.188 4.256 -7.833 497 HD13 ILE 73 2HD1 ILE 73 -3.038 3.897 -6.330 498 H ILE 74 H ILE 74 2.046 2.453 -8.080 499 HA ILE 74 HA ILE 74 0.072 1.015 -9.691 500 HB ILE 74 HB ILE 74 1.461 1.840 -11.414 501 HG13 ILE 74 2HG1 ILE 74 2.478 -0.918 -10.693 502 HG21 ILE 74 1HG2 ILE 74 3.297 2.690 -10.124 503 HG22 ILE 74 2HG2 ILE 74 3.801 1.059 -9.685 504 HG23 ILE 74 3HG2 ILE 74 3.935 1.604 -11.357 505 HD11 ILE 74 3HD1 ILE 74 0.497 -0.859 -12.764 506 HD12 ILE 74 1HD1 ILE 74 0.529 -1.788 -11.265 507 HD13 ILE 74 2HD1 ILE 74 -0.142 -0.156 -11.278 508 H THR 75 H THR 75 -0.040 -1.129 -9.265 509 HA THR 75 HA THR 75 2.029 -2.284 -7.515 510 HB THR 75 HB THR 75 0.089 -1.798 -6.134 511 HG1 THR 75 1HG THR 75 0.075 -4.589 -6.676 512 HG21 THR 75 3HG2 THR 75 -1.356 -2.594 -8.456 513 HG22 THR 75 1HG2 THR 75 -1.976 -1.894 -6.962 514 HG23 THR 75 2HG2 THR 75 -1.827 -3.644 -7.121 515 H GLN 76 H GLN 76 2.590 -4.398 -7.889 516 HA GLN 76 HA GLN 76 1.089 -5.983 -9.804 517 HB3 GLN 76 2HB GLN 76 3.543 -6.386 -10.863 518 HG3 GLN 76 2HG GLN 76 1.384 -4.483 -11.630 519 HE21 GLN 76 1HE2 GLN 76 3.559 -2.997 -11.426 520 HE22 GLN 76 2HE2 GLN 76 4.260 -2.673 -12.972 521 H GLY 77 H GLY 77 1.580 -8.204 -9.739 522 HA2 GLY 77 2HA GLY 77 2.813 -9.027 -7.233 523 HA3 GLY 77 3HA GLY 77 1.866 -10.041 -8.311 524 H ALA 78 H ALA 78 3.832 -11.415 -7.575 525 HA ALA 78 HA ALA 78 5.829 -11.234 -9.723 526 HB1 ALA 78 1HB ALA 78 6.321 -10.931 -6.911 527 HB2 ALA 78 2HB ALA 78 7.158 -12.358 -7.528 528 HB3 ALA 78 3HB ALA 78 7.440 -10.781 -8.266 529 H ARG 79 H ARG 79 7.059 -13.329 -9.954 530 HA ARG 79 HA ARG 79 5.386 -15.644 -9.251 531 HB3 ARG 79 2HB ARG 79 4.933 -15.031 -11.581 532 HG3 ARG 79 2HG ARG 79 7.744 -15.739 -12.308 533 HD3 ARG 79 2HD ARG 79 5.323 -14.689 -13.645 534 HE ARG 79 HE ARG 79 7.523 -13.112 -13.885 535 HH11 ARG 79 1HH1 ARG 79 5.812 -15.240 -16.044 536 HH12 ARG 79 2HH1 ARG 79 6.213 -14.333 -17.466 537 HH21 ARG 79 1HH2 ARG 79 8.057 -11.910 -15.748 538 HH22 ARG 79 2HH2 ARG 79 7.491 -12.439 -17.296 539 H ASP 80 H ASP 80 6.485 -17.636 -9.054 540 HA ASP 80 HA ASP 80 9.388 -17.342 -8.658 541 HB3 ASP 80 2HB ASP 80 7.474 -19.276 -7.335 542 H PHE 81 H PHE 81 9.119 -17.752 -11.144 543 HA PHE 81 HA PHE 81 9.415 -19.123 -12.940 544 HB3 PHE 81 2HB PHE 81 10.906 -21.075 -12.543 545 HD1 PHE 81 2HD PHE 81 11.488 -18.572 -9.865 546 HD2 PHE 81 1HD PHE 81 12.556 -19.963 -13.744 547 HE1 PHE 81 2HE PHE 81 13.377 -16.997 -9.906 548 HE2 PHE 81 1HE PHE 81 14.447 -18.389 -13.790 549 HZ PHE 81 HZ PHE 81 14.859 -16.903 -11.870 550 H GLY 82 H GLY 82 7.231 -19.581 -13.347 551 HA2 GLY 82 2HA GLY 82 5.810 -21.345 -14.047 552 HA3 GLY 82 3HA GLY 82 6.513 -22.370 -12.805 553 H HIS 83 H HIS 83 6.212 -21.009 -10.522 554 HA HIS 83 HA HIS 83 3.345 -21.113 -10.132 555 HB3 HIS 83 2HB HIS 83 4.625 -20.307 -7.742 556 HD1 HIS 83 1HD HIS 83 1.887 -21.495 -8.425 557 HD2 HIS 83 2HD HIS 83 5.115 -23.739 -7.082 558 HE1 HIS 83 1HE HIS 83 0.889 -23.572 -7.418 559 H ILE 84 H ILE 84 2.082 -19.397 -10.316 560 HA ILE 84 HA ILE 84 3.251 -16.725 -10.226 561 HB ILE 84 HB ILE 84 0.475 -17.621 -11.007 562 HG13 ILE 84 2HG1 ILE 84 2.946 -17.659 -12.410 563 HG21 ILE 84 1HG2 ILE 84 0.227 -15.423 -10.227 564 HG22 ILE 84 2HG2 ILE 84 1.763 -14.912 -10.923 565 HG23 ILE 84 3HG2 ILE 84 0.392 -15.261 -11.976 566 HD11 ILE 84 3HD1 ILE 84 1.547 -19.305 -13.111 567 HD12 ILE 84 1HD1 ILE 84 0.117 -18.273 -13.044 568 HD13 ILE 84 2HD1 ILE 84 1.259 -18.114 -14.379 569 H GLN 85 H GLN 85 3.094 -15.441 -8.513 570 HA GLN 85 HA GLN 85 0.994 -16.003 -6.524 571 HB3 GLN 85 2HB GLN 85 2.498 -15.503 -4.747 572 HG3 GLN 85 2HG GLN 85 3.100 -17.595 -6.538 573 HE21 GLN 85 1HE2 GLN 85 5.493 -17.528 -4.213 574 HE22 GLN 85 2HE2 GLN 85 6.853 -17.247 -5.241 575 H TYR 86 H TYR 86 0.224 -14.182 -5.315 576 HA TYR 86 HA TYR 86 0.995 -11.527 -5.764 577 HB3 TYR 86 2HB TYR 86 0.201 -11.833 -8.033 578 HD1 TYR 86 1HD TYR 86 -0.465 -14.234 -8.388 579 HD2 TYR 86 2HD TYR 86 -3.188 -11.304 -6.935 580 HE1 TYR 86 1HE TYR 86 -2.351 -15.690 -9.002 581 HE2 TYR 86 2HE TYR 86 -5.080 -12.753 -7.543 582 HH TYR 86 HH TYR 86 -4.561 -16.000 -8.856 583 H VAL 87 H VAL 87 -0.063 -10.137 -4.401 584 HA VAL 87 HA VAL 87 -1.854 -11.367 -2.477 585 HB VAL 87 HB VAL 87 -0.842 -8.525 -2.486 586 HG11 VAL 87 1HG1 VAL 87 -2.523 -8.579 -0.916 587 HG12 VAL 87 2HG1 VAL 87 -2.238 -10.272 -0.512 588 HG13 VAL 87 3HG1 VAL 87 -1.128 -9.028 0.064 589 HG21 VAL 87 3HG2 VAL 87 1.040 -10.098 -2.587 590 HG22 VAL 87 1HG2 VAL 87 0.955 -9.276 -1.029 591 HG23 VAL 87 2HG2 VAL 87 0.401 -10.944 -1.178 592 H ALA 88 H ALA 88 -3.924 -10.634 -1.968 593 HA ALA 88 HA ALA 88 -5.212 -9.042 -4.086 594 HB1 ALA 88 1HB ALA 88 -7.322 -10.203 -3.294 595 HB2 ALA 88 2HB ALA 88 -6.138 -11.207 -4.131 596 HB3 ALA 88 3HB ALA 88 -6.267 -11.276 -2.373 597 H SER 89 H SER 89 -6.255 -9.924 -0.808 598 HA SER 89 HA SER 89 -7.214 -7.241 -0.358 599 HB3 SER 89 2HB SER 89 -7.120 -9.269 1.834 600 HG SER 89 HG SER 89 -9.109 -8.361 2.282 601 H TYR 90 H TYR 90 -6.129 -5.646 0.576 602 HA TYR 90 HA TYR 90 -4.213 -6.118 2.668 603 HB3 TYR 90 2HB TYR 90 -2.905 -6.527 0.561 604 HD1 TYR 90 2HD TYR 90 -2.446 -2.899 0.874 605 HD2 TYR 90 1HD TYR 90 -3.835 -6.057 -1.616 606 HE1 TYR 90 2HE TYR 90 -2.518 -1.352 -1.036 607 HE2 TYR 90 1HE TYR 90 -3.908 -4.518 -3.535 608 HH TYR 90 HH TYR 90 -3.457 -2.471 -4.272 609 H LYS 91 H LYS 91 -4.011 -4.378 3.979 610 HA LYS 91 HA LYS 91 -5.603 -2.028 3.294 611 HB3 LYS 91 2HB LYS 91 -4.485 -1.880 5.926 612 HG3 LYS 91 2HG LYS 91 -7.158 -2.699 6.118 613 HD3 LYS 91 2HD LYS 91 -6.173 0.137 5.892 614 HE3 LYS 91 2HE LYS 91 -8.673 -0.857 6.404 615 HZ1 LYS 91 3HZ LYS 91 -8.880 -1.401 8.524 616 HZ2 LYS 91 1HZ LYS 91 -8.337 0.132 8.992 617 HZ3 LYS 91 2HZ LYS 91 -7.231 -1.132 8.792 618 H VAL 92 H VAL 92 -4.541 -0.467 2.261 619 HA VAL 92 HA VAL 92 -1.750 0.087 3.013 620 HB VAL 92 HB VAL 92 -1.954 -0.386 0.668 621 HG11 VAL 92 1HG1 VAL 92 -4.451 0.960 0.933 622 HG12 VAL 92 2HG1 VAL 92 -3.510 1.752 -0.332 623 HG13 VAL 92 3HG1 VAL 92 -3.838 0.022 -0.428 624 HG21 VAL 92 3HG2 VAL 92 -0.421 1.424 1.331 625 HG22 VAL 92 1HG2 VAL 92 -1.064 1.655 -0.295 626 HG23 VAL 92 2HG2 VAL 92 -1.708 2.598 1.050 627 H ALA 93 H ALA 93 -1.485 1.725 4.366 628 HA ALA 93 HA ALA 93 -3.325 4.022 4.176 629 HB1 ALA 93 1HB ALA 93 -3.394 4.246 6.461 630 HB2 ALA 93 2HB ALA 93 -3.293 2.493 6.299 631 HB3 ALA 93 3HB ALA 93 -1.850 3.426 6.697 632 H HIS 94 H HIS 94 -2.470 6.072 4.203 633 HA HIS 94 HA HIS 94 0.470 6.248 4.078 634 HB3 HIS 94 2HB HIS 94 0.060 8.253 2.583 635 HD1 HIS 94 1HD HIS 94 0.861 7.736 0.282 636 HD2 HIS 94 2HD HIS 94 -1.246 4.574 1.963 637 HE1 HIS 94 1HE HIS 94 1.103 5.828 -1.339 638 H SER 95 H SER 95 1.484 7.916 5.140 639 HA SER 95 HA SER 95 -0.230 9.650 6.794 640 HB3 SER 95 2HB SER 95 2.430 8.490 7.654 641 HG SER 95 HG SER 95 0.908 9.182 9.677 642 H ASP 96 H ASP 96 0.025 11.704 6.263 643 HA ASP 96 HA ASP 96 2.423 12.571 4.865 644 HB3 ASP 96 2HB ASP 96 0.117 13.236 4.119 645 H ASP 97 H ASP 97 0.764 13.112 7.922 646 HA ASP 97 HA ASP 97 2.842 14.987 8.770 647 HB3 ASP 97 2HB ASP 97 0.926 14.434 10.832 648 H GLY 98 H GLY 98 2.197 11.698 8.871 649 HA2 GLY 98 2HA GLY 98 3.750 10.143 9.770 650 HA3 GLY 98 3HA GLY 98 4.223 11.345 10.962 651 H VAL 99 H VAL 99 1.398 11.974 11.588 652 HA VAL 99 HA VAL 99 0.927 9.684 13.360 653 HB VAL 99 HB VAL 99 -0.505 11.208 14.661 654 HG11 VAL 99 1HG1 VAL 99 2.177 12.479 14.150 655 HG12 VAL 99 2HG1 VAL 99 1.245 12.483 15.649 656 HG13 VAL 99 3HG1 VAL 99 1.965 10.984 15.060 657 HG21 VAL 99 3HG2 VAL 99 -0.473 13.627 14.133 658 HG22 VAL 99 1HG2 VAL 99 0.346 13.255 12.617 659 HG23 VAL 99 2HG2 VAL 99 -1.290 12.663 12.901 660 H GLN 100 H GLN 100 -0.603 11.670 10.900 661 HA GLN 100 HA GLN 100 -3.194 10.498 11.180 662 HB3 GLN 100 2HB GLN 100 -3.803 11.756 9.250 663 HG3 GLN 100 2HG GLN 100 -1.642 13.408 10.528 664 HE21 GLN 100 1HE2 GLN 100 -4.879 14.371 10.698 665 HE22 GLN 100 2HE2 GLN 100 -4.852 15.548 9.435 666 H TRP 101 H TRP 101 -4.130 8.848 10.061 667 HA TRP 101 HA TRP 101 -2.405 7.369 8.184 668 HB3 TRP 101 2HB TRP 101 -3.176 5.288 9.067 669 HD1 TRP 101 HD TRP 101 -0.719 7.192 9.939 670 HE1 TRP 101 1HE TRP 101 0.274 6.913 12.296 671 HE3 TRP 101 3HE TRP 101 -4.676 4.896 12.220 672 HZ2 TRP 101 2HZ TRP 101 -0.515 5.859 14.793 673 HZ3 TRP 101 3HZ TRP 101 -4.476 4.285 14.596 674 HH2 TRP 101 HH TRP 101 -2.437 4.757 15.853 675 H THR 102 H THR 102 -3.244 7.680 6.225 676 HA THR 102 HA THR 102 -6.159 7.761 5.907 677 HB THR 102 HB THR 102 -3.978 8.531 3.958 678 HG1 THR 102 1HG THR 102 -4.411 10.586 4.561 679 HG21 THR 102 3HG2 THR 102 -5.705 7.986 2.539 680 HG22 THR 102 1HG2 THR 102 -6.100 9.667 2.893 681 HG23 THR 102 2HG2 THR 102 -6.948 8.368 3.730 682 H VAL 103 H VAL 103 -6.854 5.686 5.791 683 HA VAL 103 HA VAL 103 -5.425 3.676 4.305 684 HB VAL 103 HB VAL 103 -7.417 2.246 4.818 685 HG11 VAL 103 1HG1 VAL 103 -7.040 2.372 7.359 686 HG12 VAL 103 2HG1 VAL 103 -5.652 2.023 6.326 687 HG13 VAL 103 3HG1 VAL 103 -5.882 3.646 6.980 688 HG21 VAL 103 3HG2 VAL 103 -9.336 3.115 5.528 689 HG22 VAL 103 1HG2 VAL 103 -8.523 3.963 6.844 690 HG23 VAL 103 2HG2 VAL 103 -8.653 4.717 5.255 691 H TYR 104 H TYR 104 -7.258 6.197 3.331 692 HA TYR 104 HA TYR 104 -8.334 6.749 1.405 693 HB3 TYR 104 2HB TYR 104 -7.850 5.325 -0.607 694 HD1 TYR 104 1HD TYR 104 -4.971 5.097 1.727 695 HD2 TYR 104 2HD TYR 104 -6.786 7.231 -1.476 696 HE1 TYR 104 1HE TYR 104 -2.923 6.434 1.466 697 HE2 TYR 104 2HE TYR 104 -4.742 8.574 -1.746 698 HH TYR 104 HH TYR 104 -2.007 7.936 -0.976 699 H GLU 105 H GLU 105 -9.479 4.757 3.429 700 HA GLU 105 HA GLU 105 -11.243 3.278 3.619 701 HB3 GLU 105 2HB GLU 105 -13.270 4.362 3.207 702 HG3 GLU 105 2HG GLU 105 -11.398 5.848 4.345 703 H GLU 106 H GLU 106 -13.426 3.088 1.655 704 HA GLU 106 HA GLU 106 -12.231 1.885 -0.692 705 HB3 GLU 106 2HB GLU 106 -13.987 0.118 0.985 706 HG3 GLU 106 2HG GLU 106 -12.087 -1.415 -0.277 707 H GLN 107 H GLN 107 -15.159 2.392 1.230 708 HA GLN 107 HA GLN 107 -16.551 3.572 -0.938 709 HB3 GLN 107 2HB GLN 107 -16.797 1.330 -1.764 710 HG3 GLN 107 2HG GLN 107 -17.847 0.621 0.965 711 HE21 GLN 107 1HE2 GLN 107 -16.782 -2.087 -0.049 712 HE22 GLN 107 2HE2 GLN 107 -18.135 -2.747 -0.896 713 H GLY 108 H GLY 108 -16.090 4.593 1.483 714 HA2 GLY 108 2HA GLY 108 -17.221 5.726 3.139 715 HA3 GLY 108 3HA GLY 108 -18.719 5.090 2.475 716 H SER 109 H SER 109 -16.583 2.588 3.084 717 HA SER 109 HA SER 109 -17.817 2.089 5.714 718 HB3 SER 109 2HB SER 109 -16.968 -0.014 3.709 719 HG SER 109 HG SER 109 -18.687 -1.062 5.213 720 H SER 110 H SER 110 -14.963 2.690 4.106 721 HA SER 110 HA SER 110 -12.773 2.648 4.722 722 HB3 SER 110 2HB SER 110 -12.234 2.764 7.010 723 HG SER 110 HG SER 110 -14.017 4.242 6.245 724 H LYS 111 H LYS 111 -13.121 0.623 3.270 725 HA LYS 111 HA LYS 111 -12.492 -1.841 4.728 726 HB3 LYS 111 2HB LYS 111 -12.736 -2.035 1.817 727 HG3 LYS 111 2HG LYS 111 -12.866 -3.970 3.350 728 HD3 LYS 111 2HD LYS 111 -14.460 -2.438 4.907 729 HE3 LYS 111 2HE LYS 111 -16.250 -4.207 3.250 730 HZ1 LYS 111 3HZ LYS 111 -16.621 -3.124 5.963 731 HZ2 LYS 111 1HZ LYS 111 -17.037 -4.646 5.354 732 HZ3 LYS 111 2HZ LYS 111 -17.954 -3.290 4.933 733 H VAL 112 H VAL 112 -11.093 -3.266 2.889 734 HA VAL 112 HA VAL 112 -8.531 -1.843 2.857 735 HB VAL 112 HB VAL 112 -7.467 -3.999 2.652 736 HG11 VAL 112 1HG1 VAL 112 -9.337 -4.867 4.687 737 HG12 VAL 112 2HG1 VAL 112 -7.651 -4.367 4.842 738 HG13 VAL 112 3HG1 VAL 112 -8.936 -3.157 4.850 739 HG21 VAL 112 3HG2 VAL 112 -10.125 -4.820 1.792 740 HG22 VAL 112 1HG2 VAL 112 -8.553 -5.554 1.472 741 HG23 VAL 112 2HG2 VAL 112 -9.412 -5.924 2.967 742 H PHE 113 H PHE 113 -7.052 -2.801 0.987 743 HA PHE 113 HA PHE 113 -8.431 -2.096 -1.487 744 HB3 PHE 113 2HB PHE 113 -5.795 -2.451 -2.167 745 HD1 PHE 113 1HD PHE 113 -7.835 -0.022 -0.217 746 HD2 PHE 113 2HD PHE 113 -5.188 -0.663 -3.486 747 HE1 PHE 113 1HE PHE 113 -8.149 2.314 -0.924 748 HE2 PHE 113 2HE PHE 113 -5.495 1.672 -4.199 749 HZ PHE 113 HZ PHE 113 -6.977 3.164 -2.917 750 H GLN 114 H GLN 114 -8.157 -3.343 -3.422 751 HA GLN 114 HA GLN 114 -7.636 -6.196 -2.901 752 HB3 GLN 114 2HB GLN 114 -9.392 -6.793 -4.408 753 HG3 GLN 114 2HG GLN 114 -9.949 -5.249 -2.117 754 HE21 GLN 114 1HE2 GLN 114 -9.958 -3.277 -4.017 755 HE22 GLN 114 2HE2 GLN 114 -11.557 -2.647 -4.192 756 H GLY 115 H GLY 115 -6.325 -7.274 -4.286 757 HA2 GLY 115 2HA GLY 115 -5.088 -5.665 -6.419 758 HA3 GLY 115 3HA GLY 115 -4.343 -7.043 -5.621 759 H ASN 116 H ASN 116 -4.910 -9.143 -6.246 760 HA ASN 116 HA ASN 116 -5.502 -10.789 -7.700 761 HB3 ASN 116 2HB ASN 116 -7.663 -10.736 -8.679 762 HD21 ASN 116 1HD2 ASN 116 -7.864 -11.797 -6.651 763 HD22 ASN 116 2HD2 ASN 116 -8.653 -11.016 -5.327 764 H LEU 117 H LEU 117 -6.650 -10.516 -10.320 765 HA LEU 117 HA LEU 117 -6.075 -10.125 -12.488 766 HB3 LEU 117 2HB LEU 117 -5.138 -8.092 -13.100 767 HG LEU 117 HG LEU 117 -6.318 -7.615 -10.371 768 HD11 LEU 117 1HD1 LEU 117 -4.605 -5.876 -11.525 769 HD12 LEU 117 2HD1 LEU 117 -5.962 -5.400 -10.505 770 HD13 LEU 117 3HD1 LEU 117 -6.127 -5.371 -12.260 771 HD21 LEU 117 3HD2 LEU 117 -7.874 -8.463 -12.025 772 HD22 LEU 117 1HD2 LEU 117 -7.367 -7.221 -13.171 773 HD23 LEU 117 2HD2 LEU 117 -8.212 -6.764 -11.691 774 H ASP 118 H ASP 118 -4.382 -11.678 -10.448 775 HA ASP 118 HA ASP 118 -2.533 -13.002 -10.485 776 HB3 ASP 118 2HB ASP 118 -1.678 -13.711 -12.628 777 H ASN 119 H ASN 119 -0.120 -12.906 -11.734 778 HA ASN 119 HA ASN 119 1.007 -10.465 -10.613 779 HB3 ASN 119 2HB ASN 119 1.846 -12.973 -10.332 780 HD21 ASN 119 1HD2 ASN 119 1.306 -13.663 -12.720 781 HD22 ASN 119 2HD2 ASN 119 2.700 -13.947 -13.701 782 H ASN 120 H ASN 120 0.338 -11.908 -13.671 783 HA ASN 120 HA ASN 120 2.238 -10.475 -15.222 784 HB3 ASN 120 2HB ASN 120 1.344 -12.417 -16.228 785 HD21 ASN 120 1HD2 ASN 120 0.050 -13.675 -14.928 786 HD22 ASN 120 2HD2 ASN 120 -1.675 -13.601 -14.976 787 H SER 121 H SER 121 -1.261 -10.009 -14.721 788 HA SER 121 HA SER 121 -1.335 -7.530 -16.117 789 HB3 SER 121 2HB SER 121 -3.600 -7.526 -15.685 790 HG SER 121 HG SER 121 -4.097 -9.919 -15.098 791 H HIS 122 H HIS 122 -1.204 -5.464 -15.391 792 HA HIS 122 HA HIS 122 -0.253 -5.111 -12.640 793 HB3 HIS 122 2HB HIS 122 1.041 -4.276 -14.712 794 HD1 HIS 122 1HD HIS 122 -1.826 -3.792 -15.926 795 HD2 HIS 122 2HD HIS 122 0.862 -0.833 -14.794 796 HE1 HIS 122 1HE HIS 122 -2.468 -1.756 -17.255 797 H LYS 123 H LYS 123 -0.987 -3.249 -11.414 798 HA LYS 123 HA LYS 123 -3.661 -2.295 -12.178 799 HB3 LYS 123 2HB LYS 123 -2.809 -3.446 -9.523 800 HG3 LYS 123 2HG LYS 123 -4.071 -1.430 -9.033 801 HD3 LYS 123 2HD LYS 123 -5.716 -2.398 -11.254 802 HE3 LYS 123 2HE LYS 123 -7.570 -0.946 -9.792 803 HZ1 LYS 123 3HZ LYS 123 -7.404 -3.415 -11.057 804 HZ2 LYS 123 1HZ LYS 123 -8.801 -2.584 -10.588 805 HZ3 LYS 123 2HZ LYS 123 -8.086 -3.700 -9.536 806 H LYS 124 H LYS 124 -3.044 -0.243 -12.692 807 HA LYS 124 HA LYS 124 -1.629 1.302 -10.623 808 HB3 LYS 124 2HB LYS 124 -1.954 1.901 -13.571 809 HG3 LYS 124 2HG LYS 124 0.211 3.218 -12.144 810 HD3 LYS 124 2HD LYS 124 -2.036 4.234 -13.887 811 HE3 LYS 124 2HE LYS 124 0.440 5.492 -12.767 812 HZ1 LYS 124 3HZ LYS 124 -0.979 6.382 -15.220 813 HZ2 LYS 124 1HZ LYS 124 0.587 5.744 -15.172 814 HZ3 LYS 124 2HZ LYS 124 0.255 7.225 -14.426 815 H ASN 125 H ASN 125 -2.622 2.954 -9.634 816 HA ASN 125 HA ASN 125 -5.331 3.650 -10.547 817 HB3 ASN 125 2HB ASN 125 -5.988 3.890 -8.362 818 HD21 ASN 125 1HD2 ASN 125 -6.579 1.873 -7.959 819 HD22 ASN 125 2HD2 ASN 125 -5.531 0.608 -7.423 820 H ILE 126 H ILE 126 -5.788 5.675 -11.161 821 HA ILE 126 HA ILE 126 -3.757 7.542 -11.673 822 HB ILE 126 HB ILE 126 -6.262 7.289 -12.579 823 HG13 ILE 126 2HG1 ILE 126 -4.201 9.356 -12.685 824 HG21 ILE 126 1HG2 ILE 126 -6.601 9.789 -11.005 825 HG22 ILE 126 2HG2 ILE 126 -7.817 8.701 -11.674 826 HG23 ILE 126 3HG2 ILE 126 -6.930 8.247 -10.219 827 HD11 ILE 126 3HD1 ILE 126 -5.531 7.580 -14.474 828 HD12 ILE 126 1HD1 ILE 126 -5.635 9.226 -15.095 829 HD13 ILE 126 2HD1 ILE 126 -4.061 8.521 -14.723 830 H PHE 127 H PHE 127 -4.093 9.936 -10.913 831 HA PHE 127 HA PHE 127 -3.157 10.272 -8.399 832 HB3 PHE 127 2HB PHE 127 -3.249 12.132 -9.924 833 HD1 PHE 127 1HD PHE 127 -4.537 11.488 -11.961 834 HD2 PHE 127 2HD PHE 127 -6.396 13.171 -8.522 835 HE1 PHE 127 1HE PHE 127 -6.511 12.063 -13.314 836 HE2 PHE 127 2HE PHE 127 -8.372 13.748 -9.868 837 HZ PHE 127 HZ PHE 127 -8.432 13.194 -12.267 838 H GLU 128 H GLU 128 -6.602 10.361 -9.289 839 HA GLU 128 HA GLU 128 -8.481 10.407 -7.958 840 HB3 GLU 128 2HB GLU 128 -7.046 8.152 -6.558 841 HG3 GLU 128 2HG GLU 128 -9.566 9.065 -6.137 842 H LYS 129 H LYS 129 -7.339 12.492 -7.062 843 HA LYS 129 HA LYS 129 -7.292 13.889 -5.255 844 HB3 LYS 129 2HB LYS 129 -8.223 13.244 -3.189 845 HG3 LYS 129 2HG LYS 129 -9.584 11.191 -4.870 846 HD3 LYS 129 2HD LYS 129 -11.049 13.338 -3.490 847 HE3 LYS 129 2HE LYS 129 -11.256 10.328 -3.537 848 HZ1 LYS 129 3HZ LYS 129 -13.586 11.846 -2.820 849 HZ2 LYS 129 1HZ LYS 129 -12.340 11.979 -1.682 850 HZ3 LYS 129 2HZ LYS 129 -12.941 10.455 -2.104 851 HA PRO 130 HA PRO 130 -2.979 12.393 -4.589 852 HB3 PRO 130 2HB PRO 130 -2.271 13.524 -6.461 853 HG3 PRO 130 2HG PRO 130 -3.467 15.338 -7.290 854 HD3 PRO 130 2HD PRO 130 -5.173 13.804 -7.072 855 H PHE 131 H PHE 131 -1.253 13.414 -3.207 856 HA PHE 131 HA PHE 131 -1.701 15.565 -1.500 857 HB3 PHE 131 2HB PHE 131 -1.998 13.617 0.493 858 HD1 PHE 131 1HD PHE 131 -1.966 16.369 0.773 859 HD2 PHE 131 2HD PHE 131 -5.271 13.932 -0.348 860 HE1 PHE 131 1HE PHE 131 -3.514 18.093 1.601 861 HE2 PHE 131 2HE PHE 131 -6.824 15.652 0.477 862 HZ PHE 131 HZ PHE 131 -5.946 17.737 1.453 863 H MET 132 H MET 132 -0.134 15.678 0.271 864 HA MET 132 HA MET 132 2.370 14.539 -0.514 865 HB3 MET 132 2HB MET 132 2.286 16.797 0.374 866 HG3 MET 132 2HG MET 132 1.921 16.027 3.168 867 HE1 MET 132 3HE MET 132 -0.518 17.764 0.803 868 HE2 MET 132 1HE MET 132 -0.141 19.482 0.944 869 HE3 MET 132 2HE MET 132 0.936 18.415 0.043 870 H ALA 133 H ALA 133 3.742 13.215 0.779 871 HA ALA 133 HA ALA 133 2.580 11.833 3.053 872 HB1 ALA 133 1HB ALA 133 2.959 9.599 2.083 873 HB2 ALA 133 2HB ALA 133 1.728 10.514 1.212 874 HB3 ALA 133 3HB ALA 133 3.350 10.357 0.538 875 H ARG 134 H ARG 134 4.100 10.833 4.376 876 HA ARG 134 HA ARG 134 6.917 11.204 3.596 877 HB3 ARG 134 2HB ARG 134 6.223 12.917 5.227 878 HG3 ARG 134 2HG ARG 134 4.929 10.737 6.525 879 HD3 ARG 134 2HD ARG 134 5.667 11.043 8.792 880 HE ARG 134 HE ARG 134 7.615 10.113 6.882 881 HH11 ARG 134 1HH1 ARG 134 6.858 10.557 10.251 882 HH12 ARG 134 2HH1 ARG 134 7.957 9.333 10.793 883 HH21 ARG 134 1HH2 ARG 134 9.065 8.498 7.583 884 HH22 ARG 134 2HH2 ARG 134 9.212 8.162 9.275 885 H TYR 135 H TYR 135 4.507 9.258 5.164 886 HA TYR 135 HA TYR 135 6.236 6.952 5.040 887 HB3 TYR 135 2HB TYR 135 5.322 8.095 7.675 888 HD1 TYR 135 1HD TYR 135 7.445 5.175 6.771 889 HD2 TYR 135 2HD TYR 135 4.006 6.566 8.855 890 HE1 TYR 135 1HE TYR 135 7.175 2.955 7.797 891 HE2 TYR 135 2HE TYR 135 3.727 4.351 9.887 892 HH TYR 135 HH TYR 135 6.127 1.826 9.494 893 H VAL 136 H VAL 136 5.071 5.226 4.491 894 HA VAL 136 HA VAL 136 2.181 5.245 5.074 895 HB VAL 136 HB VAL 136 1.676 4.296 2.967 896 HG11 VAL 136 1HG1 VAL 136 3.745 6.459 2.592 897 HG12 VAL 136 2HG1 VAL 136 2.587 5.943 1.363 898 HG13 VAL 136 3HG1 VAL 136 2.017 6.684 2.859 899 HG21 VAL 136 3HG2 VAL 136 4.491 3.519 3.014 900 HG22 VAL 136 1HG2 VAL 136 3.115 2.749 2.225 901 HG23 VAL 136 2HG2 VAL 136 3.943 4.094 1.440 902 H ARG 137 H ARG 137 1.197 3.237 5.480 903 HA ARG 137 HA ARG 137 3.058 1.015 6.003 904 HB3 ARG 137 2HB ARG 137 0.638 1.578 7.703 905 HG3 ARG 137 2HG ARG 137 3.178 0.064 8.265 906 HD3 ARG 137 2HD ARG 137 1.317 -0.633 10.151 907 HE ARG 137 HE ARG 137 3.810 0.461 10.255 908 HH11 ARG 137 1HH1 ARG 137 0.836 0.967 11.995 909 HH12 ARG 137 2HH1 ARG 137 1.624 1.439 13.463 910 HH21 ARG 137 1HH2 ARG 137 4.858 1.081 12.183 911 HH22 ARG 137 2HH2 ARG 137 3.912 1.505 13.570 912 H VAL 138 H VAL 138 2.437 -0.965 5.326 913 HA VAL 138 HA VAL 138 -0.308 -1.267 4.299 914 HB VAL 138 HB VAL 138 2.154 -2.423 2.988 915 HG11 VAL 138 1HG1 VAL 138 0.039 -3.697 2.728 916 HG12 VAL 138 2HG1 VAL 138 -0.687 -2.267 1.990 917 HG13 VAL 138 3HG1 VAL 138 0.676 -3.070 1.208 918 HG21 VAL 138 3HG2 VAL 138 2.463 -0.470 1.977 919 HG22 VAL 138 1HG2 VAL 138 0.840 -0.583 1.295 920 HG23 VAL 138 2HG2 VAL 138 1.092 0.221 2.844 921 H LEU 139 H LEU 139 -1.335 -3.122 4.814 922 HA LEU 139 HA LEU 139 0.221 -5.326 5.964 923 HB3 LEU 139 2HB LEU 139 -2.342 -4.362 7.203 924 HG LEU 139 HG LEU 139 -0.227 -6.279 8.122 925 HD11 LEU 139 1HD1 LEU 139 -1.252 -6.165 10.368 926 HD12 LEU 139 2HD1 LEU 139 -2.165 -4.749 9.849 927 HD13 LEU 139 3HD1 LEU 139 -0.405 -4.687 9.917 928 HD21 LEU 139 3HD2 LEU 139 -1.855 -7.657 7.448 929 HD22 LEU 139 1HD2 LEU 139 -3.052 -6.362 7.390 930 HD23 LEU 139 2HD2 LEU 139 -2.694 -7.163 8.920 931 HA PRO 140 HA PRO 140 -2.558 -7.149 2.887 932 HB3 PRO 140 2HB PRO 140 -0.691 -7.883 1.765 933 HG3 PRO 140 2HG PRO 140 1.310 -8.259 2.887 934 HD3 PRO 140 2HD PRO 140 0.814 -6.146 3.661 935 H VAL 141 H VAL 141 -4.168 -8.632 3.116 936 HA VAL 141 HA VAL 141 -4.134 -10.277 5.565 937 HB VAL 141 HB VAL 141 -6.543 -9.029 4.233 938 HG11 VAL 141 1HG1 VAL 141 -7.106 -11.157 5.227 939 HG12 VAL 141 2HG1 VAL 141 -6.298 -10.706 6.729 940 HG13 VAL 141 3HG1 VAL 141 -7.758 -9.854 6.221 941 HG21 VAL 141 3HG2 VAL 141 -5.150 -7.386 5.397 942 HG22 VAL 141 1HG2 VAL 141 -6.685 -7.635 6.229 943 HG23 VAL 141 2HG2 VAL 141 -5.212 -8.369 6.861 944 H SER 142 H SER 142 -5.381 -10.042 2.250 945 HA SER 142 HA SER 142 -5.499 -12.986 2.181 946 HB3 SER 142 2HB SER 142 -7.438 -12.937 0.887 947 HG SER 142 HG SER 142 -7.405 -10.966 2.848 948 H TRP 143 H TRP 143 -4.117 -13.905 0.828 949 HA TRP 143 HA TRP 143 -3.270 -12.422 -1.565 950 HB3 TRP 143 2HB TRP 143 -1.508 -12.259 0.165 951 HD1 TRP 143 HD TRP 143 -0.109 -15.576 -0.879 952 HE1 TRP 143 1HE TRP 143 0.136 -17.103 1.178 953 HE3 TRP 143 3HE TRP 143 -2.743 -12.800 2.512 954 HZ2 TRP 143 2HZ TRP 143 -0.679 -17.129 3.880 955 HZ3 TRP 143 3HZ TRP 143 -2.963 -13.646 4.811 956 HH2 TRP 143 HH TRP 143 -1.952 -15.766 5.479 957 H HIS 144 H HIS 144 -2.016 -13.974 -3.080 958 HA HIS 144 HA HIS 144 -3.379 -16.586 -3.095 959 HB3 HIS 144 2HB HIS 144 -2.669 -15.844 -5.752 960 HD1 HIS 144 1HD HIS 144 -4.150 -17.507 -6.814 961 HD2 HIS 144 2HD HIS 144 -6.092 -15.432 -3.784 962 HE1 HIS 144 1HE HIS 144 -6.519 -18.351 -6.834 963 H ASN 145 H ASN 145 -2.063 -18.280 -3.087 964 HA ASN 145 HA ASN 145 -0.249 -19.617 -3.458 965 HB3 ASN 145 2HB ASN 145 1.158 -17.466 -4.998 966 HD21 ASN 145 1HD2 ASN 145 2.696 -19.171 -3.943 967 HD22 ASN 145 2HD2 ASN 145 3.098 -20.500 -4.971 968 H ARG 146 H ARG 146 1.171 -16.346 -3.409 969 HA ARG 146 HA ARG 146 2.139 -16.659 -0.726 970 HB3 ARG 146 2HB ARG 146 4.504 -16.155 -2.262 971 HG3 ARG 146 2HG ARG 146 4.882 -18.620 -1.175 972 HD3 ARG 146 2HD ARG 146 5.160 -16.709 0.913 973 HE ARG 146 HE ARG 146 7.038 -18.020 0.724 974 HH11 ARG 146 1HH1 ARG 146 6.435 -16.399 -2.297 975 HH12 ARG 146 2HH1 ARG 146 7.952 -16.858 -2.995 976 HH21 ARG 146 1HH2 ARG 146 9.039 -18.630 -0.184 977 HH22 ARG 146 2HH2 ARG 146 9.433 -18.127 -1.793 978 H ILE 147 H ILE 147 2.873 -14.732 0.161 979 HA ILE 147 HA ILE 147 1.921 -12.357 -1.045 980 HB ILE 147 HB ILE 147 3.756 -12.724 1.324 981 HG13 ILE 147 2HG1 ILE 147 0.803 -12.667 0.938 982 HG21 ILE 147 1HG2 ILE 147 2.523 -10.323 1.685 983 HG22 ILE 147 2HG2 ILE 147 4.156 -10.535 1.054 984 HG23 ILE 147 3HG2 ILE 147 2.802 -10.325 -0.056 985 HD11 ILE 147 3HD1 ILE 147 2.714 -14.123 2.718 986 HD12 ILE 147 1HD1 ILE 147 0.990 -14.055 3.084 987 HD13 ILE 147 2HD1 ILE 147 1.544 -14.772 1.569 988 H THR 148 H THR 148 2.988 -12.280 -3.079 989 HA THR 148 HA THR 148 5.680 -11.125 -2.900 990 HB THR 148 HB THR 148 5.158 -12.767 -5.307 991 HG1 THR 148 1HG THR 148 4.456 -14.256 -3.814 992 HG21 THR 148 3HG2 THR 148 7.364 -11.587 -3.941 993 HG22 THR 148 1HG2 THR 148 7.346 -12.402 -5.504 994 HG23 THR 148 2HG2 THR 148 7.626 -13.328 -4.029 995 H LEU 149 H LEU 149 5.229 -9.065 -3.432 996 HA LEU 149 HA LEU 149 4.382 -8.501 -6.125 997 HB3 LEU 149 2HB LEU 149 2.269 -8.766 -4.744 998 HG LEU 149 HG LEU 149 3.182 -6.143 -3.571 999 HD11 LEU 149 1HD1 LEU 149 0.591 -6.865 -4.454 1000 HD12 LEU 149 2HD1 LEU 149 1.082 -5.440 -3.539 1001 HD13 LEU 149 3HD1 LEU 149 0.590 -6.906 -2.691 1002 HD21 LEU 149 3HD2 LEU 149 2.759 -8.877 -2.555 1003 HD22 LEU 149 1HD2 LEU 149 2.118 -7.574 -1.554 1004 HD23 LEU 149 2HD2 LEU 149 3.831 -7.600 -1.977 1005 H ARG 150 H ARG 150 3.902 -5.836 -5.998 1006 HA ARG 150 HA ARG 150 5.829 -4.501 -4.330 1007 HB3 ARG 150 2HB ARG 150 7.357 -5.323 -5.996 1008 HG3 ARG 150 2HG ARG 150 5.387 -5.419 -7.779 1009 HD3 ARG 150 2HD ARG 150 6.386 -2.689 -7.896 1010 HE ARG 150 HE ARG 150 7.277 -4.216 -10.017 1011 HH11 ARG 150 1HH1 ARG 150 5.181 -1.476 -9.547 1012 HH12 ARG 150 2HH1 ARG 150 5.514 -0.788 -11.102 1013 HH21 ARG 150 1HH2 ARG 150 7.724 -3.321 -12.067 1014 HH22 ARG 150 2HH2 ARG 150 6.961 -1.840 -12.536 1015 H LEU 151 H LEU 151 5.224 -2.447 -3.983 1016 HA LEU 151 HA LEU 151 3.243 -1.271 -5.822 1017 HB3 LEU 151 2HB LEU 151 3.395 -0.719 -2.870 1018 HG LEU 151 HG LEU 151 1.414 -0.030 -4.981 1019 HD11 LEU 151 1HD1 LEU 151 0.220 -1.546 -3.419 1020 HD12 LEU 151 2HD1 LEU 151 -0.393 0.107 -3.412 1021 HD13 LEU 151 3HD1 LEU 151 0.643 -0.454 -2.099 1022 HD21 LEU 151 3HD2 LEU 151 1.967 2.018 -4.335 1023 HD22 LEU 151 1HD2 LEU 151 3.114 1.331 -3.183 1024 HD23 LEU 151 2HD2 LEU 151 1.454 1.662 -2.684 1025 H GLU 152 H GLU 152 3.989 0.463 -6.829 1026 HA GLU 152 HA GLU 152 6.119 2.036 -5.546 1027 HB3 GLU 152 2HB GLU 152 5.765 2.749 -8.290 1028 HG3 GLU 152 2HG GLU 152 7.983 1.023 -7.262 1029 H LEU 153 H LEU 153 5.953 4.250 -5.367 1030 HA LEU 153 HA LEU 153 3.276 5.361 -5.885 1031 HB3 LEU 153 2HB LEU 153 3.823 5.267 -3.529 1032 HG LEU 153 HG LEU 153 6.406 5.642 -3.976 1033 HD11 LEU 153 1HD1 LEU 153 6.484 8.182 -2.894 1034 HD12 LEU 153 2HD1 LEU 153 5.261 8.302 -4.157 1035 HD13 LEU 153 3HD1 LEU 153 6.883 7.738 -4.554 1036 HD21 LEU 153 3HD2 LEU 153 6.444 6.607 -1.547 1037 HD22 LEU 153 1HD2 LEU 153 5.836 4.979 -1.849 1038 HD23 LEU 153 2HD2 LEU 153 4.706 6.312 -1.617 1039 H LEU 154 H LEU 154 3.059 7.199 -7.052 1040 HA LEU 154 HA LEU 154 5.530 8.506 -7.984 1041 HB3 LEU 154 2HB LEU 154 4.425 8.903 -10.130 1042 HG LEU 154 HG LEU 154 5.635 6.636 -9.659 1043 HD11 LEU 154 1HD1 LEU 154 3.435 5.082 -10.507 1044 HD12 LEU 154 2HD1 LEU 154 2.929 5.971 -9.071 1045 HD13 LEU 154 3HD1 LEU 154 4.361 4.944 -9.012 1046 HD21 LEU 154 3HD2 LEU 154 5.638 7.396 -11.849 1047 HD22 LEU 154 1HD2 LEU 154 3.879 7.363 -11.972 1048 HD23 LEU 154 2HD2 LEU 154 4.792 5.854 -11.975 1049 H GLY 155 H GLY 155 5.461 10.747 -8.309 1050 HA2 GLY 155 2HA GLY 155 3.041 12.103 -7.304 1051 HA3 GLY 155 3HA GLY 155 4.632 12.533 -6.696 1052 H CYS 156 H CYS 156 3.096 14.493 -7.751 1053 HA CYS 156 HA CYS 156 3.662 14.879 -10.545 1054 HB3 CYS 156 2HB CYS 156 2.613 16.856 -8.509 1055 H LEU 157 H LEU 157 5.272 15.510 -7.592 1056 HA LEU 157 HA LEU 157 7.268 16.475 -7.092 1057 HB3 LEU 157 2HB LEU 157 8.241 17.103 -9.717 1058 HG LEU 157 HG LEU 157 9.980 15.530 -9.313 1059 HD11 LEU 157 1HD1 LEU 157 9.453 17.625 -7.653 1060 HD12 LEU 157 2HD1 LEU 157 10.945 16.685 -7.658 1061 HD13 LEU 157 3HD1 LEU 157 9.664 16.299 -6.508 1062 HD21 LEU 157 3HD2 LEU 157 8.590 13.650 -8.602 1063 HD22 LEU 157 1HD2 LEU 157 8.291 14.450 -7.059 1064 HD23 LEU 157 2HD2 LEU 157 9.922 13.925 -7.478 1065 H GLU 158 H GLU 158 4.827 18.080 -7.694 1066 HA GLU 158 HA GLU 158 6.186 20.667 -8.021 1067 HB3 GLU 158 2HB GLU 158 3.388 20.506 -8.967 1068 HG3 GLU 158 2HG GLU 158 5.893 21.873 -9.876 Start of MODEL 3 1 H1 MET -5 H MET -5 16.565 15.824 -15.358 2 HA MET -5 HA MET -5 18.429 16.508 -17.084 3 HB3 MET -5 2HB MET -5 18.716 14.104 -18.308 4 HG3 MET -5 2HG MET -5 20.417 15.605 -16.413 5 HE1 MET -5 3HE MET -5 23.466 14.220 -17.398 6 HE2 MET -5 1HE MET -5 23.160 12.556 -17.898 7 HE3 MET -5 2HE MET -5 22.345 13.887 -18.719 8 H LYS -4 H LYS -4 17.741 16.663 -19.249 9 HA LYS -4 HA LYS -4 16.214 16.827 -20.927 10 HB3 LYS -4 2HB LYS -4 14.476 14.627 -20.377 11 HG3 LYS -4 2HG LYS -4 15.944 15.592 -22.528 12 HD3 LYS -4 2HD LYS -4 16.671 12.706 -22.073 13 HE3 LYS -4 2HE LYS -4 16.498 13.800 -24.406 14 HZ1 LYS -4 3HZ LYS -4 19.200 14.791 -23.757 15 HZ2 LYS -4 1HZ LYS -4 17.847 15.792 -23.575 16 HZ3 LYS -4 2HZ LYS -4 18.228 15.154 -25.094 17 H SER -3 H SER -3 13.759 16.913 -21.364 18 HA SER -3 HA SER -3 12.235 17.621 -18.971 19 HB3 SER -3 2HB SER -3 11.875 19.543 -21.167 20 HG SER -3 HG SER -3 12.332 20.884 -19.127 21 H GLY -2 H GLY -2 9.976 18.620 -20.084 22 HA2 GLY -2 2HA GLY -2 8.307 18.176 -21.741 23 HA3 GLY -2 3HA GLY -2 9.142 16.679 -22.130 24 H HIS -1 H HIS -1 9.457 15.551 -19.638 25 HA HIS -1 HA HIS -1 6.946 14.357 -19.221 26 HB3 HIS -1 2HB HIS -1 8.033 13.383 -17.166 27 HD1 HIS -1 1HD HIS -1 7.659 12.818 -20.384 28 HD2 HIS -1 2HD HIS -1 10.947 12.019 -17.972 29 HE1 HIS -1 1HE HIS -1 8.920 10.982 -21.552 30 H GLY 0 H GLY 0 5.402 14.594 -17.629 31 HA2 GLY 0 2HA GLY 0 5.537 17.143 -16.155 32 HA3 GLY 0 3HA GLY 0 4.054 16.332 -16.637 33 H CYS 1 H CYS 1 3.016 15.245 -15.108 34 HA CYS 1 HA CYS 1 4.359 14.773 -12.565 35 HB3 CYS 1 2HB CYS 1 2.150 14.403 -11.655 36 H SER 2 H SER 2 3.000 12.649 -11.539 37 HA SER 2 HA SER 2 2.986 10.377 -11.420 38 HB3 SER 2 2HB SER 2 3.171 10.145 -14.403 39 HG SER 2 HG SER 2 1.808 8.821 -12.311 40 H GLU 3 H GLU 3 5.223 10.861 -10.604 41 HA GLU 3 HA GLU 3 7.196 9.467 -12.287 42 HB3 GLU 3 2HB GLU 3 8.922 10.948 -11.626 43 HG3 GLU 3 2HG GLU 3 8.111 13.222 -12.155 44 HA PRO 4 HA PRO 4 7.829 6.757 -8.889 45 HB3 PRO 4 2HB PRO 4 9.093 5.476 -10.318 46 HG3 PRO 4 2HG PRO 4 10.448 6.460 -11.931 47 HD3 PRO 4 2HD PRO 4 8.472 7.577 -12.337 48 H LEU 5 H LEU 5 9.981 6.264 -7.371 49 HA LEU 5 HA LEU 5 10.494 8.843 -6.049 50 HB3 LEU 5 2HB LEU 5 9.363 7.633 -4.470 51 HG LEU 5 HG LEU 5 9.254 5.470 -5.754 52 HD11 LEU 5 1HD1 LEU 5 11.242 4.543 -6.190 53 HD12 LEU 5 2HD1 LEU 5 11.142 3.913 -4.546 54 HD13 LEU 5 3HD1 LEU 5 12.041 5.396 -4.869 55 HD21 LEU 5 3HD2 LEU 5 9.454 4.123 -3.461 56 HD22 LEU 5 1HD2 LEU 5 8.130 5.240 -3.797 57 HD23 LEU 5 2HD2 LEU 5 9.500 5.766 -2.817 58 H GLY 6 H GLY 6 11.944 6.087 -7.528 59 HA2 GLY 6 2HA GLY 6 14.544 7.330 -7.379 60 HA3 GLY 6 3HA GLY 6 14.423 5.835 -6.464 61 H LEU 7 H LEU 7 12.698 6.434 -9.457 62 HA LEU 7 HA LEU 7 14.430 4.448 -10.777 63 HB3 LEU 7 2HB LEU 7 12.600 3.456 -11.808 64 HG LEU 7 HG LEU 7 11.347 4.293 -9.194 65 HD11 LEU 7 1HD1 LEU 7 10.344 2.793 -11.333 66 HD12 LEU 7 2HD1 LEU 7 9.675 2.929 -9.707 67 HD13 LEU 7 3HD1 LEU 7 10.794 1.622 -10.093 68 HD21 LEU 7 3HD2 LEU 7 13.520 2.384 -9.848 69 HD22 LEU 7 1HD2 LEU 7 12.308 1.868 -8.675 70 HD23 LEU 7 2HD2 LEU 7 13.243 3.336 -8.388 71 H LYS 8 H LYS 8 14.197 7.535 -10.707 72 HA LYS 8 HA LYS 8 14.300 7.871 -13.630 73 HB3 LYS 8 2HB LYS 8 13.328 9.972 -11.692 74 HG3 LYS 8 2HG LYS 8 12.464 10.010 -14.495 75 HD3 LYS 8 2HD LYS 8 13.776 12.280 -13.091 76 HE3 LYS 8 2HE LYS 8 11.462 11.864 -14.950 77 HZ1 LYS 8 3HZ LYS 8 12.055 14.521 -13.840 78 HZ2 LYS 8 1HZ LYS 8 11.010 13.488 -13.002 79 HZ3 LYS 8 2HZ LYS 8 10.642 13.961 -14.584 80 H ASN 9 H ASN 9 15.077 9.779 -10.715 81 HA ASN 9 HA ASN 9 17.842 9.995 -11.677 82 HB3 ASN 9 2HB ASN 9 17.490 12.453 -10.571 83 HD21 ASN 9 1HD2 ASN 9 19.309 12.451 -11.954 84 HD22 ASN 9 2HD2 ASN 9 19.138 12.780 -13.642 85 H ASN 10 H ASN 10 15.566 10.348 -9.003 86 HA ASN 10 HA ASN 10 17.307 10.836 -6.913 87 HB3 ASN 10 2HB ASN 10 15.558 9.406 -5.578 88 HD21 ASN 10 1HD2 ASN 10 15.270 11.934 -8.031 89 HD22 ASN 10 2HD2 ASN 10 14.556 13.110 -6.986 90 H THR 11 H THR 11 16.464 7.761 -8.431 91 HA THR 11 HA THR 11 17.305 5.651 -8.200 92 HB THR 11 HB THR 11 19.668 5.436 -8.331 93 HG1 THR 11 1HG THR 11 20.626 6.574 -6.789 94 HG21 THR 11 3HG2 THR 11 19.800 8.037 -9.571 95 HG22 THR 11 1HG2 THR 11 18.263 7.252 -9.928 96 HG23 THR 11 2HG2 THR 11 19.778 6.441 -10.320 97 H ILE 12 H ILE 12 16.095 6.611 -5.855 98 HA ILE 12 HA ILE 12 17.519 6.452 -3.502 99 HB ILE 12 HB ILE 12 14.735 5.377 -3.969 100 HG13 ILE 12 2HG1 ILE 12 13.970 7.593 -3.264 101 HG21 ILE 12 1HG2 ILE 12 16.018 6.346 -1.418 102 HG22 ILE 12 2HG2 ILE 12 14.389 5.699 -1.603 103 HG23 ILE 12 3HG2 ILE 12 15.786 4.652 -1.850 104 HD11 ILE 12 3HD1 ILE 12 15.800 8.313 -1.859 105 HD12 ILE 12 1HD1 ILE 12 16.879 8.360 -3.252 106 HD13 ILE 12 2HD1 ILE 12 15.521 9.482 -3.150 107 HA PRO 13 HA PRO 13 19.010 2.289 -3.396 108 HB3 PRO 13 2HB PRO 13 20.669 3.091 -2.023 109 HG3 PRO 13 2HG PRO 13 20.264 4.848 -0.554 110 HD3 PRO 13 2HD PRO 13 19.415 5.753 -2.496 111 H ASP 14 H ASP 14 18.882 0.542 -1.376 112 HA ASP 14 HA ASP 14 16.059 -0.110 -1.278 113 HB3 ASP 14 2HB ASP 14 17.740 -1.836 -1.848 114 H SER 15 H SER 15 16.344 2.103 0.187 115 HA SER 15 HA SER 15 16.092 1.124 2.952 116 HB3 SER 15 2HB SER 15 17.478 2.716 3.800 117 HG SER 15 HG SER 15 18.977 1.963 2.449 118 H GLN 16 H GLN 16 14.357 2.102 0.502 119 HA GLN 16 HA GLN 16 12.793 4.170 1.829 120 HB3 GLN 16 2HB GLN 16 13.251 4.431 -0.555 121 HG3 GLN 16 2HG GLN 16 11.393 2.273 -1.333 122 HE21 GLN 16 1HE2 GLN 16 13.047 1.089 -3.147 123 HE22 GLN 16 2HE2 GLN 16 13.518 2.235 -4.351 124 H MET 17 H MET 17 12.459 0.827 0.725 125 HA MET 17 HA MET 17 9.809 0.672 1.957 126 HB3 MET 17 2HB MET 17 10.444 -1.826 0.876 127 HG3 MET 17 2HG MET 17 8.876 0.475 -0.241 128 HE1 MET 17 3HE MET 17 7.481 -3.381 -1.313 129 HE2 MET 17 1HE MET 17 9.171 -3.787 -1.619 130 HE3 MET 17 2HE MET 17 8.684 -3.173 -0.039 131 H SER 18 H SER 18 9.305 -0.800 3.580 132 HA SER 18 HA SER 18 11.311 -2.544 4.684 133 HB3 SER 18 2HB SER 18 12.172 -0.741 5.867 134 HG SER 18 HG SER 18 10.191 0.582 6.926 135 H ALA 19 H ALA 19 10.257 -4.310 5.272 136 HA ALA 19 HA ALA 19 7.514 -4.033 6.320 137 HB1 ALA 19 1HB ALA 19 8.190 -6.598 5.062 138 HB2 ALA 19 2HB ALA 19 6.727 -5.619 4.938 139 HB3 ALA 19 3HB ALA 19 8.141 -5.219 3.962 140 H SER 20 H SER 20 6.852 -6.128 7.514 141 HA SER 20 HA SER 20 8.305 -6.365 9.839 142 HB3 SER 20 2HB SER 20 6.159 -7.936 8.543 143 HG SER 20 HG SER 20 7.201 -9.715 9.183 144 H SER 21 H SER 21 8.262 -8.714 7.156 145 HA SER 21 HA SER 21 11.064 -9.244 7.443 146 HB3 SER 21 2HB SER 21 10.791 -11.671 7.964 147 HG SER 21 HG SER 21 11.180 -10.975 9.897 148 H SER 22 H SER 22 11.922 -10.347 5.688 149 HA SER 22 HA SER 22 10.034 -10.779 3.473 150 HB3 SER 22 2HB SER 22 12.250 -9.163 3.543 151 HG SER 22 HG SER 22 13.599 -10.405 1.931 152 H TYR 23 H TYR 23 10.719 -12.462 1.875 153 HA TYR 23 HA TYR 23 10.788 -14.973 2.981 154 HB3 TYR 23 2HB TYR 23 10.275 -14.342 0.576 155 HD1 TYR 23 1HD TYR 23 11.806 -12.171 0.284 156 HD2 TYR 23 2HD TYR 23 13.025 -16.158 -0.563 157 HE1 TYR 23 1HE TYR 23 13.547 -11.312 -1.226 158 HE2 TYR 23 2HE TYR 23 14.769 -15.310 -2.075 159 HH TYR 23 HH TYR 23 15.852 -13.488 -2.799 160 H LYS 24 H LYS 24 12.386 -16.570 3.235 161 HA LYS 24 HA LYS 24 14.777 -15.729 4.414 162 HB3 LYS 24 2HB LYS 24 13.812 -17.879 4.951 163 HG3 LYS 24 2HG LYS 24 13.929 -18.310 2.057 164 HD3 LYS 24 2HD LYS 24 14.824 -20.426 4.003 165 HE3 LYS 24 2HE LYS 24 14.698 -21.639 1.553 166 HZ1 LYS 24 3HZ LYS 24 13.563 -21.979 4.054 167 HZ2 LYS 24 1HZ LYS 24 13.637 -23.110 2.798 168 HZ3 LYS 24 2HZ LYS 24 12.286 -22.104 2.950 169 H THR 25 H THR 25 16.969 -16.036 3.740 170 HA THR 25 HA THR 25 17.309 -15.595 0.861 171 HB THR 25 HB THR 25 19.418 -15.191 2.978 172 HG1 THR 25 1HG THR 25 17.249 -13.921 3.062 173 HG21 THR 25 3HG2 THR 25 19.818 -15.267 0.380 174 HG22 THR 25 1HG2 THR 25 20.612 -14.047 1.375 175 HG23 THR 25 2HG2 THR 25 19.171 -13.627 0.447 176 H TRP 26 H TRP 26 18.838 -17.391 3.532 177 HA TRP 26 HA TRP 26 19.797 -19.339 1.538 178 HB3 TRP 26 2HB TRP 26 21.362 -19.741 3.779 179 HD1 TRP 26 HD TRP 26 21.830 -16.834 1.247 180 HE1 TRP 26 1HE TRP 26 23.826 -17.422 -0.267 181 HE3 TRP 26 3HE TRP 26 22.892 -21.490 3.073 182 HZ2 TRP 26 2HZ TRP 26 25.613 -19.576 -0.640 183 HZ3 TRP 26 3HZ TRP 26 24.759 -22.749 2.082 184 HH2 TRP 26 HH TRP 26 26.091 -21.809 0.263 185 H ASN 27 H ASN 27 19.487 -19.352 5.086 186 HA ASN 27 HA ASN 27 17.326 -21.181 5.145 187 HB3 ASN 27 2HB ASN 27 20.057 -22.356 5.716 188 HD21 ASN 27 1HD2 ASN 27 19.683 -24.870 5.538 189 HD22 ASN 27 2HD2 ASN 27 18.447 -25.469 6.586 190 H LEU 28 H LEU 28 20.264 -20.153 6.854 191 HA LEU 28 HA LEU 28 18.608 -19.721 9.248 192 HB3 LEU 28 2HB LEU 28 21.316 -20.160 9.999 193 HG LEU 28 HG LEU 28 18.736 -21.160 10.797 194 HD11 LEU 28 1HD1 LEU 28 19.495 -23.242 9.756 195 HD12 LEU 28 2HD1 LEU 28 19.404 -23.383 11.511 196 HD13 LEU 28 3HD1 LEU 28 20.969 -23.185 10.723 197 HD21 LEU 28 3HD2 LEU 28 21.407 -20.619 11.963 198 HD22 LEU 28 1HD2 LEU 28 20.334 -21.701 12.851 199 HD23 LEU 28 2HD2 LEU 28 19.813 -20.060 12.469 200 H ARG 29 H ARG 29 21.714 -18.893 7.716 201 HA ARG 29 HA ARG 29 21.923 -16.428 9.184 202 HB3 ARG 29 2HB ARG 29 23.903 -17.757 8.467 203 HG3 ARG 29 2HG ARG 29 23.306 -16.686 5.719 204 HD3 ARG 29 2HD ARG 29 25.355 -18.746 6.145 205 HE ARG 29 HE ARG 29 25.735 -17.878 4.074 206 HH11 ARG 29 1HH1 ARG 29 25.061 -15.258 6.264 207 HH12 ARG 29 2HH1 ARG 29 25.379 -14.023 5.090 208 HH21 ARG 29 1HH2 ARG 29 26.156 -16.262 2.520 209 HH22 ARG 29 2HH2 ARG 29 26.001 -14.595 2.961 210 H ALA 30 H ALA 30 21.733 -14.336 8.379 211 HA ALA 30 HA ALA 30 20.751 -12.654 7.197 212 HB1 ALA 30 1HB ALA 30 20.776 -13.662 4.551 213 HB2 ALA 30 2HB ALA 30 21.874 -12.498 5.292 214 HB3 ALA 30 3HB ALA 30 22.245 -14.221 5.353 215 H PHE 31 H PHE 31 18.664 -12.820 7.987 216 HA PHE 31 HA PHE 31 16.755 -14.692 7.062 217 HB3 PHE 31 2HB PHE 31 15.145 -12.838 8.035 218 HD1 PHE 31 1HD PHE 31 17.939 -13.357 10.340 219 HD2 PHE 31 2HD PHE 31 14.251 -14.904 8.883 220 HE1 PHE 31 1HE PHE 31 17.848 -14.920 12.240 221 HE2 PHE 31 2HE PHE 31 14.153 -16.468 10.781 222 HZ PHE 31 HZ PHE 31 15.953 -16.477 12.462 223 H GLY 32 H GLY 32 17.614 -11.427 6.065 224 HA2 GLY 32 2HA GLY 32 17.237 -11.248 3.532 225 HA3 GLY 32 3HA GLY 32 15.560 -11.559 3.956 226 H TRP 33 H TRP 33 14.424 -9.985 5.225 227 HA TRP 33 HA TRP 33 13.682 -7.800 5.276 228 HB3 TRP 33 2HB TRP 33 14.572 -7.874 7.438 229 HD1 TRP 33 HD TRP 33 16.213 -10.035 7.678 230 HE1 TRP 33 1HE TRP 33 18.766 -10.168 7.970 231 HE3 TRP 33 3HE TRP 33 17.454 -5.319 6.142 232 HZ2 TRP 33 2HZ TRP 33 21.010 -8.496 7.601 233 HZ3 TRP 33 3HZ TRP 33 19.826 -4.665 6.143 234 HH2 TRP 33 HH TRP 33 21.565 -6.222 6.857 235 H TYR 34 H TYR 34 14.754 -8.205 2.790 236 HA TYR 34 HA TYR 34 16.091 -5.632 2.279 237 HB3 TYR 34 2HB TYR 34 16.588 -8.009 0.519 238 HD1 TYR 34 2HD TYR 34 16.782 -6.281 -1.266 239 HD2 TYR 34 1HD TYR 34 19.263 -6.233 2.190 240 HE1 TYR 34 2HE TYR 34 18.344 -4.767 -2.415 241 HE2 TYR 34 1HE TYR 34 20.831 -4.718 1.052 242 HH TYR 34 HH TYR 34 21.329 -4.297 -1.676 243 HA PRO 35 HA PRO 35 12.101 -6.087 -0.119 244 HB3 PRO 35 2HB PRO 35 10.825 -5.237 1.591 245 HG3 PRO 35 2HG PRO 35 11.773 -3.914 3.251 246 HD3 PRO 35 2HD PRO 35 13.241 -5.690 3.274 247 H HIS 36 H HIS 36 11.071 -3.801 -1.194 248 HA HIS 36 HA HIS 36 11.369 -2.158 -2.753 249 HB3 HIS 36 2HB HIS 36 13.695 -1.944 -1.128 250 HD1 HIS 36 1HD HIS 36 14.276 0.030 -4.135 251 HD2 HIS 36 2HD HIS 36 15.703 -3.530 -2.537 252 HE1 HIS 36 1HE HIS 36 16.404 -0.463 -5.382 253 H LEU 37 H LEU 37 12.355 -5.207 -2.914 254 HA LEU 37 HA LEU 37 14.086 -5.449 -5.068 255 HB3 LEU 37 2HB LEU 37 12.983 -7.654 -5.455 256 HG LEU 37 HG LEU 37 14.065 -8.635 -3.772 257 HD11 LEU 37 1HD1 LEU 37 15.385 -6.554 -4.107 258 HD12 LEU 37 2HD1 LEU 37 15.562 -7.266 -2.505 259 HD13 LEU 37 3HD1 LEU 37 14.538 -5.848 -2.731 260 HD21 LEU 37 3HD2 LEU 37 12.496 -6.940 -1.831 261 HD22 LEU 37 1HD2 LEU 37 13.512 -8.322 -1.417 262 HD23 LEU 37 2HD2 LEU 37 12.054 -8.555 -2.384 263 H GLY 38 H GLY 38 10.665 -4.713 -5.007 264 HA2 GLY 38 2HA GLY 38 10.061 -5.219 -7.707 265 HA3 GLY 38 3HA GLY 38 9.200 -4.100 -6.661 266 H ARG 39 H ARG 39 12.119 -2.898 -6.385 267 HA ARG 39 HA ARG 39 11.787 -0.585 -7.757 268 HB3 ARG 39 2HB ARG 39 13.653 -1.108 -6.178 269 HG3 ARG 39 2HG ARG 39 14.562 -2.738 -8.458 270 HD3 ARG 39 2HD ARG 39 16.840 -1.982 -6.893 271 HE ARG 39 HE ARG 39 16.296 -2.512 -9.600 272 HH11 ARG 39 1HH1 ARG 39 18.436 -0.628 -7.603 273 HH12 ARG 39 2HH1 ARG 39 19.730 -0.633 -8.756 274 HH21 ARG 39 1HH2 ARG 39 17.991 -2.526 -11.126 275 HH22 ARG 39 2HH2 ARG 39 19.474 -1.713 -10.761 276 H LEU 40 H LEU 40 12.510 0.269 -9.757 277 HA LEU 40 HA LEU 40 12.102 -1.479 -11.968 278 HB3 LEU 40 2HB LEU 40 13.079 1.373 -11.879 279 HG LEU 40 HG LEU 40 13.539 0.410 -14.091 280 HD11 LEU 40 1HD1 LEU 40 11.055 -0.891 -13.651 281 HD12 LEU 40 2HD1 LEU 40 12.182 -1.090 -14.992 282 HD13 LEU 40 3HD1 LEU 40 10.903 0.119 -15.089 283 HD21 LEU 40 3HD2 LEU 40 12.845 2.769 -13.836 284 HD22 LEU 40 1HD2 LEU 40 11.174 2.281 -14.119 285 HD23 LEU 40 2HD2 LEU 40 12.378 2.078 -15.392 286 H ASP 41 H ASP 41 13.586 -1.850 -13.724 287 HA ASP 41 HA ASP 41 15.573 -2.501 -14.624 288 HB3 ASP 41 2HB ASP 41 16.944 -0.702 -12.629 289 H ASN 42 H ASN 42 14.395 -3.786 -12.211 290 HA ASN 42 HA ASN 42 16.186 -4.633 -10.323 291 HB3 ASN 42 2HB ASN 42 14.094 -5.491 -9.925 292 HD21 ASN 42 1HD2 ASN 42 14.821 -6.629 -13.210 293 HD22 ASN 42 2HD2 ASN 42 13.221 -6.406 -13.822 294 H GLN 43 H GLN 43 18.024 -5.747 -10.321 295 HA GLN 43 HA GLN 43 18.823 -7.111 -12.795 296 HB3 GLN 43 2HB GLN 43 20.439 -5.494 -12.261 297 HG3 GLN 43 2HG GLN 43 20.171 -6.408 -9.419 298 HE21 GLN 43 1HE2 GLN 43 21.423 -4.446 -8.160 299 HE22 GLN 43 2HE2 GLN 43 23.118 -4.455 -8.492 300 H GLY 44 H GLY 44 18.228 -7.589 -9.397 301 HA2 GLY 44 2HA GLY 44 19.534 -10.018 -8.973 302 HA3 GLY 44 3HA GLY 44 18.086 -9.493 -8.127 303 H LYS 45 H LYS 45 16.115 -10.326 -8.687 304 HA LYS 45 HA LYS 45 15.494 -11.649 -11.070 305 HB3 LYS 45 2HB LYS 45 17.163 -13.292 -10.308 306 HG3 LYS 45 2HG LYS 45 16.504 -14.800 -8.406 307 HD3 LYS 45 2HD LYS 45 17.003 -12.114 -7.240 308 HE3 LYS 45 2HE LYS 45 17.275 -14.520 -6.206 309 HZ1 LYS 45 3HZ LYS 45 20.013 -14.547 -6.595 310 HZ2 LYS 45 1HZ LYS 45 19.335 -14.457 -8.143 311 HZ3 LYS 45 2HZ LYS 45 18.896 -15.714 -7.098 312 H ILE 46 H ILE 46 14.969 -11.272 -7.638 313 HA ILE 46 HA ILE 46 12.354 -12.338 -7.523 314 HB ILE 46 HB ILE 46 13.373 -10.136 -5.741 315 HG13 ILE 46 2HG1 ILE 46 14.403 -12.848 -6.095 316 HG21 ILE 46 1HG2 ILE 46 11.671 -12.483 -4.979 317 HG22 ILE 46 2HG2 ILE 46 11.858 -10.935 -4.156 318 HG23 ILE 46 3HG2 ILE 46 10.968 -11.024 -5.677 319 HD11 ILE 46 3HD1 ILE 46 15.676 -10.616 -5.912 320 HD12 ILE 46 1HD1 ILE 46 15.464 -10.824 -4.174 321 HD13 ILE 46 2HD1 ILE 46 16.329 -12.044 -5.108 322 H ASN 47 H ASN 47 13.586 -9.062 -8.064 323 HA ASN 47 HA ASN 47 12.506 -7.105 -8.583 324 HB3 ASN 47 2HB ASN 47 12.648 -8.216 -10.755 325 HD21 ASN 47 1HD2 ASN 47 12.459 -10.189 -11.512 326 HD22 ASN 47 2HD2 ASN 47 11.022 -11.149 -11.510 327 H ALA 48 H ALA 48 11.370 -8.330 -6.308 328 HA ALA 48 HA ALA 48 9.017 -6.884 -5.998 329 HB1 ALA 48 1HB ALA 48 7.933 -9.543 -5.883 330 HB2 ALA 48 2HB ALA 48 7.351 -8.133 -6.768 331 HB3 ALA 48 3HB ALA 48 8.552 -9.198 -7.498 332 H TRP 49 H TRP 49 8.468 -6.772 -3.877 333 HA TRP 49 HA TRP 49 10.182 -8.074 -1.989 334 HB3 TRP 49 2HB TRP 49 8.001 -6.041 -1.852 335 HD1 TRP 49 HD TRP 49 10.175 -7.073 1.139 336 HE1 TRP 49 1HE TRP 49 8.630 -7.569 3.137 337 HE3 TRP 49 3HE TRP 49 5.655 -6.727 -1.225 338 HZ2 TRP 49 2HZ TRP 49 5.861 -7.785 3.643 339 HZ3 TRP 49 3HZ TRP 49 3.607 -7.093 0.087 340 HH2 TRP 49 HH TRP 49 3.710 -7.612 2.471 341 H THR 50 H THR 50 9.853 -9.920 -0.939 342 HA THR 50 HA THR 50 7.163 -11.118 -1.045 343 HB THR 50 HB THR 50 9.561 -12.783 -0.438 344 HG1 THR 50 1HG THR 50 9.607 -13.051 -2.874 345 HG21 THR 50 3HG2 THR 50 7.512 -13.946 -0.357 346 HG22 THR 50 1HG2 THR 50 8.212 -14.365 -1.920 347 HG23 THR 50 2HG2 THR 50 6.920 -13.169 -1.825 348 H ALA 51 H ALA 51 6.678 -12.621 0.794 349 HA ALA 51 HA ALA 51 7.285 -11.260 3.292 350 HB1 ALA 51 1HB ALA 51 4.995 -11.700 3.047 351 HB2 ALA 51 2HB ALA 51 5.281 -13.355 2.510 352 HB3 ALA 51 3HB ALA 51 5.564 -12.913 4.194 353 H GLN 52 H GLN 52 7.652 -12.646 5.260 354 HA GLN 52 HA GLN 52 9.759 -14.582 4.646 355 HB3 GLN 52 2HB GLN 52 9.059 -13.338 7.309 356 HG3 GLN 52 2HG GLN 52 11.818 -13.962 6.980 357 HE21 GLN 52 1HE2 GLN 52 10.971 -16.610 8.411 358 HE22 GLN 52 2HE2 GLN 52 10.664 -16.074 10.024 359 H SER 53 H SER 53 7.047 -14.256 6.942 360 HA SER 53 HA SER 53 7.003 -17.156 7.276 361 HB3 SER 53 2HB SER 53 5.026 -16.327 8.896 362 HG SER 53 HG SER 53 6.705 -17.338 9.828 363 H ASN 54 H ASN 54 5.731 -15.025 5.154 364 HA ASN 54 HA ASN 54 3.815 -14.891 3.891 365 HB3 ASN 54 2HB ASN 54 4.953 -16.703 2.790 366 HD21 ASN 54 1HD2 ASN 54 6.399 -17.851 4.067 367 HD22 ASN 54 2HD2 ASN 54 5.979 -19.359 4.798 368 H SER 55 H SER 55 2.795 -14.281 6.115 369 HA SER 55 HA SER 55 0.479 -16.056 6.507 370 HB3 SER 55 2HB SER 55 1.306 -14.440 8.839 371 HG SER 55 HG SER 55 0.806 -17.213 8.724 372 H ALA 56 H ALA 56 -1.013 -14.542 8.194 373 HA ALA 56 HA ALA 56 -1.639 -12.210 6.523 374 HB1 ALA 56 1HB ALA 56 -3.827 -12.596 6.879 375 HB2 ALA 56 2HB ALA 56 -3.272 -14.221 7.281 376 HB3 ALA 56 3HB ALA 56 -3.582 -13.053 8.565 377 H LYS 57 H LYS 57 0.352 -12.485 8.829 378 HA LYS 57 HA LYS 57 -0.704 -10.282 10.480 379 HB3 LYS 57 2HB LYS 57 -0.303 -12.366 11.743 380 HG3 LYS 57 2HG LYS 57 2.602 -12.132 11.734 381 HD3 LYS 57 2HD LYS 57 1.140 -14.638 11.102 382 HE3 LYS 57 2HE LYS 57 3.686 -14.043 11.869 383 HZ1 LYS 57 3HZ LYS 57 3.966 -14.110 14.061 384 HZ2 LYS 57 1HZ LYS 57 2.882 -15.393 14.264 385 HZ3 LYS 57 2HZ LYS 57 2.308 -13.803 14.200 386 H GLU 58 H GLU 58 1.219 -10.780 7.947 387 HA GLU 58 HA GLU 58 3.504 -9.205 8.792 388 HB3 GLU 58 2HB GLU 58 3.654 -11.143 7.176 389 HG3 GLU 58 2HG GLU 58 1.662 -9.859 5.789 390 H TRP 59 H TRP 59 4.155 -7.268 7.605 391 HA TRP 59 HA TRP 59 2.153 -5.824 6.117 392 HB3 TRP 59 2HB TRP 59 1.274 -5.232 8.225 393 HD1 TRP 59 HD TRP 59 4.891 -3.962 8.873 394 HE1 TRP 59 1HE TRP 59 5.514 -4.571 11.294 395 HE3 TRP 59 3HE TRP 59 0.647 -6.490 10.195 396 HZ2 TRP 59 2HZ TRP 59 4.362 -5.940 13.477 397 HZ3 TRP 59 3HZ TRP 59 0.488 -7.418 12.468 398 HH2 TRP 59 HH TRP 59 2.307 -7.148 14.073 399 H LEU 60 H LEU 60 3.041 -4.289 4.821 400 HA LEU 60 HA LEU 60 5.928 -3.799 5.146 401 HB3 LEU 60 2HB LEU 60 4.235 -4.214 2.712 402 HG LEU 60 HG LEU 60 5.576 -2.186 2.228 403 HD11 LEU 60 1HD1 LEU 60 7.895 -2.142 2.320 404 HD12 LEU 60 2HD1 LEU 60 8.026 -3.898 2.420 405 HD13 LEU 60 3HD1 LEU 60 7.451 -2.977 3.809 406 HD21 LEU 60 3HD2 LEU 60 5.110 -4.281 0.643 407 HD22 LEU 60 1HD2 LEU 60 6.874 -4.319 0.635 408 HD23 LEU 60 2HD2 LEU 60 6.021 -2.868 0.110 409 H GLN 61 H GLN 61 6.521 -1.766 5.493 410 HA GLN 61 HA GLN 61 4.669 0.387 4.709 411 HB3 GLN 61 2HB GLN 61 4.887 -0.095 7.209 412 HG3 GLN 61 2HG GLN 61 7.248 1.615 7.369 413 HE21 GLN 61 1HE2 GLN 61 7.385 -1.741 8.131 414 HE22 GLN 61 2HE2 GLN 61 7.119 -1.589 9.830 415 H VAL 62 H VAL 62 5.537 2.241 3.828 416 HA VAL 62 HA VAL 62 8.404 2.101 3.153 417 HB VAL 62 HB VAL 62 6.204 3.430 1.564 418 HG11 VAL 62 1HG1 VAL 62 8.459 4.472 1.395 419 HG12 VAL 62 2HG1 VAL 62 9.077 2.929 0.802 420 HG13 VAL 62 3HG1 VAL 62 7.862 3.809 -0.126 421 HG21 VAL 62 3HG2 VAL 62 5.759 1.271 1.042 422 HG22 VAL 62 1HG2 VAL 62 7.120 1.502 -0.055 423 HG23 VAL 62 2HG2 VAL 62 7.368 0.713 1.503 424 H ASP 63 H ASP 63 9.668 3.705 3.829 425 HA ASP 63 HA ASP 63 8.398 6.226 4.676 426 HB3 ASP 63 2HB ASP 63 9.964 6.397 6.504 427 H LEU 64 H LEU 64 9.112 7.974 3.658 428 HA LEU 64 HA LEU 64 11.726 7.832 2.304 429 HB3 LEU 64 2HB LEU 64 10.325 8.052 0.526 430 HG LEU 64 HG LEU 64 8.400 9.420 2.343 431 HD11 LEU 64 1HD1 LEU 64 8.923 10.177 -0.431 432 HD12 LEU 64 2HD1 LEU 64 8.022 11.022 0.828 433 HD13 LEU 64 3HD1 LEU 64 7.244 9.744 -0.105 434 HD21 LEU 64 3HD2 LEU 64 8.586 6.905 1.300 435 HD22 LEU 64 1HD2 LEU 64 7.483 7.690 0.170 436 HD23 LEU 64 2HD2 LEU 64 7.101 7.652 1.891 437 H GLY 65 H GLY 65 9.606 9.697 4.352 438 HA2 GLY 65 2HA GLY 65 9.939 11.608 5.581 439 HA3 GLY 65 3HA GLY 65 11.617 11.092 5.647 440 H THR 66 H THR 66 10.153 11.763 2.579 441 HA THR 66 HA THR 66 11.829 14.171 2.364 442 HB THR 66 HB THR 66 12.317 12.302 0.776 443 HG1 THR 66 1HG THR 66 12.935 13.859 -0.508 444 HG21 THR 66 3HG2 THR 66 9.515 12.305 0.468 445 HG22 THR 66 1HG2 THR 66 10.692 11.293 -0.366 446 HG23 THR 66 2HG2 THR 66 10.192 12.828 -1.073 447 H GLN 67 H GLN 67 8.645 13.176 2.665 448 HA GLN 67 HA GLN 67 6.614 14.158 2.329 449 HB3 GLN 67 2HB GLN 67 7.927 16.842 2.339 450 HG3 GLN 67 2HG GLN 67 5.413 15.656 3.332 451 HE21 GLN 67 1HE2 GLN 67 6.537 18.900 3.952 452 HE22 GLN 67 2HE2 GLN 67 6.366 18.842 5.671 453 H ARG 68 H ARG 68 6.506 13.357 0.143 454 HA ARG 68 HA ARG 68 6.767 15.496 -1.867 455 HB3 ARG 68 2HB ARG 68 6.786 13.348 -3.436 456 HG3 ARG 68 2HG ARG 68 9.278 13.264 -3.274 457 HD3 ARG 68 2HD ARG 68 8.027 16.007 -3.370 458 HE ARG 68 HE ARG 68 10.727 15.182 -3.933 459 HH11 ARG 68 1HH1 ARG 68 8.204 17.463 -4.672 460 HH12 ARG 68 2HH1 ARG 68 9.294 18.686 -5.234 461 HH21 ARG 68 1HH2 ARG 68 12.173 16.783 -4.672 462 HH22 ARG 68 2HH2 ARG 68 11.552 18.298 -5.235 463 H GLN 69 H GLN 69 5.094 15.799 -3.318 464 HA GLN 69 HA GLN 69 2.510 14.886 -2.426 465 HB3 GLN 69 2HB GLN 69 3.460 16.794 -4.539 466 HG3 GLN 69 2HG GLN 69 0.638 15.835 -4.149 467 HE21 GLN 69 1HE2 GLN 69 1.646 17.493 -6.952 468 HE22 GLN 69 2HE2 GLN 69 0.806 18.974 -6.661 469 H VAL 70 H VAL 70 1.636 13.035 -3.050 470 HA VAL 70 HA VAL 70 2.605 11.685 -5.436 471 HB VAL 70 HB VAL 70 1.338 9.767 -4.691 472 HG11 VAL 70 1HG1 VAL 70 3.453 9.904 -3.659 473 HG12 VAL 70 2HG1 VAL 70 2.917 11.165 -2.548 474 HG13 VAL 70 3HG1 VAL 70 2.320 9.515 -2.365 475 HG21 VAL 70 3HG2 VAL 70 0.237 10.178 -2.291 476 HG22 VAL 70 1HG2 VAL 70 0.000 11.782 -2.986 477 HG23 VAL 70 2HG2 VAL 70 -0.663 10.364 -3.797 478 H THR 71 H THR 71 1.342 11.102 -7.191 479 HA THR 71 HA THR 71 -1.387 12.169 -7.316 480 HB THR 71 HB THR 71 -0.089 12.533 -9.866 481 HG1 THR 71 1HG THR 71 1.675 13.544 -9.299 482 HG21 THR 71 3HG2 THR 71 -1.351 14.423 -9.910 483 HG22 THR 71 1HG2 THR 71 -0.980 14.843 -8.240 484 HG23 THR 71 2HG2 THR 71 -2.188 13.606 -8.591 485 H GLY 72 H GLY 72 -0.104 9.466 -7.144 486 HA2 GLY 72 2HA GLY 72 -1.854 7.994 -8.677 487 HA3 GLY 72 3HA GLY 72 -0.432 8.202 -9.687 488 H ILE 73 H ILE 73 -1.339 5.701 -8.839 489 HA ILE 73 HA ILE 73 0.979 4.839 -7.277 490 HB ILE 73 HB ILE 73 -0.364 3.310 -5.923 491 HG13 ILE 73 2HG1 ILE 73 -2.456 4.180 -7.756 492 HG21 ILE 73 1HG2 ILE 73 0.146 5.347 -4.854 493 HG22 ILE 73 2HG2 ILE 73 -1.063 6.229 -5.785 494 HG23 ILE 73 3HG2 ILE 73 -1.570 5.074 -4.554 495 HD11 ILE 73 3HD1 ILE 73 -1.882 1.855 -6.030 496 HD12 ILE 73 1HD1 ILE 73 -3.574 2.170 -6.417 497 HD13 ILE 73 2HD1 ILE 73 -2.404 1.925 -7.714 498 H ILE 74 H ILE 74 1.373 2.500 -7.443 499 HA ILE 74 HA ILE 74 0.014 1.049 -9.538 500 HB ILE 74 HB ILE 74 1.507 2.263 -10.949 501 HG13 ILE 74 2HG1 ILE 74 2.724 -0.456 -10.415 502 HG21 ILE 74 1HG2 ILE 74 3.348 3.154 -10.085 503 HG22 ILE 74 2HG2 ILE 74 3.267 2.085 -8.686 504 HG23 ILE 74 3HG2 ILE 74 4.094 1.558 -10.151 505 HD11 ILE 74 3HD1 ILE 74 1.029 -0.505 -12.661 506 HD12 ILE 74 1HD1 ILE 74 0.865 -1.392 -11.146 507 HD13 ILE 74 2HD1 ILE 74 0.109 0.191 -11.327 508 H THR 75 H THR 75 0.173 -1.118 -9.275 509 HA THR 75 HA THR 75 2.142 -2.117 -7.326 510 HB THR 75 HB THR 75 0.115 -2.123 -6.104 511 HG1 THR 75 1HG THR 75 0.255 -4.743 -7.207 512 HG21 THR 75 3HG2 THR 75 -1.154 -3.302 -8.575 513 HG22 THR 75 1HG2 THR 75 -1.491 -1.734 -7.842 514 HG23 THR 75 2HG2 THR 75 -1.951 -3.216 -7.004 515 H GLN 76 H GLN 76 3.008 -4.138 -7.716 516 HA GLN 76 HA GLN 76 2.083 -5.624 -10.054 517 HB3 GLN 76 2HB GLN 76 4.995 -5.468 -9.972 518 HG3 GLN 76 2HG GLN 76 3.856 -4.403 -12.358 519 HE21 GLN 76 1HE2 GLN 76 3.796 -6.947 -13.701 520 HE22 GLN 76 2HE2 GLN 76 5.422 -7.530 -13.740 521 H GLY 77 H GLY 77 2.302 -7.798 -9.863 522 HA2 GLY 77 2HA GLY 77 3.321 -8.773 -7.299 523 HA3 GLY 77 3HA GLY 77 2.290 -9.662 -8.412 524 H ALA 78 H ALA 78 4.209 -11.141 -7.505 525 HA ALA 78 HA ALA 78 6.224 -11.189 -9.654 526 HB1 ALA 78 1HB ALA 78 7.864 -11.030 -8.171 527 HB2 ALA 78 2HB ALA 78 6.682 -10.902 -6.867 528 HB3 ALA 78 3HB ALA 78 7.280 -12.486 -7.364 529 H ARG 79 H ARG 79 6.821 -13.212 -10.439 530 HA ARG 79 HA ARG 79 5.203 -15.481 -9.486 531 HB3 ARG 79 2HB ARG 79 4.401 -14.520 -11.663 532 HG3 ARG 79 2HG ARG 79 7.148 -14.685 -12.364 533 HD3 ARG 79 2HD ARG 79 5.960 -16.996 -13.184 534 HE ARG 79 HE ARG 79 4.755 -15.293 -14.878 535 HH11 ARG 79 1HH1 ARG 79 7.288 -17.640 -15.317 536 HH12 ARG 79 2HH1 ARG 79 6.867 -17.978 -16.964 537 HH21 ARG 79 1HH2 ARG 79 4.192 -15.729 -17.045 538 HH22 ARG 79 2HH2 ARG 79 5.107 -16.889 -17.946 539 H ASP 80 H ASP 80 6.148 -17.545 -9.642 540 HA ASP 80 HA ASP 80 9.079 -17.493 -9.933 541 HB3 ASP 80 2HB ASP 80 7.572 -19.582 -8.379 542 H PHE 81 H PHE 81 7.404 -17.813 -12.174 543 HA PHE 81 HA PHE 81 7.204 -19.107 -14.035 544 HB3 PHE 81 2HB PHE 81 8.850 -20.793 -14.460 545 HD1 PHE 81 1HD PHE 81 9.668 -18.816 -15.649 546 HD2 PHE 81 2HD PHE 81 10.618 -19.512 -11.559 547 HE1 PHE 81 1HE PHE 81 11.483 -17.160 -15.793 548 HE2 PHE 81 2HE PHE 81 12.435 -17.859 -11.696 549 HZ PHE 81 HZ PHE 81 12.869 -16.680 -13.815 550 H GLY 82 H GLY 82 5.067 -19.695 -13.699 551 HA2 GLY 82 2HA GLY 82 3.513 -21.456 -13.806 552 HA3 GLY 82 3HA GLY 82 4.686 -22.508 -13.029 553 H HIS 83 H HIS 83 5.301 -20.983 -10.780 554 HA HIS 83 HA HIS 83 2.839 -21.344 -9.252 555 HB3 HIS 83 2HB HIS 83 4.522 -20.908 -7.303 556 HD1 HIS 83 1HD HIS 83 5.669 -23.127 -6.260 557 HD2 HIS 83 2HD HIS 83 3.441 -23.637 -9.730 558 HE1 HIS 83 1HE HIS 83 5.181 -25.590 -6.389 559 H ILE 84 H ILE 84 2.941 -19.083 -10.949 560 HA ILE 84 HA ILE 84 3.759 -16.678 -10.108 561 HB ILE 84 HB ILE 84 0.905 -17.230 -10.929 562 HG13 ILE 84 2HG1 ILE 84 3.317 -17.633 -12.349 563 HG21 ILE 84 1HG2 ILE 84 2.449 -14.774 -10.452 564 HG22 ILE 84 2HG2 ILE 84 1.522 -14.806 -11.952 565 HG23 ILE 84 3HG2 ILE 84 0.707 -15.050 -10.407 566 HD11 ILE 84 3HD1 ILE 84 1.608 -18.980 -13.051 567 HD12 ILE 84 1HD1 ILE 84 0.426 -17.669 -13.046 568 HD13 ILE 84 2HD1 ILE 84 1.629 -17.768 -14.333 569 H GLN 85 H GLN 85 3.462 -15.284 -8.462 570 HA GLN 85 HA GLN 85 1.459 -15.989 -6.420 571 HB3 GLN 85 2HB GLN 85 2.969 -15.402 -4.681 572 HG3 GLN 85 2HG GLN 85 4.398 -17.004 -6.780 573 HE21 GLN 85 1HE2 GLN 85 5.116 -18.706 -4.410 574 HE22 GLN 85 2HE2 GLN 85 6.543 -17.971 -3.769 575 H TYR 86 H TYR 86 0.609 -14.222 -5.177 576 HA TYR 86 HA TYR 86 1.175 -11.523 -5.622 577 HB3 TYR 86 2HB TYR 86 0.407 -11.660 -7.845 578 HD1 TYR 86 2HD TYR 86 -2.951 -12.325 -6.511 579 HD2 TYR 86 1HD TYR 86 0.270 -13.852 -8.834 580 HE1 TYR 86 2HE TYR 86 -4.413 -14.115 -7.353 581 HE2 TYR 86 1HE TYR 86 -1.184 -15.645 -9.683 582 HH TYR 86 HH TYR 86 -4.536 -15.612 -9.337 583 H VAL 87 H VAL 87 -0.237 -10.113 -4.485 584 HA VAL 87 HA VAL 87 -1.801 -11.498 -2.444 585 HB VAL 87 HB VAL 87 -1.161 -8.554 -2.520 586 HG11 VAL 87 1HG1 VAL 87 -2.025 -10.476 -0.374 587 HG12 VAL 87 2HG1 VAL 87 -1.350 -8.885 -0.016 588 HG13 VAL 87 3HG1 VAL 87 -2.849 -9.021 -0.936 589 HG21 VAL 87 3HG2 VAL 87 0.775 -9.044 -1.102 590 HG22 VAL 87 1HG2 VAL 87 0.479 -10.772 -1.297 591 HG23 VAL 87 2HG2 VAL 87 0.934 -9.792 -2.691 592 H ALA 88 H ALA 88 -3.907 -10.758 -1.830 593 HA ALA 88 HA ALA 88 -5.387 -9.542 -4.070 594 HB1 ALA 88 1HB ALA 88 -6.616 -11.394 -4.009 595 HB2 ALA 88 2HB ALA 88 -5.866 -11.923 -2.502 596 HB3 ALA 88 3HB ALA 88 -7.247 -10.828 -2.461 597 H SER 89 H SER 89 -6.237 -10.109 -0.668 598 HA SER 89 HA SER 89 -7.272 -7.397 -0.499 599 HB3 SER 89 2HB SER 89 -7.378 -9.028 1.937 600 HG SER 89 HG SER 89 -9.594 -8.460 1.713 601 H TYR 90 H TYR 90 -6.245 -5.755 0.436 602 HA TYR 90 HA TYR 90 -4.392 -6.142 2.602 603 HB3 TYR 90 2HB TYR 90 -2.862 -6.625 0.815 604 HD1 TYR 90 2HD TYR 90 -3.258 -3.015 0.094 605 HD2 TYR 90 1HD TYR 90 -3.486 -6.977 -1.441 606 HE1 TYR 90 2HE TYR 90 -3.473 -2.114 -2.184 607 HE2 TYR 90 1HE TYR 90 -3.700 -6.087 -3.724 608 HH TYR 90 HH TYR 90 -2.912 -3.083 -4.606 609 H LYS 91 H LYS 91 -4.073 -4.295 3.791 610 HA LYS 91 HA LYS 91 -5.710 -1.995 2.997 611 HB3 LYS 91 2HB LYS 91 -4.637 -1.804 5.666 612 HG3 LYS 91 2HG LYS 91 -7.308 -2.376 5.933 613 HD3 LYS 91 2HD LYS 91 -6.373 0.368 5.171 614 HE3 LYS 91 2HE LYS 91 -8.635 -0.756 6.483 615 HZ1 LYS 91 3HZ LYS 91 -8.188 1.222 8.308 616 HZ2 LYS 91 1HZ LYS 91 -6.725 0.374 8.282 617 HZ3 LYS 91 2HZ LYS 91 -8.167 -0.441 8.619 618 H VAL 92 H VAL 92 -4.469 -0.695 1.752 619 HA VAL 92 HA VAL 92 -1.784 0.013 2.714 620 HB VAL 92 HB VAL 92 -1.762 -0.756 0.439 621 HG11 VAL 92 1HG1 VAL 92 -3.522 -0.502 -0.886 622 HG12 VAL 92 2HG1 VAL 92 -4.271 0.580 0.289 623 HG13 VAL 92 3HG1 VAL 92 -3.211 1.232 -0.960 624 HG21 VAL 92 3HG2 VAL 92 -1.598 2.213 0.119 625 HG22 VAL 92 1HG2 VAL 92 -0.480 1.372 1.193 626 HG23 VAL 92 2HG2 VAL 92 -0.537 0.958 -0.520 627 H ALA 93 H ALA 93 -1.640 1.819 3.855 628 HA ALA 93 HA ALA 93 -3.404 4.075 3.152 629 HB1 ALA 93 1HB ALA 93 -4.049 3.043 5.293 630 HB2 ALA 93 2HB ALA 93 -2.432 3.367 5.918 631 HB3 ALA 93 3HB ALA 93 -3.495 4.707 5.487 632 H HIS 94 H HIS 94 -2.532 6.183 3.426 633 HA HIS 94 HA HIS 94 0.414 6.243 3.442 634 HB3 HIS 94 2HB HIS 94 0.194 8.294 2.026 635 HD1 HIS 94 1HD HIS 94 0.910 7.821 -0.316 636 HD2 HIS 94 2HD HIS 94 -1.509 4.818 1.230 637 HE1 HIS 94 1HE HIS 94 0.933 5.987 -2.036 638 H SER 95 H SER 95 1.461 7.780 4.649 639 HA SER 95 HA SER 95 -0.229 9.514 6.327 640 HB3 SER 95 2HB SER 95 2.350 8.338 7.333 641 HG SER 95 HG SER 95 0.157 9.689 8.378 642 H ASP 96 H ASP 96 0.223 11.594 6.108 643 HA ASP 96 HA ASP 96 2.674 12.401 4.764 644 HB3 ASP 96 2HB ASP 96 0.341 14.103 5.665 645 H ASP 97 H ASP 97 1.108 12.692 7.893 646 HA ASP 97 HA ASP 97 3.299 14.344 8.902 647 HB3 ASP 97 2HB ASP 97 0.853 13.410 10.408 648 H GLY 98 H GLY 98 2.257 11.087 8.818 649 HA2 GLY 98 2HA GLY 98 3.824 9.356 9.415 650 HA3 GLY 98 3HA GLY 98 4.397 10.386 10.719 651 H VAL 99 H VAL 99 1.654 11.111 11.521 652 HA VAL 99 HA VAL 99 1.068 8.661 13.021 653 HB VAL 99 HB VAL 99 1.486 10.661 14.365 654 HG11 VAL 99 1HG1 VAL 99 0.730 12.327 12.730 655 HG12 VAL 99 2HG1 VAL 99 -0.939 11.822 12.997 656 HG13 VAL 99 3HG1 VAL 99 -0.022 12.567 14.307 657 HG21 VAL 99 3HG2 VAL 99 -0.435 8.851 14.781 658 HG22 VAL 99 1HG2 VAL 99 -0.117 10.180 15.895 659 HG23 VAL 99 2HG2 VAL 99 -1.430 10.306 14.725 660 H GLN 100 H GLN 100 -0.383 11.023 10.867 661 HA GLN 100 HA GLN 100 -3.010 9.831 11.062 662 HB3 GLN 100 2HB GLN 100 -3.642 11.493 9.355 663 HG3 GLN 100 2HG GLN 100 -1.903 12.875 11.374 664 HE21 GLN 100 1HE2 GLN 100 -2.249 14.990 11.473 665 HE22 GLN 100 2HE2 GLN 100 -3.500 15.842 10.637 666 H TRP 101 H TRP 101 -3.126 7.825 10.229 667 HA TRP 101 HA TRP 101 -1.853 7.259 7.660 668 HB3 TRP 101 2HB TRP 101 -2.154 4.955 8.143 669 HD1 TRP 101 HD TRP 101 0.029 7.101 9.247 670 HE1 TRP 101 1HE TRP 101 1.357 6.493 11.366 671 HE3 TRP 101 3HE TRP 101 -3.113 3.566 11.187 672 HZ2 TRP 101 2HZ TRP 101 1.106 4.745 13.569 673 HZ3 TRP 101 3HZ TRP 101 -2.496 2.473 13.303 674 HH2 TRP 101 HH TRP 101 -0.429 3.052 14.468 675 H THR 102 H THR 102 -3.041 7.882 5.967 676 HA THR 102 HA THR 102 -5.937 7.783 6.047 677 HB THR 102 HB THR 102 -4.073 8.617 3.815 678 HG1 THR 102 1HG THR 102 -3.965 10.069 5.526 679 HG21 THR 102 3HG2 THR 102 -7.061 8.603 4.080 680 HG22 THR 102 1HG2 THR 102 -6.062 8.076 2.726 681 HG23 THR 102 2HG2 THR 102 -6.253 9.796 3.063 682 H VAL 103 H VAL 103 -6.831 5.830 5.804 683 HA VAL 103 HA VAL 103 -5.622 3.780 4.183 684 HB VAL 103 HB VAL 103 -7.473 2.375 4.843 685 HG11 VAL 103 1HG1 VAL 103 -7.318 3.357 7.466 686 HG12 VAL 103 2HG1 VAL 103 -6.327 2.099 6.727 687 HG13 VAL 103 3HG1 VAL 103 -5.790 3.778 6.695 688 HG21 VAL 103 3HG2 VAL 103 -8.700 4.961 5.746 689 HG22 VAL 103 1HG2 VAL 103 -9.374 3.727 4.683 690 HG23 VAL 103 2HG2 VAL 103 -9.218 3.412 6.411 691 H TYR 104 H TYR 104 -7.003 2.578 2.571 692 HA TYR 104 HA TYR 104 -8.318 4.532 0.813 693 HB3 TYR 104 2HB TYR 104 -7.921 2.531 -0.871 694 HD1 TYR 104 1HD TYR 104 -5.649 4.669 1.171 695 HD2 TYR 104 2HD TYR 104 -6.747 3.326 -2.714 696 HE1 TYR 104 1HE TYR 104 -4.077 6.278 0.177 697 HE2 TYR 104 2HE TYR 104 -5.177 4.931 -3.718 698 HH TYR 104 HH TYR 104 -3.956 6.839 -3.270 699 H GLU 105 H GLU 105 -10.344 4.377 1.886 700 HA GLU 105 HA GLU 105 -11.767 2.089 2.481 701 HB3 GLU 105 2HB GLU 105 -12.645 4.157 3.220 702 HG3 GLU 105 2HG GLU 105 -12.177 5.034 0.484 703 H GLU 106 H GLU 106 -13.288 0.830 1.391 704 HA GLU 106 HA GLU 106 -12.867 0.697 -1.496 705 HB3 GLU 106 2HB GLU 106 -14.537 -1.293 -0.029 706 HG3 GLU 106 2HG GLU 106 -12.738 -2.693 -1.474 707 H GLN 107 H GLN 107 -15.373 1.290 0.872 708 HA GLN 107 HA GLN 107 -17.249 1.856 -1.329 709 HB3 GLN 107 2HB GLN 107 -18.460 0.223 -0.336 710 HG3 GLN 107 2HG GLN 107 -16.809 0.740 2.093 711 HE21 GLN 107 1HE2 GLN 107 -18.627 1.465 3.377 712 HE22 GLN 107 2HE2 GLN 107 -19.706 0.296 4.051 713 H GLY 108 H GLY 108 -17.409 2.569 2.143 714 HA2 GLY 108 2HA GLY 108 -16.977 5.404 1.649 715 HA3 GLY 108 3HA GLY 108 -18.596 4.960 2.165 716 H SER 109 H SER 109 -16.178 2.939 3.418 717 HA SER 109 HA SER 109 -16.198 4.439 5.957 718 HB3 SER 109 2HB SER 109 -16.474 1.488 5.427 719 HG SER 109 HG SER 109 -16.132 2.412 8.037 720 H SER 110 H SER 110 -14.435 1.528 4.978 721 HA SER 110 HA SER 110 -11.974 2.666 4.382 722 HB3 SER 110 2HB SER 110 -11.714 3.579 6.530 723 HG SER 110 HG SER 110 -12.465 2.671 8.338 724 H LYS 111 H LYS 111 -13.620 0.448 3.658 725 HA LYS 111 HA LYS 111 -12.610 -2.001 4.639 726 HB3 LYS 111 2HB LYS 111 -14.036 -1.260 2.088 727 HG3 LYS 111 2HG LYS 111 -12.712 -3.276 1.645 728 HD3 LYS 111 2HD LYS 111 -13.793 -4.036 4.273 729 HE3 LYS 111 2HE LYS 111 -14.959 -5.489 2.442 730 HZ1 LYS 111 3HZ LYS 111 -12.185 -6.189 2.129 731 HZ2 LYS 111 1HZ LYS 111 -13.497 -6.477 1.101 732 HZ3 LYS 111 2HZ LYS 111 -13.191 -7.524 2.392 733 H VAL 112 H VAL 112 -10.911 -3.238 4.044 734 HA VAL 112 HA VAL 112 -8.649 -2.150 2.894 735 HB VAL 112 HB VAL 112 -7.748 -4.381 2.735 736 HG11 VAL 112 1HG1 VAL 112 -9.225 -5.017 5.108 737 HG12 VAL 112 2HG1 VAL 112 -7.566 -4.438 4.949 738 HG13 VAL 112 3HG1 VAL 112 -8.896 -3.285 5.055 739 HG21 VAL 112 3HG2 VAL 112 -9.538 -6.233 3.458 740 HG22 VAL 112 1HG2 VAL 112 -10.605 -5.130 2.589 741 HG23 VAL 112 2HG2 VAL 112 -9.206 -5.828 1.773 742 H PHE 113 H PHE 113 -7.525 -3.108 0.898 743 HA PHE 113 HA PHE 113 -9.395 -2.883 -1.354 744 HB3 PHE 113 2HB PHE 113 -6.834 -2.747 -2.401 745 HD1 PHE 113 1HD PHE 113 -9.285 -0.631 -0.573 746 HD2 PHE 113 2HD PHE 113 -6.795 -1.074 -3.998 747 HE1 PHE 113 1HE PHE 113 -10.269 1.403 -1.548 748 HE2 PHE 113 2HE PHE 113 -7.774 0.960 -4.976 749 HZ PHE 113 HZ PHE 113 -9.513 2.201 -3.752 750 H GLN 114 H GLN 114 -9.871 -4.627 -2.506 751 HA GLN 114 HA GLN 114 -8.148 -6.993 -2.246 752 HB3 GLN 114 2HB GLN 114 -10.332 -7.532 -1.532 753 HG3 GLN 114 2HG GLN 114 -12.086 -7.157 -3.633 754 HE21 GLN 114 1HE2 GLN 114 -10.699 -5.461 -0.858 755 HE22 GLN 114 2HE2 GLN 114 -12.193 -5.251 -0.016 756 H GLY 115 H GLY 115 -7.278 -7.988 -4.006 757 HA2 GLY 115 2HA GLY 115 -8.055 -7.873 -6.638 758 HA3 GLY 115 3HA GLY 115 -7.054 -6.447 -6.409 759 H ASN 116 H ASN 116 -6.997 -9.551 -7.439 760 HA ASN 116 HA ASN 116 -4.655 -10.625 -6.334 761 HB3 ASN 116 2HB ASN 116 -4.577 -11.923 -8.550 762 HD21 ASN 116 1HD2 ASN 116 -7.458 -12.718 -8.946 763 HD22 ASN 116 2HD2 ASN 116 -7.837 -13.650 -7.542 764 H LEU 117 H LEU 117 -5.108 -8.837 -9.384 765 HA LEU 117 HA LEU 117 -3.707 -7.411 -10.493 766 HB3 LEU 117 2HB LEU 117 -1.837 -6.466 -9.445 767 HG LEU 117 HG LEU 117 -4.029 -7.037 -7.565 768 HD11 LEU 117 1HD1 LEU 117 -2.962 -6.527 -5.591 769 HD12 LEU 117 2HD1 LEU 117 -1.583 -5.783 -6.402 770 HD13 LEU 117 3HD1 LEU 117 -1.757 -7.538 -6.390 771 HD21 LEU 117 3HD2 LEU 117 -3.475 -4.495 -7.194 772 HD22 LEU 117 1HD2 LEU 117 -4.313 -5.038 -8.647 773 HD23 LEU 117 2HD2 LEU 117 -2.583 -4.694 -8.703 774 H ASP 118 H ASP 118 -1.919 -10.107 -9.001 775 HA ASP 118 HA ASP 118 -0.592 -11.724 -9.893 776 HB3 ASP 118 2HB ASP 118 -0.988 -11.548 -12.676 777 H ASN 119 H ASN 119 1.326 -12.067 -11.279 778 HA ASN 119 HA ASN 119 2.941 -9.695 -11.314 779 HB3 ASN 119 2HB ASN 119 3.427 -12.599 -11.892 780 HD21 ASN 119 1HD2 ASN 119 5.791 -10.125 -11.224 781 HD22 ASN 119 2HD2 ASN 119 6.719 -10.347 -12.664 782 H ASN 120 H ASN 120 1.421 -11.772 -13.714 783 HA ASN 120 HA ASN 120 2.650 -10.925 -16.030 784 HB3 ASN 120 2HB ASN 120 0.537 -11.502 -17.186 785 HD21 ASN 120 1HD2 ASN 120 -0.646 -13.585 -15.077 786 HD22 ASN 120 2HD2 ASN 120 0.441 -14.913 -15.275 787 H SER 121 H SER 121 -0.383 -9.578 -14.715 788 HA SER 121 HA SER 121 0.196 -7.089 -16.175 789 HB3 SER 121 2HB SER 121 -1.990 -6.946 -16.707 790 HG SER 121 HG SER 121 -1.438 -9.381 -16.652 791 H HIS 122 H HIS 122 -0.130 -5.080 -15.139 792 HA HIS 122 HA HIS 122 0.163 -5.224 -12.218 793 HB3 HIS 122 2HB HIS 122 2.045 -4.136 -13.151 794 HD1 HIS 122 1HD HIS 122 -0.957 -2.836 -15.000 795 HD2 HIS 122 2HD HIS 122 3.187 -2.582 -15.142 796 HE1 HIS 122 1HE HIS 122 -0.426 -1.719 -17.190 797 H LYS 123 H LYS 123 -0.531 -2.872 -11.295 798 HA LYS 123 HA LYS 123 -3.106 -2.066 -12.394 799 HB3 LYS 123 2HB LYS 123 -3.054 -2.656 -9.469 800 HG3 LYS 123 2HG LYS 123 -5.421 -3.439 -10.093 801 HD3 LYS 123 2HD LYS 123 -4.699 -0.525 -10.412 802 HE3 LYS 123 2HE LYS 123 -7.240 -1.996 -10.053 803 HZ1 LYS 123 3HZ LYS 123 -7.496 0.643 -9.034 804 HZ2 LYS 123 1HZ LYS 123 -6.453 -0.268 -8.061 805 HZ3 LYS 123 2HZ LYS 123 -8.023 -0.819 -8.363 806 H LYS 124 H LYS 124 -3.022 0.070 -12.502 807 HA LYS 124 HA LYS 124 -1.675 1.539 -10.330 808 HB3 LYS 124 2HB LYS 124 -0.532 1.577 -12.595 809 HG3 LYS 124 2HG LYS 124 -2.354 3.712 -13.482 810 HD3 LYS 124 2HD LYS 124 -1.782 2.010 -15.577 811 HE3 LYS 124 2HE LYS 124 0.202 3.701 -15.877 812 HZ1 LYS 124 3HZ LYS 124 -1.303 5.289 -16.743 813 HZ2 LYS 124 1HZ LYS 124 -2.557 4.777 -15.728 814 HZ3 LYS 124 2HZ LYS 124 -2.021 3.775 -16.980 815 H ASN 125 H ASN 125 -2.674 3.348 -9.508 816 HA ASN 125 HA ASN 125 -5.454 3.765 -10.386 817 HB3 ASN 125 2HB ASN 125 -4.504 4.710 -7.718 818 HD21 ASN 125 1HD2 ASN 125 -6.425 3.083 -6.401 819 HD22 ASN 125 2HD2 ASN 125 -7.989 3.680 -6.826 820 H ILE 126 H ILE 126 -6.224 5.829 -10.722 821 HA ILE 126 HA ILE 126 -4.308 7.782 -11.521 822 HB ILE 126 HB ILE 126 -6.794 7.328 -12.338 823 HG13 ILE 126 2HG1 ILE 126 -4.875 9.414 -12.640 824 HG21 ILE 126 1HG2 ILE 126 -7.266 9.730 -10.614 825 HG22 ILE 126 2HG2 ILE 126 -8.438 8.701 -11.434 826 HG23 ILE 126 3HG2 ILE 126 -7.584 8.103 -10.012 827 HD11 ILE 126 3HD1 ILE 126 -5.567 7.968 -14.458 828 HD12 ILE 126 1HD1 ILE 126 -7.194 8.647 -14.396 829 HD13 ILE 126 2HD1 ILE 126 -5.832 9.663 -14.869 830 H PHE 127 H PHE 127 -4.863 10.180 -10.815 831 HA PHE 127 HA PHE 127 -4.153 10.338 -8.045 832 HB3 PHE 127 2HB PHE 127 -3.101 11.985 -9.298 833 HD1 PHE 127 2HD PHE 127 -6.415 13.458 -9.924 834 HD2 PHE 127 1HD PHE 127 -2.961 11.663 -11.643 835 HE1 PHE 127 2HE PHE 127 -7.175 14.145 -12.160 836 HE2 PHE 127 1HE PHE 127 -3.715 12.348 -13.882 837 HZ PHE 127 HZ PHE 127 -5.826 13.590 -14.144 838 H GLU 128 H GLU 128 -6.338 9.130 -7.641 839 HA GLU 128 HA GLU 128 -8.771 10.521 -7.711 840 HB3 GLU 128 2HB GLU 128 -8.434 8.698 -5.433 841 HG3 GLU 128 2HG GLU 128 -10.254 8.855 -7.807 842 H LYS 129 H LYS 129 -6.048 10.828 -5.635 843 HA LYS 129 HA LYS 129 -7.087 13.148 -4.381 844 HB3 LYS 129 2HB LYS 129 -6.662 11.822 -2.028 845 HG3 LYS 129 2HG LYS 129 -9.429 11.587 -2.987 846 HD3 LYS 129 2HD LYS 129 -8.034 12.046 -0.568 847 HE3 LYS 129 2HE LYS 129 -9.476 13.960 0.255 848 HZ1 LYS 129 3HZ LYS 129 -7.816 15.442 -0.138 849 HZ2 LYS 129 1HZ LYS 129 -7.661 15.034 -1.773 850 HZ3 LYS 129 2HZ LYS 129 -7.002 14.027 -0.583 851 HA PRO 130 HA PRO 130 -2.482 12.694 -4.551 852 HB3 PRO 130 2HB PRO 130 -2.406 13.698 -6.616 853 HG3 PRO 130 2HG PRO 130 -4.122 15.092 -7.337 854 HD3 PRO 130 2HD PRO 130 -5.354 13.271 -6.646 855 H PHE 131 H PHE 131 -1.002 13.578 -3.145 856 HA PHE 131 HA PHE 131 -1.218 16.046 -1.846 857 HB3 PHE 131 2HB PHE 131 -3.205 14.813 -0.829 858 HD1 PHE 131 2HD PHE 131 -2.568 12.301 -1.511 859 HD2 PHE 131 1HD PHE 131 -1.451 14.250 2.104 860 HE1 PHE 131 2HE PHE 131 -2.293 10.113 -0.421 861 HE2 PHE 131 1HE PHE 131 -1.173 12.065 3.200 862 HZ PHE 131 HZ PHE 131 -1.595 9.994 1.938 863 H MET 132 H MET 132 0.295 16.200 0.056 864 HA MET 132 HA MET 132 2.760 14.947 -0.617 865 HB3 MET 132 2HB MET 132 3.473 16.071 1.614 866 HG3 MET 132 2HG MET 132 2.937 17.200 -0.975 867 HE1 MET 132 3HE MET 132 1.366 18.393 -1.585 868 HE2 MET 132 1HE MET 132 0.258 19.178 -0.461 869 HE3 MET 132 2HE MET 132 1.376 20.149 -1.419 870 H ALA 133 H ALA 133 3.895 13.350 0.419 871 HA ALA 133 HA ALA 133 2.646 12.050 2.733 872 HB1 ALA 133 1HB ALA 133 2.466 9.990 1.782 873 HB2 ALA 133 2HB ALA 133 2.199 10.983 0.349 874 HB3 ALA 133 3HB ALA 133 3.786 10.274 0.646 875 H ARG 134 H ARG 134 4.066 10.977 4.113 876 HA ARG 134 HA ARG 134 6.923 11.456 3.571 877 HB3 ARG 134 2HB ARG 134 6.273 11.090 6.378 878 HG3 ARG 134 2HG ARG 134 7.194 13.721 5.503 879 HD3 ARG 134 2HD ARG 134 7.372 12.994 7.806 880 HE ARG 134 HE ARG 134 8.335 10.552 6.768 881 HH11 ARG 134 1HH1 ARG 134 8.805 12.761 9.417 882 HH12 ARG 134 2HH1 ARG 134 9.363 11.538 10.510 883 HH21 ARG 134 1HH2 ARG 134 9.068 8.932 8.198 884 HH22 ARG 134 2HH2 ARG 134 9.513 9.360 9.814 885 H TYR 135 H TYR 135 4.503 9.208 4.675 886 HA TYR 135 HA TYR 135 6.171 6.968 4.137 887 HB3 TYR 135 2HB TYR 135 6.358 8.051 6.757 888 HD1 TYR 135 2HD TYR 135 6.071 4.407 6.541 889 HD2 TYR 135 1HD TYR 135 4.309 7.971 8.059 890 HE1 TYR 135 2HE TYR 135 4.657 3.063 8.040 891 HE2 TYR 135 1HE TYR 135 2.891 6.636 9.562 892 HH TYR 135 HH TYR 135 3.256 4.051 10.622 893 H VAL 136 H VAL 136 4.959 5.203 3.725 894 HA VAL 136 HA VAL 136 2.101 5.339 4.439 895 HB VAL 136 HB VAL 136 1.541 4.199 2.428 896 HG11 VAL 136 1HG1 VAL 136 1.912 6.587 2.167 897 HG12 VAL 136 2HG1 VAL 136 3.618 6.301 1.817 898 HG13 VAL 136 3HG1 VAL 136 2.379 5.728 0.700 899 HG21 VAL 136 3HG2 VAL 136 3.009 2.573 1.881 900 HG22 VAL 136 1HG2 VAL 136 3.691 3.825 0.843 901 HG23 VAL 136 2HG2 VAL 136 4.405 3.504 2.423 902 H ARG 137 H ARG 137 1.024 3.366 4.922 903 HA ARG 137 HA ARG 137 2.818 1.160 5.695 904 HB3 ARG 137 2HB ARG 137 0.373 2.045 7.231 905 HG3 ARG 137 2HG ARG 137 2.521 0.503 8.524 906 HD3 ARG 137 2HD ARG 137 -0.210 -0.440 8.753 907 HE ARG 137 HE ARG 137 1.961 -0.068 10.472 908 HH11 ARG 137 1HH1 ARG 137 -1.507 0.233 10.491 909 HH12 ARG 137 2HH1 ARG 137 -1.656 -0.096 12.185 910 HH21 ARG 137 1HH2 ARG 137 1.777 -0.501 12.704 911 HH22 ARG 137 2HH2 ARG 137 0.212 -0.512 13.443 912 H VAL 138 H VAL 138 2.187 -0.858 5.150 913 HA VAL 138 HA VAL 138 -0.519 -1.200 4.042 914 HB VAL 138 HB VAL 138 1.970 -2.478 2.907 915 HG11 VAL 138 1HG1 VAL 138 -0.116 -3.764 2.641 916 HG12 VAL 138 2HG1 VAL 138 -0.851 -2.371 1.843 917 HG13 VAL 138 3HG1 VAL 138 0.524 -3.191 1.101 918 HG21 VAL 138 3HG2 VAL 138 0.952 0.162 2.534 919 HG22 VAL 138 1HG2 VAL 138 2.345 -0.606 1.774 920 HG23 VAL 138 2HG2 VAL 138 0.750 -0.748 1.037 921 H LEU 139 H LEU 139 -1.588 -3.001 4.654 922 HA LEU 139 HA LEU 139 -0.100 -5.117 6.041 923 HB3 LEU 139 2HB LEU 139 -2.727 -4.043 7.041 924 HG LEU 139 HG LEU 139 -0.754 -5.984 8.178 925 HD11 LEU 139 1HD1 LEU 139 -0.997 -4.077 9.775 926 HD12 LEU 139 2HD1 LEU 139 -1.560 -5.630 10.392 927 HD13 LEU 139 3HD1 LEU 139 -2.725 -4.426 9.839 928 HD21 LEU 139 3HD2 LEU 139 -2.490 -7.225 7.432 929 HD22 LEU 139 1HD2 LEU 139 -3.632 -5.884 7.521 930 HD23 LEU 139 2HD2 LEU 139 -3.190 -6.765 8.984 931 HA PRO 140 HA PRO 140 -2.736 -7.111 2.915 932 HB3 PRO 140 2HB PRO 140 -0.827 -7.791 1.833 933 HG3 PRO 140 2HG PRO 140 1.178 -8.046 2.984 934 HD3 PRO 140 2HD PRO 140 0.579 -5.937 3.695 935 H VAL 141 H VAL 141 -4.290 -8.645 3.180 936 HA VAL 141 HA VAL 141 -4.201 -10.230 5.667 937 HB VAL 141 HB VAL 141 -6.652 -9.114 4.296 938 HG11 VAL 141 1HG1 VAL 141 -6.361 -10.696 6.848 939 HG12 VAL 141 2HG1 VAL 141 -7.853 -9.947 6.275 940 HG13 VAL 141 3HG1 VAL 141 -7.107 -11.250 5.349 941 HG21 VAL 141 3HG2 VAL 141 -5.198 -8.291 6.802 942 HG22 VAL 141 1HG2 VAL 141 -5.513 -7.321 5.364 943 HG23 VAL 141 2HG2 VAL 141 -6.844 -7.785 6.423 944 H SER 142 H SER 142 -5.427 -10.123 2.339 945 HA SER 142 HA SER 142 -5.452 -13.071 2.346 946 HB3 SER 142 2HB SER 142 -7.396 -13.122 1.105 947 HG SER 142 HG SER 142 -8.812 -11.568 1.955 948 H TRP 143 H TRP 143 -3.936 -13.940 1.113 949 HA TRP 143 HA TRP 143 -3.082 -12.496 -1.307 950 HB3 TRP 143 2HB TRP 143 -1.369 -12.310 0.462 951 HD1 TRP 143 HD TRP 143 0.138 -15.596 -0.460 952 HE1 TRP 143 1HE TRP 143 0.295 -17.106 1.618 953 HE3 TRP 143 3HE TRP 143 -2.775 -12.876 2.742 954 HZ2 TRP 143 2HZ TRP 143 -0.686 -17.141 4.264 955 HZ3 TRP 143 3HZ TRP 143 -3.116 -13.718 5.029 956 HH2 TRP 143 HH TRP 143 -2.094 -15.806 5.772 957 H HIS 144 H HIS 144 -1.708 -14.092 -2.724 958 HA HIS 144 HA HIS 144 -2.999 -16.734 -2.734 959 HB3 HIS 144 2HB HIS 144 -2.519 -16.065 -5.421 960 HD1 HIS 144 1HD HIS 144 -5.367 -15.736 -2.912 961 HD2 HIS 144 2HD HIS 144 -4.529 -17.406 -6.623 962 HE1 HIS 144 1HE HIS 144 -7.448 -16.984 -3.573 963 H ASN 145 H ASN 145 -1.595 -18.356 -2.835 964 HA ASN 145 HA ASN 145 0.271 -19.579 -3.331 965 HB3 ASN 145 2HB ASN 145 1.609 -17.356 -4.790 966 HD21 ASN 145 1HD2 ASN 145 0.459 -19.543 -6.912 967 HD22 ASN 145 2HD2 ASN 145 1.766 -20.671 -6.920 968 H ARG 146 H ARG 146 1.352 -16.189 -3.045 969 HA ARG 146 HA ARG 146 2.373 -16.447 -0.443 970 HB3 ARG 146 2HB ARG 146 4.421 -16.726 -2.648 971 HG3 ARG 146 2HG ARG 146 4.792 -15.447 -0.216 972 HD3 ARG 146 2HD ARG 146 4.660 -17.746 0.811 973 HE ARG 146 HE ARG 146 5.871 -19.301 -0.356 974 HH11 ARG 146 1HH1 ARG 146 7.807 -16.445 0.101 975 HH12 ARG 146 2HH1 ARG 146 9.259 -17.175 -0.501 976 HH21 ARG 146 1HH2 ARG 146 7.776 -20.273 -1.150 977 HH22 ARG 146 2HH2 ARG 146 9.240 -19.352 -1.213 978 H ILE 147 H ILE 147 2.775 -14.468 0.380 979 HA ILE 147 HA ILE 147 2.077 -12.160 -0.993 980 HB ILE 147 HB ILE 147 3.896 -12.352 1.410 981 HG13 ILE 147 2HG1 ILE 147 0.960 -12.586 1.039 982 HG21 ILE 147 1HG2 ILE 147 2.524 -10.030 1.679 983 HG22 ILE 147 2HG2 ILE 147 4.141 -10.159 0.990 984 HG23 ILE 147 3HG2 ILE 147 2.733 -10.100 -0.070 985 HD11 ILE 147 3HD1 ILE 147 1.956 -13.429 3.585 986 HD12 ILE 147 1HD1 ILE 147 1.221 -14.382 2.298 987 HD13 ILE 147 2HD1 ILE 147 2.960 -14.087 2.293 988 H THR 148 H THR 148 3.107 -11.830 -2.922 989 HA THR 148 HA THR 148 5.859 -10.881 -2.745 990 HB THR 148 HB THR 148 5.339 -12.542 -5.136 991 HG1 THR 148 1HG THR 148 4.625 -14.083 -3.784 992 HG21 THR 148 3HG2 THR 148 7.564 -11.484 -3.634 993 HG22 THR 148 1HG2 THR 148 7.529 -12.134 -5.273 994 HG23 THR 148 2HG2 THR 148 7.755 -13.217 -3.898 995 H LEU 149 H LEU 149 5.441 -8.815 -3.300 996 HA LEU 149 HA LEU 149 4.778 -8.230 -6.018 997 HB3 LEU 149 2HB LEU 149 2.546 -8.611 -4.894 998 HG LEU 149 HG LEU 149 3.231 -6.024 -3.510 999 HD11 LEU 149 1HD1 LEU 149 0.764 -6.795 -4.712 1000 HD12 LEU 149 2HD1 LEU 149 1.136 -5.355 -3.766 1001 HD13 LEU 149 3HD1 LEU 149 0.581 -6.820 -2.957 1002 HD21 LEU 149 3HD2 LEU 149 1.988 -7.536 -1.688 1003 HD22 LEU 149 1HD2 LEU 149 3.732 -7.583 -1.946 1004 HD23 LEU 149 2HD2 LEU 149 2.699 -8.812 -2.677 1005 H ARG 150 H ARG 150 4.096 -5.571 -5.809 1006 HA ARG 150 HA ARG 150 5.958 -4.268 -4.007 1007 HB3 ARG 150 2HB ARG 150 6.356 -4.380 -6.984 1008 HG3 ARG 150 2HG ARG 150 6.337 -1.999 -6.407 1009 HD3 ARG 150 2HD ARG 150 8.701 -2.547 -4.638 1010 HE ARG 150 HE ARG 150 7.107 -0.168 -4.312 1011 HH11 ARG 150 1HH1 ARG 150 9.804 -1.631 -5.955 1012 HH12 ARG 150 2HH1 ARG 150 10.578 -0.122 -6.305 1013 HH21 ARG 150 1HH2 ARG 150 8.116 1.827 -4.766 1014 HH22 ARG 150 2HH2 ARG 150 9.618 1.845 -5.627 1015 H LEU 151 H LEU 151 5.211 -2.329 -3.400 1016 HA LEU 151 HA LEU 151 2.908 -1.240 -4.865 1017 HB3 LEU 151 2HB LEU 151 2.345 -1.750 -2.618 1018 HG LEU 151 HG LEU 151 4.987 -1.039 -1.905 1019 HD11 LEU 151 1HD1 LEU 151 4.174 0.336 0.184 1020 HD12 LEU 151 2HD1 LEU 151 2.911 0.858 -0.930 1021 HD13 LEU 151 3HD1 LEU 151 4.606 1.139 -1.325 1022 HD21 LEU 151 3HD2 LEU 151 3.948 -1.730 0.413 1023 HD22 LEU 151 1HD2 LEU 151 4.163 -2.912 -0.879 1024 HD23 LEU 151 2HD2 LEU 151 2.576 -2.196 -0.595 1025 H GLU 152 H GLU 152 4.041 -0.072 -6.429 1026 HA GLU 152 HA GLU 152 6.018 1.881 -5.625 1027 HB3 GLU 152 2HB GLU 152 5.606 2.487 -8.198 1028 HG3 GLU 152 2HG GLU 152 7.077 0.049 -7.226 1029 H LEU 153 H LEU 153 5.794 4.099 -5.667 1030 HA LEU 153 HA LEU 153 3.024 5.087 -5.838 1031 HB3 LEU 153 2HB LEU 153 4.889 6.811 -4.427 1032 HG LEU 153 HG LEU 153 2.388 5.465 -3.405 1033 HD11 LEU 153 1HD1 LEU 153 3.477 6.144 -1.498 1034 HD12 LEU 153 2HD1 LEU 153 2.539 7.583 -1.893 1035 HD13 LEU 153 3HD1 LEU 153 4.254 7.511 -2.296 1036 HD21 LEU 153 3HD2 LEU 153 1.512 6.789 -5.044 1037 HD22 LEU 153 1HD2 LEU 153 2.860 7.924 -5.004 1038 HD23 LEU 153 2HD2 LEU 153 1.628 7.975 -3.744 1039 H LEU 154 H LEU 154 2.622 7.049 -6.867 1040 HA LEU 154 HA LEU 154 4.849 8.095 -8.491 1041 HB3 LEU 154 2HB LEU 154 3.468 8.338 -10.342 1042 HG LEU 154 HG LEU 154 2.362 5.840 -9.059 1043 HD11 LEU 154 1HD1 LEU 154 1.747 5.156 -11.270 1044 HD12 LEU 154 2HD1 LEU 154 2.460 6.609 -11.970 1045 HD13 LEU 154 3HD1 LEU 154 1.024 6.733 -10.954 1046 HD21 LEU 154 3HD2 LEU 154 4.232 5.307 -11.109 1047 HD22 LEU 154 1HD2 LEU 154 4.366 4.949 -9.388 1048 HD23 LEU 154 2HD2 LEU 154 4.968 6.483 -10.019 1049 H GLY 155 H GLY 155 4.971 10.318 -8.801 1050 HA2 GLY 155 2HA GLY 155 3.006 11.974 -7.371 1051 HA3 GLY 155 3HA GLY 155 4.711 12.137 -6.978 1052 H CYS 156 H CYS 156 3.385 14.344 -7.783 1053 HA CYS 156 HA CYS 156 3.846 14.698 -10.640 1054 HB3 CYS 156 2HB CYS 156 2.763 16.668 -8.615 1055 H LEU 157 H LEU 157 5.480 15.153 -7.711 1056 HA LEU 157 HA LEU 157 7.481 16.088 -7.171 1057 HB3 LEU 157 2HB LEU 157 8.381 16.940 -9.764 1058 HG LEU 157 HG LEU 157 10.087 15.203 -9.544 1059 HD11 LEU 157 1HD1 LEU 157 9.526 17.229 -7.515 1060 HD12 LEU 157 2HD1 LEU 157 11.006 16.899 -8.417 1061 HD13 LEU 157 3HD1 LEU 157 10.622 15.956 -6.977 1062 HD21 LEU 157 3HD2 LEU 157 8.533 14.381 -7.093 1063 HD22 LEU 157 1HD2 LEU 157 10.132 13.783 -7.536 1064 HD23 LEU 157 2HD2 LEU 157 8.744 13.437 -8.568 1065 H GLU 158 H GLU 158 5.021 17.722 -7.573 1066 HA GLU 158 HA GLU 158 6.341 20.318 -7.454 1067 HB3 GLU 158 2HB GLU 158 3.887 19.966 -9.169 1068 HG3 GLU 158 2HG GLU 158 5.446 22.076 -10.086 Start of MODEL 4 1 H1 MET -5 H MET -5 5.790 32.183 -5.776 2 HA MET -5 HA MET -5 5.410 31.712 -7.969 3 HB3 MET -5 2HB MET -5 7.389 32.718 -9.476 4 HG3 MET -5 2HG MET -5 4.924 33.635 -8.669 5 HE1 MET -5 3HE MET -5 4.074 36.835 -7.368 6 HE2 MET -5 1HE MET -5 3.683 35.217 -7.954 7 HE3 MET -5 2HE MET -5 4.235 35.444 -6.295 8 H LYS -4 H LYS -4 5.529 29.529 -8.153 9 HA LYS -4 HA LYS -4 7.901 28.447 -9.412 10 HB3 LYS -4 2HB LYS -4 8.533 28.051 -7.147 11 HG3 LYS -4 2HG LYS -4 5.737 27.785 -6.660 12 HD3 LYS -4 2HD LYS -4 7.413 25.517 -5.586 13 HE3 LYS -4 2HE LYS -4 4.448 25.991 -5.345 14 HZ1 LYS -4 3HZ LYS -4 5.830 24.371 -3.406 15 HZ2 LYS -4 1HZ LYS -4 5.867 23.729 -4.971 16 HZ3 LYS -4 2HZ LYS -4 4.385 24.071 -4.233 17 H SER -3 H SER -3 7.481 26.675 -10.687 18 HA SER -3 HA SER -3 5.011 25.218 -10.491 19 HB3 SER -3 2HB SER -3 3.898 26.832 -11.691 20 HG SER -3 HG SER -3 4.956 28.445 -12.500 21 H GLY -2 H GLY -2 4.807 23.662 -12.408 22 HA2 GLY -2 2HA GLY -2 6.968 23.060 -14.081 23 HA3 GLY -2 3HA GLY -2 7.183 22.155 -12.589 24 H HIS -1 H HIS -1 5.918 22.030 -15.637 25 HA HIS -1 HA HIS -1 3.562 20.479 -15.123 26 HB3 HIS -1 2HB HIS -1 3.624 20.047 -17.579 27 HD1 HIS -1 1HD HIS -1 3.250 22.165 -19.392 28 HD2 HIS -1 2HD HIS -1 3.253 22.992 -15.320 29 HE1 HIS -1 1HE HIS -1 2.081 24.378 -19.155 30 H GLY 0 H GLY 0 3.390 18.259 -16.268 31 HA2 GLY 0 2HA GLY 0 4.287 16.131 -16.703 32 HA3 GLY 0 3HA GLY 0 5.832 16.676 -16.067 33 H CYS 1 H CYS 1 3.035 14.899 -15.440 34 HA CYS 1 HA CYS 1 3.683 14.780 -12.568 35 HB3 CYS 1 2HB CYS 1 1.276 13.828 -12.425 36 H SER 2 H SER 2 2.592 12.542 -11.726 37 HA SER 2 HA SER 2 2.859 10.289 -11.578 38 HB3 SER 2 2HB SER 2 2.296 9.008 -13.430 39 HG SER 2 HG SER 2 0.947 10.371 -14.786 40 H GLU 3 H GLU 3 5.034 11.188 -10.770 41 HA GLU 3 HA GLU 3 7.215 10.090 -12.420 42 HB3 GLU 3 2HB GLU 3 8.719 11.598 -11.163 43 HG3 GLU 3 2HG GLU 3 7.925 13.767 -12.024 44 HA PRO 4 HA PRO 4 8.078 7.061 -9.363 45 HB3 PRO 4 2HB PRO 4 9.662 6.231 -10.806 46 HG3 PRO 4 2HG PRO 4 10.956 7.654 -12.114 47 HD3 PRO 4 2HD PRO 4 8.858 8.488 -12.577 48 H LEU 5 H LEU 5 10.118 6.687 -7.685 49 HA LEU 5 HA LEU 5 10.300 9.165 -6.105 50 HB3 LEU 5 2HB LEU 5 8.776 7.905 -4.894 51 HG LEU 5 HG LEU 5 9.179 5.508 -4.208 52 HD11 LEU 5 1HD1 LEU 5 8.782 5.246 -7.064 53 HD12 LEU 5 2HD1 LEU 5 7.873 6.599 -6.390 54 HD13 LEU 5 3HD1 LEU 5 7.655 4.975 -5.735 55 HD21 LEU 5 3HD2 LEU 5 10.919 5.364 -6.648 56 HD22 LEU 5 1HD2 LEU 5 10.667 4.150 -5.394 57 HD23 LEU 5 2HD2 LEU 5 11.599 5.606 -5.039 58 H GLY 6 H GLY 6 11.998 6.920 -7.805 59 HA2 GLY 6 2HA GLY 6 14.513 7.825 -6.869 60 HA3 GLY 6 3HA GLY 6 14.177 6.231 -6.211 61 H LEU 7 H LEU 7 13.080 7.296 -9.365 62 HA LEU 7 HA LEU 7 15.114 5.589 -10.630 63 HB3 LEU 7 2HB LEU 7 13.541 4.519 -12.003 64 HG LEU 7 HG LEU 7 12.334 4.699 -9.252 65 HD11 LEU 7 1HD1 LEU 7 11.460 3.076 -11.627 66 HD12 LEU 7 2HD1 LEU 7 10.497 4.189 -10.655 67 HD13 LEU 7 3HD1 LEU 7 11.043 2.661 -9.964 68 HD21 LEU 7 3HD2 LEU 7 14.564 3.600 -9.580 69 HD22 LEU 7 1HD2 LEU 7 13.758 2.424 -10.619 70 HD23 LEU 7 2HD2 LEU 7 13.308 2.552 -8.918 71 H LYS 8 H LYS 8 14.587 8.563 -10.300 72 HA LYS 8 HA LYS 8 14.784 9.233 -13.161 73 HB3 LYS 8 2HB LYS 8 13.858 11.551 -12.059 74 HG3 LYS 8 2HG LYS 8 11.625 10.959 -12.929 75 HD3 LYS 8 2HD LYS 8 13.141 9.857 -15.111 76 HE3 LYS 8 2HE LYS 8 11.137 11.431 -15.106 77 HZ1 LYS 8 3HZ LYS 8 12.387 13.053 -13.579 78 HZ2 LYS 8 1HZ LYS 8 11.468 13.690 -14.849 79 HZ3 LYS 8 2HZ LYS 8 13.150 13.582 -14.993 80 H ASN 9 H ASN 9 15.143 11.102 -10.157 81 HA ASN 9 HA ASN 9 17.952 11.593 -10.892 82 HB3 ASN 9 2HB ASN 9 17.252 13.859 -9.520 83 HD21 ASN 9 1HD2 ASN 9 17.649 15.705 -10.723 84 HD22 ASN 9 2HD2 ASN 9 18.192 15.640 -12.363 85 H ASN 10 H ASN 10 15.551 11.358 -8.325 86 HA ASN 10 HA ASN 10 17.233 11.765 -6.127 87 HB3 ASN 10 2HB ASN 10 15.480 10.216 -4.967 88 HD21 ASN 10 1HD2 ASN 10 15.163 12.885 -7.264 89 HD22 ASN 10 2HD2 ASN 10 14.383 13.968 -6.165 90 H THR 11 H THR 11 16.376 8.785 -7.849 91 HA THR 11 HA THR 11 17.241 6.674 -7.778 92 HB THR 11 HB THR 11 19.583 6.485 -8.034 93 HG1 THR 11 1HG THR 11 20.024 9.083 -7.001 94 HG21 THR 11 3HG2 THR 11 19.513 9.267 -8.974 95 HG22 THR 11 1HG2 THR 11 18.157 8.276 -9.509 96 HG23 THR 11 2HG2 THR 11 19.811 7.777 -9.866 97 H ILE 12 H ILE 12 16.095 7.464 -5.349 98 HA ILE 12 HA ILE 12 17.604 7.178 -3.056 99 HB ILE 12 HB ILE 12 14.803 6.135 -3.496 100 HG13 ILE 12 2HG1 ILE 12 14.993 8.502 -4.071 101 HG21 ILE 12 1HG2 ILE 12 14.535 6.296 -1.104 102 HG22 ILE 12 2HG2 ILE 12 15.918 5.265 -1.470 103 HG23 ILE 12 3HG2 ILE 12 16.175 6.924 -0.929 104 HD11 ILE 12 3HD1 ILE 12 13.806 8.328 -1.316 105 HD12 ILE 12 1HD1 ILE 12 13.413 9.483 -2.589 106 HD13 ILE 12 2HD1 ILE 12 12.990 7.781 -2.780 107 HA PRO 13 HA PRO 13 19.096 3.019 -3.253 108 HB3 PRO 13 2HB PRO 13 20.802 3.740 -1.893 109 HG3 PRO 13 2HG PRO 13 20.451 5.404 -0.307 110 HD3 PRO 13 2HD PRO 13 19.534 6.423 -2.161 111 H ASP 14 H ASP 14 19.036 1.146 -1.353 112 HA ASP 14 HA ASP 14 16.216 0.495 -1.184 113 HB3 ASP 14 2HB ASP 14 17.585 -1.298 -1.923 114 H SER 15 H SER 15 16.569 2.603 0.413 115 HA SER 15 HA SER 15 16.440 1.442 3.115 116 HB3 SER 15 2HB SER 15 17.503 3.417 4.039 117 HG SER 15 HG SER 15 19.535 3.061 3.262 118 H GLN 16 H GLN 16 14.586 2.552 0.818 119 HA GLN 16 HA GLN 16 13.052 4.481 2.384 120 HB3 GLN 16 2HB GLN 16 13.491 4.965 0.007 121 HG3 GLN 16 2HG GLN 16 11.720 2.598 -0.561 122 HE21 GLN 16 1HE2 GLN 16 14.185 4.217 -2.457 123 HE22 GLN 16 2HE2 GLN 16 13.138 4.728 -3.732 124 H MET 17 H MET 17 12.790 1.247 1.011 125 HA MET 17 HA MET 17 10.146 0.932 2.241 126 HB3 MET 17 2HB MET 17 10.600 -1.409 0.918 127 HG3 MET 17 2HG MET 17 9.221 1.094 0.235 128 HE1 MET 17 3HE MET 17 7.187 -0.129 -2.105 129 HE2 MET 17 1HE MET 17 7.726 1.518 -1.769 130 HE3 MET 17 2HE MET 17 7.936 0.833 -3.381 131 H SER 18 H SER 18 9.754 -0.502 3.860 132 HA SER 18 HA SER 18 11.729 -2.456 4.650 133 HB3 SER 18 2HB SER 18 12.736 -0.692 5.843 134 HG SER 18 HG SER 18 10.662 0.286 7.264 135 H ALA 19 H ALA 19 10.565 -4.203 5.054 136 HA ALA 19 HA ALA 19 7.912 -3.881 6.298 137 HB1 ALA 19 1HB ALA 19 7.600 -4.787 4.141 138 HB2 ALA 19 2HB ALA 19 8.926 -5.931 4.345 139 HB3 ALA 19 3HB ALA 19 7.434 -6.138 5.261 140 H SER 20 H SER 20 7.235 -6.051 7.406 141 HA SER 20 HA SER 20 8.715 -6.369 9.709 142 HB3 SER 20 2HB SER 20 6.501 -7.804 8.413 143 HG SER 20 HG SER 20 7.614 -9.204 10.541 144 H SER 21 H SER 21 8.649 -8.579 6.913 145 HA SER 21 HA SER 21 11.442 -9.147 7.160 146 HB3 SER 21 2HB SER 21 11.075 -11.638 7.523 147 HG SER 21 HG SER 21 11.472 -11.282 9.565 148 H SER 22 H SER 22 12.133 -10.824 5.550 149 HA SER 22 HA SER 22 10.319 -10.801 3.225 150 HB3 SER 22 2HB SER 22 11.962 -9.663 2.193 151 HG SER 22 HG SER 22 13.788 -9.112 3.218 152 H TYR 23 H TYR 23 10.388 -12.619 1.815 153 HA TYR 23 HA TYR 23 10.287 -15.091 3.025 154 HB3 TYR 23 2HB TYR 23 10.962 -14.555 0.125 155 HD1 TYR 23 1HD TYR 23 9.389 -16.908 2.552 156 HD2 TYR 23 2HD TYR 23 11.050 -16.370 -1.328 157 HE1 TYR 23 1HE TYR 23 9.229 -19.330 2.153 158 HE2 TYR 23 2HE TYR 23 10.894 -18.790 -1.738 159 HH TYR 23 HH TYR 23 9.805 -21.014 0.789 160 H LYS 24 H LYS 24 11.716 -16.602 3.611 161 HA LYS 24 HA LYS 24 14.428 -16.083 3.872 162 HB3 LYS 24 2HB LYS 24 14.275 -18.851 3.783 163 HG3 LYS 24 2HG LYS 24 13.866 -16.888 6.003 164 HD3 LYS 24 2HD LYS 24 14.345 -19.114 7.374 165 HE3 LYS 24 2HE LYS 24 11.999 -17.557 6.753 166 HZ1 LYS 24 3HZ LYS 24 11.643 -20.372 6.666 167 HZ2 LYS 24 1HZ LYS 24 10.505 -19.143 6.427 168 HZ3 LYS 24 2HZ LYS 24 10.817 -19.714 7.988 169 H THR 25 H THR 25 13.112 -18.605 1.723 170 HA THR 25 HA THR 25 13.810 -19.406 -0.290 171 HB THR 25 HB THR 25 15.346 -17.074 -1.151 172 HG1 THR 25 1HG THR 25 13.440 -15.714 -1.177 173 HG21 THR 25 3HG2 THR 25 13.101 -18.771 -2.118 174 HG22 THR 25 1HG2 THR 25 14.613 -18.340 -2.915 175 HG23 THR 25 2HG2 THR 25 13.297 -17.169 -2.827 176 H TRP 26 H TRP 26 15.600 -19.456 2.123 177 HA TRP 26 HA TRP 26 17.772 -20.802 0.995 178 HB3 TRP 26 2HB TRP 26 19.309 -18.750 2.115 179 HD1 TRP 26 HD TRP 26 19.082 -17.388 -1.152 180 HE1 TRP 26 1HE TRP 26 20.600 -18.593 -2.845 181 HE3 TRP 26 3HE TRP 26 20.018 -21.660 1.495 182 HZ2 TRP 26 2HZ TRP 26 22.008 -21.032 -3.034 183 HZ3 TRP 26 3HZ TRP 26 21.461 -23.381 0.486 184 HH2 TRP 26 HH TRP 26 22.433 -23.071 -1.732 185 H ASN 27 H ASN 27 17.810 -18.470 3.681 186 HA ASN 27 HA ASN 27 17.162 -20.256 5.729 187 HB3 ASN 27 2HB ASN 27 20.091 -20.085 5.054 188 HD21 ASN 27 1HD2 ASN 27 18.391 -21.925 7.511 189 HD22 ASN 27 2HD2 ASN 27 19.335 -21.369 8.847 190 H LEU 28 H LEU 28 19.740 -17.830 5.259 191 HA LEU 28 HA LEU 28 18.279 -15.853 6.752 192 HB3 LEU 28 2HB LEU 28 20.886 -16.838 7.893 193 HG LEU 28 HG LEU 28 20.213 -14.469 8.458 194 HD11 LEU 28 1HD1 LEU 28 17.906 -15.966 9.646 195 HD12 LEU 28 2HD1 LEU 28 17.894 -14.511 8.649 196 HD13 LEU 28 3HD1 LEU 28 18.446 -14.430 10.322 197 HD21 LEU 28 3HD2 LEU 28 21.724 -15.878 9.834 198 HD22 LEU 28 1HD2 LEU 28 20.325 -16.395 10.775 199 HD23 LEU 28 2HD2 LEU 28 20.810 -14.699 10.774 200 H ARG 29 H ARG 29 18.723 -13.947 5.873 201 HA ARG 29 HA ARG 29 19.769 -12.272 4.744 202 HB3 ARG 29 2HB ARG 29 22.511 -13.126 4.896 203 HG3 ARG 29 2HG ARG 29 21.158 -11.086 6.634 204 HD3 ARG 29 2HD ARG 29 23.648 -11.852 6.847 205 HE ARG 29 HE ARG 29 23.835 -11.059 4.259 206 HH11 ARG 29 1HH1 ARG 29 25.202 -9.908 7.247 207 HH12 ARG 29 2HH1 ARG 29 26.651 -9.313 6.506 208 HH21 ARG 29 1HH2 ARG 29 25.737 -10.279 3.272 209 HH22 ARG 29 2HH2 ARG 29 26.954 -9.523 4.245 210 H ALA 30 H ALA 30 21.048 -11.793 2.786 211 HA ALA 30 HA ALA 30 22.137 -13.770 1.125 212 HB1 ALA 30 1HB ALA 30 19.635 -13.073 -0.208 213 HB2 ALA 30 2HB ALA 30 20.456 -14.629 -0.073 214 HB3 ALA 30 3HB ALA 30 19.417 -14.063 1.235 215 H PHE 31 H PHE 31 22.127 -12.962 -1.274 216 HA PHE 31 HA PHE 31 23.371 -10.468 -1.337 217 HB3 PHE 31 2HB PHE 31 22.240 -11.090 -3.910 218 HD1 PHE 31 1HD PHE 31 24.027 -9.012 -3.216 219 HD2 PHE 31 2HD PHE 31 24.913 -13.096 -4.024 220 HE1 PHE 31 1HE PHE 31 26.310 -8.381 -3.880 221 HE2 PHE 31 2HE PHE 31 27.199 -12.472 -4.687 222 HZ PHE 31 HZ PHE 31 27.900 -10.113 -4.615 223 H GLY 32 H GLY 32 20.036 -11.384 -2.077 224 HA2 GLY 32 2HA GLY 32 19.340 -8.517 -2.001 225 HA3 GLY 32 3HA GLY 32 18.684 -9.571 -3.246 226 H TRP 33 H TRP 33 19.084 -9.810 0.290 227 HA TRP 33 HA TRP 33 16.369 -10.881 0.462 228 HB3 TRP 33 2HB TRP 33 18.357 -10.639 2.718 229 HD1 TRP 33 HD TRP 33 15.609 -13.067 1.403 230 HE1 TRP 33 1HE TRP 33 14.230 -13.856 3.429 231 HE3 TRP 33 3HE TRP 33 18.055 -10.512 5.094 232 HZ2 TRP 33 2HZ TRP 33 14.186 -13.449 6.222 233 HZ3 TRP 33 3HZ TRP 33 17.282 -10.767 7.416 234 HH2 TRP 33 HH TRP 33 15.387 -12.203 7.966 235 H TYR 34 H TYR 34 16.672 -8.111 -0.129 236 HA TYR 34 HA TYR 34 15.438 -6.961 2.283 237 HB3 TYR 34 2HB TYR 34 16.502 -4.754 1.150 238 HD1 TYR 34 2HD TYR 34 18.535 -7.520 2.630 239 HD2 TYR 34 1HD TYR 34 16.754 -3.696 3.190 240 HE1 TYR 34 2HE TYR 34 19.577 -7.366 4.852 241 HE2 TYR 34 1HE TYR 34 17.792 -3.531 5.413 242 HH TYR 34 HH TYR 34 19.856 -4.549 6.560 243 HA PRO 35 HA PRO 35 12.111 -5.627 -0.246 244 HB3 PRO 35 2HB PRO 35 11.170 -4.713 1.639 245 HG3 PRO 35 2HG PRO 35 12.480 -3.657 3.243 246 HD3 PRO 35 2HD PRO 35 13.652 -5.628 3.010 247 H HIS 36 H HIS 36 11.320 -3.209 -1.140 248 HA HIS 36 HA HIS 36 11.640 -1.630 -2.748 249 HB3 HIS 36 2HB HIS 36 14.591 -1.749 -2.129 250 HD1 HIS 36 1HD HIS 36 15.855 0.192 -3.087 251 HD2 HIS 36 2HD HIS 36 11.741 0.612 -3.488 252 HE1 HIS 36 1HE HIS 36 15.524 2.208 -4.555 253 H LEU 37 H LEU 37 11.184 -3.846 -3.907 254 HA LEU 37 HA LEU 37 13.377 -4.383 -5.795 255 HB3 LEU 37 2HB LEU 37 12.086 -6.489 -6.287 256 HG LEU 37 HG LEU 37 12.833 -7.787 -4.458 257 HD11 LEU 37 1HD1 LEU 37 15.106 -7.026 -4.138 258 HD12 LEU 37 2HD1 LEU 37 14.661 -5.398 -4.652 259 HD13 LEU 37 3HD1 LEU 37 14.602 -6.734 -5.802 260 HD21 LEU 37 3HD2 LEU 37 12.628 -7.186 -2.328 261 HD22 LEU 37 1HD2 LEU 37 11.853 -5.706 -2.893 262 HD23 LEU 37 2HD2 LEU 37 13.589 -5.728 -2.581 263 H GLY 38 H GLY 38 10.132 -3.248 -5.462 264 HA2 GLY 38 2HA GLY 38 9.134 -3.641 -8.040 265 HA3 GLY 38 3HA GLY 38 8.667 -2.328 -6.968 266 H ARG 39 H ARG 39 11.682 -1.612 -7.000 267 HA ARG 39 HA ARG 39 11.600 0.574 -8.637 268 HB3 ARG 39 2HB ARG 39 13.385 0.081 -6.979 269 HG3 ARG 39 2HG ARG 39 14.332 -1.809 -9.108 270 HD3 ARG 39 2HD ARG 39 16.055 -0.057 -8.185 271 HE ARG 39 HE ARG 39 15.399 -1.039 -5.768 272 HH11 ARG 39 1HH1 ARG 39 18.278 -1.297 -7.708 273 HH12 ARG 39 2HH1 ARG 39 19.342 -1.425 -6.347 274 HH21 ARG 39 1HH2 ARG 39 16.789 -1.206 -3.967 275 HH22 ARG 39 2HH2 ARG 39 18.493 -1.374 -4.219 276 H LEU 40 H LEU 40 12.145 1.064 -10.742 277 HA LEU 40 HA LEU 40 11.640 -0.909 -12.695 278 HB3 LEU 40 2HB LEU 40 12.878 1.826 -12.975 279 HG LEU 40 HG LEU 40 12.415 -0.129 -15.022 280 HD11 LEU 40 1HD1 LEU 40 10.651 2.301 -15.062 281 HD12 LEU 40 2HD1 LEU 40 10.205 0.613 -15.306 282 HD13 LEU 40 3HD1 LEU 40 11.143 1.463 -16.535 283 HD21 LEU 40 3HD2 LEU 40 14.309 1.056 -15.388 284 HD22 LEU 40 1HD2 LEU 40 13.655 2.533 -14.680 285 HD23 LEU 40 2HD2 LEU 40 13.210 2.071 -16.323 286 H ASP 41 H ASP 41 12.972 -2.037 -14.052 287 HA ASP 41 HA ASP 41 14.846 -3.095 -14.789 288 HB3 ASP 41 2HB ASP 41 16.469 -0.767 -13.782 289 H ASN 42 H ASN 42 14.359 -4.548 -12.954 290 HA ASN 42 HA ASN 42 15.607 -4.365 -10.458 291 HB3 ASN 42 2HB ASN 42 13.765 -5.931 -10.964 292 HD21 ASN 42 1HD2 ASN 42 13.331 -6.257 -13.159 293 HD22 ASN 42 2HD2 ASN 42 13.976 -7.611 -14.017 294 H GLN 43 H GLN 43 17.059 -6.597 -9.975 295 HA GLN 43 HA GLN 43 19.475 -6.161 -11.601 296 HB3 GLN 43 2HB GLN 43 19.996 -5.477 -9.419 297 HG3 GLN 43 2HG GLN 43 18.742 -7.985 -8.326 298 HE21 GLN 43 1HE2 GLN 43 18.712 -8.108 -6.075 299 HE22 GLN 43 2HE2 GLN 43 19.823 -7.217 -5.097 300 H GLY 44 H GLY 44 17.304 -8.543 -10.258 301 HA2 GLY 44 2HA GLY 44 18.823 -10.640 -11.683 302 HA3 GLY 44 3HA GLY 44 17.969 -10.934 -10.176 303 H LYS 45 H LYS 45 15.555 -10.306 -10.301 304 HA LYS 45 HA LYS 45 14.142 -10.267 -12.694 305 HB3 LYS 45 2HB LYS 45 14.917 -12.412 -13.287 306 HG3 LYS 45 2HG LYS 45 15.718 -12.962 -10.913 307 HD3 LYS 45 2HD LYS 45 12.846 -13.441 -10.693 308 HE3 LYS 45 2HE LYS 45 14.563 -15.500 -9.379 309 HZ1 LYS 45 3HZ LYS 45 12.264 -15.222 -8.678 310 HZ2 LYS 45 1HZ LYS 45 12.491 -16.733 -9.405 311 HZ3 LYS 45 2HZ LYS 45 11.726 -15.490 -10.259 312 H ILE 46 H ILE 46 14.344 -11.091 -9.337 313 HA ILE 46 HA ILE 46 11.805 -11.653 -8.556 314 HB ILE 46 HB ILE 46 13.571 -9.643 -7.156 315 HG13 ILE 46 2HG1 ILE 46 13.852 -12.516 -7.602 316 HG21 ILE 46 1HG2 ILE 46 11.999 -11.435 -5.507 317 HG22 ILE 46 2HG2 ILE 46 12.126 -9.677 -5.462 318 HG23 ILE 46 3HG2 ILE 46 10.991 -10.450 -6.568 319 HD11 ILE 46 3HD1 ILE 46 15.592 -10.622 -7.829 320 HD12 ILE 46 1HD1 ILE 46 15.776 -10.814 -6.085 321 HD13 ILE 46 2HD1 ILE 46 16.087 -12.177 -7.160 322 H ASN 47 H ASN 47 12.997 -8.292 -8.473 323 HA ASN 47 HA ASN 47 11.905 -6.302 -8.664 324 HB3 ASN 47 2HB ASN 47 10.246 -7.737 -10.744 325 HD21 ASN 47 1HD2 ASN 47 12.135 -4.776 -10.213 326 HD22 ASN 47 2HD2 ASN 47 10.922 -3.697 -10.805 327 H ALA 48 H ALA 48 10.923 -8.005 -6.625 328 HA ALA 48 HA ALA 48 8.493 -6.703 -6.003 329 HB1 ALA 48 1HB ALA 48 6.873 -8.125 -6.596 330 HB2 ALA 48 2HB ALA 48 8.066 -8.802 -7.705 331 HB3 ALA 48 3HB ALA 48 7.813 -9.540 -6.124 332 H TRP 49 H TRP 49 8.219 -6.699 -3.848 333 HA TRP 49 HA TRP 49 10.111 -8.154 -2.227 334 HB3 TRP 49 2HB TRP 49 8.019 -6.069 -1.667 335 HD1 TRP 49 HD TRP 49 10.835 -6.856 0.769 336 HE1 TRP 49 1HE TRP 49 9.815 -7.503 3.042 337 HE3 TRP 49 3HE TRP 49 5.917 -7.148 -0.600 338 HZ2 TRP 49 2HZ TRP 49 7.265 -8.065 4.113 339 HZ3 TRP 49 3HZ TRP 49 4.251 -7.747 1.108 340 HH2 TRP 49 HH TRP 49 4.913 -8.196 3.415 341 H THR 50 H THR 50 9.744 -9.907 -0.996 342 HA THR 50 HA THR 50 7.013 -11.013 -1.008 343 HB THR 50 HB THR 50 9.326 -12.774 -0.389 344 HG1 THR 50 1HG THR 50 10.258 -12.184 -2.207 345 HG21 THR 50 3HG2 THR 50 6.733 -13.052 -1.902 346 HG22 THR 50 1HG2 THR 50 7.157 -13.763 -0.344 347 HG23 THR 50 2HG2 THR 50 7.948 -14.327 -1.816 348 H ALA 51 H ALA 51 6.420 -12.326 0.883 349 HA ALA 51 HA ALA 51 7.282 -11.002 3.331 350 HB1 ALA 51 1HB ALA 51 5.068 -13.013 2.955 351 HB2 ALA 51 2HB ALA 51 5.341 -11.980 4.359 352 HB3 ALA 51 3HB ALA 51 4.872 -11.266 2.817 353 H GLN 52 H GLN 52 7.610 -12.325 5.302 354 HA GLN 52 HA GLN 52 9.188 -14.718 4.649 355 HB3 GLN 52 2HB GLN 52 9.309 -13.152 7.221 356 HG3 GLN 52 2HG GLN 52 11.820 -14.061 6.649 357 HE21 GLN 52 1HE2 GLN 52 12.628 -15.390 8.303 358 HE22 GLN 52 2HE2 GLN 52 11.699 -15.728 9.721 359 H SER 53 H SER 53 6.946 -13.454 7.106 360 HA SER 53 HA SER 53 6.560 -16.000 8.340 361 HB3 SER 53 2HB SER 53 4.829 -13.525 8.541 362 HG SER 53 HG SER 53 4.996 -15.936 9.959 363 H ASN 54 H ASN 54 5.496 -14.733 5.448 364 HA ASN 54 HA ASN 54 3.738 -15.159 4.037 365 HB3 ASN 54 2HB ASN 54 5.126 -17.209 3.900 366 HD21 ASN 54 1HD2 ASN 54 6.088 -17.993 5.753 367 HD22 ASN 54 2HD2 ASN 54 5.337 -19.179 6.760 368 H SER 55 H SER 55 2.844 -14.175 6.525 369 HA SER 55 HA SER 55 0.242 -15.539 6.716 370 HB3 SER 55 2HB SER 55 0.188 -15.026 9.129 371 HG SER 55 HG SER 55 2.640 -16.327 8.741 372 H ALA 56 H ALA 56 -1.487 -14.121 7.588 373 HA ALA 56 HA ALA 56 -1.627 -11.707 6.138 374 HB1 ALA 56 1HB ALA 56 -3.552 -13.176 6.883 375 HB2 ALA 56 2HB ALA 56 -3.393 -12.413 8.466 376 HB3 ALA 56 3HB ALA 56 -3.784 -11.435 7.052 377 H LYS 57 H LYS 57 -0.391 -12.454 9.257 378 HA LYS 57 HA LYS 57 -0.706 -9.941 10.508 379 HB3 LYS 57 2HB LYS 57 1.050 -10.711 12.048 380 HG3 LYS 57 2HG LYS 57 -1.329 -12.210 11.463 381 HD3 LYS 57 2HD LYS 57 0.682 -13.931 11.269 382 HE3 LYS 57 2HE LYS 57 0.144 -13.828 14.235 383 HZ1 LYS 57 3HZ LYS 57 1.171 -15.783 14.375 384 HZ2 LYS 57 1HZ LYS 57 2.380 -15.345 13.275 385 HZ3 LYS 57 2HZ LYS 57 0.901 -15.944 12.713 386 H GLU 58 H GLU 58 1.325 -10.991 7.979 387 HA GLU 58 HA GLU 58 3.612 -9.452 8.314 388 HB3 GLU 58 2HB GLU 58 3.614 -9.430 5.733 389 HG3 GLU 58 2HG GLU 58 3.788 -11.994 5.633 390 H TRP 59 H TRP 59 4.220 -7.502 7.012 391 HA TRP 59 HA TRP 59 2.295 -5.691 6.050 392 HB3 TRP 59 2HB TRP 59 1.652 -5.591 8.439 393 HD1 TRP 59 HD TRP 59 4.103 -7.087 9.399 394 HE1 TRP 59 1HE TRP 59 5.633 -6.196 11.267 395 HE3 TRP 59 3HE TRP 59 2.913 -2.123 9.123 396 HZ2 TRP 59 2HZ TRP 59 6.253 -3.717 12.466 397 HZ3 TRP 59 3HZ TRP 59 4.018 -0.558 10.666 398 HH2 TRP 59 HH TRP 59 5.654 -1.341 12.302 399 H LEU 60 H LEU 60 3.246 -3.972 5.027 400 HA LEU 60 HA LEU 60 6.175 -3.778 5.282 401 HB3 LEU 60 2HB LEU 60 4.374 -3.496 2.893 402 HG LEU 60 HG LEU 60 6.796 -2.039 3.247 403 HD11 LEU 60 1HD1 LEU 60 7.678 -3.047 0.929 404 HD12 LEU 60 2HD1 LEU 60 7.044 -4.519 1.663 405 HD13 LEU 60 3HD1 LEU 60 8.275 -3.577 2.503 406 HD21 LEU 60 3HD2 LEU 60 6.234 -1.540 0.758 407 HD22 LEU 60 1HD2 LEU 60 5.126 -1.014 2.025 408 HD23 LEU 60 2HD2 LEU 60 4.770 -2.467 1.091 409 H GLN 61 H GLN 61 7.079 -1.819 5.617 410 HA GLN 61 HA GLN 61 5.281 0.515 5.630 411 HB3 GLN 61 2HB GLN 61 5.840 1.000 7.742 412 HG3 GLN 61 2HG GLN 61 7.228 -1.666 7.646 413 HE21 GLN 61 1HE2 GLN 61 8.454 -2.152 9.308 414 HE22 GLN 61 2HE2 GLN 61 8.423 -1.391 10.858 415 H VAL 62 H VAL 62 5.933 2.271 4.541 416 HA VAL 62 HA VAL 62 8.712 2.327 3.557 417 HB VAL 62 HB VAL 62 6.277 3.325 2.073 418 HG11 VAL 62 1HG1 VAL 62 8.198 4.617 1.486 419 HG12 VAL 62 2HG1 VAL 62 9.193 3.168 1.330 420 HG13 VAL 62 3HG1 VAL 62 7.897 3.477 0.174 421 HG21 VAL 62 3HG2 VAL 62 7.168 1.380 0.504 422 HG22 VAL 62 1HG2 VAL 62 7.718 0.730 2.049 423 HG23 VAL 62 2HG2 VAL 62 6.007 1.078 1.797 424 H ASP 63 H ASP 63 9.834 4.063 4.128 425 HA ASP 63 HA ASP 63 8.374 6.535 4.785 426 HB3 ASP 63 2HB ASP 63 9.013 5.986 6.913 427 H LEU 64 H LEU 64 9.169 8.391 3.954 428 HA LEU 64 HA LEU 64 11.719 8.227 2.485 429 HB3 LEU 64 2HB LEU 64 10.354 8.477 0.709 430 HG LEU 64 HG LEU 64 8.318 9.492 2.598 431 HD11 LEU 64 1HD1 LEU 64 8.709 10.585 -0.133 432 HD12 LEU 64 2HD1 LEU 64 8.035 11.346 1.308 433 HD13 LEU 64 3HD1 LEU 64 7.065 10.203 0.378 434 HD21 LEU 64 3HD2 LEU 64 8.580 7.160 1.471 435 HD22 LEU 64 1HD2 LEU 64 7.844 7.957 0.079 436 HD23 LEU 64 2HD2 LEU 64 6.980 7.890 1.616 437 H GLY 65 H GLY 65 9.598 10.146 4.506 438 HA2 GLY 65 2HA GLY 65 9.967 12.039 5.748 439 HA3 GLY 65 3HA GLY 65 11.654 11.548 5.759 440 H THR 66 H THR 66 10.175 12.120 2.702 441 HA THR 66 HA THR 66 11.729 14.607 2.457 442 HB THR 66 HB THR 66 12.340 12.742 0.914 443 HG1 THR 66 1HG THR 66 12.919 14.572 -0.032 444 HG21 THR 66 3HG2 THR 66 9.543 12.575 0.579 445 HG22 THR 66 1HG2 THR 66 10.787 11.607 -0.210 446 HG23 THR 66 2HG2 THR 66 10.211 13.090 -0.969 447 H GLN 67 H GLN 67 8.610 13.506 2.820 448 HA GLN 67 HA GLN 67 6.535 14.382 2.466 449 HB3 GLN 67 2HB GLN 67 7.722 17.115 2.267 450 HG3 GLN 67 2HG GLN 67 5.296 15.883 3.407 451 HE21 GLN 67 1HE2 GLN 67 6.248 15.731 5.607 452 HE22 GLN 67 2HE2 GLN 67 6.137 17.122 6.626 453 H ARG 68 H ARG 68 6.346 13.459 0.359 454 HA ARG 68 HA ARG 68 6.544 15.446 -1.809 455 HB3 ARG 68 2HB ARG 68 6.526 13.180 -3.210 456 HG3 ARG 68 2HG ARG 68 9.018 13.133 -3.142 457 HD3 ARG 68 2HD ARG 68 7.692 15.829 -3.403 458 HE ARG 68 HE ARG 68 10.429 15.089 -3.914 459 HH11 ARG 68 1HH1 ARG 68 7.807 17.212 -4.779 460 HH12 ARG 68 2HH1 ARG 68 8.844 18.445 -5.415 461 HH21 ARG 68 1HH2 ARG 68 11.803 16.706 -4.747 462 HH22 ARG 68 2HH2 ARG 68 11.117 18.157 -5.397 463 H GLN 69 H GLN 69 4.833 15.633 -3.235 464 HA GLN 69 HA GLN 69 2.282 14.726 -2.215 465 HB3 GLN 69 2HB GLN 69 3.152 16.629 -4.359 466 HG3 GLN 69 2HG GLN 69 0.445 15.396 -4.081 467 HE21 GLN 69 1HE2 GLN 69 -1.158 16.730 -3.670 468 HE22 GLN 69 2HE2 GLN 69 -1.316 18.346 -4.258 469 H VAL 70 H VAL 70 1.427 12.846 -2.772 470 HA VAL 70 HA VAL 70 2.368 11.434 -5.123 471 HB VAL 70 HB VAL 70 0.990 9.571 -4.331 472 HG11 VAL 70 1HG1 VAL 70 2.171 9.136 -2.233 473 HG12 VAL 70 2HG1 VAL 70 3.249 9.828 -3.447 474 HG13 VAL 70 3HG1 VAL 70 2.631 10.836 -2.138 475 HG21 VAL 70 3HG2 VAL 70 -0.867 10.076 -3.201 476 HG22 VAL 70 1HG2 VAL 70 0.170 10.290 -1.790 477 HG23 VAL 70 2HG2 VAL 70 -0.268 11.681 -2.782 478 H THR 71 H THR 71 1.263 11.108 -6.974 479 HA THR 71 HA THR 71 -1.530 12.014 -7.116 480 HB THR 71 HB THR 71 0.178 12.531 -9.492 481 HG1 THR 71 1HG THR 71 0.121 14.374 -7.329 482 HG21 THR 71 3HG2 THR 71 -1.362 14.728 -9.059 483 HG22 THR 71 1HG2 THR 71 -2.343 13.473 -8.304 484 HG23 THR 71 2HG2 THR 71 -1.872 13.326 -9.997 485 H GLY 72 H GLY 72 -0.071 9.363 -7.058 486 HA2 GLY 72 2HA GLY 72 -1.747 7.941 -8.783 487 HA3 GLY 72 3HA GLY 72 -0.214 8.169 -9.614 488 H ILE 73 H ILE 73 -1.199 5.647 -8.977 489 HA ILE 73 HA ILE 73 0.968 4.679 -7.302 490 HB ILE 73 HB ILE 73 -0.427 3.319 -5.870 491 HG13 ILE 73 2HG1 ILE 73 -2.492 4.117 -7.775 492 HG21 ILE 73 1HG2 ILE 73 -1.370 5.037 -4.468 493 HG22 ILE 73 2HG2 ILE 73 0.133 5.627 -5.177 494 HG23 ILE 73 3HG2 ILE 73 -1.418 6.164 -5.822 495 HD11 ILE 73 3HD1 ILE 73 -2.341 1.847 -7.623 496 HD12 ILE 73 1HD1 ILE 73 -2.014 1.872 -5.891 497 HD13 ILE 73 2HD1 ILE 73 -3.651 2.156 -6.483 498 H ILE 74 H ILE 74 1.207 2.319 -7.423 499 HA ILE 74 HA ILE 74 -0.278 0.856 -9.394 500 HB ILE 74 HB ILE 74 1.076 1.995 -10.979 501 HG13 ILE 74 2HG1 ILE 74 2.411 -0.667 -10.442 502 HG21 ILE 74 1HG2 ILE 74 3.020 1.957 -8.867 503 HG22 ILE 74 2HG2 ILE 74 3.734 1.357 -10.362 504 HG23 ILE 74 3HG2 ILE 74 2.973 2.947 -10.324 505 HD11 ILE 74 3HD1 ILE 74 0.483 -1.661 -10.855 506 HD12 ILE 74 1HD1 ILE 74 -0.310 -0.114 -11.147 507 HD13 ILE 74 2HD1 ILE 74 0.512 -0.947 -12.467 508 H THR 75 H THR 75 -0.151 -1.288 -9.029 509 HA THR 75 HA THR 75 2.028 -2.276 -7.314 510 HB THR 75 HB THR 75 0.036 -2.014 -5.918 511 HG1 THR 75 1HG THR 75 0.325 -4.786 -6.445 512 HG21 THR 75 3HG2 THR 75 -2.028 -2.493 -6.616 513 HG22 THR 75 1HG2 THR 75 -1.560 -4.134 -7.059 514 HG23 THR 75 2HG2 THR 75 -1.345 -2.814 -8.210 515 H GLN 76 H GLN 76 2.773 -4.328 -7.742 516 HA GLN 76 HA GLN 76 1.440 -5.896 -9.817 517 HB3 GLN 76 2HB GLN 76 4.326 -5.858 -10.212 518 HG3 GLN 76 2HG GLN 76 2.577 -4.849 -12.333 519 HE21 GLN 76 1HE2 GLN 76 3.783 -8.102 -11.871 520 HE22 GLN 76 2HE2 GLN 76 5.057 -8.001 -13.033 521 H GLY 77 H GLY 77 2.053 -8.114 -9.859 522 HA2 GLY 77 2HA GLY 77 3.105 -9.017 -7.273 523 HA3 GLY 77 3HA GLY 77 2.143 -9.978 -8.387 524 H ALA 78 H ALA 78 4.111 -11.372 -7.568 525 HA ALA 78 HA ALA 78 6.114 -11.255 -9.719 526 HB1 ALA 78 1HB ALA 78 7.685 -10.768 -8.220 527 HB2 ALA 78 2HB ALA 78 6.578 -11.030 -6.872 528 HB3 ALA 78 3HB ALA 78 7.453 -12.392 -7.572 529 H ARG 79 H ARG 79 6.930 -13.257 -10.414 530 HA ARG 79 HA ARG 79 5.446 -15.609 -9.440 531 HB3 ARG 79 2HB ARG 79 4.686 -14.813 -11.682 532 HG3 ARG 79 2HG ARG 79 7.492 -14.780 -12.238 533 HD3 ARG 79 2HD ARG 79 5.969 -16.937 -13.487 534 HE ARG 79 HE ARG 79 7.599 -15.834 -15.524 535 HH11 ARG 79 1HH1 ARG 79 4.456 -15.533 -14.055 536 HH12 ARG 79 2HH1 ARG 79 3.703 -14.912 -15.485 537 HH21 ARG 79 1HH2 ARG 79 6.617 -15.017 -17.414 538 HH22 ARG 79 2HH2 ARG 79 4.932 -14.620 -17.396 539 H ASP 80 H ASP 80 6.540 -17.612 -9.494 540 HA ASP 80 HA ASP 80 9.472 -17.351 -9.584 541 HB3 ASP 80 2HB ASP 80 7.898 -19.435 -8.066 542 H PHE 81 H PHE 81 7.836 -17.870 -11.894 543 HA PHE 81 HA PHE 81 7.840 -19.199 -13.738 544 HB3 PHE 81 2HB PHE 81 9.704 -20.629 -14.134 545 HD1 PHE 81 1HD PHE 81 10.153 -18.412 -15.199 546 HD2 PHE 81 2HD PHE 81 11.373 -19.332 -11.225 547 HE1 PHE 81 1HE PHE 81 11.753 -16.544 -15.260 548 HE2 PHE 81 2HE PHE 81 12.974 -17.465 -11.281 549 HZ PHE 81 HZ PHE 81 13.165 -16.067 -13.299 550 H GLY 82 H GLY 82 5.756 -19.996 -13.279 551 HA2 GLY 82 2HA GLY 82 4.559 -22.070 -13.502 552 HA3 GLY 82 3HA GLY 82 5.759 -22.827 -12.465 553 H HIS 83 H HIS 83 5.888 -21.335 -10.275 554 HA HIS 83 HA HIS 83 3.229 -21.668 -9.124 555 HB3 HIS 83 2HB HIS 83 4.613 -21.131 -6.965 556 HD1 HIS 83 1HD HIS 83 6.436 -23.885 -8.673 557 HD2 HIS 83 2HD HIS 83 3.008 -23.380 -6.379 558 HE1 HIS 83 1HE HIS 83 5.733 -26.202 -7.994 559 H ILE 84 H ILE 84 3.569 -19.460 -10.863 560 HA ILE 84 HA ILE 84 4.224 -17.018 -10.051 561 HB ILE 84 HB ILE 84 1.467 -17.661 -11.106 562 HG13 ILE 84 2HG1 ILE 84 4.077 -17.915 -12.285 563 HG21 ILE 84 1HG2 ILE 84 2.976 -15.137 -10.706 564 HG22 ILE 84 2HG2 ILE 84 1.987 -15.287 -12.158 565 HG23 ILE 84 3HG2 ILE 84 1.247 -15.458 -10.566 566 HD11 ILE 84 3HD1 ILE 84 2.067 -19.406 -12.603 567 HD12 ILE 84 1HD1 ILE 84 1.444 -18.172 -13.698 568 HD13 ILE 84 2HD1 ILE 84 2.967 -18.984 -14.060 569 H GLN 85 H GLN 85 3.727 -15.529 -8.532 570 HA GLN 85 HA GLN 85 1.599 -16.214 -6.613 571 HB3 GLN 85 2HB GLN 85 2.937 -15.414 -4.811 572 HG3 GLN 85 2HG GLN 85 4.367 -17.240 -6.670 573 HE21 GLN 85 1HE2 GLN 85 6.000 -15.172 -6.350 574 HE22 GLN 85 2HE2 GLN 85 7.261 -15.530 -5.226 575 H TYR 86 H TYR 86 0.695 -14.359 -5.440 576 HA TYR 86 HA TYR 86 1.123 -11.692 -6.154 577 HB3 TYR 86 2HB TYR 86 0.317 -11.931 -8.310 578 HD1 TYR 86 2HD TYR 86 -2.661 -13.419 -6.637 579 HD2 TYR 86 1HD TYR 86 0.366 -13.875 -9.592 580 HE1 TYR 86 2HE TYR 86 -3.762 -15.465 -7.442 581 HE2 TYR 86 1HE TYR 86 -0.728 -15.921 -10.406 582 HH TYR 86 HH TYR 86 -2.261 -17.586 -9.722 583 H VAL 87 H VAL 87 -0.132 -10.293 -4.948 584 HA VAL 87 HA VAL 87 -1.786 -11.573 -2.907 585 HB VAL 87 HB VAL 87 -0.896 -8.691 -3.002 586 HG11 VAL 87 1HG1 VAL 87 -1.140 -9.266 -0.407 587 HG12 VAL 87 2HG1 VAL 87 -2.487 -8.677 -1.382 588 HG13 VAL 87 3HG1 VAL 87 -2.323 -10.403 -1.053 589 HG21 VAL 87 3HG2 VAL 87 1.096 -10.018 -3.036 590 HG22 VAL 87 1HG2 VAL 87 0.871 -9.414 -1.393 591 HG23 VAL 87 2HG2 VAL 87 0.467 -11.086 -1.781 592 H ALA 88 H ALA 88 -3.867 -10.811 -2.362 593 HA ALA 88 HA ALA 88 -5.251 -9.484 -4.596 594 HB1 ALA 88 1HB ALA 88 -7.284 -10.534 -3.232 595 HB2 ALA 88 2HB ALA 88 -6.381 -11.446 -4.442 596 HB3 ALA 88 3HB ALA 88 -6.016 -11.652 -2.728 597 H SER 89 H SER 89 -6.167 -9.910 -1.193 598 HA SER 89 HA SER 89 -7.091 -7.175 -1.079 599 HB3 SER 89 2HB SER 89 -8.128 -7.751 0.949 600 HG SER 89 HG SER 89 -8.687 -9.146 -0.968 601 H TYR 90 H TYR 90 -5.880 -5.511 -0.496 602 HA TYR 90 HA TYR 90 -3.779 -5.884 1.505 603 HB3 TYR 90 2HB TYR 90 -2.972 -4.068 -0.646 604 HD1 TYR 90 2HD TYR 90 -1.735 -3.967 1.806 605 HD2 TYR 90 1HD TYR 90 -1.205 -6.959 -1.171 606 HE1 TYR 90 2HE TYR 90 0.479 -4.494 2.739 607 HE2 TYR 90 1HE TYR 90 1.009 -7.497 -0.245 608 HH TYR 90 HH TYR 90 2.346 -5.678 2.493 609 H LYS 91 H LYS 91 -3.402 -4.117 2.798 610 HA LYS 91 HA LYS 91 -5.368 -1.961 2.570 611 HB3 LYS 91 2HB LYS 91 -3.675 -1.925 4.943 612 HG3 LYS 91 2HG LYS 91 -5.844 -2.065 6.114 613 HD3 LYS 91 2HD LYS 91 -5.311 -0.043 3.990 614 HE3 LYS 91 2HE LYS 91 -7.857 -0.498 4.295 615 HZ1 LYS 91 3HZ LYS 91 -8.236 1.361 6.280 616 HZ2 LYS 91 1HZ LYS 91 -7.095 0.286 6.920 617 HZ3 LYS 91 2HZ LYS 91 -8.585 -0.292 6.365 618 H VAL 92 H VAL 92 -4.804 -0.025 1.843 619 HA VAL 92 HA VAL 92 -1.943 0.673 1.784 620 HB VAL 92 HB VAL 92 -2.821 0.592 -0.439 621 HG11 VAL 92 1HG1 VAL 92 -4.989 0.900 -0.807 622 HG12 VAL 92 2HG1 VAL 92 -5.201 1.583 0.807 623 HG13 VAL 92 3HG1 VAL 92 -4.759 2.629 -0.543 624 HG21 VAL 92 3HG2 VAL 92 -2.919 3.527 0.045 625 HG22 VAL 92 1HG2 VAL 92 -1.446 2.651 0.466 626 HG23 VAL 92 2HG2 VAL 92 -2.052 2.614 -1.189 627 H ALA 93 H ALA 93 -1.411 1.985 3.400 628 HA ALA 93 HA ALA 93 -3.237 4.206 4.052 629 HB1 ALA 93 1HB ALA 93 -2.953 2.287 5.776 630 HB2 ALA 93 2HB ALA 93 -1.397 3.051 6.105 631 HB3 ALA 93 3HB ALA 93 -2.890 3.963 6.324 632 H HIS 94 H HIS 94 -2.340 6.212 4.356 633 HA HIS 94 HA HIS 94 0.568 6.436 3.944 634 HB3 HIS 94 2HB HIS 94 0.133 8.517 2.658 635 HD1 HIS 94 1HD HIS 94 0.813 8.029 0.338 636 HD2 HIS 94 2HD HIS 94 -1.883 5.213 1.777 637 HE1 HIS 94 1HE HIS 94 0.575 6.326 -1.498 638 H SER 95 H SER 95 1.651 7.925 5.165 639 HA SER 95 HA SER 95 0.052 9.512 7.063 640 HB3 SER 95 2HB SER 95 1.149 8.690 8.868 641 HG SER 95 HG SER 95 0.592 6.789 7.548 642 H ASP 96 H ASP 96 0.507 11.610 7.061 643 HA ASP 96 HA ASP 96 2.816 12.547 5.546 644 HB3 ASP 96 2HB ASP 96 0.771 13.623 4.951 645 H ASP 97 H ASP 97 1.486 12.643 8.802 646 HA ASP 97 HA ASP 97 3.763 14.216 9.744 647 HB3 ASP 97 2HB ASP 97 1.599 13.194 11.546 648 H GLY 98 H GLY 98 2.860 10.992 9.373 649 HA2 GLY 98 2HA GLY 98 4.363 9.206 9.799 650 HA3 GLY 98 3HA GLY 98 5.092 10.160 11.082 651 H VAL 99 H VAL 99 2.517 10.881 12.264 652 HA VAL 99 HA VAL 99 2.029 8.351 13.662 653 HB VAL 99 HB VAL 99 1.063 9.674 15.450 654 HG11 VAL 99 1HG1 VAL 99 3.065 11.019 16.077 655 HG12 VAL 99 2HG1 VAL 99 3.438 9.372 15.561 656 HG13 VAL 99 3HG1 VAL 99 3.709 10.726 14.462 657 HG21 VAL 99 3HG2 VAL 99 -0.005 11.415 14.147 658 HG22 VAL 99 1HG2 VAL 99 1.070 12.139 15.343 659 HG23 VAL 99 2HG2 VAL 99 1.566 12.046 13.653 660 H GLN 100 H GLN 100 0.528 10.647 11.568 661 HA GLN 100 HA GLN 100 -2.146 9.610 12.102 662 HB3 GLN 100 2HB GLN 100 -2.950 11.375 10.670 663 HG3 GLN 100 2HG GLN 100 -0.697 12.673 12.157 664 HE21 GLN 100 1HE2 GLN 100 -0.848 14.691 11.464 665 HE22 GLN 100 2HE2 GLN 100 -2.305 15.609 11.341 666 H TRP 101 H TRP 101 -2.362 7.620 11.231 667 HA TRP 101 HA TRP 101 -1.372 7.098 8.540 668 HB3 TRP 101 2HB TRP 101 -1.767 4.801 8.972 669 HD1 TRP 101 HD TRP 101 0.612 6.768 9.982 670 HE1 TRP 101 1HE TRP 101 2.040 6.015 11.986 671 HE3 TRP 101 3HE TRP 101 -2.606 3.372 12.042 672 HZ2 TRP 101 2HZ TRP 101 1.831 4.218 14.153 673 HZ3 TRP 101 3HZ TRP 101 -1.916 2.179 14.080 674 HH2 TRP 101 HH TRP 101 0.258 2.594 15.111 675 H THR 102 H THR 102 -2.648 7.889 6.982 676 HA THR 102 HA THR 102 -5.548 7.803 7.275 677 HB THR 102 HB THR 102 -3.795 9.034 5.143 678 HG1 THR 102 1HG THR 102 -3.816 10.202 7.083 679 HG21 THR 102 3HG2 THR 102 -5.881 10.065 4.305 680 HG22 THR 102 1HG2 THR 102 -6.802 9.061 5.425 681 HG23 THR 102 2HG2 THR 102 -5.874 8.310 4.127 682 H VAL 103 H VAL 103 -6.799 6.308 6.364 683 HA VAL 103 HA VAL 103 -5.562 4.396 4.516 684 HB VAL 103 HB VAL 103 -7.607 3.009 4.991 685 HG11 VAL 103 1HG1 VAL 103 -5.969 2.115 6.241 686 HG12 VAL 103 2HG1 VAL 103 -5.441 3.686 6.849 687 HG13 VAL 103 3HG1 VAL 103 -6.818 2.869 7.590 688 HG21 VAL 103 3HG2 VAL 103 -8.069 5.064 7.150 689 HG22 VAL 103 1HG2 VAL 103 -9.059 4.863 5.704 690 HG23 VAL 103 2HG2 VAL 103 -8.983 3.576 6.907 691 H TYR 104 H TYR 104 -6.175 4.222 2.446 692 HA TYR 104 HA TYR 104 -7.838 6.209 1.282 693 HB3 TYR 104 2HB TYR 104 -7.560 4.259 -0.653 694 HD1 TYR 104 2HD TYR 104 -7.996 7.033 -0.853 695 HD2 TYR 104 1HD TYR 104 -4.269 5.001 -0.567 696 HE1 TYR 104 2HE TYR 104 -6.888 8.918 -1.979 697 HE2 TYR 104 1HE TYR 104 -3.151 6.882 -1.691 698 HH TYR 104 HH TYR 104 -4.681 9.162 -3.420 699 H GLU 105 H GLU 105 -9.848 5.953 2.355 700 HA GLU 105 HA GLU 105 -11.332 3.492 1.824 701 HB3 GLU 105 2HB GLU 105 -11.748 5.833 3.653 702 HG3 GLU 105 2HG GLU 105 -13.939 5.448 2.657 703 H GLU 106 H GLU 106 -13.357 3.485 0.784 704 HA GLU 106 HA GLU 106 -14.098 5.915 -0.676 705 HB3 GLU 106 2HB GLU 106 -13.971 3.227 -2.037 706 HG3 GLU 106 2HG GLU 106 -13.609 5.580 -3.674 707 H GLN 107 H GLN 107 -15.568 5.474 1.356 708 HA GLN 107 HA GLN 107 -18.141 4.954 0.431 709 HB3 GLN 107 2HB GLN 107 -16.680 2.592 1.390 710 HG3 GLN 107 2HG GLN 107 -19.438 3.184 2.424 711 HE21 GLN 107 1HE2 GLN 107 -17.064 0.651 3.036 712 HE22 GLN 107 2HE2 GLN 107 -18.128 -0.673 2.719 713 H GLY 108 H GLY 108 -15.943 4.927 3.176 714 HA2 GLY 108 2HA GLY 108 -16.638 6.878 4.715 715 HA3 GLY 108 3HA GLY 108 -18.107 5.932 4.902 716 H SER 109 H SER 109 -15.803 3.680 4.535 717 HA SER 109 HA SER 109 -15.197 3.585 7.417 718 HB3 SER 109 2HB SER 109 -16.004 1.354 5.549 719 HG SER 109 HG SER 109 -15.399 -0.079 7.107 720 H SER 110 H SER 110 -14.122 1.206 5.112 721 HA SER 110 HA SER 110 -11.717 2.230 4.249 722 HB3 SER 110 2HB SER 110 -10.677 2.535 6.265 723 HG SER 110 HG SER 110 -11.242 1.473 8.127 724 H LYS 111 H LYS 111 -12.162 0.930 2.504 725 HA LYS 111 HA LYS 111 -12.221 -1.971 2.930 726 HB3 LYS 111 2HB LYS 111 -12.788 -0.419 0.398 727 HG3 LYS 111 2HG LYS 111 -12.249 -3.008 0.444 728 HD3 LYS 111 2HD LYS 111 -14.380 -3.040 2.121 729 HE3 LYS 111 2HE LYS 111 -15.997 -4.313 0.339 730 HZ1 LYS 111 3HZ LYS 111 -16.581 -1.495 0.579 731 HZ2 LYS 111 1HZ LYS 111 -16.247 -2.260 2.051 732 HZ3 LYS 111 2HZ LYS 111 -17.493 -2.836 1.063 733 H VAL 112 H VAL 112 -10.543 -3.224 2.427 734 HA VAL 112 HA VAL 112 -8.066 -2.092 1.614 735 HB VAL 112 HB VAL 112 -7.174 -4.332 1.687 736 HG11 VAL 112 1HG1 VAL 112 -8.912 -4.757 3.948 737 HG12 VAL 112 2HG1 VAL 112 -7.208 -4.303 3.911 738 HG13 VAL 112 3HG1 VAL 112 -8.455 -3.060 3.812 739 HG21 VAL 112 3HG2 VAL 112 -8.717 -6.261 2.145 740 HG22 VAL 112 1HG2 VAL 112 -10.059 -5.195 1.726 741 HG23 VAL 112 2HG2 VAL 112 -8.831 -5.582 0.521 742 H PHE 113 H PHE 113 -6.948 -2.269 -0.307 743 HA PHE 113 HA PHE 113 -8.492 -2.340 -2.681 744 HB3 PHE 113 2HB PHE 113 -6.033 -2.466 -3.684 745 HD1 PHE 113 1HD PHE 113 -7.684 -0.225 -1.212 746 HD2 PHE 113 2HD PHE 113 -5.690 -0.574 -4.956 747 HE1 PHE 113 1HE PHE 113 -8.140 2.148 -1.671 748 HE2 PHE 113 2HE PHE 113 -6.142 1.799 -5.421 749 HZ PHE 113 HZ PHE 113 -7.368 3.164 -3.778 750 H GLN 114 H GLN 114 -8.575 -3.847 -4.333 751 HA GLN 114 HA GLN 114 -7.689 -6.553 -3.587 752 HB3 GLN 114 2HB GLN 114 -9.521 -7.430 -4.863 753 HG3 GLN 114 2HG GLN 114 -9.986 -5.642 -2.707 754 HE21 GLN 114 1HE2 GLN 114 -10.416 -3.948 -4.786 755 HE22 GLN 114 2HE2 GLN 114 -12.090 -3.536 -4.882 756 H GLY 115 H GLY 115 -6.444 -7.728 -4.956 757 HA2 GLY 115 2HA GLY 115 -5.386 -6.303 -7.286 758 HA3 GLY 115 3HA GLY 115 -4.652 -7.695 -6.503 759 H ASN 116 H ASN 116 -4.431 -9.036 -8.224 760 HA ASN 116 HA ASN 116 -6.930 -9.942 -9.485 761 HB3 ASN 116 2HB ASN 116 -4.528 -10.151 -11.170 762 HD21 ASN 116 1HD2 ASN 116 -5.900 -7.873 -12.695 763 HD22 ASN 116 2HD2 ASN 116 -7.218 -8.661 -13.486 764 H LEU 117 H LEU 117 -5.985 -11.991 -11.001 765 HA LEU 117 HA LEU 117 -4.801 -13.794 -8.994 766 HB3 LEU 117 2HB LEU 117 -6.047 -15.593 -9.955 767 HG LEU 117 HG LEU 117 -7.529 -13.264 -9.047 768 HD11 LEU 117 1HD1 LEU 117 -8.578 -13.689 -11.303 769 HD12 LEU 117 2HD1 LEU 117 -9.665 -13.779 -9.917 770 HD13 LEU 117 3HD1 LEU 117 -9.080 -15.259 -10.677 771 HD21 LEU 117 3HD2 LEU 117 -8.424 -16.077 -8.690 772 HD22 LEU 117 1HD2 LEU 117 -8.377 -14.748 -7.532 773 HD23 LEU 117 2HD2 LEU 117 -6.889 -15.586 -7.971 774 H ASP 118 H ASP 118 -3.179 -12.229 -10.670 775 HA ASP 118 HA ASP 118 -1.608 -14.297 -11.894 776 HB3 ASP 118 2HB ASP 118 -2.865 -14.048 -13.835 777 H ASN 119 H ASN 119 0.521 -13.629 -12.379 778 HA ASN 119 HA ASN 119 1.557 -11.638 -10.694 779 HB3 ASN 119 2HB ASN 119 2.614 -13.482 -12.728 780 HD21 ASN 119 1HD2 ASN 119 4.564 -11.220 -10.927 781 HD22 ASN 119 2HD2 ASN 119 5.384 -10.542 -12.289 782 H ASN 120 H ASN 120 0.152 -11.433 -13.794 783 HA ASN 120 HA ASN 120 1.445 -8.895 -14.427 784 HB3 ASN 120 2HB ASN 120 0.266 -9.041 -16.561 785 HD21 ASN 120 1HD2 ASN 120 0.427 -12.414 -15.709 786 HD22 ASN 120 2HD2 ASN 120 1.927 -12.746 -16.501 787 H SER 121 H SER 121 -0.378 -9.194 -12.129 788 HA SER 121 HA SER 121 -2.840 -7.897 -12.814 789 HB3 SER 121 2HB SER 121 -2.689 -9.404 -10.877 790 HG SER 121 HG SER 121 -0.475 -8.311 -10.353 791 H HIS 122 H HIS 122 -1.416 -6.212 -14.016 792 HA HIS 122 HA HIS 122 -0.086 -4.207 -12.536 793 HB3 HIS 122 2HB HIS 122 -1.371 -4.044 -15.271 794 HD1 HIS 122 1HD HIS 122 -1.945 -1.488 -14.737 795 HD2 HIS 122 2HD HIS 122 2.089 -2.480 -14.756 796 HE1 HIS 122 1HE HIS 122 -0.716 0.700 -14.906 797 H LYS 123 H LYS 123 -1.379 -3.554 -10.820 798 HA LYS 123 HA LYS 123 -3.918 -2.241 -11.490 799 HB3 LYS 123 2HB LYS 123 -3.361 -2.343 -8.662 800 HG3 LYS 123 2HG LYS 123 -5.349 -4.229 -9.476 801 HD3 LYS 123 2HD LYS 123 -5.183 -2.772 -7.392 802 HE3 LYS 123 2HE LYS 123 -5.608 -0.748 -9.426 803 HZ1 LYS 123 3HZ LYS 123 -7.173 0.557 -8.063 804 HZ2 LYS 123 1HZ LYS 123 -7.466 -0.813 -7.113 805 HZ3 LYS 123 2HZ LYS 123 -7.887 -0.814 -8.750 806 H LYS 124 H LYS 124 -3.432 -0.208 -12.131 807 HA LYS 124 HA LYS 124 -1.833 1.436 -10.279 808 HB3 LYS 124 2HB LYS 124 -0.956 0.972 -12.680 809 HG3 LYS 124 2HG LYS 124 -1.670 2.683 -14.310 810 HD3 LYS 124 2HD LYS 124 -4.191 1.249 -13.788 811 HE3 LYS 124 2HE LYS 124 -3.134 0.297 -16.106 812 HZ1 LYS 124 3HZ LYS 124 -5.168 1.158 -16.447 813 HZ2 LYS 124 1HZ LYS 124 -4.310 2.512 -16.990 814 HZ3 LYS 124 2HZ LYS 124 -4.923 2.475 -15.415 815 H ASN 125 H ASN 125 -2.673 3.340 -9.579 816 HA ASN 125 HA ASN 125 -5.391 3.998 -10.508 817 HB3 ASN 125 2HB ASN 125 -4.584 5.082 -7.901 818 HD21 ASN 125 1HD2 ASN 125 -6.413 6.047 -7.416 819 HD22 ASN 125 2HD2 ASN 125 -7.996 5.379 -7.591 820 H ILE 126 H ILE 126 -5.985 6.256 -10.513 821 HA ILE 126 HA ILE 126 -3.807 7.922 -11.451 822 HB ILE 126 HB ILE 126 -6.480 9.132 -11.215 823 HG13 ILE 126 2HG1 ILE 126 -7.282 6.948 -11.714 824 HG21 ILE 126 1HG2 ILE 126 -5.799 10.294 -13.015 825 HG22 ILE 126 2HG2 ILE 126 -4.204 9.683 -12.579 826 HG23 ILE 126 3HG2 ILE 126 -5.152 8.865 -13.820 827 HD11 ILE 126 3HD1 ILE 126 -6.936 8.198 -14.424 828 HD12 ILE 126 1HD1 ILE 126 -8.194 7.078 -13.904 829 HD13 ILE 126 2HD1 ILE 126 -8.143 8.714 -13.246 830 H PHE 127 H PHE 127 -4.439 10.434 -10.812 831 HA PHE 127 HA PHE 127 -3.290 10.963 -8.415 832 HB3 PHE 127 2HB PHE 127 -3.780 12.714 -10.035 833 HD1 PHE 127 2HD PHE 127 -5.373 11.769 -11.755 834 HD2 PHE 127 1HD PHE 127 -6.683 13.666 -8.177 835 HE1 PHE 127 2HE PHE 127 -7.592 12.121 -12.758 836 HE2 PHE 127 1HE PHE 127 -8.904 14.020 -9.174 837 HZ PHE 127 HZ PHE 127 -9.361 13.249 -11.467 838 H GLU 128 H GLU 128 -6.759 10.477 -8.977 839 HA GLU 128 HA GLU 128 -8.508 10.425 -7.462 840 HB3 GLU 128 2HB GLU 128 -6.809 8.430 -6.004 841 HG3 GLU 128 2HG GLU 128 -9.310 8.859 -5.554 842 H LYS 129 H LYS 129 -7.418 12.655 -6.751 843 HA LYS 129 HA LYS 129 -7.270 14.132 -5.022 844 HB3 LYS 129 2HB LYS 129 -8.145 13.581 -2.905 845 HG3 LYS 129 2HG LYS 129 -9.566 11.425 -4.370 846 HD3 LYS 129 2HD LYS 129 -10.551 13.860 -2.886 847 HE3 LYS 129 2HE LYS 129 -12.590 12.366 -2.651 848 HZ1 LYS 129 3HZ LYS 129 -13.218 12.761 -5.102 849 HZ2 LYS 129 1HZ LYS 129 -11.728 13.557 -5.204 850 HZ3 LYS 129 2HZ LYS 129 -12.905 14.100 -4.118 851 HA PRO 130 HA PRO 130 -2.934 12.693 -4.397 852 HB3 PRO 130 2HB PRO 130 -2.281 13.750 -6.331 853 HG3 PRO 130 2HG PRO 130 -3.509 15.521 -7.203 854 HD3 PRO 130 2HD PRO 130 -5.200 13.987 -6.880 855 H PHE 131 H PHE 131 -1.209 13.708 -3.058 856 HA PHE 131 HA PHE 131 -1.586 15.952 -1.451 857 HB3 PHE 131 2HB PHE 131 -3.430 14.939 -0.369 858 HD1 PHE 131 1HD PHE 131 -0.723 12.476 0.360 859 HD2 PHE 131 2HD PHE 131 -4.785 13.127 -0.735 860 HE1 PHE 131 1HE PHE 131 -1.122 10.048 0.409 861 HE2 PHE 131 2HE PHE 131 -5.190 10.701 -0.686 862 HZ PHE 131 HZ PHE 131 -3.358 9.158 -0.112 863 H MET 132 H MET 132 -0.003 16.103 0.303 864 HA MET 132 HA MET 132 2.470 14.885 -0.451 865 HB3 MET 132 2HB MET 132 3.307 16.104 1.637 866 HG3 MET 132 2HG MET 132 2.146 17.365 -0.764 867 HE1 MET 132 3HE MET 132 0.996 20.648 -0.295 868 HE2 MET 132 1HE MET 132 0.896 19.030 -0.990 869 HE3 MET 132 2HE MET 132 0.093 19.383 0.541 870 H ALA 133 H ALA 133 3.785 13.502 0.788 871 HA ALA 133 HA ALA 133 2.586 12.203 3.112 872 HB1 ALA 133 1HB ALA 133 3.727 10.213 1.340 873 HB2 ALA 133 2HB ALA 133 2.164 10.235 2.159 874 HB3 ALA 133 3HB ALA 133 2.357 11.049 0.606 875 H ARG 134 H ARG 134 4.071 11.218 4.491 876 HA ARG 134 HA ARG 134 6.899 11.746 3.851 877 HB3 ARG 134 2HB ARG 134 5.412 11.944 6.465 878 HG3 ARG 134 2HG ARG 134 8.002 12.792 6.935 879 HD3 ARG 134 2HD ARG 134 6.165 10.750 7.877 880 HE ARG 134 HE ARG 134 8.606 9.656 7.383 881 HH11 ARG 134 1HH1 ARG 134 6.835 10.462 10.270 882 HH12 ARG 134 2HH1 ARG 134 7.541 9.192 11.214 883 HH21 ARG 134 1HH2 ARG 134 9.542 7.980 8.616 884 HH22 ARG 134 2HH2 ARG 134 9.080 7.782 10.273 885 H TYR 135 H TYR 135 4.574 9.496 5.161 886 HA TYR 135 HA TYR 135 6.361 7.295 4.707 887 HB3 TYR 135 2HB TYR 135 5.833 8.293 7.464 888 HD1 TYR 135 1HD TYR 135 7.327 5.054 6.477 889 HD2 TYR 135 2HD TYR 135 4.189 7.006 8.586 890 HE1 TYR 135 1HE TYR 135 6.686 2.910 7.499 891 HE2 TYR 135 2HE TYR 135 3.542 4.868 9.614 892 HH TYR 135 HH TYR 135 5.254 2.405 9.970 893 H VAL 136 H VAL 136 5.113 5.804 3.816 894 HA VAL 136 HA VAL 136 2.292 5.637 4.642 895 HB VAL 136 HB VAL 136 1.740 4.778 2.504 896 HG11 VAL 136 1HG1 VAL 136 2.035 7.178 2.519 897 HG12 VAL 136 2HG1 VAL 136 3.757 6.998 2.177 898 HG13 VAL 136 3HG1 VAL 136 2.563 6.527 0.968 899 HG21 VAL 136 3HG2 VAL 136 4.708 4.537 2.025 900 HG22 VAL 136 1HG2 VAL 136 3.540 3.224 2.173 901 HG23 VAL 136 2HG2 VAL 136 3.476 4.308 0.783 902 H ARG 137 H ARG 137 1.364 3.651 5.107 903 HA ARG 137 HA ARG 137 3.224 1.380 5.351 904 HB3 ARG 137 2HB ARG 137 1.039 2.074 7.319 905 HG3 ARG 137 2HG ARG 137 3.354 0.270 7.867 906 HD3 ARG 137 2HD ARG 137 1.487 1.278 9.499 907 HE ARG 137 HE ARG 137 -0.128 -0.361 8.069 908 HH11 ARG 137 1HH1 ARG 137 1.038 -0.392 11.350 909 HH12 ARG 137 2HH1 ARG 137 -0.367 -1.186 11.980 910 HH21 ARG 137 1HH2 ARG 137 -1.984 -1.406 8.887 911 HH22 ARG 137 2HH2 ARG 137 -2.085 -1.763 10.579 912 H VAL 138 H VAL 138 2.413 -0.647 4.903 913 HA VAL 138 HA VAL 138 -0.386 -0.795 4.008 914 HB VAL 138 HB VAL 138 0.704 -2.550 2.312 915 HG11 VAL 138 1HG1 VAL 138 0.927 -0.376 0.764 916 HG12 VAL 138 2HG1 VAL 138 -0.627 -1.053 1.255 917 HG13 VAL 138 3HG1 VAL 138 0.049 0.327 2.123 918 HG21 VAL 138 3HG2 VAL 138 2.994 -2.089 3.102 919 HG22 VAL 138 1HG2 VAL 138 2.783 -1.719 1.391 920 HG23 VAL 138 2HG2 VAL 138 2.820 -0.415 2.577 921 H LEU 139 H LEU 139 -1.366 -2.852 4.161 922 HA LEU 139 HA LEU 139 0.126 -4.972 5.498 923 HB3 LEU 139 2HB LEU 139 -2.344 -3.664 6.621 924 HG LEU 139 HG LEU 139 -1.432 -6.394 7.047 925 HD11 LEU 139 1HD1 LEU 139 -0.356 -5.030 8.957 926 HD12 LEU 139 2HD1 LEU 139 -1.291 -6.469 9.360 927 HD13 LEU 139 3HD1 LEU 139 -2.007 -4.870 9.557 928 HD21 LEU 139 3HD2 LEU 139 -3.673 -6.273 6.658 929 HD22 LEU 139 1HD2 LEU 139 -3.847 -4.721 7.477 930 HD23 LEU 139 2HD2 LEU 139 -3.690 -6.202 8.421 931 HA PRO 140 HA PRO 140 -2.334 -7.140 2.472 932 HB3 PRO 140 2HB PRO 140 -0.431 -8.342 2.010 933 HG3 PRO 140 2HG PRO 140 1.171 -8.730 3.651 934 HD3 PRO 140 2HD PRO 140 0.908 -6.452 3.884 935 H VAL 141 H VAL 141 -4.105 -8.511 2.503 936 HA VAL 141 HA VAL 141 -4.938 -9.518 5.145 937 HB VAL 141 HB VAL 141 -6.708 -8.216 3.070 938 HG11 VAL 141 1HG1 VAL 141 -8.111 -9.805 3.961 939 HG12 VAL 141 2HG1 VAL 141 -7.300 -9.800 5.528 940 HG13 VAL 141 3HG1 VAL 141 -8.366 -8.467 5.081 941 HG21 VAL 141 3HG2 VAL 141 -5.638 -7.331 5.727 942 HG22 VAL 141 1HG2 VAL 141 -5.651 -6.469 4.188 943 HG23 VAL 141 2HG2 VAL 141 -7.149 -6.678 5.094 944 H SER 142 H SER 142 -5.108 -9.871 1.644 945 HA SER 142 HA SER 142 -5.512 -12.740 1.989 946 HB3 SER 142 2HB SER 142 -7.460 -12.912 0.756 947 HG SER 142 HG SER 142 -8.531 -11.849 2.213 948 H TRP 143 H TRP 143 -3.773 -13.536 1.010 949 HA TRP 143 HA TRP 143 -2.925 -12.346 -1.545 950 HB3 TRP 143 2HB TRP 143 -1.212 -12.253 0.197 951 HD1 TRP 143 HD TRP 143 -0.265 -15.839 -0.484 952 HE1 TRP 143 1HE TRP 143 -0.236 -17.153 1.729 953 HE3 TRP 143 3HE TRP 143 -2.438 -12.350 2.556 954 HZ2 TRP 143 2HZ TRP 143 -1.031 -16.761 4.409 955 HZ3 TRP 143 3HZ TRP 143 -2.767 -12.898 4.932 956 HH2 TRP 143 HH TRP 143 -2.079 -15.058 5.837 957 H HIS 144 H HIS 144 -1.711 -14.049 -2.946 958 HA HIS 144 HA HIS 144 -3.171 -16.601 -2.907 959 HB3 HIS 144 2HB HIS 144 -2.912 -16.223 -5.568 960 HD1 HIS 144 1HD HIS 144 -4.896 -17.699 -3.887 961 HD2 HIS 144 2HD HIS 144 -5.687 -13.948 -5.489 962 HE1 HIS 144 1HE HIS 144 -7.403 -17.521 -3.972 963 H ASN 145 H ASN 145 -1.853 -18.292 -2.984 964 HA ASN 145 HA ASN 145 -0.078 -19.631 -3.512 965 HB3 ASN 145 2HB ASN 145 1.469 -17.659 -5.046 966 HD21 ASN 145 1HD2 ASN 145 2.600 -19.795 -4.437 967 HD22 ASN 145 2HD2 ASN 145 2.493 -21.047 -5.624 968 H ARG 146 H ARG 146 1.150 -16.285 -3.303 969 HA ARG 146 HA ARG 146 2.340 -16.692 -0.756 970 HB3 ARG 146 2HB ARG 146 4.667 -16.110 -2.195 971 HG3 ARG 146 2HG ARG 146 5.478 -18.275 -1.452 972 HD3 ARG 146 2HD ARG 146 4.258 -16.310 0.234 973 HE ARG 146 HE ARG 146 3.127 -17.668 1.670 974 HH11 ARG 146 1HH1 ARG 146 5.909 -19.391 0.482 975 HH12 ARG 146 2HH1 ARG 146 5.649 -20.772 1.494 976 HH21 ARG 146 1HH2 ARG 146 2.774 -19.481 3.008 977 HH22 ARG 146 2HH2 ARG 146 3.864 -20.822 2.931 978 H ILE 147 H ILE 147 3.060 -14.780 0.158 979 HA ILE 147 HA ILE 147 2.048 -12.385 -0.974 980 HB ILE 147 HB ILE 147 3.939 -12.734 1.356 981 HG13 ILE 147 2HG1 ILE 147 0.979 -12.905 1.048 982 HG21 ILE 147 1HG2 ILE 147 2.555 -10.457 1.849 983 HG22 ILE 147 2HG2 ILE 147 4.154 -10.510 1.109 984 HG23 ILE 147 3HG2 ILE 147 2.717 -10.379 0.095 985 HD11 ILE 147 3HD1 ILE 147 1.489 -14.939 1.779 986 HD12 ILE 147 1HD1 ILE 147 3.097 -14.443 2.307 987 HD13 ILE 147 2HD1 ILE 147 1.704 -14.184 3.358 988 H THR 148 H THR 148 3.166 -12.409 -3.037 989 HA THR 148 HA THR 148 5.825 -11.167 -2.830 990 HB THR 148 HB THR 148 5.269 -12.804 -5.246 991 HG1 THR 148 1HG THR 148 4.663 -14.142 -3.414 992 HG21 THR 148 3HG2 THR 148 7.483 -12.615 -5.525 993 HG22 THR 148 1HG2 THR 148 7.814 -13.112 -3.865 994 HG23 THR 148 2HG2 THR 148 7.435 -11.427 -4.223 995 H LEU 149 H LEU 149 5.255 -9.096 -3.259 996 HA LEU 149 HA LEU 149 4.472 -8.467 -5.961 997 HB3 LEU 149 2HB LEU 149 2.347 -8.857 -4.567 998 HG LEU 149 HG LEU 149 2.995 -6.081 -3.576 999 HD11 LEU 149 1HD1 LEU 149 0.508 -7.390 -4.135 1000 HD12 LEU 149 2HD1 LEU 149 0.803 -5.757 -3.539 1001 HD13 LEU 149 3HD1 LEU 149 0.659 -7.097 -2.402 1002 HD21 LEU 149 3HD2 LEU 149 2.696 -8.722 -2.158 1003 HD22 LEU 149 1HD2 LEU 149 2.646 -7.160 -1.339 1004 HD23 LEU 149 2HD2 LEU 149 4.107 -7.664 -2.190 1005 H ARG 150 H ARG 150 3.959 -5.853 -5.851 1006 HA ARG 150 HA ARG 150 5.861 -4.542 -4.085 1007 HB3 ARG 150 2HB ARG 150 7.356 -5.080 -5.846 1008 HG3 ARG 150 2HG ARG 150 5.045 -4.765 -7.561 1009 HD3 ARG 150 2HD ARG 150 7.368 -4.003 -9.111 1010 HE ARG 150 HE ARG 150 4.572 -3.306 -9.041 1011 HH11 ARG 150 1HH1 ARG 150 7.694 -2.578 -10.396 1012 HH12 ARG 150 2HH1 ARG 150 7.048 -1.811 -11.808 1013 HH21 ARG 150 1HH2 ARG 150 3.708 -2.299 -10.895 1014 HH22 ARG 150 2HH2 ARG 150 4.780 -1.651 -12.091 1015 H LEU 151 H LEU 151 5.018 -2.688 -3.406 1016 HA LEU 151 HA LEU 151 2.900 -1.441 -5.028 1017 HB3 LEU 151 2HB LEU 151 2.010 -0.528 -2.965 1018 HG LEU 151 HG LEU 151 2.163 -3.389 -3.343 1019 HD11 LEU 151 1HD1 LEU 151 3.206 -3.300 -1.104 1020 HD12 LEU 151 2HD1 LEU 151 1.634 -4.099 -1.104 1021 HD13 LEU 151 3HD1 LEU 151 1.782 -2.447 -0.506 1022 HD21 LEU 151 3HD2 LEU 151 -0.104 -3.240 -3.172 1023 HD22 LEU 151 1HD2 LEU 151 0.262 -1.556 -3.551 1024 HD23 LEU 151 2HD2 LEU 151 -0.041 -2.038 -1.881 1025 H GLU 152 H GLU 152 3.701 0.225 -6.130 1026 HA GLU 152 HA GLU 152 5.492 2.089 -4.714 1027 HB3 GLU 152 2HB GLU 152 6.746 0.958 -6.441 1028 HG3 GLU 152 2HG GLU 152 5.184 2.072 -8.676 1029 H LEU 153 H LEU 153 5.122 4.275 -4.947 1030 HA LEU 153 HA LEU 153 2.603 4.999 -6.295 1031 HB3 LEU 153 2HB LEU 153 2.145 5.386 -4.076 1032 HG LEU 153 HG LEU 153 3.676 6.603 -2.492 1033 HD11 LEU 153 1HD1 LEU 153 4.095 4.596 -1.643 1034 HD12 LEU 153 2HD1 LEU 153 5.210 4.206 -2.952 1035 HD13 LEU 153 3HD1 LEU 153 3.484 3.900 -3.142 1036 HD21 LEU 153 3HD2 LEU 153 5.918 6.915 -2.946 1037 HD22 LEU 153 1HD2 LEU 153 5.176 7.304 -4.498 1038 HD23 LEU 153 2HD2 LEU 153 5.929 5.728 -4.252 1039 H LEU 154 H LEU 154 2.483 7.148 -7.204 1040 HA LEU 154 HA LEU 154 5.118 8.235 -7.950 1041 HB3 LEU 154 2HB LEU 154 4.234 8.780 -10.136 1042 HG LEU 154 HG LEU 154 4.153 6.719 -11.190 1043 HD11 LEU 154 1HD1 LEU 154 5.977 5.678 -10.359 1044 HD12 LEU 154 2HD1 LEU 154 5.326 5.597 -8.723 1045 HD13 LEU 154 3HD1 LEU 154 6.029 7.101 -9.317 1046 HD21 LEU 154 3HD2 LEU 154 2.304 6.075 -9.094 1047 HD22 LEU 154 1HD2 LEU 154 3.499 4.788 -9.260 1048 HD23 LEU 154 2HD2 LEU 154 2.543 5.288 -10.656 1049 H GLY 155 H GLY 155 5.208 10.509 -8.368 1050 HA2 GLY 155 2HA GLY 155 2.953 12.022 -7.206 1051 HA3 GLY 155 3HA GLY 155 4.617 12.369 -6.763 1052 H CYS 156 H CYS 156 3.022 14.367 -7.733 1053 HA CYS 156 HA CYS 156 3.423 14.683 -10.569 1054 HB3 CYS 156 2HB CYS 156 2.678 17.147 -9.761 1055 H LEU 157 H LEU 157 5.145 15.443 -7.690 1056 HA LEU 157 HA LEU 157 7.161 16.422 -7.308 1057 HB3 LEU 157 2HB LEU 157 8.083 16.883 -9.976 1058 HG LEU 157 HG LEU 157 9.721 15.131 -9.541 1059 HD11 LEU 157 1HD1 LEU 157 10.429 17.155 -8.670 1060 HD12 LEU 157 2HD1 LEU 157 10.548 16.075 -7.281 1061 HD13 LEU 157 3HD1 LEU 157 9.178 17.175 -7.426 1062 HD21 LEU 157 3HD2 LEU 157 7.712 14.253 -7.661 1063 HD22 LEU 157 1HD2 LEU 157 9.285 14.429 -6.884 1064 HD23 LEU 157 2HD2 LEU 157 9.114 13.390 -8.299 1065 H GLU 158 H GLU 158 4.706 18.002 -7.965 1066 HA GLU 158 HA GLU 158 5.698 20.405 -9.223 1067 HB3 GLU 158 2HB GLU 158 3.097 20.057 -7.735 1068 HG3 GLU 158 2HG GLU 158 3.449 21.714 -10.179 Start of MODEL 5 1 H1 MET -5 H MET -5 4.702 29.162 -11.415 2 HA MET -5 HA MET -5 6.325 27.568 -11.420 3 HB3 MET -5 2HB MET -5 6.331 25.929 -9.546 4 HG3 MET -5 2HG MET -5 6.265 27.571 -7.654 5 HE1 MET -5 3HE MET -5 9.797 27.312 -7.795 6 HE2 MET -5 1HE MET -5 9.019 28.700 -7.033 7 HE3 MET -5 2HE MET -5 8.229 27.124 -7.009 8 H LYS -4 H LYS -4 6.372 26.275 -13.129 9 HA LYS -4 HA LYS -4 4.749 23.859 -13.142 10 HB3 LYS -4 2HB LYS -4 4.396 24.511 -15.728 11 HG3 LYS -4 2HG LYS -4 2.734 24.527 -13.405 12 HD3 LYS -4 2HD LYS -4 1.909 26.509 -15.521 13 HE3 LYS -4 2HE LYS -4 0.737 25.934 -12.804 14 HZ1 LYS -4 3HZ LYS -4 -1.067 27.069 -14.601 15 HZ2 LYS -4 1HZ LYS -4 0.343 28.004 -14.660 16 HZ3 LYS -4 2HZ LYS -4 -0.442 27.750 -13.184 17 H SER -3 H SER -3 6.758 22.819 -12.844 18 HA SER -3 HA SER -3 8.474 22.811 -15.241 19 HB3 SER -3 2HB SER -3 9.331 22.261 -12.389 20 HG SER -3 HG SER -3 11.423 22.390 -13.346 21 H GLY -2 H GLY -2 9.241 20.827 -15.986 22 HA2 GLY -2 2HA GLY -2 9.331 18.535 -16.242 23 HA3 GLY -2 3HA GLY -2 8.682 18.373 -14.618 24 H HIS -1 H HIS -1 7.965 18.450 -17.993 25 HA HIS -1 HA HIS -1 5.177 18.714 -17.915 26 HB3 HIS -1 2HB HIS -1 5.673 16.994 -20.035 27 HD1 HIS -1 1HD HIS -1 6.540 20.665 -19.458 28 HD2 HIS -1 2HD HIS -1 4.116 18.262 -21.827 29 HE1 HIS -1 1HE HIS -1 5.277 22.247 -20.950 30 H GLY 0 H GLY 0 3.524 17.317 -17.560 31 HA2 GLY 0 2HA GLY 0 2.539 15.160 -17.401 32 HA3 GLY 0 3HA GLY 0 4.142 14.476 -17.174 33 H CYS 1 H CYS 1 1.801 13.976 -15.579 34 HA CYS 1 HA CYS 1 2.674 15.124 -13.008 35 HB3 CYS 1 2HB CYS 1 -0.076 14.010 -13.519 36 H SER 2 H SER 2 3.581 12.678 -14.468 37 HA SER 2 HA SER 2 3.026 10.749 -12.312 38 HB3 SER 2 2HB SER 2 2.008 9.488 -13.884 39 HG SER 2 HG SER 2 3.332 10.463 -16.123 40 H GLU 3 H GLU 3 4.934 11.333 -11.245 41 HA GLU 3 HA GLU 3 7.431 10.701 -12.670 42 HB3 GLU 3 2HB GLU 3 7.151 13.026 -11.729 43 HG3 GLU 3 2HG GLU 3 6.448 11.640 -9.381 44 HA PRO 4 HA PRO 4 8.147 7.219 -10.096 45 HB3 PRO 4 2HB PRO 4 9.985 6.785 -11.406 46 HG3 PRO 4 2HG PRO 4 11.300 8.513 -12.238 47 HD3 PRO 4 2HD PRO 4 9.213 9.268 -12.860 48 H LEU 5 H LEU 5 9.954 6.679 -8.218 49 HA LEU 5 HA LEU 5 9.497 8.745 -6.169 50 HB3 LEU 5 2HB LEU 5 8.353 6.937 -5.360 51 HG LEU 5 HG LEU 5 8.861 5.256 -7.047 52 HD11 LEU 5 1HD1 LEU 5 11.536 5.241 -5.696 53 HD12 LEU 5 2HD1 LEU 5 11.156 5.376 -7.413 54 HD13 LEU 5 3HD1 LEU 5 10.949 3.833 -6.584 55 HD21 LEU 5 3HD2 LEU 5 7.927 3.888 -5.568 56 HD22 LEU 5 1HD2 LEU 5 8.642 4.773 -4.220 57 HD23 LEU 5 2HD2 LEU 5 9.545 3.474 -5.001 58 H GLY 6 H GLY 6 11.861 7.208 -8.009 59 HA2 GLY 6 2HA GLY 6 13.977 8.628 -6.763 60 HA3 GLY 6 3HA GLY 6 14.025 6.937 -6.287 61 H LEU 7 H LEU 7 13.118 8.374 -9.401 62 HA LEU 7 HA LEU 7 15.445 7.037 -10.608 63 HB3 LEU 7 2HB LEU 7 13.904 6.712 -12.628 64 HG LEU 7 HG LEU 7 13.848 5.067 -10.170 65 HD11 LEU 7 1HD1 LEU 7 11.536 4.950 -10.586 66 HD12 LEU 7 2HD1 LEU 7 12.224 3.508 -11.332 67 HD13 LEU 7 3HD1 LEU 7 11.771 4.887 -12.334 68 HD21 LEU 7 3HD2 LEU 7 14.831 3.465 -11.533 69 HD22 LEU 7 1HD2 LEU 7 15.467 4.977 -12.181 70 HD23 LEU 7 2HD2 LEU 7 14.145 4.152 -13.007 71 H LYS 8 H LYS 8 14.074 9.906 -9.965 72 HA LYS 8 HA LYS 8 15.108 11.134 -12.438 73 HB3 LYS 8 2HB LYS 8 13.474 13.059 -11.512 74 HG3 LYS 8 2HG LYS 8 12.441 10.721 -13.104 75 HD3 LYS 8 2HD LYS 8 11.015 12.822 -12.176 76 HE3 LYS 8 2HE LYS 8 12.021 13.633 -14.902 77 HZ1 LYS 8 3HZ LYS 8 9.651 14.123 -14.441 78 HZ2 LYS 8 1HZ LYS 8 10.595 15.508 -14.670 79 HZ3 LYS 8 2HZ LYS 8 10.129 15.050 -13.110 80 H ASN 9 H ASN 9 14.142 12.444 -9.277 81 HA ASN 9 HA ASN 9 16.865 13.541 -9.005 82 HB3 ASN 9 2HB ASN 9 15.391 15.222 -7.475 83 HD21 ASN 9 1HD2 ASN 9 14.292 15.798 -10.605 84 HD22 ASN 9 2HD2 ASN 9 15.574 16.830 -11.133 85 H ASN 10 H ASN 10 14.143 12.016 -7.431 86 HA ASN 10 HA ASN 10 15.007 12.193 -4.767 87 HB3 ASN 10 2HB ASN 10 13.631 9.945 -4.622 88 HD21 ASN 10 1HD2 ASN 10 13.019 13.105 -6.084 89 HD22 ASN 10 2HD2 ASN 10 11.734 13.544 -5.017 90 H THR 11 H THR 11 15.613 9.742 -7.254 91 HA THR 11 HA THR 11 16.939 7.852 -7.202 92 HB THR 11 HB THR 11 18.488 9.606 -7.890 93 HG1 THR 11 1HG THR 11 19.713 7.830 -6.025 94 HG21 THR 11 3HG2 THR 11 20.054 10.524 -6.107 95 HG22 THR 11 1HG2 THR 11 18.870 9.968 -4.925 96 HG23 THR 11 2HG2 THR 11 18.417 11.178 -6.126 97 H ILE 12 H ILE 12 15.376 7.803 -4.940 98 HA ILE 12 HA ILE 12 17.058 7.380 -2.621 99 HB ILE 12 HB ILE 12 14.101 6.892 -2.998 100 HG13 ILE 12 2HG1 ILE 12 13.785 8.971 -1.789 101 HG21 ILE 12 1HG2 ILE 12 13.977 6.696 -0.593 102 HG22 ILE 12 2HG2 ILE 12 15.116 5.509 -1.226 103 HG23 ILE 12 3HG2 ILE 12 15.711 6.977 -0.451 104 HD11 ILE 12 3HD1 ILE 12 16.786 9.152 -1.705 105 HD12 ILE 12 1HD1 ILE 12 15.683 10.478 -1.334 106 HD13 ILE 12 2HD1 ILE 12 15.689 9.027 -0.330 107 HA PRO 13 HA PRO 13 17.830 3.110 -3.466 108 HB3 PRO 13 2HB PRO 13 19.702 3.357 -2.156 109 HG3 PRO 13 2HG PRO 13 19.713 4.817 -0.346 110 HD3 PRO 13 2HD PRO 13 18.881 6.216 -1.978 111 H ASP 14 H ASP 14 17.554 1.014 -1.856 112 HA ASP 14 HA ASP 14 14.715 0.681 -1.681 113 HB3 ASP 14 2HB ASP 14 15.935 -1.220 -2.403 114 H SER 15 H SER 15 16.928 2.041 0.377 115 HA SER 15 HA SER 15 16.220 1.051 2.898 116 HB3 SER 15 2HB SER 15 16.962 3.929 2.393 117 HG SER 15 HG SER 15 18.278 2.675 4.359 118 H GLN 16 H GLN 16 14.469 2.990 0.698 119 HA GLN 16 HA GLN 16 12.824 4.394 2.534 120 HB3 GLN 16 2HB GLN 16 13.032 5.158 0.248 121 HG3 GLN 16 2HG GLN 16 11.489 2.742 -0.647 122 HE21 GLN 16 1HE2 GLN 16 10.172 4.003 -1.945 123 HE22 GLN 16 2HE2 GLN 16 10.769 4.843 -3.332 124 H MET 17 H MET 17 12.428 1.348 0.763 125 HA MET 17 HA MET 17 9.925 0.828 2.172 126 HB3 MET 17 2HB MET 17 10.246 -1.369 0.663 127 HG3 MET 17 2HG MET 17 8.739 0.963 0.441 128 HE1 MET 17 3HE MET 17 7.469 1.440 -2.860 129 HE2 MET 17 1HE MET 17 8.452 0.272 -3.744 130 HE3 MET 17 2HE MET 17 7.612 -0.217 -2.273 131 H SER 18 H SER 18 9.617 -0.860 3.591 132 HA SER 18 HA SER 18 11.636 -2.812 4.129 133 HB3 SER 18 2HB SER 18 11.697 -1.928 6.640 134 HG SER 18 HG SER 18 13.604 -0.643 5.912 135 H ALA 19 H ALA 19 10.594 -4.586 4.729 136 HA ALA 19 HA ALA 19 7.995 -4.294 6.089 137 HB1 ALA 19 1HB ALA 19 8.343 -6.863 4.828 138 HB2 ALA 19 2HB ALA 19 7.071 -5.662 4.602 139 HB3 ALA 19 3HB ALA 19 8.562 -5.553 3.667 140 H SER 20 H SER 20 7.401 -6.453 7.243 141 HA SER 20 HA SER 20 9.021 -6.771 9.448 142 HB3 SER 20 2HB SER 20 7.599 -9.235 8.803 143 HG SER 20 HG SER 20 7.175 -9.008 10.844 144 H SER 21 H SER 21 8.925 -8.760 6.512 145 HA SER 21 HA SER 21 11.689 -9.423 6.733 146 HB3 SER 21 2HB SER 21 11.173 -11.961 6.829 147 HG SER 21 HG SER 21 12.030 -10.450 8.572 148 H SER 22 H SER 22 12.023 -11.494 5.137 149 HA SER 22 HA SER 22 10.342 -11.052 2.767 150 HB3 SER 22 2HB SER 22 12.030 -10.122 1.627 151 HG SER 22 HG SER 22 13.357 -9.138 2.909 152 H TYR 23 H TYR 23 10.584 -12.770 1.127 153 HA TYR 23 HA TYR 23 10.225 -15.311 2.232 154 HB3 TYR 23 2HB TYR 23 10.827 -14.419 -0.587 155 HD1 TYR 23 2HD TYR 23 9.592 -17.384 1.333 156 HD2 TYR 23 1HD TYR 23 11.467 -15.934 -2.200 157 HE1 TYR 23 2HE TYR 23 9.892 -19.696 0.550 158 HE2 TYR 23 1HE TYR 23 11.771 -18.242 -2.993 159 HH TYR 23 HH TYR 23 11.885 -20.719 -1.447 160 H LYS 24 H LYS 24 13.094 -13.618 1.453 161 HA LYS 24 HA LYS 24 14.904 -15.584 0.792 162 HB3 LYS 24 2HB LYS 24 15.150 -12.978 1.237 163 HG3 LYS 24 2HG LYS 24 16.550 -12.497 3.149 164 HD3 LYS 24 2HD LYS 24 14.340 -13.875 4.529 165 HE3 LYS 24 2HE LYS 24 13.940 -11.650 5.412 166 HZ1 LYS 24 3HZ LYS 24 16.865 -11.779 5.432 167 HZ2 LYS 24 1HZ LYS 24 16.008 -13.090 6.072 168 HZ3 LYS 24 2HZ LYS 24 15.787 -11.541 6.714 169 H THR 25 H THR 25 16.683 -16.435 2.262 170 HA THR 25 HA THR 25 15.546 -17.336 4.827 171 HB THR 25 HB THR 25 16.947 -19.470 4.388 172 HG1 THR 25 1HG THR 25 17.486 -19.871 2.316 173 HG21 THR 25 3HG2 THR 25 14.554 -19.565 4.512 174 HG22 THR 25 1HG2 THR 25 15.059 -20.484 3.094 175 HG23 THR 25 2HG2 THR 25 14.391 -18.862 2.904 176 H TRP 26 H TRP 26 16.719 -15.879 6.054 177 HA TRP 26 HA TRP 26 19.645 -16.244 6.003 178 HB3 TRP 26 2HB TRP 26 19.388 -13.880 7.276 179 HD1 TRP 26 HD TRP 26 18.549 -14.239 3.503 180 HE1 TRP 26 1HE TRP 26 20.545 -13.322 2.161 181 HE3 TRP 26 3HE TRP 26 21.708 -13.165 7.377 182 HZ2 TRP 26 2HZ TRP 26 23.117 -12.281 2.676 183 HZ3 TRP 26 3HZ TRP 26 23.918 -12.212 6.866 184 HH2 TRP 26 HH TRP 26 24.607 -11.780 4.564 185 H ASN 27 H ASN 27 20.730 -15.995 8.090 186 HA ASN 27 HA ASN 27 19.335 -17.446 10.139 187 HB3 ASN 27 2HB ASN 27 21.621 -16.841 11.364 188 HD21 ASN 27 1HD2 ASN 27 20.417 -18.995 11.546 189 HD22 ASN 27 2HD2 ASN 27 21.138 -20.327 10.716 190 H LEU 28 H LEU 28 20.299 -14.128 9.583 191 HA LEU 28 HA LEU 28 18.797 -13.352 11.985 192 HB3 LEU 28 2HB LEU 28 21.177 -13.222 12.505 193 HG LEU 28 HG LEU 28 21.368 -11.650 9.997 194 HD11 LEU 28 1HD1 LEU 28 23.115 -10.253 10.756 195 HD12 LEU 28 2HD1 LEU 28 23.168 -11.048 12.329 196 HD13 LEU 28 3HD1 LEU 28 21.786 -10.042 11.896 197 HD21 LEU 28 3HD2 LEU 28 23.588 -12.676 9.961 198 HD22 LEU 28 1HD2 LEU 28 22.322 -13.886 10.168 199 HD23 LEU 28 2HD2 LEU 28 23.292 -13.379 11.551 200 H ARG 29 H ARG 29 18.820 -10.689 11.835 201 HA ARG 29 HA ARG 29 17.486 -10.166 9.275 202 HB3 ARG 29 2HB ARG 29 16.547 -8.168 10.528 203 HG3 ARG 29 2HG ARG 29 15.930 -10.990 11.203 204 HD3 ARG 29 2HD ARG 29 15.259 -8.671 12.877 205 HE ARG 29 HE ARG 29 13.112 -9.920 11.568 206 HH11 ARG 29 1HH1 ARG 29 14.160 -9.044 14.770 207 HH12 ARG 29 2HH1 ARG 29 12.551 -8.876 15.392 208 HH21 ARG 29 1HH2 ARG 29 10.989 -9.702 12.374 209 HH22 ARG 29 2HH2 ARG 29 10.749 -9.251 14.028 210 H ALA 30 H ALA 30 17.536 -7.552 8.955 211 HA ALA 30 HA ALA 30 20.058 -6.319 9.453 212 HB1 ALA 30 1HB ALA 30 20.408 -6.198 6.808 213 HB2 ALA 30 2HB ALA 30 21.140 -7.448 7.814 214 HB3 ALA 30 3HB ALA 30 19.660 -7.790 6.919 215 H PHE 31 H PHE 31 17.207 -6.432 7.355 216 HA PHE 31 HA PHE 31 15.810 -4.811 6.581 217 HB3 PHE 31 2HB PHE 31 15.292 -2.981 8.069 218 HD1 PHE 31 2HD PHE 31 14.179 -5.604 7.885 219 HD2 PHE 31 1HD PHE 31 16.408 -3.868 11.068 220 HE1 PHE 31 2HE PHE 31 13.094 -7.135 9.474 221 HE2 PHE 31 1HE PHE 31 15.326 -5.398 12.664 222 HZ PHE 31 HZ PHE 31 13.665 -7.033 11.867 223 H GLY 32 H GLY 32 18.361 -4.905 5.402 224 HA2 GLY 32 2HA GLY 32 19.034 -2.068 4.989 225 HA3 GLY 32 3HA GLY 32 20.083 -3.425 4.610 226 H TRP 33 H TRP 33 20.049 -4.274 2.603 227 HA TRP 33 HA TRP 33 18.235 -3.007 0.679 228 HB3 TRP 33 2HB TRP 33 19.816 -3.589 -1.023 229 HD1 TRP 33 HD TRP 33 20.177 -0.932 -0.659 230 HE1 TRP 33 1HE TRP 33 22.114 0.377 0.417 231 HE3 TRP 33 3HE TRP 33 22.413 -4.751 1.901 232 HZ2 TRP 33 2HZ TRP 33 24.301 -0.142 2.125 233 HZ3 TRP 33 3HZ TRP 33 24.424 -4.261 3.232 234 HH2 TRP 33 HH TRP 33 25.347 -2.003 3.340 235 H TYR 34 H TYR 34 16.628 -4.108 -0.236 236 HA TYR 34 HA TYR 34 16.699 -6.775 -1.046 237 HB3 TYR 34 2HB TYR 34 14.759 -7.107 0.984 238 HD1 TYR 34 2HD TYR 34 15.688 -8.892 -1.027 239 HD2 TYR 34 1HD TYR 34 17.373 -8.138 2.808 240 HE1 TYR 34 2HE TYR 34 16.708 -11.130 -1.041 241 HE2 TYR 34 1HE TYR 34 18.398 -10.373 2.804 242 HH TYR 34 HH TYR 34 19.130 -12.060 1.043 243 HA PRO 35 HA PRO 35 12.120 -5.258 -1.165 244 HB3 PRO 35 2HB PRO 35 11.448 -4.541 0.911 245 HG3 PRO 35 2HG PRO 35 12.929 -3.465 2.346 246 HD3 PRO 35 2HD PRO 35 14.194 -5.306 1.778 247 H HIS 36 H HIS 36 10.980 -2.923 -1.790 248 HA HIS 36 HA HIS 36 10.887 -1.240 -3.319 249 HB3 HIS 36 2HB HIS 36 13.893 -1.053 -3.137 250 HD1 HIS 36 1HD HIS 36 14.705 1.418 -3.572 251 HD2 HIS 36 2HD HIS 36 10.725 0.674 -4.499 252 HE1 HIS 36 1HE HIS 36 13.972 3.360 -4.991 253 H LEU 37 H LEU 37 10.489 -3.421 -4.550 254 HA LEU 37 HA LEU 37 12.399 -3.575 -6.787 255 HB3 LEU 37 2HB LEU 37 11.634 -5.838 -7.167 256 HG LEU 37 HG LEU 37 12.657 -6.978 -5.467 257 HD11 LEU 37 1HD1 LEU 37 13.634 -4.334 -4.516 258 HD12 LEU 37 2HD1 LEU 37 13.886 -4.774 -6.205 259 HD13 LEU 37 3HD1 LEU 37 14.535 -5.795 -4.923 260 HD21 LEU 37 3HD2 LEU 37 11.558 -6.984 -3.527 261 HD22 LEU 37 1HD2 LEU 37 10.926 -5.358 -3.788 262 HD23 LEU 37 2HD2 LEU 37 12.531 -5.578 -3.092 263 H GLY 38 H GLY 38 9.226 -2.755 -5.856 264 HA2 GLY 38 2HA GLY 38 7.719 -3.300 -8.129 265 HA3 GLY 38 3HA GLY 38 7.438 -1.945 -7.045 266 H ARG 39 H ARG 39 10.287 -1.047 -7.732 267 HA ARG 39 HA ARG 39 9.701 0.978 -9.488 268 HB3 ARG 39 2HB ARG 39 11.778 0.772 -8.116 269 HG3 ARG 39 2HG ARG 39 12.608 -1.095 -10.320 270 HD3 ARG 39 2HD ARG 39 14.250 0.810 -9.649 271 HE ARG 39 HE ARG 39 13.978 -0.390 -7.131 272 HH11 ARG 39 1HH1 ARG 39 16.465 0.673 -9.323 273 HH12 ARG 39 2HH1 ARG 39 17.610 1.010 -8.068 274 HH21 ARG 39 1HH2 ARG 39 15.476 0.050 -5.468 275 HH22 ARG 39 2HH2 ARG 39 17.047 0.655 -5.875 276 H LEU 40 H LEU 40 9.927 1.323 -11.696 277 HA LEU 40 HA LEU 40 9.442 -0.981 -13.343 278 HB3 LEU 40 2HB LEU 40 9.999 1.637 -14.598 279 HG LEU 40 HG LEU 40 8.834 -0.413 -15.704 280 HD11 LEU 40 1HD1 LEU 40 6.545 -0.668 -15.391 281 HD12 LEU 40 2HD1 LEU 40 6.384 0.884 -14.569 282 HD13 LEU 40 3HD1 LEU 40 7.161 -0.471 -13.750 283 HD21 LEU 40 3HD2 LEU 40 9.142 1.804 -16.725 284 HD22 LEU 40 1HD2 LEU 40 7.658 2.354 -15.944 285 HD23 LEU 40 2HD2 LEU 40 7.594 1.076 -17.159 286 H ASP 41 H ASP 41 10.626 -1.218 -15.460 287 HA ASP 41 HA ASP 41 12.527 -1.688 -16.617 288 HB3 ASP 41 2HB ASP 41 14.065 0.355 -15.061 289 H ASN 42 H ASN 42 11.954 -3.152 -14.254 290 HA ASN 42 HA ASN 42 14.018 -3.508 -12.460 291 HB3 ASN 42 2HB ASN 42 11.767 -4.635 -12.411 292 HD21 ASN 42 1HD2 ASN 42 10.753 -4.843 -14.438 293 HD22 ASN 42 2HD2 ASN 42 10.886 -6.300 -15.357 294 H GLN 43 H GLN 43 16.051 -4.192 -12.604 295 HA GLN 43 HA GLN 43 17.099 -5.060 -15.144 296 HB3 GLN 43 2HB GLN 43 18.402 -3.526 -13.785 297 HG3 GLN 43 2HG GLN 43 19.184 -5.551 -11.800 298 HE21 GLN 43 1HE2 GLN 43 20.655 -4.569 -10.634 299 HE22 GLN 43 2HE2 GLN 43 20.726 -2.878 -10.284 300 H GLY 44 H GLY 44 16.589 -6.481 -11.943 301 HA2 GLY 44 2HA GLY 44 17.796 -8.988 -12.603 302 HA3 GLY 44 3HA GLY 44 16.796 -8.653 -11.197 303 H LYS 45 H LYS 45 14.605 -9.075 -11.262 304 HA LYS 45 HA LYS 45 13.111 -9.667 -13.552 305 HB3 LYS 45 2HB LYS 45 14.597 -11.607 -13.752 306 HG3 LYS 45 2HG LYS 45 14.290 -13.472 -12.079 307 HD3 LYS 45 2HD LYS 45 15.646 -11.241 -10.665 308 HE3 LYS 45 2HE LYS 45 15.765 -13.990 -10.584 309 HZ1 LYS 45 3HZ LYS 45 17.632 -13.061 -12.548 310 HZ2 LYS 45 1HZ LYS 45 17.171 -14.642 -12.161 311 HZ3 LYS 45 2HZ LYS 45 18.392 -13.877 -11.276 312 H ILE 46 H ILE 46 13.657 -10.143 -10.134 313 HA ILE 46 HA ILE 46 11.216 -11.072 -9.262 314 HB ILE 46 HB ILE 46 12.771 -8.906 -7.852 315 HG13 ILE 46 2HG1 ILE 46 13.515 -11.645 -8.513 316 HG21 ILE 46 1HG2 ILE 46 11.612 -9.421 -5.979 317 HG22 ILE 46 2HG2 ILE 46 10.401 -9.941 -7.152 318 HG23 ILE 46 3HG2 ILE 46 11.470 -11.127 -6.404 319 HD11 ILE 46 3HD1 ILE 46 15.692 -10.967 -8.034 320 HD12 ILE 46 1HD1 ILE 46 14.920 -9.532 -8.707 321 HD13 ILE 46 2HD1 ILE 46 15.150 -9.674 -6.964 322 H ASN 47 H ASN 47 12.117 -7.616 -9.305 323 HA ASN 47 HA ASN 47 10.845 -5.728 -9.414 324 HB3 ASN 47 2HB ASN 47 9.123 -7.365 -11.284 325 HD21 ASN 47 1HD2 ASN 47 7.502 -6.247 -12.065 326 HD22 ASN 47 2HD2 ASN 47 7.386 -4.524 -12.131 327 H ALA 48 H ALA 48 10.233 -7.413 -7.238 328 HA ALA 48 HA ALA 48 7.831 -6.290 -6.337 329 HB1 ALA 48 1HB ALA 48 7.093 -9.057 -6.348 330 HB2 ALA 48 2HB ALA 48 6.220 -7.667 -6.992 331 HB3 ALA 48 3HB ALA 48 7.396 -8.512 -7.998 332 H TRP 49 H TRP 49 7.744 -6.408 -4.161 333 HA TRP 49 HA TRP 49 9.877 -7.783 -2.798 334 HB3 TRP 49 2HB TRP 49 7.730 -5.855 -1.994 335 HD1 TRP 49 HD TRP 49 10.623 -6.626 0.337 336 HE1 TRP 49 1HE TRP 49 9.691 -7.466 2.585 337 HE3 TRP 49 3HE TRP 49 5.710 -7.163 -0.969 338 HZ2 TRP 49 2HZ TRP 49 7.204 -8.253 3.661 339 HZ3 TRP 49 3HZ TRP 49 4.118 -7.965 0.728 340 HH2 TRP 49 HH TRP 49 4.853 -8.499 2.995 341 H THR 50 H THR 50 9.738 -9.527 -1.460 342 HA THR 50 HA THR 50 7.147 -10.928 -1.411 343 HB THR 50 HB THR 50 9.692 -12.393 -0.885 344 HG1 THR 50 1HG THR 50 9.916 -12.686 -3.177 345 HG21 THR 50 3HG2 THR 50 7.225 -13.161 -2.442 346 HG22 THR 50 1HG2 THR 50 7.426 -13.442 -0.713 347 HG23 THR 50 2HG2 THR 50 8.502 -14.231 -1.866 348 H ALA 51 H ALA 51 6.541 -12.045 0.493 349 HA ALA 51 HA ALA 51 7.621 -10.824 2.923 350 HB1 ALA 51 1HB ALA 51 5.116 -10.903 2.290 351 HB2 ALA 51 2HB ALA 51 5.194 -12.573 2.854 352 HB3 ALA 51 3HB ALA 51 5.589 -11.251 3.953 353 H GLN 52 H GLN 52 7.563 -12.315 4.906 354 HA GLN 52 HA GLN 52 8.875 -14.848 4.177 355 HB3 GLN 52 2HB GLN 52 9.180 -13.453 6.825 356 HG3 GLN 52 2HG GLN 52 11.580 -14.556 6.178 357 HE21 GLN 52 1HE2 GLN 52 10.259 -17.360 6.832 358 HE22 GLN 52 2HE2 GLN 52 10.051 -17.255 8.544 359 H SER 53 H SER 53 6.552 -13.338 6.354 360 HA SER 53 HA SER 53 5.913 -15.761 7.738 361 HB3 SER 53 2HB SER 53 3.929 -14.385 8.555 362 HG SER 53 HG SER 53 5.225 -13.564 10.016 363 H ASN 54 H ASN 54 4.438 -13.913 5.105 364 HA ASN 54 HA ASN 54 2.759 -14.400 3.642 365 HB3 ASN 54 2HB ASN 54 3.280 -16.200 2.387 366 HD21 ASN 54 1HD2 ASN 54 4.875 -18.113 4.662 367 HD22 ASN 54 2HD2 ASN 54 6.493 -17.620 4.310 368 H SER 55 H SER 55 1.918 -14.182 6.310 369 HA SER 55 HA SER 55 -0.401 -15.985 6.266 370 HB3 SER 55 2HB SER 55 -0.273 -15.997 8.808 371 HG SER 55 HG SER 55 1.862 -17.387 8.516 372 H ALA 56 H ALA 56 0.088 -13.160 5.466 373 HA ALA 56 HA ALA 56 -1.225 -11.284 5.419 374 HB1 ALA 56 1HB ALA 56 -2.947 -11.758 7.686 375 HB2 ALA 56 2HB ALA 56 -3.356 -11.573 5.979 376 HB3 ALA 56 3HB ALA 56 -2.903 -13.157 6.612 377 H LYS 57 H LYS 57 -0.565 -12.461 8.709 378 HA LYS 57 HA LYS 57 -0.558 -10.156 10.151 379 HB3 LYS 57 2HB LYS 57 1.252 -11.173 11.538 380 HG3 LYS 57 2HG LYS 57 -1.299 -12.302 11.003 381 HD3 LYS 57 2HD LYS 57 0.945 -14.264 11.348 382 HE3 LYS 57 2HE LYS 57 -1.804 -14.363 12.485 383 HZ1 LYS 57 3HZ LYS 57 -1.478 -16.171 10.710 384 HZ2 LYS 57 1HZ LYS 57 -2.024 -16.635 12.243 385 HZ3 LYS 57 2HZ LYS 57 -0.405 -16.869 11.815 386 H GLU 58 H GLU 58 1.835 -11.180 7.807 387 HA GLU 58 HA GLU 58 3.971 -9.556 8.360 388 HB3 GLU 58 2HB GLU 58 2.859 -10.084 5.598 389 HG3 GLU 58 2HG GLU 58 4.932 -8.490 6.100 390 H TRP 59 H TRP 59 4.518 -7.444 8.069 391 HA TRP 59 HA TRP 59 2.480 -5.653 6.933 392 HB3 TRP 59 2HB TRP 59 2.174 -5.353 9.255 393 HD1 TRP 59 HD TRP 59 5.952 -4.456 9.193 394 HE1 TRP 59 1HE TRP 59 7.043 -5.498 11.278 395 HE3 TRP 59 3HE TRP 59 1.885 -6.890 11.107 396 HZ2 TRP 59 2HZ TRP 59 6.281 -7.135 13.446 397 HZ3 TRP 59 3HZ TRP 59 2.150 -8.173 13.190 398 HH2 TRP 59 HH TRP 59 4.304 -8.292 14.334 399 H LEU 60 H LEU 60 3.236 -4.012 5.685 400 HA LEU 60 HA LEU 60 6.161 -3.822 5.384 401 HB3 LEU 60 2HB LEU 60 3.956 -3.527 3.357 402 HG LEU 60 HG LEU 60 5.882 -1.858 3.011 403 HD11 LEU 60 1HD1 LEU 60 7.661 -3.479 3.614 404 HD12 LEU 60 2HD1 LEU 60 7.895 -2.726 2.037 405 HD13 LEU 60 3HD1 LEU 60 7.287 -4.377 2.142 406 HD21 LEU 60 3HD2 LEU 60 5.910 -2.337 0.578 407 HD22 LEU 60 1HD2 LEU 60 4.291 -2.357 1.277 408 HD23 LEU 60 2HD2 LEU 60 5.110 -3.875 0.906 409 H GLN 61 H GLN 61 7.060 -1.926 5.838 410 HA GLN 61 HA GLN 61 5.342 0.469 5.858 411 HB3 GLN 61 2HB GLN 61 5.866 -0.105 8.134 412 HG3 GLN 61 2HG GLN 61 8.351 0.065 8.817 413 HE21 GLN 61 1HE2 GLN 61 9.687 -2.157 8.548 414 HE22 GLN 61 2HE2 GLN 61 8.703 -3.556 8.796 415 H VAL 62 H VAL 62 6.148 2.338 4.986 416 HA VAL 62 HA VAL 62 8.840 2.198 3.797 417 HB VAL 62 HB VAL 62 6.548 3.613 2.457 418 HG11 VAL 62 1HG1 VAL 62 8.768 4.289 1.765 419 HG12 VAL 62 2HG1 VAL 62 9.218 2.607 1.478 420 HG13 VAL 62 3HG1 VAL 62 7.990 3.376 0.473 421 HG21 VAL 62 3HG2 VAL 62 5.683 1.494 2.327 422 HG22 VAL 62 1HG2 VAL 62 6.729 1.494 0.907 423 HG23 VAL 62 2HG2 VAL 62 7.269 0.724 2.399 424 H ASP 63 H ASP 63 10.092 3.710 4.652 425 HA ASP 63 HA ASP 63 8.867 6.184 5.649 426 HB3 ASP 63 2HB ASP 63 10.213 4.817 7.242 427 H LEU 64 H LEU 64 9.137 8.015 4.565 428 HA LEU 64 HA LEU 64 11.227 8.120 2.499 429 HB3 LEU 64 2HB LEU 64 9.705 10.190 1.839 430 HG LEU 64 HG LEU 64 10.045 8.201 0.377 431 HD11 LEU 64 1HD1 LEU 64 8.377 6.428 0.405 432 HD12 LEU 64 2HD1 LEU 64 7.617 7.150 1.823 433 HD13 LEU 64 3HD1 LEU 64 9.250 6.494 1.936 434 HD21 LEU 64 3HD2 LEU 64 8.351 10.169 0.053 435 HD22 LEU 64 1HD2 LEU 64 7.148 8.901 0.281 436 HD23 LEU 64 2HD2 LEU 64 8.322 8.778 -1.030 437 H GLY 65 H GLY 65 9.524 10.328 4.733 438 HA2 GLY 65 2HA GLY 65 10.316 12.054 6.028 439 HA3 GLY 65 3HA GLY 65 11.915 11.346 5.859 440 H THR 66 H THR 66 10.490 11.946 2.866 441 HA THR 66 HA THR 66 12.116 14.380 2.564 442 HB THR 66 HB THR 66 12.713 12.442 1.110 443 HG1 THR 66 1HG THR 66 13.042 14.675 0.462 444 HG21 THR 66 3HG2 THR 66 9.923 12.320 0.723 445 HG22 THR 66 1HG2 THR 66 11.160 11.299 -0.005 446 HG23 THR 66 2HG2 THR 66 10.628 12.764 -0.830 447 H GLN 67 H GLN 67 8.957 13.377 2.882 448 HA GLN 67 HA GLN 67 6.918 14.295 2.438 449 HB3 GLN 67 2HB GLN 67 8.144 16.996 2.168 450 HG3 GLN 67 2HG GLN 67 5.712 15.819 3.335 451 HE21 GLN 67 1HE2 GLN 67 7.390 18.906 3.830 452 HE22 GLN 67 2HE2 GLN 67 7.017 19.035 5.511 453 H ARG 68 H ARG 68 6.708 13.330 0.367 454 HA ARG 68 HA ARG 68 7.081 15.214 -1.868 455 HB3 ARG 68 2HB ARG 68 6.894 12.843 -3.136 456 HG3 ARG 68 2HG ARG 68 9.374 12.728 -3.168 457 HD3 ARG 68 2HD ARG 68 8.198 15.486 -3.501 458 HE ARG 68 HE ARG 68 10.316 14.784 -5.261 459 HH11 ARG 68 1HH1 ARG 68 9.644 15.958 -2.053 460 HH12 ARG 68 2HH1 ARG 68 11.155 16.793 -1.902 461 HH21 ARG 68 1HH2 ARG 68 12.307 15.880 -5.075 462 HH22 ARG 68 2HH2 ARG 68 12.668 16.750 -3.621 463 H GLN 69 H GLN 69 5.405 15.512 -3.297 464 HA GLN 69 HA GLN 69 2.786 14.720 -2.331 465 HB3 GLN 69 2HB GLN 69 3.756 16.644 -4.425 466 HG3 GLN 69 2HG GLN 69 0.986 15.596 -4.061 467 HE21 GLN 69 1HE2 GLN 69 2.143 18.127 -6.183 468 HE22 GLN 69 2HE2 GLN 69 1.038 19.343 -5.651 469 H VAL 70 H VAL 70 1.837 12.923 -2.998 470 HA VAL 70 HA VAL 70 2.712 11.654 -5.476 471 HB VAL 70 HB VAL 70 1.500 9.693 -4.735 472 HG11 VAL 70 1HG1 VAL 70 2.756 9.168 -2.731 473 HG12 VAL 70 2HG1 VAL 70 3.764 10.089 -3.849 474 HG13 VAL 70 3HG1 VAL 70 3.056 10.881 -2.441 475 HG21 VAL 70 3HG2 VAL 70 -0.353 9.978 -3.532 476 HG22 VAL 70 1HG2 VAL 70 0.687 10.252 -2.133 477 HG23 VAL 70 2HG2 VAL 70 0.113 11.620 -3.086 478 H THR 71 H THR 71 1.315 11.080 -7.148 479 HA THR 71 HA THR 71 -1.417 12.127 -7.058 480 HB THR 71 HB THR 71 -0.361 12.651 -9.668 481 HG1 THR 71 1HG THR 71 1.034 13.927 -7.530 482 HG21 THR 71 3HG2 THR 71 -2.325 13.739 -8.805 483 HG22 THR 71 1HG2 THR 71 -1.097 14.968 -9.102 484 HG23 THR 71 2HG2 THR 71 -1.412 14.417 -7.457 485 H GLY 72 H GLY 72 -0.067 9.445 -7.109 486 HA2 GLY 72 2HA GLY 72 -1.900 8.035 -8.631 487 HA3 GLY 72 3HA GLY 72 -0.505 8.285 -9.672 488 H ILE 73 H ILE 73 -1.416 5.753 -8.871 489 HA ILE 73 HA ILE 73 1.004 4.762 -7.614 490 HB ILE 73 HB ILE 73 -0.464 3.248 -6.116 491 HG13 ILE 73 2HG1 ILE 73 -2.517 4.565 -7.335 492 HG21 ILE 73 1HG2 ILE 73 -0.150 6.169 -5.436 493 HG22 ILE 73 2HG2 ILE 73 -0.327 4.843 -4.289 494 HG23 ILE 73 3HG2 ILE 73 1.113 4.946 -5.303 495 HD11 ILE 73 3HD1 ILE 73 -2.353 3.144 -4.726 496 HD12 ILE 73 1HD1 ILE 73 -3.858 3.934 -5.193 497 HD13 ILE 73 2HD1 ILE 73 -3.166 2.675 -6.218 498 H ILE 74 H ILE 74 0.951 2.292 -7.551 499 HA ILE 74 HA ILE 74 -0.823 0.971 -9.383 500 HB ILE 74 HB ILE 74 0.663 2.027 -11.002 501 HG13 ILE 74 2HG1 ILE 74 -0.178 -0.439 -11.158 502 HG21 ILE 74 1HG2 ILE 74 2.808 2.361 -10.548 503 HG22 ILE 74 2HG2 ILE 74 2.654 1.409 -9.072 504 HG23 ILE 74 3HG2 ILE 74 3.087 0.620 -10.589 505 HD11 ILE 74 3HD1 ILE 74 0.196 -0.103 -13.305 506 HD12 ILE 74 1HD1 ILE 74 1.396 1.133 -12.927 507 HD13 ILE 74 2HD1 ILE 74 1.884 -0.556 -13.071 508 H THR 75 H THR 75 -0.722 -1.260 -9.233 509 HA THR 75 HA THR 75 1.253 -2.343 -7.333 510 HB THR 75 HB THR 75 -1.685 -3.038 -7.499 511 HG1 THR 75 1HG THR 75 -0.074 -1.662 -5.613 512 HG21 THR 75 3HG2 THR 75 0.500 -4.228 -5.786 513 HG22 THR 75 1HG2 THR 75 -0.369 -5.044 -7.085 514 HG23 THR 75 2HG2 THR 75 -1.224 -4.562 -5.619 515 H GLN 76 H GLN 76 2.037 -4.397 -7.735 516 HA GLN 76 HA GLN 76 0.989 -5.957 -9.935 517 HB3 GLN 76 2HB GLN 76 3.852 -5.630 -10.320 518 HG3 GLN 76 2HG GLN 76 2.061 -4.693 -12.425 519 HE21 GLN 76 1HE2 GLN 76 4.086 -7.411 -11.367 520 HE22 GLN 76 2HE2 GLN 76 5.106 -7.415 -12.762 521 H GLY 77 H GLY 77 1.575 -8.110 -9.846 522 HA2 GLY 77 2HA GLY 77 2.871 -8.915 -7.348 523 HA3 GLY 77 3HA GLY 77 1.896 -9.943 -8.386 524 H ALA 78 H ALA 78 3.831 -11.359 -7.848 525 HA ALA 78 HA ALA 78 5.633 -11.267 -10.125 526 HB1 ALA 78 1HB ALA 78 7.458 -11.870 -8.202 527 HB2 ALA 78 2HB ALA 78 7.251 -10.277 -8.929 528 HB3 ALA 78 3HB ALA 78 6.480 -10.650 -7.387 529 H ARG 79 H ARG 79 7.226 -13.268 -9.863 530 HA ARG 79 HA ARG 79 5.709 -15.544 -8.785 531 HB3 ARG 79 2HB ARG 79 5.399 -15.256 -11.281 532 HG3 ARG 79 2HG ARG 79 8.182 -15.028 -11.306 533 HD3 ARG 79 2HD ARG 79 7.337 -17.759 -11.823 534 HE ARG 79 HE ARG 79 9.188 -16.990 -13.885 535 HH11 ARG 79 1HH1 ARG 79 5.841 -17.511 -13.085 536 HH12 ARG 79 2HH1 ARG 79 5.359 -17.808 -14.722 537 HH21 ARG 79 1HH2 ARG 79 8.567 -17.378 -16.046 538 HH22 ARG 79 2HH2 ARG 79 6.911 -17.731 -16.406 539 H ASP 80 H ASP 80 7.095 -17.568 -8.746 540 HA ASP 80 HA ASP 80 9.779 -16.829 -7.801 541 HB3 ASP 80 2HB ASP 80 9.618 -19.178 -6.722 542 H PHE 81 H PHE 81 8.034 -18.861 -10.031 543 HA PHE 81 HA PHE 81 10.093 -19.189 -11.831 544 HB3 PHE 81 2HB PHE 81 11.425 -20.466 -10.398 545 HD1 PHE 81 1HD PHE 81 8.416 -22.651 -10.331 546 HD2 PHE 81 2HD PHE 81 11.382 -20.580 -8.090 547 HE1 PHE 81 1HE PHE 81 7.580 -23.695 -8.266 548 HE2 PHE 81 2HE PHE 81 10.552 -21.621 -6.022 549 HZ PHE 81 HZ PHE 81 8.649 -23.183 -6.107 550 H GLY 82 H GLY 82 7.214 -20.458 -10.350 551 HA2 GLY 82 2HA GLY 82 6.007 -20.877 -12.923 552 HA3 GLY 82 3HA GLY 82 6.333 -22.381 -12.076 553 H HIS 83 H HIS 83 5.874 -21.107 -9.443 554 HA HIS 83 HA HIS 83 3.002 -21.468 -9.400 555 HB3 HIS 83 2HB HIS 83 3.744 -20.773 -6.834 556 HD1 HIS 83 1HD HIS 83 2.654 -22.490 -5.417 557 HD2 HIS 83 2HD HIS 83 3.934 -24.054 -9.048 558 HE1 HIS 83 1HE HIS 83 1.821 -24.862 -5.459 559 H ILE 84 H ILE 84 3.818 -19.166 -10.810 560 HA ILE 84 HA ILE 84 4.057 -16.744 -10.091 561 HB ILE 84 HB ILE 84 1.398 -17.609 -11.229 562 HG13 ILE 84 2HG1 ILE 84 3.999 -17.750 -12.292 563 HG21 ILE 84 1HG2 ILE 84 0.926 -15.448 -10.667 564 HG22 ILE 84 2HG2 ILE 84 2.610 -14.938 -10.759 565 HG23 ILE 84 3HG2 ILE 84 1.681 -15.185 -12.238 566 HD11 ILE 84 3HD1 ILE 84 1.556 -17.675 -14.015 567 HD12 ILE 84 1HD1 ILE 84 3.022 -18.637 -14.201 568 HD13 ILE 84 2HD1 ILE 84 1.870 -19.023 -12.923 569 H GLN 85 H GLN 85 3.853 -15.644 -8.267 570 HA GLN 85 HA GLN 85 1.639 -16.261 -6.454 571 HB3 GLN 85 2HB GLN 85 3.012 -15.731 -4.744 572 HG3 GLN 85 2HG GLN 85 5.426 -15.866 -5.186 573 HE21 GLN 85 1HE2 GLN 85 6.145 -17.801 -7.138 574 HE22 GLN 85 2HE2 GLN 85 5.325 -19.269 -6.743 575 H TYR 86 H TYR 86 0.534 -14.481 -5.360 576 HA TYR 86 HA TYR 86 0.653 -11.816 -6.269 577 HB3 TYR 86 2HB TYR 86 -0.245 -12.670 -8.349 578 HD1 TYR 86 2HD TYR 86 -0.323 -15.205 -8.176 579 HD2 TYR 86 1HD TYR 86 -3.569 -12.715 -7.009 580 HE1 TYR 86 2HE TYR 86 -1.848 -17.129 -8.331 581 HE2 TYR 86 1HE TYR 86 -5.102 -14.632 -7.160 582 HH TYR 86 HH TYR 86 -3.976 -17.801 -8.277 583 H VAL 87 H VAL 87 -0.558 -10.477 -4.995 584 HA VAL 87 HA VAL 87 -1.913 -11.742 -2.747 585 HB VAL 87 HB VAL 87 -1.330 -8.809 -3.167 586 HG11 VAL 87 1HG1 VAL 87 -3.069 -9.194 -1.536 587 HG12 VAL 87 2HG1 VAL 87 -2.073 -10.397 -0.714 588 HG13 VAL 87 3HG1 VAL 87 -1.590 -8.700 -0.712 589 HG21 VAL 87 3HG2 VAL 87 0.556 -9.252 -1.550 590 HG22 VAL 87 1HG2 VAL 87 0.301 -10.970 -1.854 591 HG23 VAL 87 2HG2 VAL 87 0.776 -9.902 -3.175 592 H ALA 88 H ALA 88 -4.023 -11.243 -2.100 593 HA ALA 88 HA ALA 88 -5.749 -10.327 -4.289 594 HB1 ALA 88 1HB ALA 88 -7.076 -12.014 -3.732 595 HB2 ALA 88 2HB ALA 88 -5.920 -12.489 -2.488 596 HB3 ALA 88 3HB ALA 88 -7.235 -11.385 -2.092 597 H SER 89 H SER 89 -5.984 -10.212 -0.731 598 HA SER 89 HA SER 89 -7.066 -7.491 -0.977 599 HB3 SER 89 2HB SER 89 -7.203 -9.323 1.427 600 HG SER 89 HG SER 89 -8.227 -7.715 2.293 601 H TYR 90 H TYR 90 -6.234 -5.791 0.202 602 HA TYR 90 HA TYR 90 -4.219 -6.056 2.176 603 HB3 TYR 90 2HB TYR 90 -2.867 -6.680 0.201 604 HD1 TYR 90 1HD TYR 90 -4.309 -6.505 -1.885 605 HD2 TYR 90 2HD TYR 90 -2.136 -3.209 -0.301 606 HE1 TYR 90 1HE TYR 90 -4.478 -5.360 -4.055 607 HE2 TYR 90 2HE TYR 90 -2.300 -2.053 -2.466 608 HH TYR 90 HH TYR 90 -3.604 -3.642 -5.302 609 H LYS 91 H LYS 91 -3.820 -4.133 3.221 610 HA LYS 91 HA LYS 91 -5.390 -1.835 2.268 611 HB3 LYS 91 2HB LYS 91 -4.524 -1.552 4.993 612 HG3 LYS 91 2HG LYS 91 -7.313 -2.246 4.668 613 HD3 LYS 91 2HD LYS 91 -6.397 0.533 5.134 614 HE3 LYS 91 2HE LYS 91 -8.747 -0.699 5.468 615 HZ1 LYS 91 3HZ LYS 91 -7.314 -1.024 8.044 616 HZ2 LYS 91 1HZ LYS 91 -8.095 -2.223 7.141 617 HZ3 LYS 91 2HZ LYS 91 -9.001 -1.021 7.913 618 H VAL 92 H VAL 92 -4.282 -0.189 1.462 619 HA VAL 92 HA VAL 92 -1.547 0.290 2.456 620 HB VAL 92 HB VAL 92 -1.361 -0.487 0.198 621 HG11 VAL 92 1HG1 VAL 92 -3.045 -0.253 -1.228 622 HG12 VAL 92 2HG1 VAL 92 -3.839 0.894 -0.146 623 HG13 VAL 92 3HG1 VAL 92 -2.680 1.468 -1.346 624 HG21 VAL 92 3HG2 VAL 92 0.075 1.401 0.847 625 HG22 VAL 92 1HG2 VAL 92 -0.295 1.415 -0.877 626 HG23 VAL 92 2HG2 VAL 92 -1.129 2.523 0.213 627 H ALA 93 H ALA 93 -1.526 2.062 3.664 628 HA ALA 93 HA ALA 93 -3.117 4.381 2.777 629 HB1 ALA 93 1HB ALA 93 -3.535 2.997 5.095 630 HB2 ALA 93 2HB ALA 93 -2.483 4.309 5.630 631 HB3 ALA 93 3HB ALA 93 -4.002 4.674 4.812 632 H HIS 94 H HIS 94 -2.193 6.430 3.030 633 HA HIS 94 HA HIS 94 0.719 6.405 3.477 634 HB3 HIS 94 2HB HIS 94 0.750 8.442 2.013 635 HD1 HIS 94 1HD HIS 94 1.712 7.942 -0.245 636 HD2 HIS 94 2HD HIS 94 -0.830 4.944 1.101 637 HE1 HIS 94 1HE HIS 94 1.956 6.062 -1.898 638 H SER 95 H SER 95 1.641 7.910 4.809 639 HA SER 95 HA SER 95 -0.187 9.763 6.187 640 HB3 SER 95 2HB SER 95 0.819 7.566 7.398 641 HG SER 95 HG SER 95 2.611 9.624 8.150 642 H ASP 96 H ASP 96 0.548 11.799 6.545 643 HA ASP 96 HA ASP 96 3.104 12.492 5.299 644 HB3 ASP 96 2HB ASP 96 1.130 13.715 4.524 645 H ASP 97 H ASP 97 1.323 12.880 8.328 646 HA ASP 97 HA ASP 97 3.668 14.086 9.588 647 HB3 ASP 97 2HB ASP 97 2.008 14.168 11.591 648 H GLY 98 H GLY 98 2.041 11.075 9.318 649 HA2 GLY 98 2HA GLY 98 3.278 9.086 9.959 650 HA3 GLY 98 3HA GLY 98 3.838 9.961 11.376 651 H VAL 99 H VAL 99 1.054 11.074 11.720 652 HA VAL 99 HA VAL 99 -0.011 8.744 13.147 653 HB VAL 99 HB VAL 99 0.383 10.739 14.505 654 HG11 VAL 99 1HG1 VAL 99 0.082 12.419 12.748 655 HG12 VAL 99 2HG1 VAL 99 -1.650 12.082 12.723 656 HG13 VAL 99 3HG1 VAL 99 -0.905 12.778 14.164 657 HG21 VAL 99 3HG2 VAL 99 -2.032 9.278 14.327 658 HG22 VAL 99 1HG2 VAL 99 -1.335 10.068 15.742 659 HG23 VAL 99 2HG2 VAL 99 -2.455 10.948 14.702 660 H GLN 100 H GLN 100 -0.846 11.154 10.734 661 HA GLN 100 HA GLN 100 -3.570 10.189 10.508 662 HB3 GLN 100 2HB GLN 100 -3.807 11.902 8.769 663 HG3 GLN 100 2HG GLN 100 -2.231 13.190 10.966 664 HE21 GLN 100 1HE2 GLN 100 -1.997 15.063 9.822 665 HE22 GLN 100 2HE2 GLN 100 -3.327 16.052 9.334 666 H TRP 101 H TRP 101 -3.673 8.185 9.658 667 HA TRP 101 HA TRP 101 -2.072 7.553 7.292 668 HB3 TRP 101 2HB TRP 101 -2.536 5.269 7.718 669 HD1 TRP 101 HD TRP 101 -0.433 7.292 9.135 670 HE1 TRP 101 1HE TRP 101 0.532 6.630 11.428 671 HE3 TRP 101 3HE TRP 101 -4.016 3.948 10.592 672 HZ2 TRP 101 2HZ TRP 101 -0.135 4.918 13.570 673 HZ3 TRP 101 3HZ TRP 101 -3.778 2.842 12.777 674 HH2 TRP 101 HH TRP 101 -1.877 3.318 14.234 675 H THR 102 H THR 102 -2.995 8.276 5.473 676 HA THR 102 HA THR 102 -5.874 8.286 5.150 677 HB THR 102 HB THR 102 -3.676 9.097 3.238 678 HG1 THR 102 1HG THR 102 -3.760 10.914 4.304 679 HG21 THR 102 3HG2 THR 102 -5.489 10.189 1.965 680 HG22 THR 102 1HG2 THR 102 -6.671 9.442 3.039 681 HG23 THR 102 2HG2 THR 102 -5.660 8.435 2.003 682 H VAL 103 H VAL 103 -6.838 6.415 4.688 683 HA VAL 103 HA VAL 103 -5.467 4.423 3.054 684 HB VAL 103 HB VAL 103 -7.420 2.973 3.609 685 HG11 VAL 103 1HG1 VAL 103 -5.552 2.654 4.978 686 HG12 VAL 103 2HG1 VAL 103 -5.763 4.211 5.783 687 HG13 VAL 103 3HG1 VAL 103 -6.881 2.888 6.113 688 HG21 VAL 103 3HG2 VAL 103 -9.302 3.888 4.355 689 HG22 VAL 103 1HG2 VAL 103 -8.462 4.377 5.826 690 HG23 VAL 103 2HG2 VAL 103 -8.524 5.469 4.443 691 H TYR 104 H TYR 104 -6.633 3.345 1.301 692 HA TYR 104 HA TYR 104 -7.862 5.286 -0.440 693 HB3 TYR 104 2HB TYR 104 -7.965 3.227 -2.000 694 HD1 TYR 104 2HD TYR 104 -6.853 5.879 -2.151 695 HD2 TYR 104 1HD TYR 104 -4.850 2.177 -1.533 696 HE1 TYR 104 2HE TYR 104 -4.798 6.839 -3.103 697 HE2 TYR 104 1HE TYR 104 -2.790 3.125 -2.482 698 HH TYR 104 HH TYR 104 -1.760 5.260 -2.882 699 H GLU 105 H GLU 105 -9.606 5.271 1.461 700 HA GLU 105 HA GLU 105 -11.538 3.268 1.598 701 HB3 GLU 105 2HB GLU 105 -11.587 4.945 3.263 702 HG3 GLU 105 2HG GLU 105 -11.914 6.947 1.045 703 H GLU 106 H GLU 106 -13.637 3.108 0.673 704 HA GLU 106 HA GLU 106 -13.682 3.890 -2.122 705 HB3 GLU 106 2HB GLU 106 -15.908 2.390 -0.799 706 HG3 GLU 106 2HG GLU 106 -15.191 2.920 -3.453 707 H GLN 107 H GLN 107 -15.172 4.788 0.871 708 HA GLN 107 HA GLN 107 -16.236 7.176 -0.165 709 HB3 GLN 107 2HB GLN 107 -17.945 5.916 -1.220 710 HG3 GLN 107 2HG GLN 107 -18.543 4.531 1.380 711 HE21 GLN 107 1HE2 GLN 107 -18.957 2.222 -0.554 712 HE22 GLN 107 2HE2 GLN 107 -20.556 2.474 -1.158 713 H GLY 108 H GLY 108 -14.674 6.269 2.057 714 HA2 GLY 108 2HA GLY 108 -14.560 7.413 4.157 715 HA3 GLY 108 3HA GLY 108 -16.316 7.398 4.221 716 H SER 109 H SER 109 -16.070 4.472 3.265 717 HA SER 109 HA SER 109 -16.329 3.311 5.841 718 HB3 SER 109 2HB SER 109 -16.133 2.118 3.072 719 HG SER 109 HG SER 109 -17.126 0.531 5.076 720 H SER 110 H SER 110 -13.708 3.526 3.526 721 HA SER 110 HA SER 110 -11.503 2.980 3.639 722 HB3 SER 110 2HB SER 110 -10.416 3.089 5.816 723 HG SER 110 HG SER 110 -10.795 5.139 5.636 724 H LYS 111 H LYS 111 -12.293 0.926 2.657 725 HA LYS 111 HA LYS 111 -12.115 -1.381 4.455 726 HB3 LYS 111 2HB LYS 111 -12.633 -1.947 1.636 727 HG3 LYS 111 2HG LYS 111 -13.107 -3.534 3.456 728 HD3 LYS 111 2HD LYS 111 -14.231 -1.350 4.733 729 HE3 LYS 111 2HE LYS 111 -16.260 -1.852 3.246 730 HZ1 LYS 111 3HZ LYS 111 -17.649 -3.613 4.593 731 HZ2 LYS 111 1HZ LYS 111 -16.119 -4.280 4.868 732 HZ3 LYS 111 2HZ LYS 111 -16.677 -4.071 3.286 733 H VAL 112 H VAL 112 -11.232 -3.343 2.796 734 HA VAL 112 HA VAL 112 -8.426 -2.586 2.421 735 HB VAL 112 HB VAL 112 -9.266 -5.423 2.183 736 HG11 VAL 112 1HG1 VAL 112 -7.148 -5.120 3.969 737 HG12 VAL 112 2HG1 VAL 112 -7.048 -5.578 2.268 738 HG13 VAL 112 3HG1 VAL 112 -6.888 -3.885 2.737 739 HG21 VAL 112 3HG2 VAL 112 -9.261 -5.666 4.661 740 HG22 VAL 112 1HG2 VAL 112 -9.300 -3.906 4.789 741 HG23 VAL 112 2HG2 VAL 112 -10.645 -4.766 4.037 742 H PHE 113 H PHE 113 -7.362 -2.812 0.505 743 HA PHE 113 HA PHE 113 -8.925 -2.815 -1.879 744 HB3 PHE 113 2HB PHE 113 -6.266 -3.148 -2.646 745 HD1 PHE 113 1HD PHE 113 -8.601 -0.612 -1.263 746 HD2 PHE 113 2HD PHE 113 -5.755 -1.579 -4.276 747 HE1 PHE 113 1HE PHE 113 -9.149 1.475 -2.446 748 HE2 PHE 113 2HE PHE 113 -6.298 0.506 -5.463 749 HZ PHE 113 HZ PHE 113 -7.997 2.036 -4.548 750 H GLN 114 H GLN 114 -9.885 -4.682 -2.440 751 HA GLN 114 HA GLN 114 -8.224 -7.112 -2.529 752 HB3 GLN 114 2HB GLN 114 -10.232 -8.414 -2.313 753 HG3 GLN 114 2HG GLN 114 -9.601 -6.407 -0.339 754 HE21 GLN 114 1HE2 GLN 114 -12.579 -8.066 -1.258 755 HE22 GLN 114 2HE2 GLN 114 -13.627 -7.112 -0.271 756 H GLY 115 H GLY 115 -7.992 -8.218 -4.411 757 HA2 GLY 115 2HA GLY 115 -9.027 -8.811 -6.591 758 HA3 GLY 115 3HA GLY 115 -9.380 -7.099 -6.769 759 H ASN 116 H ASN 116 -7.334 -9.504 -7.701 760 HA ASN 116 HA ASN 116 -5.337 -7.554 -8.587 761 HB3 ASN 116 2HB ASN 116 -3.855 -9.869 -8.109 762 HD21 ASN 116 1HD2 ASN 116 -2.248 -8.400 -8.470 763 HD22 ASN 116 2HD2 ASN 116 -1.790 -7.193 -7.321 764 H LEU 117 H LEU 117 -5.499 -7.616 -10.730 765 HA LEU 117 HA LEU 117 -6.624 -9.542 -12.315 766 HB3 LEU 117 2HB LEU 117 -5.311 -8.607 -14.176 767 HG LEU 117 HG LEU 117 -6.552 -6.663 -12.271 768 HD11 LEU 117 1HD1 LEU 117 -5.766 -4.838 -13.291 769 HD12 LEU 117 2HD1 LEU 117 -5.868 -5.572 -14.890 770 HD13 LEU 117 3HD1 LEU 117 -4.468 -5.884 -13.864 771 HD21 LEU 117 3HD2 LEU 117 -8.340 -7.313 -13.418 772 HD22 LEU 117 1HD2 LEU 117 -7.351 -8.223 -14.559 773 HD23 LEU 117 2HD2 LEU 117 -7.652 -6.507 -14.828 774 H ASP 118 H ASP 118 -3.223 -9.290 -11.350 775 HA ASP 118 HA ASP 118 -2.718 -11.985 -11.141 776 HB3 ASP 118 2HB ASP 118 -1.277 -11.611 -13.574 777 H ASN 119 H ASN 119 -0.157 -12.341 -11.900 778 HA ASN 119 HA ASN 119 1.242 -10.531 -10.156 779 HB3 ASN 119 2HB ASN 119 1.614 -13.086 -10.472 780 HD21 ASN 119 1HD2 ASN 119 4.636 -12.634 -11.451 781 HD22 ASN 119 2HD2 ASN 119 4.538 -13.199 -13.080 782 H ASN 120 H ASN 120 0.966 -11.056 -13.604 783 HA ASN 120 HA ASN 120 3.102 -9.166 -14.185 784 HB3 ASN 120 2HB ASN 120 3.039 -11.075 -15.627 785 HD21 ASN 120 1HD2 ASN 120 0.617 -9.795 -17.586 786 HD22 ASN 120 2HD2 ASN 120 -0.563 -11.039 -17.371 787 H SER 121 H SER 121 -0.405 -9.456 -14.612 788 HA SER 121 HA SER 121 -0.910 -7.122 -16.004 789 HB3 SER 121 2HB SER 121 -3.171 -7.185 -14.936 790 HG SER 121 HG SER 121 -3.253 -9.701 -15.432 791 H HIS 122 H HIS 122 -0.505 -5.068 -15.566 792 HA HIS 122 HA HIS 122 0.160 -4.257 -12.860 793 HB3 HIS 122 2HB HIS 122 1.465 -3.547 -14.919 794 HD1 HIS 122 1HD HIS 122 0.564 -0.273 -15.226 795 HD2 HIS 122 2HD HIS 122 -1.066 -3.729 -16.856 796 HE1 HIS 122 1HE HIS 122 -0.703 0.477 -17.264 797 H LYS 123 H LYS 123 -1.059 -3.018 -11.548 798 HA LYS 123 HA LYS 123 -3.653 -2.091 -12.594 799 HB3 LYS 123 2HB LYS 123 -3.016 -2.948 -9.765 800 HG3 LYS 123 2HG LYS 123 -5.278 -1.586 -10.899 801 HD3 LYS 123 2HD LYS 123 -5.792 -4.281 -9.642 802 HE3 LYS 123 2HE LYS 123 -7.297 -1.870 -9.488 803 HZ1 LYS 123 3HZ LYS 123 -9.391 -3.309 -10.321 804 HZ2 LYS 123 1HZ LYS 123 -8.240 -3.742 -11.483 805 HZ3 LYS 123 2HZ LYS 123 -8.637 -2.114 -11.251 806 H LYS 124 H LYS 124 -2.873 -0.030 -13.122 807 HA LYS 124 HA LYS 124 -1.687 1.604 -11.033 808 HB3 LYS 124 2HB LYS 124 -2.325 2.114 -13.937 809 HG3 LYS 124 2HG LYS 124 -1.342 4.019 -11.853 810 HD3 LYS 124 2HD LYS 124 -0.351 3.696 -14.599 811 HE3 LYS 124 2HE LYS 124 -0.704 6.511 -13.692 812 HZ1 LYS 124 3HZ LYS 124 0.674 6.187 -15.571 813 HZ2 LYS 124 1HZ LYS 124 -0.788 6.803 -16.157 814 HZ3 LYS 124 2HZ LYS 124 -0.442 5.157 -16.316 815 H ASN 125 H ASN 125 -2.799 2.904 -9.732 816 HA ASN 125 HA ASN 125 -5.624 3.413 -10.355 817 HB3 ASN 125 2HB ASN 125 -6.048 3.571 -8.052 818 HD21 ASN 125 1HD2 ASN 125 -6.768 1.574 -7.811 819 HD22 ASN 125 2HD2 ASN 125 -5.788 0.166 -7.613 820 H ILE 126 H ILE 126 -6.397 5.437 -10.594 821 HA ILE 126 HA ILE 126 -4.641 7.558 -11.168 822 HB ILE 126 HB ILE 126 -7.181 7.139 -11.810 823 HG13 ILE 126 2HG1 ILE 126 -5.336 9.182 -12.164 824 HG21 ILE 126 1HG2 ILE 126 -7.751 7.561 -9.326 825 HG22 ILE 126 2HG2 ILE 126 -7.553 9.263 -9.737 826 HG23 ILE 126 3HG2 ILE 126 -8.766 8.291 -10.568 827 HD11 ILE 126 3HD1 ILE 126 -6.538 8.284 -14.010 828 HD12 ILE 126 1HD1 ILE 126 -8.073 8.858 -13.360 829 HD13 ILE 126 2HD1 ILE 126 -6.870 10.014 -13.934 830 H PHE 127 H PHE 127 -5.133 9.816 -10.097 831 HA PHE 127 HA PHE 127 -4.149 9.643 -7.425 832 HB3 PHE 127 2HB PHE 127 -3.316 11.518 -8.468 833 HD1 PHE 127 1HD PHE 127 -6.761 12.783 -8.772 834 HD2 PHE 127 2HD PHE 127 -3.273 11.486 -10.836 835 HE1 PHE 127 1HE PHE 127 -7.688 13.653 -10.878 836 HE2 PHE 127 2HE PHE 127 -4.193 12.356 -12.945 837 HZ PHE 127 HZ PHE 127 -6.403 13.442 -12.968 838 H GLU 128 H GLU 128 -5.974 8.362 -6.576 839 HA GLU 128 HA GLU 128 -8.573 9.440 -6.334 840 HB3 GLU 128 2HB GLU 128 -7.611 7.619 -4.206 841 HG3 GLU 128 2HG GLU 128 -9.578 6.330 -4.802 842 H LYS 129 H LYS 129 -5.640 10.101 -4.697 843 HA LYS 129 HA LYS 129 -6.801 12.224 -3.204 844 HB3 LYS 129 2HB LYS 129 -5.747 10.997 -1.014 845 HG3 LYS 129 2HG LYS 129 -8.404 10.094 -1.063 846 HD3 LYS 129 2HD LYS 129 -7.046 12.554 0.012 847 HE3 LYS 129 2HE LYS 129 -9.847 11.609 0.609 848 HZ1 LYS 129 3HZ LYS 129 -8.053 13.495 1.872 849 HZ2 LYS 129 1HZ LYS 129 -9.396 12.684 2.506 850 HZ3 LYS 129 2HZ LYS 129 -9.611 14.086 1.585 851 HA PRO 130 HA PRO 130 -2.275 12.496 -4.223 852 HB3 PRO 130 2HB PRO 130 -2.714 13.391 -6.294 853 HG3 PRO 130 2HG PRO 130 -4.735 14.452 -6.738 854 HD3 PRO 130 2HD PRO 130 -5.513 12.495 -5.802 855 H PHE 131 H PHE 131 -0.798 13.529 -2.978 856 HA PHE 131 HA PHE 131 -0.932 16.040 -1.859 857 HB3 PHE 131 2HB PHE 131 -1.378 14.736 0.592 858 HD1 PHE 131 2HD PHE 131 -0.954 17.463 -0.048 859 HD2 PHE 131 1HD PHE 131 -4.606 15.277 -0.069 860 HE1 PHE 131 2HE PHE 131 -2.203 19.551 0.321 861 HE2 PHE 131 1HE PHE 131 -5.861 17.361 0.299 862 HZ PHE 131 HZ PHE 131 -4.660 19.502 0.495 863 H MET 132 H MET 132 0.546 16.231 0.151 864 HA MET 132 HA MET 132 3.004 14.954 -0.488 865 HB3 MET 132 2HB MET 132 2.981 17.209 0.407 866 HG3 MET 132 2HG MET 132 2.406 16.370 3.169 867 HE1 MET 132 3HE MET 132 1.325 18.376 0.207 868 HE2 MET 132 1HE MET 132 0.109 19.220 1.166 869 HE3 MET 132 2HE MET 132 1.565 20.068 0.646 870 H ALA 133 H ALA 133 4.243 13.519 0.782 871 HA ALA 133 HA ALA 133 2.920 12.175 3.006 872 HB1 ALA 133 1HB ALA 133 2.267 10.997 0.883 873 HB2 ALA 133 2HB ALA 133 3.967 10.569 0.685 874 HB3 ALA 133 3HB ALA 133 3.069 9.991 2.089 875 H ARG 134 H ARG 134 4.326 11.123 4.413 876 HA ARG 134 HA ARG 134 7.194 11.502 3.850 877 HB3 ARG 134 2HB ARG 134 5.666 11.926 6.414 878 HG3 ARG 134 2HG ARG 134 8.293 12.661 6.887 879 HD3 ARG 134 2HD ARG 134 6.339 10.757 7.898 880 HE ARG 134 HE ARG 134 8.903 9.684 7.627 881 HH11 ARG 134 1HH1 ARG 134 6.522 10.248 10.104 882 HH12 ARG 134 2HH1 ARG 134 7.023 8.903 11.074 883 HH21 ARG 134 1HH2 ARG 134 9.573 7.911 8.897 884 HH22 ARG 134 2HH2 ARG 134 8.760 7.575 10.387 885 H TYR 135 H TYR 135 4.699 9.486 5.238 886 HA TYR 135 HA TYR 135 6.402 7.167 4.996 887 HB3 TYR 135 2HB TYR 135 5.456 8.168 7.676 888 HD1 TYR 135 2HD TYR 135 3.817 6.433 8.216 889 HD2 TYR 135 1HD TYR 135 7.817 5.431 7.168 890 HE1 TYR 135 2HE TYR 135 3.477 4.168 9.111 891 HE2 TYR 135 1HE TYR 135 7.488 3.162 8.060 892 HH TYR 135 HH TYR 135 4.863 2.315 10.004 893 H VAL 136 H VAL 136 5.242 5.438 4.413 894 HA VAL 136 HA VAL 136 2.319 5.550 4.796 895 HB VAL 136 HB VAL 136 1.968 4.494 2.707 896 HG11 VAL 136 1HG1 VAL 136 3.073 6.019 1.105 897 HG12 VAL 136 2HG1 VAL 136 2.396 6.862 2.501 898 HG13 VAL 136 3HG1 VAL 136 4.133 6.571 2.402 899 HG21 VAL 136 3HG2 VAL 136 3.398 2.893 2.104 900 HG22 VAL 136 1HG2 VAL 136 4.414 4.177 1.449 901 HG23 VAL 136 2HG2 VAL 136 4.694 3.578 3.084 902 H ARG 137 H ARG 137 1.225 3.561 5.135 903 HA ARG 137 HA ARG 137 2.957 1.348 6.017 904 HB3 ARG 137 2HB ARG 137 0.487 2.443 7.363 905 HG3 ARG 137 2HG ARG 137 1.983 -0.105 7.891 906 HD3 ARG 137 2HD ARG 137 -0.081 1.020 9.741 907 HE ARG 137 HE ARG 137 0.408 -1.005 10.661 908 HH11 ARG 137 1HH1 ARG 137 3.352 0.398 9.441 909 HH12 ARG 137 2HH1 ARG 137 4.365 -0.859 10.070 910 HH21 ARG 137 1HH2 ARG 137 1.732 -2.666 11.494 911 HH22 ARG 137 2HH2 ARG 137 3.443 -2.601 11.237 912 H VAL 138 H VAL 138 2.333 -0.694 5.476 913 HA VAL 138 HA VAL 138 -0.233 -1.005 4.067 914 HB VAL 138 HB VAL 138 2.359 -2.267 3.167 915 HG11 VAL 138 1HG1 VAL 138 0.487 -3.644 2.606 916 HG12 VAL 138 2HG1 VAL 138 -0.423 -2.255 2.009 917 HG13 VAL 138 3HG1 VAL 138 1.007 -2.814 1.140 918 HG21 VAL 138 3HG2 VAL 138 2.828 -0.376 2.101 919 HG22 VAL 138 1HG2 VAL 138 1.322 -0.537 1.197 920 HG23 VAL 138 2HG2 VAL 138 1.350 0.368 2.710 921 H LEU 139 H LEU 139 -1.232 -3.009 4.262 922 HA LEU 139 HA LEU 139 0.062 -5.132 5.748 923 HB3 LEU 139 2HB LEU 139 -0.711 -3.915 7.606 924 HG LEU 139 HG LEU 139 -3.199 -3.394 6.047 925 HD11 LEU 139 1HD1 LEU 139 -3.851 -2.663 8.619 926 HD12 LEU 139 2HD1 LEU 139 -3.123 -4.257 8.823 927 HD13 LEU 139 3HD1 LEU 139 -4.496 -4.048 7.736 928 HD21 LEU 139 3HD2 LEU 139 -2.887 -1.226 7.441 929 HD22 LEU 139 1HD2 LEU 139 -1.814 -1.543 6.077 930 HD23 LEU 139 2HD2 LEU 139 -1.261 -1.851 7.724 931 HA PRO 140 HA PRO 140 -2.608 -6.931 2.572 932 HB3 PRO 140 2HB PRO 140 -0.719 -7.843 1.636 933 HG3 PRO 140 2HG PRO 140 1.162 -8.294 2.927 934 HD3 PRO 140 2HD PRO 140 0.756 -6.116 3.564 935 H VAL 141 H VAL 141 -4.353 -8.246 2.767 936 HA VAL 141 HA VAL 141 -4.683 -9.649 5.334 937 HB VAL 141 HB VAL 141 -6.834 -8.683 3.446 938 HG11 VAL 141 1HG1 VAL 141 -7.831 -10.429 4.568 939 HG12 VAL 141 2HG1 VAL 141 -6.867 -10.184 6.025 940 HG13 VAL 141 3HG1 VAL 141 -8.188 -9.079 5.645 941 HG21 VAL 141 3HG2 VAL 141 -5.886 -7.537 6.071 942 HG22 VAL 141 1HG2 VAL 141 -5.680 -6.811 4.477 943 HG23 VAL 141 2HG2 VAL 141 -7.294 -6.985 5.165 944 H SER 142 H SER 142 -5.420 -9.910 1.866 945 HA SER 142 HA SER 142 -5.462 -12.840 2.192 946 HB3 SER 142 2HB SER 142 -6.844 -11.841 -0.183 947 HG SER 142 HG SER 142 -8.120 -13.482 0.308 948 H TRP 143 H TRP 143 -4.133 -14.002 0.932 949 HA TRP 143 HA TRP 143 -2.844 -12.673 -1.350 950 HB3 TRP 143 2HB TRP 143 -1.291 -12.594 0.548 951 HD1 TRP 143 HD TRP 143 -0.011 -16.034 -0.005 952 HE1 TRP 143 1HE TRP 143 -0.270 -17.438 2.136 953 HE3 TRP 143 3HE TRP 143 -3.085 -12.921 2.641 954 HZ2 TRP 143 2HZ TRP 143 -1.601 -17.250 4.619 955 HZ3 TRP 143 3HZ TRP 143 -3.805 -13.607 4.891 956 HH2 TRP 143 HH TRP 143 -3.078 -15.728 5.858 957 H HIS 144 H HIS 144 -1.577 -14.362 -2.679 958 HA HIS 144 HA HIS 144 -2.982 -16.940 -2.703 959 HB3 HIS 144 2HB HIS 144 -2.449 -16.204 -5.398 960 HD1 HIS 144 1HD HIS 144 -5.729 -14.996 -4.849 961 HD2 HIS 144 2HD HIS 144 -3.978 -18.762 -4.756 962 HE1 HIS 144 1HE HIS 144 -7.626 -16.626 -5.107 963 H ASN 145 H ASN 145 -1.553 -18.529 -2.596 964 HA ASN 145 HA ASN 145 0.276 -19.823 -3.057 965 HB3 ASN 145 2HB ASN 145 1.606 -19.423 -4.946 966 HD21 ASN 145 1HD2 ASN 145 -0.882 -20.390 -4.880 967 HD22 ASN 145 2HD2 ASN 145 -1.809 -19.807 -6.217 968 H ARG 146 H ARG 146 1.560 -16.506 -3.310 969 HA ARG 146 HA ARG 146 2.738 -16.623 -0.694 970 HB3 ARG 146 2HB ARG 146 4.533 -16.723 -3.123 971 HG3 ARG 146 2HG ARG 146 5.486 -15.240 -1.443 972 HD3 ARG 146 2HD ARG 146 4.352 -17.101 0.369 973 HE ARG 146 HE ARG 146 7.092 -16.809 1.241 974 HH11 ARG 146 1HH1 ARG 146 4.715 -18.880 -0.236 975 HH12 ARG 146 2HH1 ARG 146 5.559 -20.342 0.150 976 HH21 ARG 146 1HH2 ARG 146 8.212 -18.728 1.755 977 HH22 ARG 146 2HH2 ARG 146 7.548 -20.255 1.283 978 H ILE 147 H ILE 147 3.534 -14.621 0.004 979 HA ILE 147 HA ILE 147 2.343 -12.356 -1.205 980 HB ILE 147 HB ILE 147 4.588 -11.975 0.707 981 HG13 ILE 147 2HG1 ILE 147 3.148 -12.635 2.605 982 HG21 ILE 147 1HG2 ILE 147 3.339 -10.049 0.024 983 HG22 ILE 147 2HG2 ILE 147 1.814 -10.841 0.413 984 HG23 ILE 147 3HG2 ILE 147 2.932 -10.402 1.703 985 HD11 ILE 147 3HD1 ILE 147 1.136 -13.745 2.424 986 HD12 ILE 147 1HD1 ILE 147 0.993 -12.487 1.197 987 HD13 ILE 147 2HD1 ILE 147 1.388 -14.139 0.724 988 H THR 148 H THR 148 3.091 -12.083 -3.291 989 HA THR 148 HA THR 148 5.818 -11.020 -3.494 990 HB THR 148 HB THR 148 4.811 -12.611 -5.802 991 HG1 THR 148 1HG THR 148 4.575 -13.910 -3.815 992 HG21 THR 148 3HG2 THR 148 7.019 -11.214 -5.535 993 HG22 THR 148 1HG2 THR 148 7.038 -12.763 -6.376 994 HG23 THR 148 2HG2 THR 148 7.586 -12.662 -4.704 995 H LEU 149 H LEU 149 5.121 -8.921 -3.686 996 HA LEU 149 HA LEU 149 4.228 -8.092 -6.261 997 HB3 LEU 149 2HB LEU 149 2.121 -8.845 -5.000 998 HG LEU 149 HG LEU 149 2.457 -6.152 -3.680 999 HD11 LEU 149 1HD1 LEU 149 0.220 -7.266 -2.634 1000 HD12 LEU 149 2HD1 LEU 149 0.126 -7.822 -4.303 1001 HD13 LEU 149 3HD1 LEU 149 0.231 -6.097 -3.954 1002 HD21 LEU 149 3HD2 LEU 149 1.971 -7.726 -1.642 1003 HD22 LEU 149 1HD2 LEU 149 3.609 -7.551 -2.271 1004 HD23 LEU 149 2HD2 LEU 149 2.646 -8.963 -2.704 1005 H ARG 150 H ARG 150 3.431 -5.569 -5.876 1006 HA ARG 150 HA ARG 150 4.870 -4.178 -3.850 1007 HB3 ARG 150 2HB ARG 150 6.091 -3.104 -6.157 1008 HG3 ARG 150 2HG ARG 150 8.178 -4.209 -5.112 1009 HD3 ARG 150 2HD ARG 150 6.423 -2.168 -3.785 1010 HE ARG 150 HE ARG 150 9.095 -2.123 -2.840 1011 HH11 ARG 150 1HH1 ARG 150 6.029 -3.699 -2.364 1012 HH12 ARG 150 2HH1 ARG 150 6.329 -4.070 -0.699 1013 HH21 ARG 150 1HH2 ARG 150 9.504 -2.605 -0.648 1014 HH22 ARG 150 2HH2 ARG 150 8.306 -3.446 0.276 1015 H LEU 151 H LEU 151 4.250 -2.049 -3.701 1016 HA LEU 151 HA LEU 151 2.254 -1.167 -5.680 1017 HB3 LEU 151 2HB LEU 151 1.062 -1.324 -3.725 1018 HG LEU 151 HG LEU 151 3.581 -0.734 -2.294 1019 HD11 LEU 151 1HD1 LEU 151 2.653 0.293 -0.442 1020 HD12 LEU 151 2HD1 LEU 151 1.006 -0.145 -0.894 1021 HD13 LEU 151 3HD1 LEU 151 1.854 1.124 -1.777 1022 HD21 LEU 151 3HD2 LEU 151 3.082 -2.634 -1.191 1023 HD22 LEU 151 1HD2 LEU 151 2.021 -2.915 -2.571 1024 HD23 LEU 151 2HD2 LEU 151 1.365 -2.246 -1.077 1025 H GLU 152 H GLU 152 3.636 -0.084 -7.066 1026 HA GLU 152 HA GLU 152 5.622 1.748 -6.207 1027 HB3 GLU 152 2HB GLU 152 4.590 2.330 -8.852 1028 HG3 GLU 152 2HG GLU 152 6.897 1.177 -9.388 1029 H LEU 153 H LEU 153 5.606 3.974 -6.084 1030 HA LEU 153 HA LEU 153 2.937 5.220 -6.072 1031 HB3 LEU 153 2HB LEU 153 3.988 5.075 -3.864 1032 HG LEU 153 HG LEU 153 6.403 5.651 -4.992 1033 HD11 LEU 153 1HD1 LEU 153 6.817 7.914 -3.643 1034 HD12 LEU 153 2HD1 LEU 153 5.140 8.179 -4.118 1035 HD13 LEU 153 3HD1 LEU 153 6.368 7.888 -5.349 1036 HD21 LEU 153 3HD2 LEU 153 5.656 4.685 -2.698 1037 HD22 LEU 153 1HD2 LEU 153 5.890 6.338 -2.129 1038 HD23 LEU 153 2HD2 LEU 153 7.237 5.454 -2.847 1039 H LEU 154 H LEU 154 2.610 7.092 -7.172 1040 HA LEU 154 HA LEU 154 4.916 8.204 -8.632 1041 HB3 LEU 154 2HB LEU 154 3.647 8.476 -10.559 1042 HG LEU 154 HG LEU 154 2.727 5.889 -9.331 1043 HD11 LEU 154 1HD1 LEU 154 1.048 6.757 -10.952 1044 HD12 LEU 154 2HD1 LEU 154 1.808 5.243 -11.440 1045 HD13 LEU 154 3HD1 LEU 154 2.312 6.760 -12.183 1046 HD21 LEU 154 3HD2 LEU 154 4.857 5.420 -9.866 1047 HD22 LEU 154 1HD2 LEU 154 4.995 6.800 -10.956 1048 HD23 LEU 154 2HD2 LEU 154 4.233 5.310 -11.512 1049 H GLY 155 H GLY 155 4.960 10.449 -8.969 1050 HA2 GLY 155 2HA GLY 155 2.981 11.995 -7.419 1051 HA3 GLY 155 3HA GLY 155 4.703 12.289 -7.233 1052 H CYS 156 H CYS 156 3.511 14.472 -7.829 1053 HA CYS 156 HA CYS 156 3.433 14.785 -10.744 1054 HB3 CYS 156 2HB CYS 156 2.764 17.080 -8.997 1055 H LEU 157 H LEU 157 5.281 15.590 -7.940 1056 HA LEU 157 HA LEU 157 7.180 16.804 -7.607 1057 HB3 LEU 157 2HB LEU 157 8.017 16.649 -10.419 1058 HG LEU 157 HG LEU 157 9.979 15.475 -9.534 1059 HD11 LEU 157 1HD1 LEU 157 10.964 17.332 -8.430 1060 HD12 LEU 157 2HD1 LEU 157 9.396 17.923 -7.884 1061 HD13 LEU 157 3HD1 LEU 157 9.810 17.977 -9.597 1062 HD21 LEU 157 3HD2 LEU 157 8.426 14.622 -7.529 1063 HD22 LEU 157 1HD2 LEU 157 9.193 15.996 -6.732 1064 HD23 LEU 157 2HD2 LEU 157 10.185 14.706 -7.414 1065 H GLU 158 H GLU 158 4.845 18.305 -8.346 1066 HA GLU 158 HA GLU 158 6.001 20.511 -9.908 1067 HB3 GLU 158 2HB GLU 158 3.131 20.530 -9.142 1068 HG3 GLU 158 2HG GLU 158 4.419 21.003 -11.814 Start of MODEL 6 1 H1 MET -5 H MET -5 13.408 18.112 -27.645 2 HA MET -5 HA MET -5 13.791 15.872 -27.391 3 HB3 MET -5 2HB MET -5 16.186 16.382 -27.795 4 HG3 MET -5 2HG MET -5 16.351 16.576 -24.798 5 HE1 MET -5 3HE MET -5 19.089 18.612 -25.863 6 HE2 MET -5 1HE MET -5 18.848 17.974 -24.236 7 HE3 MET -5 2HE MET -5 20.316 17.576 -25.130 8 H LYS -4 H LYS -4 13.471 14.289 -25.768 9 HA LYS -4 HA LYS -4 12.620 13.519 -23.804 10 HB3 LYS -4 2HB LYS -4 13.613 14.634 -21.704 11 HG3 LYS -4 2HG LYS -4 15.993 13.908 -23.183 12 HD3 LYS -4 2HD LYS -4 14.767 12.030 -21.278 13 HE3 LYS -4 2HE LYS -4 17.407 13.200 -21.907 14 HZ1 LYS -4 3HZ LYS -4 18.334 12.706 -19.797 15 HZ2 LYS -4 1HZ LYS -4 16.870 12.099 -19.206 16 HZ3 LYS -4 2HZ LYS -4 17.033 13.752 -19.522 17 H SER -3 H SER -3 10.493 14.187 -24.266 18 HA SER -3 HA SER -3 9.564 16.368 -22.543 19 HB3 SER -3 2HB SER -3 8.617 17.586 -24.199 20 HG SER -3 HG SER -3 9.749 16.410 -26.332 21 H GLY -2 H GLY -2 8.238 15.440 -21.132 22 HA2 GLY -2 2HA GLY -2 5.853 14.153 -21.881 23 HA3 GLY -2 3HA GLY -2 7.034 12.926 -21.448 24 H HIS -1 H HIS -1 5.217 15.696 -20.271 25 HA HIS -1 HA HIS -1 5.962 15.066 -17.516 26 HB3 HIS -1 2HB HIS -1 4.097 17.200 -17.597 27 HD1 HIS -1 1HD HIS -1 5.770 16.246 -15.342 28 HD2 HIS -1 2HD HIS -1 7.098 19.169 -17.978 29 HE1 HIS -1 1HE HIS -1 7.559 17.507 -14.102 30 H GLY 0 H GLY 0 4.034 15.376 -15.914 31 HA2 GLY 0 2HA GLY 0 1.409 14.783 -16.606 32 HA3 GLY 0 3HA GLY 0 2.228 13.242 -16.394 33 H CYS 1 H CYS 1 0.452 13.168 -14.699 34 HA CYS 1 HA CYS 1 1.379 14.441 -12.209 35 HB3 CYS 1 2HB CYS 1 -1.365 13.272 -12.576 36 H SER 2 H SER 2 2.306 11.911 -13.485 37 HA SER 2 HA SER 2 2.023 10.231 -11.116 38 HB3 SER 2 2HB SER 2 0.439 9.033 -12.254 39 HG SER 2 HG SER 2 0.246 9.024 -14.481 40 H GLU 3 H GLU 3 4.154 10.553 -10.591 41 HA GLU 3 HA GLU 3 6.119 9.450 -12.491 42 HB3 GLU 3 2HB GLU 3 7.773 11.023 -11.620 43 HG3 GLU 3 2HG GLU 3 6.815 13.177 -12.360 44 HA PRO 4 HA PRO 4 7.337 6.613 -9.371 45 HB3 PRO 4 2HB PRO 4 8.700 5.651 -10.951 46 HG3 PRO 4 2HG PRO 4 9.823 6.950 -12.518 47 HD3 PRO 4 2HD PRO 4 7.692 7.799 -12.753 48 H LEU 5 H LEU 5 9.617 6.316 -7.986 49 HA LEU 5 HA LEU 5 10.016 8.887 -6.604 50 HB3 LEU 5 2HB LEU 5 8.681 7.707 -5.116 51 HG LEU 5 HG LEU 5 9.203 5.363 -4.336 52 HD11 LEU 5 1HD1 LEU 5 8.399 4.795 -7.020 53 HD12 LEU 5 2HD1 LEU 5 7.662 6.307 -6.489 54 HD13 LEU 5 3HD1 LEU 5 7.427 4.834 -5.550 55 HD21 LEU 5 3HD2 LEU 5 10.517 3.929 -5.641 56 HD22 LEU 5 1HD2 LEU 5 11.480 5.399 -5.492 57 HD23 LEU 5 2HD2 LEU 5 10.593 5.072 -6.982 58 H GLY 6 H GLY 6 11.455 6.516 -8.379 59 HA2 GLY 6 2HA GLY 6 14.086 7.453 -7.779 60 HA3 GLY 6 3HA GLY 6 13.819 5.841 -7.133 61 H LEU 7 H LEU 7 12.244 6.876 -10.058 62 HA LEU 7 HA LEU 7 14.079 5.169 -11.608 63 HB3 LEU 7 2HB LEU 7 12.105 4.638 -13.043 64 HG LEU 7 HG LEU 7 11.651 3.809 -10.178 65 HD11 LEU 7 1HD1 LEU 7 10.910 1.747 -11.819 66 HD12 LEU 7 2HD1 LEU 7 10.361 3.164 -12.714 67 HD13 LEU 7 3HD1 LEU 7 9.812 2.900 -11.059 68 HD21 LEU 7 3HD2 LEU 7 12.874 1.715 -11.102 69 HD22 LEU 7 1HD2 LEU 7 13.819 3.108 -10.578 70 HD23 LEU 7 2HD2 LEU 7 13.527 2.837 -12.296 71 H LYS 8 H LYS 8 13.760 8.181 -11.110 72 HA LYS 8 HA LYS 8 13.935 8.934 -13.945 73 HB3 LYS 8 2HB LYS 8 12.910 11.192 -13.105 74 HG3 LYS 8 2HG LYS 8 10.542 10.195 -13.323 75 HD3 LYS 8 2HD LYS 8 12.603 10.744 -15.220 76 HE3 LYS 8 2HE LYS 8 10.676 8.576 -16.050 77 HZ1 LYS 8 3HZ LYS 8 12.311 8.763 -18.071 78 HZ2 LYS 8 1HZ LYS 8 12.455 10.363 -17.538 79 HZ3 LYS 8 2HZ LYS 8 10.940 9.748 -17.967 80 H ASN 9 H ASN 9 14.206 10.703 -10.867 81 HA ASN 9 HA ASN 9 16.998 11.321 -11.573 82 HB3 ASN 9 2HB ASN 9 16.195 13.411 -9.961 83 HD21 ASN 9 1HD2 ASN 9 17.600 14.767 -10.788 84 HD22 ASN 9 2HD2 ASN 9 17.800 15.132 -12.466 85 H ASN 10 H ASN 10 14.659 10.774 -8.997 86 HA ASN 10 HA ASN 10 16.288 11.068 -6.774 87 HB3 ASN 10 2HB ASN 10 14.730 9.174 -5.831 88 HD21 ASN 10 1HD2 ASN 10 14.130 12.098 -7.725 89 HD22 ASN 10 2HD2 ASN 10 13.256 12.931 -6.488 90 H THR 11 H THR 11 15.700 8.132 -8.696 91 HA THR 11 HA THR 11 16.801 6.136 -8.803 92 HB THR 11 HB THR 11 19.129 6.236 -9.205 93 HG1 THR 11 1HG THR 11 19.263 8.786 -7.955 94 HG21 THR 11 3HG2 THR 11 18.787 9.014 -10.004 95 HG22 THR 11 1HG2 THR 11 17.396 8.014 -10.420 96 HG23 THR 11 2HG2 THR 11 19.004 7.574 -10.997 97 H ILE 12 H ILE 12 15.716 6.588 -6.292 98 HA ILE 12 HA ILE 12 17.621 6.155 -4.211 99 HB ILE 12 HB ILE 12 14.630 5.735 -4.225 100 HG13 ILE 12 2HG1 ILE 12 15.778 8.087 -4.564 101 HG21 ILE 12 1HG2 ILE 12 16.495 5.923 -1.864 102 HG22 ILE 12 2HG2 ILE 12 14.751 5.661 -1.822 103 HG23 ILE 12 3HG2 ILE 12 15.813 4.421 -2.490 104 HD11 ILE 12 3HD1 ILE 12 13.315 7.323 -3.579 105 HD12 ILE 12 1HD1 ILE 12 13.918 8.472 -2.385 106 HD13 ILE 12 2HD1 ILE 12 13.793 8.945 -4.080 107 HA PRO 13 HA PRO 13 18.228 1.811 -4.770 108 HB3 PRO 13 2HB PRO 13 20.232 2.118 -3.689 109 HG3 PRO 13 2HG PRO 13 20.460 3.718 -2.017 110 HD3 PRO 13 2HD PRO 13 19.480 5.001 -3.662 111 H ASP 14 H ASP 14 18.136 -0.101 -2.868 112 HA ASP 14 HA ASP 14 15.297 -0.282 -2.327 113 HB3 ASP 14 2HB ASP 14 16.238 -2.267 -3.213 114 H SER 15 H SER 15 16.191 1.720 -0.804 115 HA SER 15 HA SER 15 16.271 0.557 1.903 116 HB3 SER 15 2HB SER 15 17.457 3.253 1.332 117 HG SER 15 HG SER 15 18.799 1.697 3.041 118 H GLN 16 H GLN 16 14.231 1.861 -0.109 119 HA GLN 16 HA GLN 16 13.164 3.958 1.619 120 HB3 GLN 16 2HB GLN 16 13.183 4.523 -0.702 121 HG3 GLN 16 2HG GLN 16 11.648 1.981 -1.193 122 HE21 GLN 16 1HE2 GLN 16 9.911 2.887 -2.245 123 HE22 GLN 16 2HE2 GLN 16 10.054 3.708 -3.759 124 H MET 17 H MET 17 12.331 0.763 0.376 125 HA MET 17 HA MET 17 9.863 0.753 1.939 126 HB3 MET 17 2HB MET 17 9.896 -1.686 0.803 127 HG3 MET 17 2HG MET 17 9.035 0.933 -0.338 128 HE1 MET 17 3HE MET 17 9.742 0.983 -3.168 129 HE2 MET 17 1HE MET 17 8.144 0.595 -3.808 130 HE3 MET 17 2HE MET 17 8.295 1.528 -2.319 131 H SER 18 H SER 18 9.367 -1.208 3.234 132 HA SER 18 HA SER 18 11.376 -2.962 4.141 133 HB3 SER 18 2HB SER 18 11.268 -1.846 6.571 134 HG SER 18 HG SER 18 13.152 -2.274 5.196 135 H ALA 19 H ALA 19 10.204 -4.685 4.618 136 HA ALA 19 HA ALA 19 7.601 -4.302 5.948 137 HB1 ALA 19 1HB ALA 19 8.162 -5.601 3.560 138 HB2 ALA 19 2HB ALA 19 7.939 -6.902 4.729 139 HB3 ALA 19 3HB ALA 19 6.669 -5.702 4.493 140 H SER 20 H SER 20 6.946 -6.507 7.063 141 HA SER 20 HA SER 20 8.450 -6.789 9.352 142 HB3 SER 20 2HB SER 20 7.195 -9.299 8.868 143 HG SER 20 HG SER 20 6.733 -7.020 10.422 144 H SER 21 H SER 21 8.218 -9.372 6.907 145 HA SER 21 HA SER 21 11.075 -9.727 6.850 146 HB3 SER 21 2HB SER 21 9.313 -11.834 8.120 147 HG SER 21 HG SER 21 11.950 -12.349 8.191 148 H SER 22 H SER 22 11.734 -11.418 5.331 149 HA SER 22 HA SER 22 9.726 -11.733 3.210 150 HB3 SER 22 2HB SER 22 11.431 -10.799 2.042 151 HG SER 22 HG SER 22 13.424 -11.916 3.700 152 H TYR 23 H TYR 23 9.940 -13.745 1.876 153 HA TYR 23 HA TYR 23 9.414 -16.010 3.351 154 HB3 TYR 23 2HB TYR 23 10.530 -15.836 0.543 155 HD1 TYR 23 2HD TYR 23 8.478 -17.972 2.828 156 HD2 TYR 23 1HD TYR 23 11.039 -17.792 -0.566 157 HE1 TYR 23 2HE TYR 23 8.408 -20.425 2.652 158 HE2 TYR 23 1HE TYR 23 10.976 -20.244 -0.751 159 HH TYR 23 HH TYR 23 9.875 -22.244 1.688 160 H LYS 24 H LYS 24 10.567 -17.779 4.040 161 HA LYS 24 HA LYS 24 13.346 -17.331 4.613 162 HB3 LYS 24 2HB LYS 24 11.963 -19.947 5.092 163 HG3 LYS 24 2HG LYS 24 14.375 -18.813 5.963 164 HD3 LYS 24 2HD LYS 24 12.950 -17.622 7.658 165 HE3 LYS 24 2HE LYS 24 12.502 -20.432 8.660 166 HZ1 LYS 24 3HZ LYS 24 10.922 -18.829 10.099 167 HZ2 LYS 24 1HZ LYS 24 12.271 -17.827 9.901 168 HZ3 LYS 24 2HZ LYS 24 12.447 -19.353 10.610 169 H THR 25 H THR 25 15.094 -18.662 3.990 170 HA THR 25 HA THR 25 14.697 -20.620 1.889 171 HB THR 25 HB THR 25 16.774 -19.049 0.846 172 HG1 THR 25 1HG THR 25 15.732 -17.357 2.203 173 HG21 THR 25 3HG2 THR 25 15.570 -19.206 -1.086 174 HG22 THR 25 1HG2 THR 25 14.044 -18.806 -0.296 175 HG23 THR 25 2HG2 THR 25 14.718 -20.428 -0.141 176 H TRP 26 H TRP 26 16.623 -21.843 1.409 177 HA TRP 26 HA TRP 26 18.134 -22.486 3.682 178 HB3 TRP 26 2HB TRP 26 19.608 -23.384 1.477 179 HD1 TRP 26 HD TRP 26 20.138 -25.827 2.052 180 HE1 TRP 26 1HE TRP 26 19.045 -27.649 3.504 181 HE3 TRP 26 3HE TRP 26 15.831 -23.382 3.321 182 HZ2 TRP 26 2HZ TRP 26 16.671 -28.005 4.990 183 HZ3 TRP 26 3HZ TRP 26 14.201 -24.533 4.760 184 HH2 TRP 26 HH TRP 26 14.614 -26.796 5.576 185 H ASN 27 H ASN 27 20.159 -21.950 4.368 186 HA ASN 27 HA ASN 27 21.977 -20.620 4.698 187 HB3 ASN 27 2HB ASN 27 23.078 -19.959 2.348 188 HD21 ASN 27 1HD2 ASN 27 23.227 -22.924 1.421 189 HD22 ASN 27 2HD2 ASN 27 24.346 -23.611 2.546 190 H LEU 28 H LEU 28 20.873 -18.853 5.581 191 HA LEU 28 HA LEU 28 19.518 -16.853 4.247 192 HB3 LEU 28 2HB LEU 28 19.402 -16.869 6.588 193 HG LEU 28 HG LEU 28 22.118 -17.523 6.657 194 HD11 LEU 28 1HD1 LEU 28 23.181 -15.897 7.997 195 HD12 LEU 28 2HD1 LEU 28 21.687 -14.982 8.205 196 HD13 LEU 28 3HD1 LEU 28 22.482 -15.025 6.632 197 HD21 LEU 28 3HD2 LEU 28 20.370 -18.401 8.113 198 HD22 LEU 28 1HD2 LEU 28 20.221 -16.828 8.899 199 HD23 LEU 28 2HD2 LEU 28 21.713 -17.756 9.059 200 H ARG 29 H ARG 29 22.989 -17.027 4.981 201 HA ARG 29 HA ARG 29 24.792 -15.979 4.074 202 HB3 ARG 29 2HB ARG 29 22.957 -15.311 1.769 203 HG3 ARG 29 2HG ARG 29 25.677 -14.739 2.174 204 HD3 ARG 29 2HD ARG 29 26.448 -15.947 0.003 205 HE ARG 29 HE ARG 29 26.493 -17.866 2.145 206 HH11 ARG 29 1HH1 ARG 29 27.769 -14.849 0.967 207 HH12 ARG 29 2HH1 ARG 29 29.226 -14.952 1.899 208 HH21 ARG 29 1HH2 ARG 29 28.406 -18.012 3.377 209 HH22 ARG 29 2HH2 ARG 29 29.587 -16.751 3.270 210 H ALA 30 H ALA 30 25.220 -14.281 5.369 211 HA ALA 30 HA ALA 30 25.393 -12.122 6.071 212 HB1 ALA 30 1HB ALA 30 25.529 -11.913 3.443 213 HB2 ALA 30 2HB ALA 30 23.993 -11.074 3.668 214 HB3 ALA 30 3HB ALA 30 25.444 -10.487 4.479 215 H PHE 31 H PHE 31 23.814 -9.929 5.955 216 HA PHE 31 HA PHE 31 21.829 -10.400 7.813 217 HB3 PHE 31 2HB PHE 31 21.232 -8.154 6.023 218 HD1 PHE 31 2HD PHE 31 19.665 -9.111 8.225 219 HD2 PHE 31 1HD PHE 31 23.097 -6.593 8.269 220 HE1 PHE 31 2HE PHE 31 18.917 -8.135 10.355 221 HE2 PHE 31 1HE PHE 31 22.354 -5.613 10.401 222 HZ PHE 31 HZ PHE 31 20.261 -6.383 11.446 223 H GLY 32 H GLY 32 21.530 -10.170 4.286 224 HA2 GLY 32 2HA GLY 32 19.845 -11.945 3.502 225 HA3 GLY 32 3HA GLY 32 18.728 -11.048 4.522 226 H TRP 33 H TRP 33 17.726 -11.128 2.216 227 HA TRP 33 HA TRP 33 18.763 -9.219 0.337 228 HB3 TRP 33 2HB TRP 33 16.038 -9.775 -0.226 229 HD1 TRP 33 HD TRP 33 17.691 -8.506 -2.233 230 HE1 TRP 33 1HE TRP 33 18.720 -9.663 -4.290 231 HE3 TRP 33 3HE TRP 33 17.546 -13.349 -0.600 232 HZ2 TRP 33 2HZ TRP 33 19.382 -12.281 -5.111 233 HZ3 TRP 33 3HZ TRP 33 18.396 -15.119 -2.082 234 HH2 TRP 33 HH TRP 33 19.294 -14.595 -4.291 235 H TYR 34 H TYR 34 17.176 -7.507 -0.532 236 HA TYR 34 HA TYR 34 15.913 -6.124 1.744 237 HB3 TYR 34 2HB TYR 34 16.558 -4.028 0.244 238 HD1 TYR 34 2HD TYR 34 16.317 -4.432 3.035 239 HD2 TYR 34 1HD TYR 34 19.839 -4.627 0.657 240 HE1 TYR 34 2HE TYR 34 17.675 -3.888 5.013 241 HE2 TYR 34 1HE TYR 34 21.208 -4.085 2.628 242 HH TYR 34 HH TYR 34 21.198 -3.516 4.776 243 HA PRO 35 HA PRO 35 12.243 -5.696 -0.620 244 HB3 PRO 35 2HB PRO 35 11.338 -4.566 1.165 245 HG3 PRO 35 2HG PRO 35 12.615 -3.080 2.416 246 HD3 PRO 35 2HD PRO 35 14.024 -4.904 2.409 247 H HIS 36 H HIS 36 11.044 -3.702 -1.898 248 HA HIS 36 HA HIS 36 11.003 -2.456 -3.801 249 HB3 HIS 36 2HB HIS 36 13.927 -1.861 -3.595 250 HD1 HIS 36 1HD HIS 36 14.383 0.608 -4.349 251 HD2 HIS 36 2HD HIS 36 10.465 -0.679 -4.852 252 HE1 HIS 36 1HE HIS 36 13.311 2.297 -5.875 253 H LEU 37 H LEU 37 11.510 -5.243 -3.968 254 HA LEU 37 HA LEU 37 13.604 -5.801 -5.811 255 HB3 LEU 37 2HB LEU 37 12.332 -7.953 -6.145 256 HG LEU 37 HG LEU 37 12.810 -8.953 -4.068 257 HD11 LEU 37 1HD1 LEU 37 14.716 -6.641 -4.075 258 HD12 LEU 37 2HD1 LEU 37 14.718 -7.841 -5.367 259 HD13 LEU 37 3HD1 LEU 37 15.029 -8.336 -3.703 260 HD21 LEU 37 3HD2 LEU 37 12.861 -6.245 -2.754 261 HD22 LEU 37 1HD2 LEU 37 12.943 -7.830 -1.983 262 HD23 LEU 37 2HD2 LEU 37 11.446 -7.299 -2.750 263 H GLY 38 H GLY 38 10.180 -5.033 -6.133 264 HA2 GLY 38 2HA GLY 38 10.231 -5.447 -9.007 265 HA3 GLY 38 3HA GLY 38 8.855 -4.917 -8.052 266 H ARG 39 H ARG 39 11.774 -3.234 -7.479 267 HA ARG 39 HA ARG 39 10.851 -0.720 -7.953 268 HB3 ARG 39 2HB ARG 39 12.940 -0.879 -6.898 269 HG3 ARG 39 2HG ARG 39 14.076 -2.245 -9.327 270 HD3 ARG 39 2HD ARG 39 15.617 -2.549 -6.958 271 HE ARG 39 HE ARG 39 16.939 -2.520 -8.841 272 HH11 ARG 39 1HH1 ARG 39 15.135 0.449 -8.619 273 HH12 ARG 39 2HH1 ARG 39 16.024 1.237 -9.881 274 HH21 ARG 39 1HH2 ARG 39 18.117 -1.495 -10.505 275 HH22 ARG 39 2HH2 ARG 39 17.718 0.129 -10.954 276 H LEU 40 H LEU 40 12.277 -2.922 -10.318 277 HA LEU 40 HA LEU 40 10.894 -1.666 -12.472 278 HB3 LEU 40 2HB LEU 40 13.889 -1.354 -12.331 279 HG LEU 40 HG LEU 40 12.364 -1.539 -14.679 280 HD11 LEU 40 1HD1 LEU 40 11.497 0.689 -14.297 281 HD12 LEU 40 2HD1 LEU 40 12.633 0.703 -15.645 282 HD13 LEU 40 3HD1 LEU 40 13.132 1.312 -14.066 283 HD21 LEU 40 3HD2 LEU 40 14.648 -2.111 -14.661 284 HD22 LEU 40 1HD2 LEU 40 15.122 -0.532 -14.036 285 HD23 LEU 40 2HD2 LEU 40 14.529 -0.683 -15.690 286 H ASP 41 H ASP 41 10.344 -4.034 -12.179 287 HA ASP 41 HA ASP 41 10.574 -6.258 -12.715 288 HB3 ASP 41 2HB ASP 41 11.620 -5.081 -15.295 289 H ASN 42 H ASN 42 12.638 -5.784 -11.137 290 HA ASN 42 HA ASN 42 15.227 -5.911 -11.989 291 HB3 ASN 42 2HB ASN 42 15.312 -7.651 -9.884 292 HD21 ASN 42 1HD2 ASN 42 14.394 -4.321 -10.605 293 HD22 ASN 42 2HD2 ASN 42 15.576 -3.586 -9.581 294 H GLN 43 H GLN 43 16.701 -7.547 -12.506 295 HA GLN 43 HA GLN 43 15.774 -9.557 -14.218 296 HB3 GLN 43 2HB GLN 43 18.062 -8.551 -14.246 297 HG3 GLN 43 2HG GLN 43 18.991 -10.578 -12.299 298 HE21 GLN 43 1HE2 GLN 43 20.438 -9.950 -14.367 299 HE22 GLN 43 2HE2 GLN 43 21.659 -8.785 -13.997 300 H GLY 44 H GLY 44 17.037 -11.893 -13.675 301 HA2 GLY 44 2HA GLY 44 17.019 -13.799 -12.363 302 HA3 GLY 44 3HA GLY 44 16.477 -12.819 -11.009 303 H LYS 45 H LYS 45 14.275 -12.536 -10.641 304 HA LYS 45 HA LYS 45 12.193 -13.276 -12.325 305 HB3 LYS 45 2HB LYS 45 13.177 -15.545 -12.129 306 HG3 LYS 45 2HG LYS 45 12.651 -16.742 -9.936 307 HD3 LYS 45 2HD LYS 45 14.819 -16.171 -8.969 308 HE3 LYS 45 2HE LYS 45 15.694 -15.901 -11.698 309 HZ1 LYS 45 3HZ LYS 45 16.352 -17.374 -9.524 310 HZ2 LYS 45 1HZ LYS 45 16.973 -17.600 -11.081 311 HZ3 LYS 45 2HZ LYS 45 15.666 -18.532 -10.549 312 H ILE 46 H ILE 46 13.483 -12.689 -9.199 313 HA ILE 46 HA ILE 46 11.192 -12.760 -7.607 314 HB ILE 46 HB ILE 46 13.330 -10.680 -7.244 315 HG13 ILE 46 2HG1 ILE 46 14.534 -12.508 -5.926 316 HG21 ILE 46 1HG2 ILE 46 12.741 -11.916 -4.836 317 HG22 ILE 46 2HG2 ILE 46 12.143 -10.352 -5.389 318 HG23 ILE 46 3HG2 ILE 46 11.185 -11.808 -5.658 319 HD11 ILE 46 3HD1 ILE 46 13.861 -14.614 -5.937 320 HD12 ILE 46 1HD1 ILE 46 12.358 -14.067 -6.680 321 HD13 ILE 46 2HD1 ILE 46 13.696 -14.612 -7.692 322 H ASN 47 H ASN 47 12.707 -9.739 -8.734 323 HA ASN 47 HA ASN 47 11.770 -7.660 -9.016 324 HB3 ASN 47 2HB ASN 47 11.529 -8.569 -11.235 325 HD21 ASN 47 1HD2 ASN 47 8.215 -8.891 -10.079 326 HD22 ASN 47 2HD2 ASN 47 7.957 -10.477 -10.716 327 H ALA 48 H ALA 48 10.789 -8.957 -6.675 328 HA ALA 48 HA ALA 48 8.680 -7.287 -5.970 329 HB1 ALA 48 1HB ALA 48 7.746 -9.347 -7.575 330 HB2 ALA 48 2HB ALA 48 7.344 -9.852 -5.934 331 HB3 ALA 48 3HB ALA 48 6.781 -8.294 -6.540 332 H TRP 49 H TRP 49 8.184 -7.424 -3.789 333 HA TRP 49 HA TRP 49 10.002 -9.051 -2.229 334 HB3 TRP 49 2HB TRP 49 8.029 -6.887 -1.491 335 HD1 TRP 49 HD TRP 49 6.906 -7.992 0.645 336 HE1 TRP 49 1HE TRP 49 7.810 -8.569 2.984 337 HE3 TRP 49 3HE TRP 49 11.914 -7.600 -0.304 338 HZ2 TRP 49 2HZ TRP 49 10.316 -8.825 4.259 339 HZ3 TRP 49 3HZ TRP 49 13.498 -8.027 1.531 340 HH2 TRP 49 HH TRP 49 12.714 -8.626 3.764 341 H THR 50 H THR 50 9.472 -10.717 -0.898 342 HA THR 50 HA THR 50 6.687 -11.667 -1.044 343 HB THR 50 HB THR 50 8.816 -13.543 -0.183 344 HG1 THR 50 1HG THR 50 9.977 -13.057 -1.898 345 HG21 THR 50 3HG2 THR 50 6.586 -14.377 -0.363 346 HG22 THR 50 1HG2 THR 50 7.499 -15.040 -1.718 347 HG23 THR 50 2HG2 THR 50 6.394 -13.690 -1.976 348 H ALA 51 H ALA 51 5.983 -12.989 0.858 349 HA ALA 51 HA ALA 51 6.669 -11.555 3.303 350 HB1 ALA 51 1HB ALA 51 4.469 -13.551 2.779 351 HB2 ALA 51 2HB ALA 51 4.673 -12.589 4.244 352 HB3 ALA 51 3HB ALA 51 4.307 -11.796 2.711 353 H GLN 52 H GLN 52 6.885 -12.787 5.339 354 HA GLN 52 HA GLN 52 8.672 -15.054 4.926 355 HB3 GLN 52 2HB GLN 52 8.092 -13.263 7.275 356 HG3 GLN 52 2HG GLN 52 8.416 -15.243 8.435 357 HE21 GLN 52 1HE2 GLN 52 8.529 -17.351 8.224 358 HE22 GLN 52 2HE2 GLN 52 9.551 -18.218 7.135 359 H SER 53 H SER 53 5.960 -14.261 7.107 360 HA SER 53 HA SER 53 5.542 -17.065 7.689 361 HB3 SER 53 2HB SER 53 4.400 -16.345 9.506 362 HG SER 53 HG SER 53 5.195 -14.477 10.228 363 H ASN 54 H ASN 54 4.855 -15.331 5.075 364 HA ASN 54 HA ASN 54 3.199 -15.273 3.488 365 HB3 ASN 54 2HB ASN 54 4.228 -17.512 3.206 366 HD21 ASN 54 1HD2 ASN 54 4.849 -18.653 5.020 367 HD22 ASN 54 2HD2 ASN 54 3.810 -19.790 5.803 368 H SER 55 H SER 55 2.237 -14.415 5.989 369 HA SER 55 HA SER 55 -0.561 -15.312 5.812 370 HB3 SER 55 2HB SER 55 0.755 -14.503 8.407 371 HG SER 55 HG SER 55 -1.250 -16.223 8.652 372 H ALA 56 H ALA 56 -1.750 -13.585 7.521 373 HA ALA 56 HA ALA 56 -1.537 -11.084 6.070 374 HB1 ALA 56 1HB ALA 56 -3.677 -12.425 6.977 375 HB2 ALA 56 2HB ALA 56 -3.432 -11.309 8.322 376 HB3 ALA 56 3HB ALA 56 -3.673 -10.684 6.691 377 H LYS 57 H LYS 57 -0.101 -12.376 8.772 378 HA LYS 57 HA LYS 57 -0.109 -10.102 10.500 379 HB3 LYS 57 2HB LYS 57 1.814 -11.323 11.607 380 HG3 LYS 57 2HG LYS 57 -0.895 -12.450 11.241 381 HD3 LYS 57 2HD LYS 57 1.346 -13.957 12.591 382 HE3 LYS 57 2HE LYS 57 -1.636 -14.295 12.597 383 HZ1 LYS 57 3HZ LYS 57 0.204 -16.364 12.266 384 HZ2 LYS 57 1HZ LYS 57 -1.453 -16.486 12.584 385 HZ3 LYS 57 2HZ LYS 57 -0.348 -16.442 13.863 386 H GLU 58 H GLU 58 1.382 -10.686 7.570 387 HA GLU 58 HA GLU 58 3.841 -9.269 8.103 388 HB3 GLU 58 2HB GLU 58 3.130 -9.514 5.295 389 HG3 GLU 58 2HG GLU 58 5.164 -11.330 6.000 390 H TRP 59 H TRP 59 4.424 -7.248 7.220 391 HA TRP 59 HA TRP 59 2.368 -5.607 5.995 392 HB3 TRP 59 2HB TRP 59 1.780 -5.142 8.235 393 HD1 TRP 59 HD TRP 59 5.538 -4.166 8.481 394 HE1 TRP 59 1HE TRP 59 6.404 -4.952 10.774 395 HE3 TRP 59 3HE TRP 59 1.289 -6.411 10.226 396 HZ2 TRP 59 2HZ TRP 59 5.416 -6.340 13.024 397 HZ3 TRP 59 3HZ TRP 59 1.334 -7.445 12.459 398 HH2 TRP 59 HH TRP 59 3.356 -7.410 13.826 399 H LEU 60 H LEU 60 3.188 -3.938 4.789 400 HA LEU 60 HA LEU 60 6.125 -3.696 4.748 401 HB3 LEU 60 2HB LEU 60 4.097 -3.666 2.539 402 HG LEU 60 HG LEU 60 5.602 -1.745 2.102 403 HD11 LEU 60 1HD1 LEU 60 7.549 -2.884 3.320 404 HD12 LEU 60 2HD1 LEU 60 7.908 -1.968 1.855 405 HD13 LEU 60 3HD1 LEU 60 7.827 -3.728 1.796 406 HD21 LEU 60 3HD2 LEU 60 4.874 -3.834 0.410 407 HD22 LEU 60 1HD2 LEU 60 6.568 -3.512 0.038 408 HD23 LEU 60 2HD2 LEU 60 5.381 -2.210 -0.060 409 H GLN 61 H GLN 61 6.968 -1.744 5.100 410 HA GLN 61 HA GLN 61 5.181 0.591 4.935 411 HB3 GLN 61 2HB GLN 61 5.948 -0.240 7.269 412 HG3 GLN 61 2HG GLN 61 8.275 1.520 7.032 413 HE21 GLN 61 1HE2 GLN 61 7.737 -1.931 7.628 414 HE22 GLN 61 2HE2 GLN 61 8.205 -1.893 9.290 415 H VAL 62 H VAL 62 6.029 2.508 4.135 416 HA VAL 62 HA VAL 62 8.734 2.342 2.979 417 HB VAL 62 HB VAL 62 6.430 3.731 1.622 418 HG11 VAL 62 1HG1 VAL 62 8.110 3.226 -0.343 419 HG12 VAL 62 2HG1 VAL 62 8.320 4.635 0.699 420 HG13 VAL 62 3HG1 VAL 62 9.282 3.183 0.974 421 HG21 VAL 62 3HG2 VAL 62 7.207 0.882 1.612 422 HG22 VAL 62 1HG2 VAL 62 5.644 1.636 1.299 423 HG23 VAL 62 2HG2 VAL 62 6.878 1.607 0.038 424 H ASP 63 H ASP 63 10.011 3.888 3.729 425 HA ASP 63 HA ASP 63 8.786 6.365 4.742 426 HB3 ASP 63 2HB ASP 63 10.075 4.996 6.378 427 H LEU 64 H LEU 64 9.124 8.194 3.670 428 HA LEU 64 HA LEU 64 11.208 8.235 1.600 429 HB3 LEU 64 2HB LEU 64 9.797 10.400 1.006 430 HG LEU 64 HG LEU 64 9.989 8.459 -0.520 431 HD11 LEU 64 1HD1 LEU 64 7.586 7.423 0.976 432 HD12 LEU 64 2HD1 LEU 64 9.210 6.737 1.042 433 HD13 LEU 64 3HD1 LEU 64 8.304 6.715 -0.471 434 HD21 LEU 64 3HD2 LEU 64 7.135 8.979 -0.735 435 HD22 LEU 64 1HD2 LEU 64 8.449 9.392 -1.837 436 HD23 LEU 64 2HD2 LEU 64 8.081 10.444 -0.469 437 H GLY 65 H GLY 65 9.702 10.413 3.996 438 HA2 GLY 65 2HA GLY 65 10.634 12.033 5.334 439 HA3 GLY 65 3HA GLY 65 12.202 11.313 4.995 440 H THR 66 H THR 66 10.612 12.077 2.143 441 HA THR 66 HA THR 66 12.204 14.538 1.882 442 HB THR 66 HB THR 66 12.747 12.675 0.311 443 HG1 THR 66 1HG THR 66 13.038 14.087 -1.332 444 HG21 THR 66 3HG2 THR 66 11.163 11.589 -0.820 445 HG22 THR 66 1HG2 THR 66 10.558 13.097 -1.502 446 HG23 THR 66 2HG2 THR 66 9.953 12.528 0.053 447 H GLN 67 H GLN 67 9.125 13.610 2.479 448 HA GLN 67 HA GLN 67 7.055 14.529 2.211 449 HB3 GLN 67 2HB GLN 67 8.356 17.185 1.747 450 HG3 GLN 67 2HG GLN 67 5.967 16.188 3.228 451 HE21 GLN 67 1HE2 GLN 67 6.970 19.491 2.705 452 HE22 GLN 67 2HE2 GLN 67 6.996 19.954 4.370 453 H ARG 68 H ARG 68 6.789 13.426 0.162 454 HA ARG 68 HA ARG 68 6.876 15.253 -2.148 455 HB3 ARG 68 2HB ARG 68 6.555 12.797 -3.268 456 HG3 ARG 68 2HG ARG 68 9.013 12.747 -3.632 457 HD3 ARG 68 2HD ARG 68 7.448 15.271 -4.058 458 HE ARG 68 HE ARG 68 9.796 15.088 -5.660 459 HH11 ARG 68 1HH1 ARG 68 8.604 16.155 -2.568 460 HH12 ARG 68 2HH1 ARG 68 9.829 17.363 -2.366 461 HH21 ARG 68 1HH2 ARG 68 11.415 16.674 -5.405 462 HH22 ARG 68 2HH2 ARG 68 11.428 17.658 -3.981 463 H GLN 69 H GLN 69 5.107 15.248 -3.603 464 HA GLN 69 HA GLN 69 2.573 14.679 -2.292 465 HB3 GLN 69 2HB GLN 69 3.354 16.257 -4.730 466 HG3 GLN 69 2HG GLN 69 0.632 15.332 -3.940 467 HE21 GLN 69 1HE2 GLN 69 0.440 16.980 -6.712 468 HE22 GLN 69 2HE2 GLN 69 -0.163 18.494 -6.139 469 H VAL 70 H VAL 70 1.574 12.813 -2.608 470 HA VAL 70 HA VAL 70 2.236 11.178 -4.928 471 HB VAL 70 HB VAL 70 1.130 9.369 -3.828 472 HG11 VAL 70 1HG1 VAL 70 2.630 10.962 -1.751 473 HG12 VAL 70 2HG1 VAL 70 2.373 9.216 -1.750 474 HG13 VAL 70 3HG1 VAL 70 3.369 9.962 -3.000 475 HG21 VAL 70 3HG2 VAL 70 -0.304 11.509 -2.493 476 HG22 VAL 70 1HG2 VAL 70 -0.757 9.821 -2.731 477 HG23 VAL 70 2HG2 VAL 70 0.257 10.277 -1.362 478 H THR 71 H THR 71 0.633 10.262 -6.297 479 HA THR 71 HA THR 71 -2.028 11.464 -6.234 480 HB THR 71 HB THR 71 -0.584 11.467 -8.859 481 HG1 THR 71 1HG THR 71 0.676 12.694 -7.304 482 HG21 THR 71 3HG2 THR 71 -2.544 12.289 -9.521 483 HG22 THR 71 1HG2 THR 71 -2.284 13.692 -8.486 484 HG23 THR 71 2HG2 THR 71 -3.140 12.281 -7.862 485 H GLY 72 H GLY 72 -0.659 8.755 -5.974 486 HA2 GLY 72 2HA GLY 72 -2.556 7.033 -6.724 487 HA3 GLY 72 3HA GLY 72 -1.730 7.296 -8.252 488 H ILE 73 H ILE 73 -1.799 4.781 -7.350 489 HA ILE 73 HA ILE 73 1.006 4.269 -6.759 490 HB ILE 73 HB ILE 73 0.676 2.862 -4.913 491 HG13 ILE 73 2HG1 ILE 73 -1.563 2.216 -4.075 492 HG21 ILE 73 1HG2 ILE 73 -0.523 4.260 -3.263 493 HG22 ILE 73 2HG2 ILE 73 0.580 5.186 -4.281 494 HG23 ILE 73 3HG2 ILE 73 -1.155 5.234 -4.590 495 HD11 ILE 73 3HD1 ILE 73 -2.871 2.960 -6.612 496 HD12 ILE 73 1HD1 ILE 73 -3.539 2.803 -4.987 497 HD13 ILE 73 2HD1 ILE 73 -2.629 4.248 -5.431 498 H ILE 74 H ILE 74 1.677 2.111 -7.271 499 HA ILE 74 HA ILE 74 -0.247 0.487 -8.766 500 HB ILE 74 HB ILE 74 0.745 1.724 -10.531 501 HG13 ILE 74 2HG1 ILE 74 1.424 -0.014 -11.867 502 HG21 ILE 74 1HG2 ILE 74 2.604 2.778 -9.624 503 HG22 ILE 74 2HG2 ILE 74 3.303 1.266 -9.045 504 HG23 ILE 74 3HG2 ILE 74 3.315 1.641 -10.769 505 HD11 ILE 74 3HD1 ILE 74 2.765 -1.989 -10.746 506 HD12 ILE 74 1HD1 ILE 74 3.574 -0.564 -11.397 507 HD13 ILE 74 2HD1 ILE 74 3.279 -0.697 -9.662 508 H THR 75 H THR 75 0.123 -1.691 -8.691 509 HA THR 75 HA THR 75 2.541 -2.596 -7.276 510 HB THR 75 HB THR 75 0.645 -2.632 -5.711 511 HG1 THR 75 1HG THR 75 1.998 -4.254 -5.223 512 HG21 THR 75 3HG2 THR 75 -1.158 -4.352 -6.145 513 HG22 THR 75 1HG2 THR 75 -0.604 -4.385 -7.819 514 HG23 THR 75 2HG2 THR 75 -1.240 -2.892 -7.131 515 H GLN 76 H GLN 76 3.082 -4.865 -7.646 516 HA GLN 76 HA GLN 76 1.848 -6.151 -9.940 517 HB3 GLN 76 2HB GLN 76 4.763 -6.109 -10.208 518 HG3 GLN 76 2HG GLN 76 2.899 -5.093 -12.286 519 HE21 GLN 76 1HE2 GLN 76 5.346 -7.550 -11.517 520 HE22 GLN 76 2HE2 GLN 76 6.327 -7.251 -12.908 521 H GLY 77 H GLY 77 1.920 -8.329 -9.812 522 HA2 GLY 77 2HA GLY 77 3.063 -9.483 -7.415 523 HA3 GLY 77 3HA GLY 77 2.063 -10.310 -8.601 524 H ALA 78 H ALA 78 4.064 -11.758 -7.714 525 HA ALA 78 HA ALA 78 5.913 -11.821 -9.985 526 HB1 ALA 78 1HB ALA 78 7.563 -12.613 -7.968 527 HB2 ALA 78 2HB ALA 78 7.532 -10.996 -8.672 528 HB3 ALA 78 3HB ALA 78 6.637 -11.330 -7.190 529 H ARG 79 H ARG 79 7.080 -13.921 -10.129 530 HA ARG 79 HA ARG 79 5.339 -16.100 -9.190 531 HB3 ARG 79 2HB ARG 79 5.540 -15.719 -11.674 532 HG3 ARG 79 2HG ARG 79 8.308 -16.838 -11.289 533 HD3 ARG 79 2HD ARG 79 6.620 -16.230 -13.696 534 HE ARG 79 HE ARG 79 9.471 -15.924 -13.539 535 HH11 ARG 79 1HH1 ARG 79 6.802 -16.830 -15.584 536 HH12 ARG 79 2HH1 ARG 79 7.642 -16.475 -17.058 537 HH21 ARG 79 1HH2 ARG 79 10.586 -15.454 -15.472 538 HH22 ARG 79 2HH2 ARG 79 9.795 -15.694 -16.993 539 H ASP 80 H ASP 80 6.414 -18.187 -8.781 540 HA ASP 80 HA ASP 80 9.057 -17.770 -7.552 541 HB3 ASP 80 2HB ASP 80 6.793 -19.620 -6.805 542 H PHE 81 H PHE 81 10.062 -18.216 -9.610 543 HA PHE 81 HA PHE 81 11.045 -19.539 -11.186 544 HB3 PHE 81 2HB PHE 81 12.071 -21.533 -10.374 545 HD1 PHE 81 2HD PHE 81 10.855 -20.310 -7.133 546 HD2 PHE 81 1HD PHE 81 13.927 -20.062 -10.069 547 HE1 PHE 81 2HE PHE 81 12.277 -19.090 -5.538 548 HE2 PHE 81 1HE PHE 81 15.354 -18.843 -8.478 549 HZ PHE 81 HZ PHE 81 14.529 -18.355 -6.210 550 H GLY 82 H GLY 82 8.447 -19.312 -11.765 551 HA2 GLY 82 2HA GLY 82 7.528 -20.752 -13.605 552 HA3 GLY 82 3HA GLY 82 7.590 -22.060 -12.434 553 H HIS 83 H HIS 83 6.247 -21.818 -10.482 554 HA HIS 83 HA HIS 83 3.584 -21.272 -11.123 555 HB3 HIS 83 2HB HIS 83 3.696 -21.096 -8.353 556 HD1 HIS 83 1HD HIS 83 1.503 -22.006 -10.089 557 HD2 HIS 83 2HD HIS 83 4.287 -24.673 -8.539 558 HE1 HIS 83 1HE HIS 83 0.381 -24.256 -10.144 559 H ILE 84 H ILE 84 2.593 -19.397 -11.413 560 HA ILE 84 HA ILE 84 3.792 -16.922 -10.576 561 HB ILE 84 HB ILE 84 1.085 -17.383 -11.833 562 HG13 ILE 84 2HG1 ILE 84 3.699 -17.700 -12.916 563 HG21 ILE 84 1HG2 ILE 84 1.128 -15.232 -10.833 564 HG22 ILE 84 2HG2 ILE 84 2.755 -14.913 -11.433 565 HG23 ILE 84 3HG2 ILE 84 1.401 -14.994 -12.558 566 HD11 ILE 84 3HD1 ILE 84 0.929 -17.990 -13.825 567 HD12 ILE 84 1HD1 ILE 84 2.103 -17.658 -15.098 568 HD13 ILE 84 2HD1 ILE 84 2.319 -19.054 -14.042 569 H GLN 85 H GLN 85 3.404 -15.817 -8.773 570 HA GLN 85 HA GLN 85 1.014 -16.511 -7.195 571 HB3 GLN 85 2HB GLN 85 2.306 -16.107 -5.162 572 HG3 GLN 85 2HG GLN 85 3.135 -18.174 -7.073 573 HE21 GLN 85 1HE2 GLN 85 4.253 -19.798 -4.968 574 HE22 GLN 85 2HE2 GLN 85 5.892 -19.293 -4.768 575 H TYR 86 H TYR 86 0.255 -14.786 -5.750 576 HA TYR 86 HA TYR 86 1.094 -12.147 -5.801 577 HB3 TYR 86 2HB TYR 86 0.688 -11.906 -8.099 578 HD1 TYR 86 1HD TYR 86 -2.830 -12.686 -7.205 579 HD2 TYR 86 2HD TYR 86 0.525 -13.689 -9.621 580 HE1 TYR 86 1HE TYR 86 -4.239 -14.218 -8.515 581 HE2 TYR 86 2HE TYR 86 -0.875 -15.224 -10.939 582 HH TYR 86 HH TYR 86 -4.149 -15.992 -9.994 583 H VAL 87 H VAL 87 -0.437 -10.672 -4.827 584 HA VAL 87 HA VAL 87 -2.362 -12.099 -3.153 585 HB VAL 87 HB VAL 87 -2.276 -10.311 -1.643 586 HG11 VAL 87 1HG1 VAL 87 0.507 -10.226 -2.771 587 HG12 VAL 87 2HG1 VAL 87 -0.002 -10.127 -1.084 588 HG13 VAL 87 3HG1 VAL 87 -0.132 -11.654 -1.957 589 HG21 VAL 87 3HG2 VAL 87 -0.780 -8.241 -2.626 590 HG22 VAL 87 1HG2 VAL 87 -1.711 -8.736 -4.039 591 HG23 VAL 87 2HG2 VAL 87 -2.541 -8.279 -2.552 592 H ALA 88 H ALA 88 -4.184 -10.271 -2.478 593 HA ALA 88 HA ALA 88 -5.366 -9.268 -4.971 594 HB1 ALA 88 1HB ALA 88 -6.586 -11.215 -4.828 595 HB2 ALA 88 2HB ALA 88 -6.566 -11.224 -3.064 596 HB3 ALA 88 3HB ALA 88 -7.609 -10.096 -3.928 597 H SER 89 H SER 89 -6.227 -9.489 -1.513 598 HA SER 89 HA SER 89 -7.108 -6.714 -1.575 599 HB3 SER 89 2HB SER 89 -7.178 -8.379 0.909 600 HG SER 89 HG SER 89 -9.462 -7.190 0.292 601 H TYR 90 H TYR 90 -5.873 -5.082 -0.943 602 HA TYR 90 HA TYR 90 -3.783 -5.551 1.059 603 HB3 TYR 90 2HB TYR 90 -2.982 -3.679 -1.056 604 HD1 TYR 90 2HD TYR 90 -1.615 -3.445 1.216 605 HD2 TYR 90 1HD TYR 90 -1.335 -6.736 -1.467 606 HE1 TYR 90 2HE TYR 90 0.605 -3.990 2.125 607 HE2 TYR 90 1HE TYR 90 0.885 -7.291 -0.564 608 HH TYR 90 HH TYR 90 2.673 -6.337 0.643 609 H LYS 91 H LYS 91 -3.192 -3.720 2.270 610 HA LYS 91 HA LYS 91 -5.197 -1.577 2.205 611 HB3 LYS 91 2HB LYS 91 -3.356 -1.704 4.499 612 HG3 LYS 91 2HG LYS 91 -5.738 -1.897 5.614 613 HD3 LYS 91 2HD LYS 91 -4.172 0.363 4.583 614 HE3 LYS 91 2HE LYS 91 -6.239 1.736 5.703 615 HZ1 LYS 91 3HZ LYS 91 -6.713 1.661 2.949 616 HZ2 LYS 91 1HZ LYS 91 -5.042 1.535 3.182 617 HZ3 LYS 91 2HZ LYS 91 -5.890 2.843 3.837 618 H VAL 92 H VAL 92 -4.654 0.443 1.677 619 HA VAL 92 HA VAL 92 -1.787 1.113 1.524 620 HB VAL 92 HB VAL 92 -2.618 0.989 -0.713 621 HG11 VAL 92 1HG1 VAL 92 -4.788 1.246 -1.112 622 HG12 VAL 92 2HG1 VAL 92 -5.034 1.980 0.474 623 HG13 VAL 92 3HG1 VAL 92 -4.582 2.985 -0.904 624 HG21 VAL 92 3HG2 VAL 92 -2.596 3.904 0.054 625 HG22 VAL 92 1HG2 VAL 92 -1.150 2.908 -0.115 626 HG23 VAL 92 2HG2 VAL 92 -2.183 3.209 -1.513 627 H ALA 93 H ALA 93 -1.318 2.431 3.160 628 HA ALA 93 HA ALA 93 -3.161 4.663 3.715 629 HB1 ALA 93 1HB ALA 93 -3.346 3.224 5.581 630 HB2 ALA 93 2HB ALA 93 -1.601 2.981 5.660 631 HB3 ALA 93 3HB ALA 93 -2.294 4.546 6.085 632 H HIS 94 H HIS 94 -2.278 6.672 3.984 633 HA HIS 94 HA HIS 94 0.646 6.887 3.697 634 HB3 HIS 94 2HB HIS 94 0.295 8.909 2.329 635 HD1 HIS 94 1HD HIS 94 0.965 8.350 0.019 636 HD2 HIS 94 2HD HIS 94 -1.810 5.645 1.517 637 HE1 HIS 94 1HE HIS 94 0.695 6.603 -1.770 638 H SER 95 H SER 95 1.679 8.388 4.940 639 HA SER 95 HA SER 95 0.007 10.030 6.725 640 HB3 SER 95 2HB SER 95 0.754 8.808 8.454 641 HG SER 95 HG SER 95 2.149 7.105 8.164 642 H ASP 96 H ASP 96 0.391 12.108 6.406 643 HA ASP 96 HA ASP 96 2.858 12.969 5.136 644 HB3 ASP 96 2HB ASP 96 1.761 14.923 4.587 645 H ASP 97 H ASP 97 1.028 13.865 8.063 646 HA ASP 97 HA ASP 97 3.451 15.063 9.179 647 HB3 ASP 97 2HB ASP 97 0.781 15.064 10.549 648 H GLY 98 H GLY 98 1.918 12.115 9.169 649 HA2 GLY 98 2HA GLY 98 2.776 10.227 10.313 650 HA3 GLY 98 3HA GLY 98 3.390 11.296 11.566 651 H VAL 99 H VAL 99 0.692 12.688 11.556 652 HA VAL 99 HA VAL 99 -0.600 10.788 13.378 653 HB VAL 99 HB VAL 99 -1.781 12.673 14.320 654 HG11 VAL 99 1HG1 VAL 99 0.634 12.165 14.943 655 HG12 VAL 99 2HG1 VAL 99 1.063 13.580 13.978 656 HG13 VAL 99 3HG1 VAL 99 0.013 13.755 15.385 657 HG21 VAL 99 3HG2 VAL 99 -1.250 14.989 13.500 658 HG22 VAL 99 1HG2 VAL 99 -0.510 14.240 12.086 659 HG23 VAL 99 2HG2 VAL 99 -2.229 14.013 12.406 660 H GLN 100 H GLN 100 -1.040 12.456 10.376 661 HA GLN 100 HA GLN 100 -3.876 11.764 10.267 662 HB3 GLN 100 2HB GLN 100 -3.978 13.127 8.279 663 HG3 GLN 100 2HG GLN 100 -2.207 14.500 10.288 664 HE21 GLN 100 1HE2 GLN 100 -1.562 16.419 9.661 665 HE22 GLN 100 2HE2 GLN 100 -2.327 17.424 8.483 666 H TRP 101 H TRP 101 -4.029 9.604 9.910 667 HA TRP 101 HA TRP 101 -2.398 8.357 7.845 668 HB3 TRP 101 2HB TRP 101 -3.133 6.278 8.688 669 HD1 TRP 101 HD TRP 101 -0.964 8.330 9.907 670 HE1 TRP 101 1HE TRP 101 -0.336 8.121 12.395 671 HE3 TRP 101 3HE TRP 101 -5.084 5.803 11.576 672 HZ2 TRP 101 2HZ TRP 101 -1.440 7.030 14.752 673 HZ3 TRP 101 3HZ TRP 101 -5.220 5.214 13.961 674 HH2 TRP 101 HH TRP 101 -3.434 5.815 15.514 675 H THR 102 H THR 102 -3.107 8.899 5.854 676 HA THR 102 HA THR 102 -5.933 9.033 5.248 677 HB THR 102 HB THR 102 -3.523 9.332 3.445 678 HG1 THR 102 1HG THR 102 -3.938 10.974 5.121 679 HG21 THR 102 3HG2 THR 102 -5.126 10.328 1.848 680 HG22 THR 102 1HG2 THR 102 -6.449 9.865 2.918 681 HG23 THR 102 2HG2 THR 102 -5.454 8.623 2.158 682 H VAL 103 H VAL 103 -6.983 7.152 5.077 683 HA VAL 103 HA VAL 103 -5.659 4.860 3.828 684 HB VAL 103 HB VAL 103 -7.616 3.563 4.613 685 HG11 VAL 103 1HG1 VAL 103 -6.595 5.090 6.970 686 HG12 VAL 103 2HG1 VAL 103 -6.853 3.354 6.784 687 HG13 VAL 103 3HG1 VAL 103 -5.483 4.135 5.991 688 HG21 VAL 103 3HG2 VAL 103 -8.683 6.205 5.032 689 HG22 VAL 103 1HG2 VAL 103 -9.507 4.645 5.059 690 HG23 VAL 103 2HG2 VAL 103 -8.744 5.265 6.523 691 H TYR 104 H TYR 104 -7.525 3.428 2.670 692 HA TYR 104 HA TYR 104 -8.649 5.189 0.592 693 HB3 TYR 104 2HB TYR 104 -8.564 2.814 -0.659 694 HD1 TYR 104 2HD TYR 104 -6.161 5.364 0.579 695 HD2 TYR 104 1HD TYR 104 -7.466 3.017 -2.721 696 HE1 TYR 104 2HE TYR 104 -4.676 6.641 -0.909 697 HE2 TYR 104 1HE TYR 104 -5.984 4.286 -4.218 698 HH TYR 104 HH TYR 104 -4.580 6.002 -4.399 699 H GLU 105 H GLU 105 -10.535 5.378 2.017 700 HA GLU 105 HA GLU 105 -12.136 3.125 2.661 701 HB3 GLU 105 2HB GLU 105 -12.208 5.394 3.775 702 HG3 GLU 105 2HG GLU 105 -14.339 6.351 2.057 703 H GLU 106 H GLU 106 -13.999 2.335 1.695 704 HA GLU 106 HA GLU 106 -14.684 3.375 -0.961 705 HB3 GLU 106 2HB GLU 106 -14.796 0.454 -0.787 706 HG3 GLU 106 2HG GLU 106 -13.750 2.455 -2.751 707 H GLN 107 H GLN 107 -15.959 3.537 1.674 708 HA GLN 107 HA GLN 107 -18.618 3.041 0.908 709 HB3 GLN 107 2HB GLN 107 -17.496 1.096 2.932 710 HG3 GLN 107 2HG GLN 107 -20.027 2.047 2.964 711 HE21 GLN 107 1HE2 GLN 107 -21.596 2.137 1.531 712 HE22 GLN 107 2HE2 GLN 107 -22.098 0.853 0.488 713 H GLY 108 H GLY 108 -16.320 3.486 3.536 714 HA2 GLY 108 2HA GLY 108 -16.838 5.767 4.618 715 HA3 GLY 108 3HA GLY 108 -18.355 4.987 5.041 716 H SER 109 H SER 109 -16.301 2.521 5.165 717 HA SER 109 HA SER 109 -15.749 2.947 8.024 718 HB3 SER 109 2HB SER 109 -15.515 0.351 7.942 719 HG SER 109 HG SER 109 -17.648 0.202 8.440 720 H SER 110 H SER 110 -14.152 3.496 5.401 721 HA SER 110 HA SER 110 -12.000 3.326 4.643 722 HB3 SER 110 2HB SER 110 -11.403 4.750 6.393 723 HG SER 110 HG SER 110 -11.396 2.785 8.376 724 H LYS 111 H LYS 111 -12.480 1.155 3.809 725 HA LYS 111 HA LYS 111 -11.268 -1.029 5.339 726 HB3 LYS 111 2HB LYS 111 -12.417 -1.734 2.752 727 HG3 LYS 111 2HG LYS 111 -11.987 -3.357 4.555 728 HD3 LYS 111 2HD LYS 111 -13.348 -1.459 6.137 729 HE3 LYS 111 2HE LYS 111 -15.450 -2.528 5.529 730 HZ1 LYS 111 3HZ LYS 111 -15.532 -4.694 5.155 731 HZ2 LYS 111 1HZ LYS 111 -15.210 -4.998 6.788 732 HZ3 LYS 111 2HZ LYS 111 -13.936 -4.892 5.681 733 H VAL 112 H VAL 112 -10.465 -2.733 3.381 734 HA VAL 112 HA VAL 112 -8.088 -1.374 2.368 735 HB VAL 112 HB VAL 112 -7.156 -3.569 1.996 736 HG11 VAL 112 1HG1 VAL 112 -8.265 -4.254 4.574 737 HG12 VAL 112 2HG1 VAL 112 -6.627 -3.756 4.151 738 HG13 VAL 112 3HG1 VAL 112 -7.862 -2.541 4.481 739 HG21 VAL 112 3HG2 VAL 112 -9.855 -4.648 2.805 740 HG22 VAL 112 1HG2 VAL 112 -9.158 -4.696 1.187 741 HG23 VAL 112 2HG2 VAL 112 -8.412 -5.613 2.495 742 H PHE 113 H PHE 113 -7.285 -1.995 0.187 743 HA PHE 113 HA PHE 113 -9.528 -2.070 -1.715 744 HB3 PHE 113 2HB PHE 113 -7.348 -1.263 -3.177 745 HD1 PHE 113 1HD PHE 113 -9.686 0.130 -0.643 746 HD2 PHE 113 2HD PHE 113 -8.005 0.487 -4.536 747 HE1 PHE 113 1HE PHE 113 -11.242 1.969 -1.143 748 HE2 PHE 113 2HE PHE 113 -9.557 2.328 -5.042 749 HZ PHE 113 HZ PHE 113 -11.179 3.072 -3.343 750 H GLN 114 H GLN 114 -9.806 -3.902 -2.785 751 HA GLN 114 HA GLN 114 -7.480 -5.662 -3.193 752 HB3 GLN 114 2HB GLN 114 -9.182 -6.664 -1.761 753 HG3 GLN 114 2HG GLN 114 -11.096 -5.362 -2.935 754 HE21 GLN 114 1HE2 GLN 114 -12.079 -5.091 -4.794 755 HE22 GLN 114 2HE2 GLN 114 -12.259 -6.274 -6.040 756 H GLY 115 H GLY 115 -7.261 -6.746 -5.195 757 HA2 GLY 115 2HA GLY 115 -8.730 -6.937 -7.388 758 HA3 GLY 115 3HA GLY 115 -8.366 -5.218 -7.424 759 H ASN 116 H ASN 116 -6.781 -8.392 -7.187 760 HA ASN 116 HA ASN 116 -4.855 -7.588 -9.189 761 HB3 ASN 116 2HB ASN 116 -2.884 -8.003 -7.837 762 HD21 ASN 116 1HD2 ASN 116 -4.835 -6.840 -5.242 763 HD22 ASN 116 2HD2 ASN 116 -4.454 -5.164 -5.425 764 H LEU 117 H LEU 117 -5.524 -9.261 -10.472 765 HA LEU 117 HA LEU 117 -5.092 -11.976 -9.408 766 HB3 LEU 117 2HB LEU 117 -6.807 -12.802 -10.810 767 HG LEU 117 HG LEU 117 -7.749 -10.227 -9.569 768 HD11 LEU 117 1HD1 LEU 117 -9.040 -11.432 -11.646 769 HD12 LEU 117 2HD1 LEU 117 -9.815 -10.469 -10.389 770 HD13 LEU 117 3HD1 LEU 117 -9.771 -12.226 -10.252 771 HD21 LEU 117 3HD2 LEU 117 -7.203 -11.726 -7.875 772 HD22 LEU 117 1HD2 LEU 117 -7.767 -13.122 -8.794 773 HD23 LEU 117 2HD2 LEU 117 -8.932 -11.988 -8.109 774 H ASP 118 H ASP 118 -3.076 -10.286 -10.575 775 HA ASP 118 HA ASP 118 -2.077 -12.121 -12.548 776 HB3 ASP 118 2HB ASP 118 -1.782 -9.548 -13.772 777 H ASN 119 H ASN 119 0.139 -12.033 -12.759 778 HA ASN 119 HA ASN 119 1.494 -10.314 -10.817 779 HB3 ASN 119 2HB ASN 119 1.774 -12.894 -10.970 780 HD21 ASN 119 1HD2 ASN 119 4.818 -12.794 -11.786 781 HD22 ASN 119 2HD2 ASN 119 4.767 -13.387 -13.409 782 H ASN 120 H ASN 120 1.168 -10.847 -14.219 783 HA ASN 120 HA ASN 120 3.552 -9.437 -14.976 784 HB3 ASN 120 2HB ASN 120 2.174 -9.417 -17.250 785 HD21 ASN 120 1HD2 ASN 120 1.811 -12.409 -17.512 786 HD22 ASN 120 2HD2 ASN 120 3.426 -13.019 -17.596 787 H SER 121 H SER 121 0.144 -8.678 -15.699 788 HA SER 121 HA SER 121 0.482 -6.041 -16.405 789 HB3 SER 121 2HB SER 121 -1.862 -5.749 -16.071 790 HG SER 121 HG SER 121 -0.996 -7.706 -17.401 791 H HIS 122 H HIS 122 0.811 -4.158 -15.376 792 HA HIS 122 HA HIS 122 1.091 -4.254 -12.452 793 HB3 HIS 122 2HB HIS 122 3.034 -3.578 -14.028 794 HD1 HIS 122 1HD HIS 122 1.121 -2.463 -16.047 795 HD2 HIS 122 2HD HIS 122 3.214 -0.057 -13.383 796 HE1 HIS 122 1HE HIS 122 1.185 -0.183 -17.106 797 H LYS 123 H LYS 123 -0.109 -2.986 -11.157 798 HA LYS 123 HA LYS 123 -1.226 -0.529 -11.700 799 HB3 LYS 123 2HB LYS 123 -3.682 -1.920 -11.809 800 HG3 LYS 123 2HG LYS 123 -2.684 -0.835 -14.346 801 HD3 LYS 123 2HD LYS 123 -5.123 -1.291 -13.286 802 HE3 LYS 123 2HE LYS 123 -4.364 1.535 -12.619 803 HZ1 LYS 123 3HZ LYS 123 -7.169 0.811 -12.480 804 HZ2 LYS 123 1HZ LYS 123 -6.566 1.069 -14.039 805 HZ3 LYS 123 2HZ LYS 123 -6.450 2.290 -12.876 806 H LYS 124 H LYS 124 -3.155 -0.042 -10.201 807 HA LYS 124 HA LYS 124 -3.622 -1.779 -7.992 808 HB3 LYS 124 2HB LYS 124 -2.113 0.695 -7.219 809 HG3 LYS 124 2HG LYS 124 -1.424 -0.764 -5.311 810 HD3 LYS 124 2HD LYS 124 -4.381 -0.803 -5.252 811 HE3 LYS 124 2HE LYS 124 -3.497 0.914 -3.332 812 HZ1 LYS 124 3HZ LYS 124 -3.764 -0.889 -1.821 813 HZ2 LYS 124 1HZ LYS 124 -3.499 -2.038 -3.035 814 HZ3 LYS 124 2HZ LYS 124 -4.901 -1.092 -3.057 815 H ASN 125 H ASN 125 -3.305 1.759 -8.314 816 HA ASN 125 HA ASN 125 -6.124 2.158 -8.539 817 HB3 ASN 125 2HB ASN 125 -5.219 3.485 -6.077 818 HD21 ASN 125 1HD2 ASN 125 -7.026 4.606 -5.832 819 HD22 ASN 125 2HD2 ASN 125 -8.623 3.947 -5.826 820 H ILE 126 H ILE 126 -6.653 4.265 -9.104 821 HA ILE 126 HA ILE 126 -4.403 5.886 -9.964 822 HB ILE 126 HB ILE 126 -6.705 5.372 -11.209 823 HG13 ILE 126 2HG1 ILE 126 -4.636 7.388 -11.400 824 HG21 ILE 126 1HG2 ILE 126 -7.887 6.621 -9.297 825 HG22 ILE 126 2HG2 ILE 126 -7.294 8.085 -10.081 826 HG23 ILE 126 3HG2 ILE 126 -8.364 6.989 -10.955 827 HD11 ILE 126 3HD1 ILE 126 -5.311 7.091 -13.910 828 HD12 ILE 126 1HD1 ILE 126 -4.456 5.816 -13.042 829 HD13 ILE 126 2HD1 ILE 126 -6.200 5.703 -13.281 830 H PHE 127 H PHE 127 -4.893 8.382 -9.798 831 HA PHE 127 HA PHE 127 -4.402 9.231 -7.256 832 HB3 PHE 127 2HB PHE 127 -4.189 10.655 -9.261 833 HD1 PHE 127 2HD PHE 127 -5.504 9.646 -11.158 834 HD2 PHE 127 1HD PHE 127 -7.229 12.287 -8.300 835 HE1 PHE 127 2HE PHE 127 -7.369 10.092 -12.700 836 HE2 PHE 127 1HE PHE 127 -9.097 12.736 -9.837 837 HZ PHE 127 HZ PHE 127 -9.167 11.639 -12.041 838 H GLU 128 H GLU 128 -5.519 8.979 -5.446 839 HA GLU 128 HA GLU 128 -8.445 9.311 -5.545 840 HB3 GLU 128 2HB GLU 128 -7.212 7.592 -3.444 841 HG3 GLU 128 2HG GLU 128 -9.603 7.960 -3.364 842 H LYS 129 H LYS 129 -5.553 10.458 -4.346 843 HA LYS 129 HA LYS 129 -6.776 12.429 -2.739 844 HB3 LYS 129 2HB LYS 129 -5.258 11.406 -0.689 845 HG3 LYS 129 2HG LYS 129 -7.833 10.322 -0.323 846 HD3 LYS 129 2HD LYS 129 -6.128 11.871 1.070 847 HE3 LYS 129 2HE LYS 129 -8.355 13.687 0.155 848 HZ1 LYS 129 3HZ LYS 129 -7.972 14.995 1.907 849 HZ2 LYS 129 1HZ LYS 129 -6.297 14.755 1.863 850 HZ3 LYS 129 2HZ LYS 129 -7.294 13.626 2.633 851 HA PRO 130 HA PRO 130 -2.543 13.342 -4.351 852 HB3 PRO 130 2HB PRO 130 -3.427 14.256 -6.266 853 HG3 PRO 130 2HG PRO 130 -5.607 15.062 -6.313 854 HD3 PRO 130 2HD PRO 130 -5.973 12.983 -5.388 855 H PHE 131 H PHE 131 -1.177 14.034 -2.841 856 HA PHE 131 HA PHE 131 -1.149 16.606 -1.776 857 HB3 PHE 131 2HB PHE 131 -1.735 14.949 0.567 858 HD1 PHE 131 1HD PHE 131 -3.091 17.758 -1.485 859 HD2 PHE 131 2HD PHE 131 -1.871 16.375 2.350 860 HE1 PHE 131 1HE PHE 131 -3.554 19.983 -0.540 861 HE2 PHE 131 2HE PHE 131 -2.332 18.596 3.302 862 HZ PHE 131 HZ PHE 131 -3.175 20.404 1.857 863 H MET 132 H MET 132 0.461 16.833 0.029 864 HA MET 132 HA MET 132 2.801 15.376 -0.600 865 HB3 MET 132 2HB MET 132 2.990 17.639 0.191 866 HG3 MET 132 2HG MET 132 2.439 17.202 2.997 867 HE1 MET 132 3HE MET 132 1.219 20.354 -0.077 868 HE2 MET 132 1HE MET 132 1.230 18.601 -0.273 869 HE3 MET 132 2HE MET 132 -0.110 19.385 0.563 870 H ALA 133 H ALA 133 4.102 14.102 0.899 871 HA ALA 133 HA ALA 133 2.825 12.899 3.181 872 HB1 ALA 133 1HB ALA 133 2.490 10.746 2.413 873 HB2 ALA 133 2HB ALA 133 1.970 11.716 1.035 874 HB3 ALA 133 3HB ALA 133 3.564 10.960 1.030 875 H ARG 134 H ARG 134 4.262 11.777 4.506 876 HA ARG 134 HA ARG 134 7.087 12.188 3.828 877 HB3 ARG 134 2HB ARG 134 6.601 11.302 6.542 878 HG3 ARG 134 2HG ARG 134 7.357 14.085 6.200 879 HD3 ARG 134 2HD ARG 134 7.749 12.575 8.184 880 HE ARG 134 HE ARG 134 8.926 10.837 6.502 881 HH11 ARG 134 1HH1 ARG 134 10.147 12.759 9.135 882 HH12 ARG 134 2HH1 ARG 134 11.387 11.625 9.560 883 HH21 ARG 134 1HH2 ARG 134 10.554 9.336 7.052 884 HH22 ARG 134 2HH2 ARG 134 11.617 9.679 8.374 885 H TYR 135 H TYR 135 4.839 9.735 5.038 886 HA TYR 135 HA TYR 135 6.442 7.644 3.866 887 HB3 TYR 135 2HB TYR 135 7.661 7.521 5.822 888 HD1 TYR 135 1HD TYR 135 4.295 7.434 7.430 889 HD2 TYR 135 2HD TYR 135 8.143 9.243 7.303 890 HE1 TYR 135 1HE TYR 135 3.740 8.741 9.438 891 HE2 TYR 135 2HE TYR 135 7.599 10.555 9.311 892 HH TYR 135 HH TYR 135 6.139 10.701 11.074 893 H VAL 136 H VAL 136 5.255 5.851 3.380 894 HA VAL 136 HA VAL 136 2.439 5.863 4.255 895 HB VAL 136 HB VAL 136 1.733 5.074 2.164 896 HG11 VAL 136 1HG1 VAL 136 2.644 6.682 0.535 897 HG12 VAL 136 2HG1 VAL 136 2.292 7.431 2.094 898 HG13 VAL 136 3HG1 VAL 136 3.957 7.048 1.654 899 HG21 VAL 136 3HG2 VAL 136 3.024 3.385 1.397 900 HG22 VAL 136 1HG2 VAL 136 3.746 4.668 0.424 901 HG23 VAL 136 2HG2 VAL 136 4.524 4.150 1.920 902 H ARG 137 H ARG 137 1.468 3.906 4.774 903 HA ARG 137 HA ARG 137 3.274 1.587 4.975 904 HB3 ARG 137 2HB ARG 137 1.128 2.171 7.001 905 HG3 ARG 137 2HG ARG 137 3.472 0.344 6.854 906 HD3 ARG 137 2HD ARG 137 2.913 2.023 9.097 907 HE ARG 137 HE ARG 137 2.838 -0.619 10.183 908 HH11 ARG 137 1HH1 ARG 137 0.876 2.002 9.002 909 HH12 ARG 137 2HH1 ARG 137 -0.515 1.552 9.931 910 HH21 ARG 137 1HH2 ARG 137 1.013 -1.222 11.412 911 HH22 ARG 137 2HH2 ARG 137 -0.435 -0.281 11.303 912 H VAL 138 H VAL 138 2.460 -0.357 4.377 913 HA VAL 138 HA VAL 138 -0.399 -0.483 3.682 914 HB VAL 138 HB VAL 138 0.335 -2.053 1.802 915 HG11 VAL 138 1HG1 VAL 138 -0.464 -0.198 0.823 916 HG12 VAL 138 2HG1 VAL 138 0.404 0.876 1.922 917 HG13 VAL 138 3HG1 VAL 138 1.234 0.179 0.530 918 HG21 VAL 138 3HG2 VAL 138 2.954 -0.596 2.109 919 HG22 VAL 138 1HG2 VAL 138 2.682 -2.243 2.679 920 HG23 VAL 138 2HG2 VAL 138 2.554 -1.873 0.960 921 H LEU 139 H LEU 139 -1.338 -2.604 3.716 922 HA LEU 139 HA LEU 139 0.197 -4.747 4.939 923 HB3 LEU 139 2HB LEU 139 -1.495 -5.064 6.725 924 HG LEU 139 HG LEU 139 0.639 -3.479 6.977 925 HD11 LEU 139 1HD1 LEU 139 -0.652 -1.453 8.260 926 HD12 LEU 139 2HD1 LEU 139 -1.664 -1.681 6.834 927 HD13 LEU 139 3HD1 LEU 139 0.056 -1.343 6.648 928 HD21 LEU 139 3HD2 LEU 139 0.416 -3.875 9.190 929 HD22 LEU 139 1HD2 LEU 139 -0.912 -4.901 8.645 930 HD23 LEU 139 2HD2 LEU 139 -1.241 -3.275 9.243 931 HA PRO 140 HA PRO 140 -2.436 -6.848 2.029 932 HB3 PRO 140 2HB PRO 140 -0.592 -8.120 1.519 933 HG3 PRO 140 2HG PRO 140 1.038 -8.567 3.116 934 HD3 PRO 140 2HD PRO 140 0.864 -6.281 3.355 935 H VAL 141 H VAL 141 -4.333 -7.963 2.152 936 HA VAL 141 HA VAL 141 -5.114 -8.985 4.805 937 HB VAL 141 HB VAL 141 -6.898 -7.686 2.741 938 HG11 VAL 141 1HG1 VAL 141 -7.435 -9.244 5.193 939 HG12 VAL 141 2HG1 VAL 141 -8.392 -7.779 4.965 940 HG13 VAL 141 3HG1 VAL 141 -8.409 -9.046 3.736 941 HG21 VAL 141 3HG2 VAL 141 -5.716 -6.715 5.322 942 HG22 VAL 141 1HG2 VAL 141 -5.696 -5.944 3.736 943 HG23 VAL 141 2HG2 VAL 141 -7.195 -6.016 4.663 944 H SER 142 H SER 142 -5.526 -9.342 1.307 945 HA SER 142 HA SER 142 -6.089 -12.193 1.743 946 HB3 SER 142 2HB SER 142 -7.910 -12.225 0.264 947 HG SER 142 HG SER 142 -9.098 -10.152 0.882 948 H TRP 143 H TRP 143 -4.366 -13.190 0.928 949 HA TRP 143 HA TRP 143 -3.196 -12.180 -1.574 950 HB3 TRP 143 2HB TRP 143 -1.600 -12.300 0.245 951 HD1 TRP 143 HD TRP 143 -1.235 -16.032 -0.167 952 HE1 TRP 143 1HE TRP 143 -1.581 -17.181 2.110 953 HE3 TRP 143 3HE TRP 143 -2.980 -12.035 2.501 954 HZ2 TRP 143 2HZ TRP 143 -2.477 -16.485 4.695 955 HZ3 TRP 143 3HZ TRP 143 -3.560 -12.362 4.871 956 HH2 TRP 143 HH TRP 143 -3.313 -14.541 5.943 957 H HIS 144 H HIS 144 -2.162 -14.013 -2.917 958 HA HIS 144 HA HIS 144 -3.893 -16.384 -2.961 959 HB3 HIS 144 2HB HIS 144 -3.202 -15.526 -5.642 960 HD1 HIS 144 1HD HIS 144 -6.574 -14.679 -4.376 961 HD2 HIS 144 2HD HIS 144 -4.633 -17.958 -6.033 962 HE1 HIS 144 1HE HIS 144 -8.400 -16.275 -5.042 963 H ASN 145 H ASN 145 -2.702 -18.163 -2.932 964 HA ASN 145 HA ASN 145 -1.064 -19.673 -3.453 965 HB3 ASN 145 2HB ASN 145 0.541 -17.752 -5.056 966 HD21 ASN 145 1HD2 ASN 145 -0.331 -19.316 -7.416 967 HD22 ASN 145 2HD2 ASN 145 0.493 -20.829 -7.282 968 H ARG 146 H ARG 146 0.444 -16.441 -3.301 969 HA ARG 146 HA ARG 146 1.585 -16.858 -0.749 970 HB3 ARG 146 2HB ARG 146 3.505 -17.104 -3.071 971 HG3 ARG 146 2HG ARG 146 4.230 -16.011 -0.803 972 HD3 ARG 146 2HD ARG 146 3.326 -17.792 0.616 973 HE ARG 146 HE ARG 146 3.625 -19.905 -0.205 974 HH11 ARG 146 1HH1 ARG 146 6.653 -18.193 -0.348 975 HH12 ARG 146 2HH1 ARG 146 7.569 -19.587 -0.815 976 HH21 ARG 146 1HH2 ARG 146 4.819 -21.748 -0.820 977 HH22 ARG 146 2HH2 ARG 146 6.526 -21.609 -1.084 978 H ILE 147 H ILE 147 2.189 -14.946 0.108 979 HA ILE 147 HA ILE 147 1.607 -12.547 -1.215 980 HB ILE 147 HB ILE 147 3.330 -12.966 1.230 981 HG13 ILE 147 2HG1 ILE 147 0.407 -12.876 0.750 982 HG21 ILE 147 1HG2 ILE 147 3.847 -10.809 0.645 983 HG22 ILE 147 2HG2 ILE 147 2.285 -10.527 -0.123 984 HG23 ILE 147 3HG2 ILE 147 2.413 -10.544 1.636 985 HD11 ILE 147 3HD1 ILE 147 1.329 -13.825 3.325 986 HD12 ILE 147 1HD1 ILE 147 0.366 -14.641 2.094 987 HD13 ILE 147 2HD1 ILE 147 2.127 -14.640 1.981 988 H THR 148 H THR 148 2.734 -12.491 -3.177 989 HA THR 148 HA THR 148 5.526 -11.646 -2.911 990 HB THR 148 HB THR 148 4.899 -13.301 -5.295 991 HG1 THR 148 1HG THR 148 4.076 -14.591 -3.602 992 HG21 THR 148 3HG2 THR 148 7.164 -12.148 -4.140 993 HG22 THR 148 1HG2 THR 148 7.122 -13.273 -5.497 994 HG23 THR 148 2HG2 THR 148 7.337 -13.879 -3.856 995 H LEU 149 H LEU 149 5.237 -9.551 -3.453 996 HA LEU 149 HA LEU 149 4.734 -8.901 -6.184 997 HB3 LEU 149 2HB LEU 149 2.433 -9.202 -5.010 998 HG LEU 149 HG LEU 149 2.994 -6.349 -4.207 999 HD11 LEU 149 1HD1 LEU 149 0.698 -6.582 -3.205 1000 HD12 LEU 149 2HD1 LEU 149 0.528 -8.069 -4.137 1001 HD13 LEU 149 3HD1 LEU 149 0.759 -6.531 -4.968 1002 HD21 LEU 149 3HD2 LEU 149 4.025 -7.955 -2.665 1003 HD22 LEU 149 1HD2 LEU 149 2.471 -8.766 -2.481 1004 HD23 LEU 149 2HD2 LEU 149 2.669 -7.106 -1.920 1005 H ARG 150 H ARG 150 4.435 -6.319 -6.273 1006 HA ARG 150 HA ARG 150 6.324 -5.156 -4.336 1007 HB3 ARG 150 2HB ARG 150 7.562 -5.529 -6.366 1008 HG3 ARG 150 2HG ARG 150 5.285 -5.333 -7.767 1009 HD3 ARG 150 2HD ARG 150 5.094 -2.926 -7.528 1010 HE ARG 150 HE ARG 150 7.819 -2.778 -7.761 1011 HH11 ARG 150 1HH1 ARG 150 5.099 -1.302 -9.353 1012 HH12 ARG 150 2HH1 ARG 150 5.941 0.169 -9.714 1013 HH21 ARG 150 1HH2 ARG 150 8.940 -0.847 -8.229 1014 HH22 ARG 150 2HH2 ARG 150 8.126 0.425 -9.075 1015 H LEU 151 H LEU 151 5.894 -3.103 -3.642 1016 HA LEU 151 HA LEU 151 3.409 -1.882 -4.651 1017 HB3 LEU 151 2HB LEU 151 4.443 -1.250 -1.937 1018 HG LEU 151 HG LEU 151 2.135 -1.162 -1.263 1019 HD11 LEU 151 1HD1 LEU 151 3.280 0.715 -2.653 1020 HD12 LEU 151 2HD1 LEU 151 1.550 0.798 -2.323 1021 HD13 LEU 151 3HD1 LEU 151 2.121 0.246 -3.897 1022 HD21 LEU 151 3HD2 LEU 151 0.923 -1.497 -3.882 1023 HD22 LEU 151 1HD2 LEU 151 0.462 -2.182 -2.324 1024 HD23 LEU 151 2HD2 LEU 151 1.700 -2.970 -3.302 1025 H GLU 152 H GLU 152 3.765 -0.095 -5.774 1026 HA GLU 152 HA GLU 152 5.976 1.667 -4.946 1027 HB3 GLU 152 2HB GLU 152 5.036 0.960 -7.722 1028 HG3 GLU 152 2HG GLU 152 7.020 3.093 -6.968 1029 H LEU 153 H LEU 153 5.598 3.861 -4.922 1030 HA LEU 153 HA LEU 153 2.785 4.659 -5.261 1031 HB3 LEU 153 2HB LEU 153 3.602 4.820 -2.970 1032 HG LEU 153 HG LEU 153 6.028 5.643 -3.893 1033 HD11 LEU 153 1HD1 LEU 153 4.365 8.031 -3.398 1034 HD12 LEU 153 2HD1 LEU 153 5.783 7.823 -4.426 1035 HD13 LEU 153 3HD1 LEU 153 5.978 8.033 -2.686 1036 HD21 LEU 153 3HD2 LEU 153 4.778 6.086 -1.186 1037 HD22 LEU 153 1HD2 LEU 153 6.508 6.176 -1.520 1038 HD23 LEU 153 2HD2 LEU 153 5.647 4.652 -1.735 1039 H LEU 154 H LEU 154 2.268 6.386 -6.514 1040 HA LEU 154 HA LEU 154 4.494 7.722 -7.909 1041 HB3 LEU 154 2HB LEU 154 3.271 7.767 -9.882 1042 HG LEU 154 HG LEU 154 3.511 5.240 -8.734 1043 HD11 LEU 154 1HD1 LEU 154 1.549 4.195 -8.706 1044 HD12 LEU 154 2HD1 LEU 154 1.094 4.847 -10.280 1045 HD13 LEU 154 3HD1 LEU 154 0.797 5.786 -8.817 1046 HD21 LEU 154 3HD2 LEU 154 3.751 4.517 -10.940 1047 HD22 LEU 154 1HD2 LEU 154 4.216 6.217 -11.000 1048 HD23 LEU 154 2HD2 LEU 154 2.618 5.719 -11.558 1049 H GLY 155 H GLY 155 4.303 9.942 -8.366 1050 HA2 GLY 155 2HA GLY 155 2.149 11.330 -6.898 1051 HA3 GLY 155 3HA GLY 155 3.825 11.841 -6.768 1052 H CYS 156 H CYS 156 2.285 13.798 -7.473 1053 HA CYS 156 HA CYS 156 1.842 13.947 -10.317 1054 HB3 CYS 156 2HB CYS 156 1.817 16.370 -8.567 1055 H LEU 157 H LEU 157 4.348 14.822 -8.086 1056 HA LEU 157 HA LEU 157 6.362 15.861 -8.323 1057 HB3 LEU 157 2HB LEU 157 6.544 15.260 -11.197 1058 HG LEU 157 HG LEU 157 8.604 14.188 -10.693 1059 HD11 LEU 157 1HD1 LEU 157 8.309 16.614 -8.928 1060 HD12 LEU 157 2HD1 LEU 157 8.657 16.626 -10.656 1061 HD13 LEU 157 3HD1 LEU 157 9.827 15.945 -9.526 1062 HD21 LEU 157 3HD2 LEU 157 8.463 14.550 -7.772 1063 HD22 LEU 157 1HD2 LEU 157 9.174 13.247 -8.726 1064 HD23 LEU 157 2HD2 LEU 157 7.435 13.280 -8.439 1065 H GLU 158 H GLU 158 4.045 17.500 -8.790 1066 HA GLU 158 HA GLU 158 5.292 19.551 -10.483 1067 HB3 GLU 158 2HB GLU 158 2.313 19.105 -10.426 1068 HG3 GLU 158 2HG GLU 158 4.033 20.477 -12.477 Start of MODEL 7 1 H1 MET -5 H MET -5 21.547 22.017 -18.785 2 HA MET -5 HA MET -5 19.429 22.794 -16.908 3 HB3 MET -5 2HB MET -5 18.820 24.481 -18.605 4 HG3 MET -5 2HG MET -5 21.377 25.446 -18.717 5 HE1 MET -5 3HE MET -5 20.319 28.428 -17.899 6 HE2 MET -5 1HE MET -5 20.189 27.204 -19.163 7 HE3 MET -5 2HE MET -5 18.737 27.788 -18.349 8 H LYS -4 H LYS -4 17.706 21.518 -16.897 9 HA LYS -4 HA LYS -4 16.452 20.778 -19.411 10 HB3 LYS -4 2HB LYS -4 16.164 18.386 -18.373 11 HG3 LYS -4 2HG LYS -4 18.857 19.106 -19.506 12 HD3 LYS -4 2HD LYS -4 17.709 16.699 -20.512 13 HE3 LYS -4 2HE LYS -4 20.148 17.469 -20.219 14 HZ1 LYS -4 3HZ LYS -4 19.469 17.218 -17.545 15 HZ2 LYS -4 1HZ LYS -4 21.005 17.505 -18.193 16 HZ3 LYS -4 2HZ LYS -4 20.500 15.920 -17.885 17 H SER -3 H SER -3 14.328 19.562 -18.923 18 HA SER -3 HA SER -3 13.136 20.083 -16.356 19 HB3 SER -3 2HB SER -3 11.450 21.368 -18.343 20 HG SER -3 HG SER -3 12.219 23.069 -16.521 21 H GLY -2 H GLY -2 10.814 19.399 -16.319 22 HA2 GLY -2 2HA GLY -2 9.752 17.866 -18.475 23 HA3 GLY -2 3HA GLY -2 10.485 16.826 -17.264 24 H HIS -1 H HIS -1 8.022 19.303 -17.775 25 HA HIS -1 HA HIS -1 6.813 18.964 -15.210 26 HB3 HIS -1 2HB HIS -1 6.613 21.045 -16.557 27 HD1 HIS -1 1HD HIS -1 7.222 20.758 -19.106 28 HD2 HIS -1 2HD HIS -1 3.330 19.719 -18.089 29 HE1 HIS -1 1HE HIS -1 5.968 20.637 -21.282 30 H GLY 0 H GLY 0 4.757 18.032 -14.752 31 HA2 GLY 0 2HA GLY 0 2.880 16.777 -16.038 32 HA3 GLY 0 3HA GLY 0 4.205 15.696 -16.447 33 H CYS 1 H CYS 1 1.788 15.068 -14.988 34 HA CYS 1 HA CYS 1 2.709 14.658 -12.249 35 HB3 CYS 1 2HB CYS 1 0.117 13.507 -13.003 36 H SER 2 H SER 2 1.598 12.344 -11.488 37 HA SER 2 HA SER 2 2.080 10.121 -11.341 38 HB3 SER 2 2HB SER 2 1.334 8.833 -13.124 39 HG SER 2 HG SER 2 -0.461 9.893 -13.282 40 H GLU 3 H GLU 3 4.272 10.731 -10.670 41 HA GLU 3 HA GLU 3 6.279 9.873 -12.650 42 HB3 GLU 3 2HB GLU 3 7.854 11.411 -11.770 43 HG3 GLU 3 2HG GLU 3 6.800 13.608 -11.892 44 HA PRO 4 HA PRO 4 7.499 6.692 -9.883 45 HB3 PRO 4 2HB PRO 4 8.905 5.956 -11.545 46 HG3 PRO 4 2HG PRO 4 10.029 7.457 -12.918 47 HD3 PRO 4 2HD PRO 4 7.888 8.294 -13.086 48 H LEU 5 H LEU 5 9.790 6.275 -8.524 49 HA LEU 5 HA LEU 5 10.043 8.636 -6.777 50 HB3 LEU 5 2HB LEU 5 8.830 7.114 -5.502 51 HG LEU 5 HG LEU 5 9.610 4.737 -5.091 52 HD11 LEU 5 1HD1 LEU 5 7.791 5.775 -6.835 53 HD12 LEU 5 2HD1 LEU 5 7.979 4.062 -6.466 54 HD13 LEU 5 3HD1 LEU 5 8.762 4.747 -7.890 55 HD21 LEU 5 3HD2 LEU 5 10.889 3.667 -6.854 56 HD22 LEU 5 1HD2 LEU 5 11.824 4.974 -6.128 57 HD23 LEU 5 2HD2 LEU 5 11.054 5.208 -7.697 58 H GLY 6 H GLY 6 11.729 8.003 -9.014 59 HA2 GLY 6 2HA GLY 6 14.218 8.593 -8.158 60 HA3 GLY 6 3HA GLY 6 14.160 6.850 -7.946 61 H LEU 7 H LEU 7 12.272 6.783 -10.348 62 HA LEU 7 HA LEU 7 14.367 6.432 -12.308 63 HB3 LEU 7 2HB LEU 7 12.529 5.594 -13.743 64 HG LEU 7 HG LEU 7 12.042 3.566 -12.661 65 HD11 LEU 7 1HD1 LEU 7 14.468 4.072 -13.054 66 HD12 LEU 7 2HD1 LEU 7 14.146 2.849 -11.826 67 HD13 LEU 7 3HD1 LEU 7 14.586 4.487 -11.344 68 HD21 LEU 7 3HD2 LEU 7 12.723 4.718 -9.975 69 HD22 LEU 7 1HD2 LEU 7 11.875 3.219 -10.355 70 HD23 LEU 7 2HD2 LEU 7 11.081 4.771 -10.621 71 H LYS 8 H LYS 8 12.551 9.011 -11.315 72 HA LYS 8 HA LYS 8 12.206 10.206 -13.948 73 HB3 LYS 8 2HB LYS 8 11.662 11.475 -11.264 74 HG3 LYS 8 2HG LYS 8 9.728 12.236 -13.099 75 HD3 LYS 8 2HD LYS 8 12.146 13.923 -12.617 76 HE3 LYS 8 2HE LYS 8 9.512 14.918 -11.881 77 HZ1 LYS 8 3HZ LYS 8 10.433 16.800 -12.584 78 HZ2 LYS 8 1HZ LYS 8 10.835 16.151 -14.095 79 HZ3 LYS 8 2HZ LYS 8 11.876 15.938 -12.780 80 H ASN 9 H ASN 9 13.727 11.241 -10.887 81 HA ASN 9 HA ASN 9 16.199 11.910 -12.054 82 HB3 ASN 9 2HB ASN 9 15.370 14.520 -11.330 83 HD21 ASN 9 1HD2 ASN 9 14.457 14.386 -14.431 84 HD22 ASN 9 2HD2 ASN 9 15.987 14.553 -15.214 85 H ASN 10 H ASN 10 15.007 10.679 -9.682 86 HA ASN 10 HA ASN 10 16.237 12.363 -7.599 87 HB3 ASN 10 2HB ASN 10 14.762 11.074 -6.001 88 HD21 ASN 10 1HD2 ASN 10 13.497 12.319 -9.078 89 HD22 ASN 10 2HD2 ASN 10 12.619 13.631 -8.378 90 H THR 11 H THR 11 16.078 9.229 -9.086 91 HA THR 11 HA THR 11 17.227 7.279 -8.751 92 HB THR 11 HB THR 11 19.628 7.508 -8.517 93 HG1 THR 11 1HG THR 11 20.289 9.010 -7.187 94 HG21 THR 11 3HG2 THR 11 18.331 9.676 -10.160 95 HG22 THR 11 1HG2 THR 11 18.840 8.075 -10.692 96 HG23 THR 11 2HG2 THR 11 20.047 9.285 -10.258 97 H ILE 12 H ILE 12 15.676 7.163 -6.782 98 HA ILE 12 HA ILE 12 17.021 7.334 -4.215 99 HB ILE 12 HB ILE 12 14.245 6.336 -4.864 100 HG13 ILE 12 2HG1 ILE 12 13.504 8.535 -4.008 101 HG21 ILE 12 1HG2 ILE 12 13.800 6.545 -2.498 102 HG22 ILE 12 2HG2 ILE 12 15.180 5.476 -2.748 103 HG23 ILE 12 3HG2 ILE 12 15.436 7.137 -2.213 104 HD11 ILE 12 3HD1 ILE 12 15.100 10.386 -3.869 105 HD12 ILE 12 1HD1 ILE 12 15.381 9.170 -2.624 106 HD13 ILE 12 2HD1 ILE 12 16.429 9.239 -4.040 107 HA PRO 13 HA PRO 13 18.441 3.146 -4.306 108 HB3 PRO 13 2HB PRO 13 20.057 3.835 -2.826 109 HG3 PRO 13 2HG PRO 13 19.626 5.508 -1.270 110 HD3 PRO 13 2HD PRO 13 18.869 6.542 -3.186 111 H ASP 14 H ASP 14 18.199 1.264 -2.448 112 HA ASP 14 HA ASP 14 15.317 0.797 -2.346 113 HB3 ASP 14 2HB ASP 14 16.582 -0.978 -3.364 114 H SER 15 H SER 15 16.842 2.566 -0.464 115 HA SER 15 HA SER 15 16.430 1.137 2.064 116 HB3 SER 15 2HB SER 15 17.788 3.792 1.534 117 HG SER 15 HG SER 15 17.790 3.980 3.615 118 H GLN 16 H GLN 16 14.275 2.218 0.325 119 HA GLN 16 HA GLN 16 13.155 4.288 2.079 120 HB3 GLN 16 2HB GLN 16 13.186 4.902 -0.260 121 HG3 GLN 16 2HG GLN 16 11.460 2.501 -0.810 122 HE21 GLN 16 1HE2 GLN 16 13.781 3.750 -2.997 123 HE22 GLN 16 2HE2 GLN 16 12.677 4.492 -4.098 124 H MET 17 H MET 17 12.416 1.153 0.613 125 HA MET 17 HA MET 17 9.985 0.932 2.209 126 HB3 MET 17 2HB MET 17 10.015 -1.399 0.946 127 HG3 MET 17 2HG MET 17 9.199 1.277 -0.003 128 HE1 MET 17 3HE MET 17 8.893 1.809 -3.240 129 HE2 MET 17 1HE MET 17 7.382 0.919 -3.058 130 HE3 MET 17 2HE MET 17 7.988 1.908 -1.729 131 H SER 18 H SER 18 9.586 -0.947 3.538 132 HA SER 18 HA SER 18 11.619 -2.771 4.269 133 HB3 SER 18 2HB SER 18 12.781 -1.078 5.402 134 HG SER 18 HG SER 18 11.849 0.626 6.325 135 H ALA 19 H ALA 19 10.466 -4.499 4.779 136 HA ALA 19 HA ALA 19 7.932 -4.128 6.236 137 HB1 ALA 19 1HB ALA 19 8.147 -6.706 4.979 138 HB2 ALA 19 2HB ALA 19 6.927 -5.451 4.762 139 HB3 ALA 19 3HB ALA 19 8.407 -5.417 3.802 140 H SER 20 H SER 20 7.316 -6.367 7.323 141 HA SER 20 HA SER 20 8.899 -6.703 9.545 142 HB3 SER 20 2HB SER 20 7.032 -8.695 8.239 143 HG SER 20 HG SER 20 7.259 -8.957 10.897 144 H SER 21 H SER 21 8.805 -8.842 6.694 145 HA SER 21 HA SER 21 11.575 -9.244 6.581 146 HB3 SER 21 2HB SER 21 10.039 -11.405 8.039 147 HG SER 21 HG SER 21 12.774 -11.579 7.459 148 H SER 22 H SER 22 12.184 -10.955 5.041 149 HA SER 22 HA SER 22 10.044 -11.338 3.069 150 HB3 SER 22 2HB SER 22 12.784 -10.556 2.867 151 HG SER 22 HG SER 22 12.618 -12.380 0.915 152 H TYR 23 H TYR 23 10.283 -13.375 1.716 153 HA TYR 23 HA TYR 23 9.793 -15.619 3.236 154 HB3 TYR 23 2HB TYR 23 10.789 -15.379 0.395 155 HD1 TYR 23 1HD TYR 23 9.406 -17.776 2.891 156 HD2 TYR 23 2HD TYR 23 11.234 -17.252 -0.916 157 HE1 TYR 23 1HE TYR 23 9.638 -20.215 2.673 158 HE2 TYR 23 2HE TYR 23 11.469 -19.689 -1.144 159 HH TYR 23 HH TYR 23 10.874 -21.685 -0.292 160 H LYS 24 H LYS 24 10.983 -17.119 4.241 161 HA LYS 24 HA LYS 24 13.654 -16.736 4.872 162 HB3 LYS 24 2HB LYS 24 13.627 -19.043 5.720 163 HG3 LYS 24 2HG LYS 24 11.958 -17.030 6.593 164 HD3 LYS 24 2HD LYS 24 10.193 -18.672 5.437 165 HE3 LYS 24 2HE LYS 24 11.130 -20.448 7.156 166 HZ1 LYS 24 3HZ LYS 24 10.482 -18.884 9.044 167 HZ2 LYS 24 1HZ LYS 24 10.026 -20.507 9.186 168 HZ3 LYS 24 2HZ LYS 24 8.886 -19.346 8.728 169 H THR 25 H THR 25 15.513 -17.099 3.851 170 HA THR 25 HA THR 25 15.457 -18.338 1.223 171 HB THR 25 HB THR 25 16.671 -16.219 1.511 172 HG1 THR 25 1HG THR 25 17.381 -18.011 0.032 173 HG21 THR 25 3HG2 THR 25 17.433 -16.484 3.801 174 HG22 THR 25 1HG2 THR 25 18.813 -16.208 2.741 175 HG23 THR 25 2HG2 THR 25 18.464 -17.834 3.328 176 H TRP 26 H TRP 26 16.647 -18.985 4.438 177 HA TRP 26 HA TRP 26 17.529 -21.633 3.519 178 HB3 TRP 26 2HB TRP 26 18.993 -19.888 5.512 179 HD1 TRP 26 HD TRP 26 19.819 -23.085 3.454 180 HE1 TRP 26 1HE TRP 26 21.024 -24.735 5.020 181 HE3 TRP 26 3HE TRP 26 19.669 -20.359 7.777 182 HZ2 TRP 26 2HZ TRP 26 21.807 -24.864 7.728 183 HZ3 TRP 26 3HZ TRP 26 20.669 -21.318 9.810 184 HH2 TRP 26 HH TRP 26 21.714 -23.524 9.785 185 H ASN 27 H ASN 27 17.129 -19.805 6.561 186 HA ASN 27 HA ASN 27 14.998 -21.454 7.472 187 HB3 ASN 27 2HB ASN 27 17.230 -21.830 9.344 188 HD21 ASN 27 1HD2 ASN 27 16.422 -23.130 10.807 189 HD22 ASN 27 2HD2 ASN 27 15.233 -24.356 10.544 190 H LEU 28 H LEU 28 13.949 -20.556 9.203 191 HA LEU 28 HA LEU 28 13.337 -18.980 10.724 192 HB3 LEU 28 2HB LEU 28 14.940 -18.177 12.250 193 HG LEU 28 HG LEU 28 16.158 -20.753 11.257 194 HD11 LEU 28 1HD1 LEU 28 17.061 -18.966 13.197 195 HD12 LEU 28 2HD1 LEU 28 17.574 -20.635 12.962 196 HD13 LEU 28 3HD1 LEU 28 16.273 -20.264 14.092 197 HD21 LEU 28 3HD2 LEU 28 14.032 -21.438 11.730 198 HD22 LEU 28 1HD2 LEU 28 13.751 -20.140 12.890 199 HD23 LEU 28 2HD2 LEU 28 14.738 -21.530 13.344 200 H ARG 29 H ARG 29 14.158 -16.496 11.371 201 HA ARG 29 HA ARG 29 13.539 -15.016 8.996 202 HB3 ARG 29 2HB ARG 29 13.514 -13.073 10.425 203 HG3 ARG 29 2HG ARG 29 11.946 -15.310 10.956 204 HD3 ARG 29 2HD ARG 29 13.198 -14.180 13.427 205 HE ARG 29 HE ARG 29 10.413 -14.562 13.180 206 HH11 ARG 29 1HH1 ARG 29 13.084 -15.310 15.285 207 HH12 ARG 29 2HH1 ARG 29 12.106 -15.387 16.714 208 HH21 ARG 29 1HH2 ARG 29 9.116 -14.658 15.053 209 HH22 ARG 29 2HH2 ARG 29 9.848 -15.016 16.580 210 H ALA 30 H ALA 30 14.809 -13.395 8.012 211 HA ALA 30 HA ALA 30 17.695 -13.889 8.243 212 HB1 ALA 30 1HB ALA 30 15.897 -13.184 6.014 213 HB2 ALA 30 2HB ALA 30 17.489 -12.422 5.997 214 HB3 ALA 30 3HB ALA 30 17.354 -14.180 6.032 215 H PHE 31 H PHE 31 19.173 -12.141 8.268 216 HA PHE 31 HA PHE 31 18.060 -9.724 9.497 217 HB3 PHE 31 2HB PHE 31 20.969 -9.932 9.472 218 HD1 PHE 31 2HD PHE 31 20.179 -7.613 10.301 219 HD2 PHE 31 1HD PHE 31 19.546 -11.246 12.429 220 HE1 PHE 31 2HE PHE 31 19.872 -6.337 12.382 221 HE2 PHE 31 1HE PHE 31 19.237 -9.975 14.513 222 HZ PHE 31 HZ PHE 31 19.401 -7.518 14.492 223 H GLY 32 H GLY 32 17.919 -10.146 6.640 224 HA2 GLY 32 2HA GLY 32 19.182 -7.661 5.817 225 HA3 GLY 32 3HA GLY 32 19.735 -9.100 4.974 226 H TRP 33 H TRP 33 17.268 -6.743 5.258 227 HA TRP 33 HA TRP 33 15.567 -8.184 3.344 228 HB3 TRP 33 2HB TRP 33 14.306 -7.486 5.241 229 HD1 TRP 33 HD TRP 33 14.616 -3.843 4.160 230 HE1 TRP 33 1HE TRP 33 15.414 -2.447 6.169 231 HE3 TRP 33 3HE TRP 33 15.678 -7.638 7.416 232 HZ2 TRP 33 2HZ TRP 33 16.367 -2.894 8.789 233 HZ3 TRP 33 3HZ TRP 33 16.530 -7.070 9.653 234 HH2 TRP 33 HH TRP 33 16.867 -4.747 10.324 235 H TYR 34 H TYR 34 15.557 -7.594 1.280 236 HA TYR 34 HA TYR 34 16.613 -4.931 0.584 237 HB3 TYR 34 2HB TYR 34 17.386 -5.920 -1.537 238 HD1 TYR 34 2HD TYR 34 18.925 -4.808 0.473 239 HD2 TYR 34 1HD TYR 34 18.429 -8.951 -0.358 240 HE1 TYR 34 2HE TYR 34 21.085 -5.277 1.552 241 HE2 TYR 34 1HE TYR 34 20.587 -9.432 0.719 242 HH TYR 34 HH TYR 34 22.825 -7.005 1.515 243 HA PRO 35 HA PRO 35 12.176 -5.257 -0.822 244 HB3 PRO 35 2HB PRO 35 11.372 -4.388 1.148 245 HG3 PRO 35 2HG PRO 35 12.727 -3.105 2.534 246 HD3 PRO 35 2HD PRO 35 14.109 -4.921 2.198 247 H HIS 36 H HIS 36 10.934 -3.188 -1.821 248 HA HIS 36 HA HIS 36 10.814 -1.712 -3.548 249 HB3 HIS 36 2HB HIS 36 13.713 -1.076 -2.988 250 HD1 HIS 36 1HD HIS 36 14.540 0.790 -4.386 251 HD2 HIS 36 2HD HIS 36 10.389 0.627 -4.316 252 HE1 HIS 36 1HE HIS 36 13.770 2.574 -5.982 253 H LEU 37 H LEU 37 11.159 -4.272 -4.309 254 HA LEU 37 HA LEU 37 13.311 -4.358 -6.278 255 HB3 LEU 37 2HB LEU 37 12.867 -6.666 -6.495 256 HG LEU 37 HG LEU 37 12.740 -5.754 -3.669 257 HD11 LEU 37 1HD1 LEU 37 12.924 -8.530 -3.538 258 HD12 LEU 37 2HD1 LEU 37 11.543 -8.208 -4.586 259 HD13 LEU 37 3HD1 LEU 37 11.597 -7.521 -2.963 260 HD21 LEU 37 3HD2 LEU 37 14.922 -5.907 -4.234 261 HD22 LEU 37 1HD2 LEU 37 14.623 -7.087 -5.510 262 HD23 LEU 37 2HD2 LEU 37 14.677 -7.605 -3.824 263 H GLY 38 H GLY 38 9.936 -3.755 -6.058 264 HA2 GLY 38 2HA GLY 38 9.410 -4.331 -8.855 265 HA3 GLY 38 3HA GLY 38 8.264 -3.691 -7.686 266 H ARG 39 H ARG 39 11.208 -2.029 -7.656 267 HA ARG 39 HA ARG 39 10.276 0.456 -8.176 268 HB3 ARG 39 2HB ARG 39 12.449 0.629 -7.568 269 HG3 ARG 39 2HG ARG 39 13.058 -1.765 -9.282 270 HD3 ARG 39 2HD ARG 39 15.314 -1.659 -8.504 271 HE ARG 39 HE ARG 39 15.082 1.113 -9.289 272 HH11 ARG 39 1HH1 ARG 39 15.106 -2.210 -10.328 273 HH12 ARG 39 2HH1 ARG 39 15.547 -1.833 -11.961 274 HH21 ARG 39 1HH2 ARG 39 15.664 1.622 -11.435 275 HH22 ARG 39 2HH2 ARG 39 15.866 0.347 -12.589 276 H LEU 40 H LEU 40 12.284 -0.961 -10.718 277 HA LEU 40 HA LEU 40 10.392 -1.067 -12.759 278 HB3 LEU 40 2HB LEU 40 11.751 1.583 -12.412 279 HG LEU 40 HG LEU 40 12.225 1.136 -14.718 280 HD11 LEU 40 1HD1 LEU 40 9.634 -0.203 -14.617 281 HD12 LEU 40 2HD1 LEU 40 11.016 -0.478 -15.678 282 HD13 LEU 40 3HD1 LEU 40 9.861 0.801 -16.049 283 HD21 LEU 40 3HD2 LEU 40 11.628 3.339 -14.627 284 HD22 LEU 40 1HD2 LEU 40 9.993 2.990 -14.067 285 HD23 LEU 40 2HD2 LEU 40 10.414 2.745 -15.762 286 H ASP 41 H ASP 41 11.281 -2.318 -14.258 287 HA ASP 41 HA ASP 41 12.806 -3.366 -15.582 288 HB3 ASP 41 2HB ASP 41 14.865 -1.257 -15.145 289 H ASN 42 H ASN 42 12.709 -4.355 -13.107 290 HA ASN 42 HA ASN 42 14.912 -4.353 -11.472 291 HB3 ASN 42 2HB ASN 42 12.647 -5.658 -11.315 292 HD21 ASN 42 1HD2 ASN 42 12.633 -6.377 -13.764 293 HD22 ASN 42 2HD2 ASN 42 12.823 -8.079 -13.991 294 H GLN 43 H GLN 43 16.928 -5.180 -11.505 295 HA GLN 43 HA GLN 43 17.943 -6.162 -14.020 296 HB3 GLN 43 2HB GLN 43 19.270 -4.571 -12.756 297 HG3 GLN 43 2HG GLN 43 20.070 -6.494 -10.680 298 HE21 GLN 43 1HE2 GLN 43 21.798 -4.829 -11.269 299 HE22 GLN 43 2HE2 GLN 43 21.777 -3.365 -10.352 300 H GLY 44 H GLY 44 17.467 -7.426 -10.749 301 HA2 GLY 44 2HA GLY 44 18.713 -9.925 -11.163 302 HA3 GLY 44 3HA GLY 44 17.521 -9.568 -9.922 303 H LYS 45 H LYS 45 15.365 -10.058 -10.269 304 HA LYS 45 HA LYS 45 14.228 -10.821 -12.709 305 HB3 LYS 45 2HB LYS 45 15.778 -12.716 -12.584 306 HG3 LYS 45 2HG LYS 45 15.280 -14.501 -10.868 307 HD3 LYS 45 2HD LYS 45 16.368 -12.159 -9.404 308 HE3 LYS 45 2HE LYS 45 18.238 -13.761 -9.054 309 HZ1 LYS 45 3HZ LYS 45 16.814 -15.445 -7.803 310 HZ2 LYS 45 1HZ LYS 45 15.485 -14.531 -8.313 311 HZ3 LYS 45 2HZ LYS 45 16.680 -13.821 -7.349 312 H ILE 46 H ILE 46 14.294 -11.072 -9.228 313 HA ILE 46 HA ILE 46 11.775 -12.040 -8.660 314 HB ILE 46 HB ILE 46 13.019 -9.749 -7.149 315 HG13 ILE 46 2HG1 ILE 46 14.048 -12.429 -7.617 316 HG21 ILE 46 1HG2 ILE 46 11.465 -12.088 -6.080 317 HG22 ILE 46 2HG2 ILE 46 11.846 -10.567 -5.276 318 HG23 ILE 46 3HG2 ILE 46 10.690 -10.595 -6.607 319 HD11 ILE 46 3HD1 ILE 46 16.072 -11.581 -6.861 320 HD12 ILE 46 1HD1 ILE 46 15.292 -10.195 -7.622 321 HD13 ILE 46 2HD1 ILE 46 15.295 -10.352 -5.866 322 H ASN 47 H ASN 47 12.544 -8.557 -8.603 323 HA ASN 47 HA ASN 47 11.319 -6.718 -9.138 324 HB3 ASN 47 2HB ASN 47 9.752 -8.590 -10.925 325 HD21 ASN 47 1HD2 ASN 47 10.986 -5.310 -10.415 326 HD22 ASN 47 2HD2 ASN 47 9.687 -4.509 -11.225 327 H ALA 48 H ALA 48 10.554 -8.337 -6.878 328 HA ALA 48 HA ALA 48 8.187 -7.068 -6.123 329 HB1 ALA 48 1HB ALA 48 6.501 -8.358 -6.782 330 HB2 ALA 48 2HB ALA 48 7.647 -9.198 -7.826 331 HB3 ALA 48 3HB ALA 48 7.309 -9.818 -6.211 332 H TRP 49 H TRP 49 8.156 -7.043 -3.967 333 HA TRP 49 HA TRP 49 10.027 -8.655 -2.500 334 HB3 TRP 49 2HB TRP 49 8.021 -6.555 -1.677 335 HD1 TRP 49 HD TRP 49 6.998 -7.661 0.503 336 HE1 TRP 49 1HE TRP 49 7.996 -8.225 2.808 337 HE3 TRP 49 3HE TRP 49 11.962 -7.206 -0.630 338 HZ2 TRP 49 2HZ TRP 49 10.550 -8.447 3.989 339 HZ3 TRP 49 3HZ TRP 49 13.619 -7.611 1.145 340 HH2 TRP 49 HH TRP 49 12.926 -8.217 3.406 341 H THR 50 H THR 50 9.626 -10.312 -1.099 342 HA THR 50 HA THR 50 6.886 -11.392 -1.125 343 HB THR 50 HB THR 50 9.163 -13.138 -0.347 344 HG1 THR 50 1HG THR 50 10.081 -13.092 -2.256 345 HG21 THR 50 3HG2 THR 50 6.645 -13.488 -1.974 346 HG22 THR 50 1HG2 THR 50 6.948 -14.068 -0.337 347 HG23 THR 50 2HG2 THR 50 7.829 -14.765 -1.696 348 H ALA 51 H ALA 51 6.267 -12.656 0.815 349 HA ALA 51 HA ALA 51 7.017 -11.183 3.213 350 HB1 ALA 51 1HB ALA 51 5.090 -12.262 4.245 351 HB2 ALA 51 2HB ALA 51 4.643 -11.498 2.719 352 HB3 ALA 51 3HB ALA 51 4.856 -13.247 2.801 353 H GLN 52 H GLN 52 7.440 -12.324 5.233 354 HA GLN 52 HA GLN 52 9.276 -14.525 4.801 355 HB3 GLN 52 2HB GLN 52 8.594 -12.851 7.215 356 HG3 GLN 52 2HG GLN 52 10.975 -14.180 7.734 357 HE21 GLN 52 1HE2 GLN 52 9.225 -16.467 8.921 358 HE22 GLN 52 2HE2 GLN 52 8.550 -15.729 10.330 359 H SER 53 H SER 53 6.557 -13.916 7.032 360 HA SER 53 HA SER 53 6.288 -16.760 7.529 361 HB3 SER 53 2HB SER 53 4.927 -16.195 9.325 362 HG SER 53 HG SER 53 5.810 -13.742 9.665 363 H ASN 54 H ASN 54 5.465 -15.008 4.999 364 HA ASN 54 HA ASN 54 3.755 -14.952 3.468 365 HB3 ASN 54 2HB ASN 54 4.796 -17.185 3.140 366 HD21 ASN 54 1HD2 ASN 54 5.460 -18.361 4.911 367 HD22 ASN 54 2HD2 ASN 54 4.439 -19.503 5.709 368 H SER 55 H SER 55 2.890 -14.167 6.052 369 HA SER 55 HA SER 55 0.085 -15.054 5.936 370 HB3 SER 55 2HB SER 55 0.089 -14.616 8.476 371 HG SER 55 HG SER 55 1.014 -16.740 8.839 372 H ALA 56 H ALA 56 -1.438 -13.483 6.893 373 HA ALA 56 HA ALA 56 -1.067 -10.911 5.808 374 HB1 ALA 56 1HB ALA 56 -3.271 -10.916 6.040 375 HB2 ALA 56 2HB ALA 56 -3.180 -12.374 7.028 376 HB3 ALA 56 3HB ALA 56 -3.085 -10.785 7.789 377 H LYS 57 H LYS 57 -0.060 -12.269 8.769 378 HA LYS 57 HA LYS 57 -0.106 -10.028 10.459 379 HB3 LYS 57 2HB LYS 57 0.287 -12.235 11.353 380 HG3 LYS 57 2HG LYS 57 3.081 -12.393 10.413 381 HD3 LYS 57 2HD LYS 57 2.540 -14.801 10.412 382 HE3 LYS 57 2HE LYS 57 1.466 -14.352 13.005 383 HZ1 LYS 57 3HZ LYS 57 3.628 -15.602 11.851 384 HZ2 LYS 57 1HZ LYS 57 3.198 -15.625 13.488 385 HZ3 LYS 57 2HZ LYS 57 4.302 -14.477 12.920 386 H GLU 58 H GLU 58 1.799 -10.720 7.715 387 HA GLU 58 HA GLU 58 4.067 -9.115 8.444 388 HB3 GLU 58 2HB GLU 58 3.194 -10.129 5.732 389 HG3 GLU 58 2HG GLU 58 5.904 -10.038 5.677 390 H TRP 59 H TRP 59 4.660 -7.105 7.530 391 HA TRP 59 HA TRP 59 2.673 -5.609 6.035 392 HB3 TRP 59 2HB TRP 59 1.862 -5.127 8.220 393 HD1 TRP 59 HD TRP 59 5.516 -3.854 8.641 394 HE1 TRP 59 1HE TRP 59 6.265 -4.404 11.041 395 HE3 TRP 59 3HE TRP 59 1.302 -6.240 10.279 396 HZ2 TRP 59 2HZ TRP 59 5.209 -5.680 13.327 397 HZ3 TRP 59 3HZ TRP 59 1.252 -7.095 12.586 398 HH2 TRP 59 HH TRP 59 3.166 -6.821 14.076 399 H LEU 60 H LEU 60 3.518 -3.835 4.945 400 HA LEU 60 HA LEU 60 6.446 -3.553 5.105 401 HB3 LEU 60 2HB LEU 60 4.581 -3.427 2.752 402 HG LEU 60 HG LEU 60 6.950 -1.888 2.969 403 HD11 LEU 60 1HD1 LEU 60 7.391 -3.660 0.670 404 HD12 LEU 60 2HD1 LEU 60 7.740 -4.374 2.243 405 HD13 LEU 60 3HD1 LEU 60 8.551 -2.887 1.751 406 HD21 LEU 60 3HD2 LEU 60 6.384 -1.598 0.450 407 HD22 LEU 60 1HD2 LEU 60 5.245 -1.029 1.671 408 HD23 LEU 60 2HD2 LEU 60 4.958 -2.560 0.845 409 H GLN 61 H GLN 61 7.270 -1.575 5.437 410 HA GLN 61 HA GLN 61 5.429 0.721 5.291 411 HB3 GLN 61 2HB GLN 61 6.181 -0.114 7.620 412 HG3 GLN 61 2HG GLN 61 8.505 1.657 7.424 413 HE21 GLN 61 1HE2 GLN 61 8.269 -1.820 7.921 414 HE22 GLN 61 2HE2 GLN 61 8.602 -1.785 9.616 415 H VAL 62 H VAL 62 6.229 2.657 4.505 416 HA VAL 62 HA VAL 62 8.953 2.581 3.385 417 HB VAL 62 HB VAL 62 6.624 3.906 2.003 418 HG11 VAL 62 1HG1 VAL 62 9.466 3.291 1.250 419 HG12 VAL 62 2HG1 VAL 62 8.233 3.656 0.042 420 HG13 VAL 62 3HG1 VAL 62 8.646 4.851 1.271 421 HG21 VAL 62 3HG2 VAL 62 5.935 1.742 1.750 422 HG22 VAL 62 1HG2 VAL 62 7.066 1.848 0.401 423 HG23 VAL 62 2HG2 VAL 62 7.564 1.086 1.912 424 H ASP 63 H ASP 63 10.177 4.187 4.096 425 HA ASP 63 HA ASP 63 8.873 6.701 4.914 426 HB3 ASP 63 2HB ASP 63 9.724 5.341 6.836 427 H LEU 64 H LEU 64 9.526 8.438 3.838 428 HA LEU 64 HA LEU 64 12.147 8.350 2.493 429 HB3 LEU 64 2HB LEU 64 10.844 8.423 0.654 430 HG LEU 64 HG LEU 64 8.679 9.561 2.362 431 HD11 LEU 64 1HD1 LEU 64 7.594 9.635 -0.143 432 HD12 LEU 64 2HD1 LEU 64 9.205 10.298 -0.415 433 HD13 LEU 64 3HD1 LEU 64 8.138 11.040 0.776 434 HD21 LEU 64 3HD2 LEU 64 9.183 7.066 1.611 435 HD22 LEU 64 1HD2 LEU 64 8.278 7.583 0.188 436 HD23 LEU 64 2HD2 LEU 64 7.538 7.678 1.786 437 H GLY 65 H GLY 65 9.880 10.202 4.389 438 HA2 GLY 65 2HA GLY 65 10.085 12.185 5.527 439 HA3 GLY 65 3HA GLY 65 11.798 11.804 5.602 440 H THR 66 H THR 66 10.308 12.163 2.504 441 HA THR 66 HA THR 66 11.841 14.632 2.101 442 HB THR 66 HB THR 66 12.228 12.696 0.555 443 HG1 THR 66 1HG THR 66 11.192 15.096 -0.587 444 HG21 THR 66 3HG2 THR 66 10.589 11.732 -0.643 445 HG22 THR 66 1HG2 THR 66 9.831 13.278 -1.024 446 HG23 THR 66 2HG2 THR 66 9.497 12.487 0.517 447 H GLN 67 H GLN 67 8.715 13.633 2.719 448 HA GLN 67 HA GLN 67 6.653 14.582 2.523 449 HB3 GLN 67 2HB GLN 67 7.943 17.263 2.224 450 HG3 GLN 67 2HG GLN 67 5.515 16.162 3.487 451 HE21 GLN 67 1HE2 GLN 67 4.833 16.578 5.461 452 HE22 GLN 67 2HE2 GLN 67 5.514 17.736 6.548 453 H ARG 68 H ARG 68 6.530 13.571 0.364 454 HA ARG 68 HA ARG 68 6.476 15.594 -1.780 455 HB3 ARG 68 2HB ARG 68 6.433 13.272 -3.152 456 HG3 ARG 68 2HG ARG 68 8.910 13.427 -3.364 457 HD3 ARG 68 2HD ARG 68 7.231 15.912 -3.597 458 HE ARG 68 HE ARG 68 10.053 15.714 -4.061 459 HH11 ARG 68 1HH1 ARG 68 7.093 17.207 -5.125 460 HH12 ARG 68 2HH1 ARG 68 7.884 18.582 -5.821 461 HH21 ARG 68 1HH2 ARG 68 11.106 17.520 -4.973 462 HH22 ARG 68 2HH2 ARG 68 10.166 18.759 -5.735 463 H GLN 69 H GLN 69 4.709 15.627 -3.195 464 HA GLN 69 HA GLN 69 2.249 14.607 -2.018 465 HB3 GLN 69 2HB GLN 69 2.903 16.656 -4.102 466 HG3 GLN 69 2HG GLN 69 0.261 15.298 -3.734 467 HE21 GLN 69 1HE2 GLN 69 1.573 18.123 -5.439 468 HE22 GLN 69 2HE2 GLN 69 0.209 19.143 -5.151 469 H VAL 70 H VAL 70 1.449 12.718 -2.625 470 HA VAL 70 HA VAL 70 2.341 11.445 -5.068 471 HB VAL 70 HB VAL 70 1.133 9.494 -4.317 472 HG11 VAL 70 1HG1 VAL 70 3.319 9.881 -3.324 473 HG12 VAL 70 2HG1 VAL 70 2.580 10.830 -2.032 474 HG13 VAL 70 3HG1 VAL 70 2.242 9.103 -2.163 475 HG21 VAL 70 3HG2 VAL 70 0.129 10.031 -1.816 476 HG22 VAL 70 1HG2 VAL 70 -0.330 11.460 -2.741 477 HG23 VAL 70 2HG2 VAL 70 -0.821 9.858 -3.291 478 H THR 71 H THR 71 1.010 10.776 -6.768 479 HA THR 71 HA THR 71 -1.737 11.771 -6.832 480 HB THR 71 HB THR 71 -0.231 12.290 -9.320 481 HG1 THR 71 1HG THR 71 0.093 13.957 -7.028 482 HG21 THR 71 3HG2 THR 71 -2.040 13.532 -9.710 483 HG22 THR 71 1HG2 THR 71 -1.741 14.492 -8.261 484 HG23 THR 71 2HG2 THR 71 -2.689 13.008 -8.156 485 H GLY 72 H GLY 72 -0.499 9.119 -6.710 486 HA2 GLY 72 2HA GLY 72 -2.144 7.665 -8.351 487 HA3 GLY 72 3HA GLY 72 -0.692 7.921 -9.306 488 H ILE 73 H ILE 73 -1.443 5.378 -8.702 489 HA ILE 73 HA ILE 73 0.832 4.473 -7.164 490 HB ILE 73 HB ILE 73 -0.694 2.872 -5.849 491 HG13 ILE 73 2HG1 ILE 73 -2.670 4.157 -7.295 492 HG21 ILE 73 1HG2 ILE 73 -0.781 4.370 -3.999 493 HG22 ILE 73 2HG2 ILE 73 0.657 4.772 -4.936 494 HG23 ILE 73 3HG2 ILE 73 -0.787 5.776 -5.063 495 HD11 ILE 73 3HD1 ILE 73 -3.532 2.242 -6.538 496 HD12 ILE 73 1HD1 ILE 73 -2.602 2.297 -5.041 497 HD13 ILE 73 2HD1 ILE 73 -4.095 3.224 -5.186 498 H ILE 74 H ILE 74 1.398 2.320 -7.578 499 HA ILE 74 HA ILE 74 -0.277 0.752 -9.367 500 HB ILE 74 HB ILE 74 1.206 2.246 -10.787 501 HG13 ILE 74 2HG1 ILE 74 0.472 -0.465 -11.048 502 HG21 ILE 74 1HG2 ILE 74 3.197 2.070 -9.332 503 HG22 ILE 74 2HG2 ILE 74 3.363 0.382 -9.809 504 HG23 ILE 74 3HG2 ILE 74 3.535 1.659 -11.013 505 HD11 ILE 74 3HD1 ILE 74 0.483 -0.056 -13.429 506 HD12 ILE 74 1HD1 ILE 74 -0.207 1.323 -12.574 507 HD13 ILE 74 2HD1 ILE 74 1.443 1.406 -13.194 508 H THR 75 H THR 75 -0.013 -1.407 -9.113 509 HA THR 75 HA THR 75 2.267 -2.329 -7.493 510 HB THR 75 HB THR 75 0.282 -2.230 -6.054 511 HG1 THR 75 1HG THR 75 1.653 -3.900 -5.554 512 HG21 THR 75 3HG2 THR 75 -0.916 -3.942 -8.216 513 HG22 THR 75 1HG2 THR 75 -1.549 -2.454 -7.513 514 HG23 THR 75 2HG2 THR 75 -1.547 -3.946 -6.570 515 H GLN 76 H GLN 76 2.710 -4.650 -7.705 516 HA GLN 76 HA GLN 76 1.573 -6.035 -9.975 517 HB3 GLN 76 2HB GLN 76 4.497 -5.979 -10.192 518 HG3 GLN 76 2HG GLN 76 2.742 -5.103 -12.401 519 HE21 GLN 76 1HE2 GLN 76 4.907 -7.719 -11.353 520 HE22 GLN 76 2HE2 GLN 76 5.983 -7.594 -12.697 521 H GLY 77 H GLY 77 1.815 -8.234 -9.851 522 HA2 GLY 77 2HA GLY 77 2.856 -9.239 -7.326 523 HA3 GLY 77 3HA GLY 77 1.904 -10.141 -8.496 524 H ALA 78 H ALA 78 3.816 -11.596 -7.592 525 HA ALA 78 HA ALA 78 5.939 -11.476 -9.632 526 HB1 ALA 78 1HB ALA 78 7.010 -12.859 -7.459 527 HB2 ALA 78 2HB ALA 78 7.433 -11.236 -8.005 528 HB3 ALA 78 3HB ALA 78 6.200 -11.455 -6.763 529 H ARG 79 H ARG 79 7.159 -13.771 -9.483 530 HA ARG 79 HA ARG 79 5.139 -15.897 -9.370 531 HB3 ARG 79 2HB ARG 79 5.335 -15.128 -11.713 532 HG3 ARG 79 2HG ARG 79 8.130 -16.219 -11.706 533 HD3 ARG 79 2HD ARG 79 6.364 -14.815 -13.677 534 HE ARG 79 HE ARG 79 8.234 -13.663 -14.319 535 HH11 ARG 79 1HH1 ARG 79 9.137 -16.913 -13.457 536 HH12 ARG 79 2HH1 ARG 79 10.770 -16.745 -14.013 537 HH21 ARG 79 1HH2 ARG 79 10.381 -13.431 -15.054 538 HH22 ARG 79 2HH2 ARG 79 11.476 -14.764 -14.921 539 H ASP 80 H ASP 80 5.989 -18.017 -9.097 540 HA ASP 80 HA ASP 80 8.718 -18.029 -7.989 541 HB3 ASP 80 2HB ASP 80 6.474 -19.947 -7.336 542 H PHE 81 H PHE 81 8.762 -18.266 -10.617 543 HA PHE 81 HA PHE 81 9.316 -19.577 -12.398 544 HB3 PHE 81 2HB PHE 81 10.900 -21.325 -11.956 545 HD1 PHE 81 2HD PHE 81 12.258 -19.382 -12.576 546 HD2 PHE 81 1HD PHE 81 11.027 -20.056 -8.558 547 HE1 PHE 81 2HE PHE 81 13.952 -17.780 -11.792 548 HE2 PHE 81 1HE PHE 81 12.718 -18.453 -7.767 549 HZ PHE 81 HZ PHE 81 14.185 -17.314 -9.386 550 H GLY 82 H GLY 82 7.098 -19.976 -12.947 551 HA2 GLY 82 2HA GLY 82 5.909 -21.829 -13.949 552 HA3 GLY 82 3HA GLY 82 6.366 -22.805 -12.562 553 H HIS 83 H HIS 83 5.653 -21.395 -10.419 554 HA HIS 83 HA HIS 83 2.741 -21.203 -10.719 555 HB3 HIS 83 2HB HIS 83 3.568 -21.102 -7.980 556 HD1 HIS 83 1HD HIS 83 3.106 -24.267 -7.615 557 HD2 HIS 83 2HD HIS 83 0.710 -21.605 -9.720 558 HE1 HIS 83 1HE HIS 83 0.827 -25.328 -7.691 559 H ILE 84 H ILE 84 1.864 -19.254 -10.813 560 HA ILE 84 HA ILE 84 3.367 -16.900 -10.124 561 HB ILE 84 HB ILE 84 0.497 -17.184 -11.023 562 HG13 ILE 84 2HG1 ILE 84 2.944 -17.464 -12.430 563 HG21 ILE 84 1HG2 ILE 84 0.705 -15.115 -9.868 564 HG22 ILE 84 2HG2 ILE 84 2.243 -14.760 -10.653 565 HG23 ILE 84 3HG2 ILE 84 0.751 -14.751 -11.593 566 HD11 ILE 84 3HD1 ILE 84 0.078 -17.543 -13.057 567 HD12 ILE 84 1HD1 ILE 84 1.146 -17.184 -14.412 568 HD13 ILE 84 2HD1 ILE 84 1.370 -18.666 -13.481 569 H GLN 85 H GLN 85 3.234 -15.690 -8.330 570 HA GLN 85 HA GLN 85 1.128 -16.346 -6.378 571 HB3 GLN 85 2HB GLN 85 2.650 -16.242 -4.591 572 HG3 GLN 85 2HG GLN 85 4.117 -17.531 -6.879 573 HE21 GLN 85 1HE2 GLN 85 5.706 -16.043 -5.311 574 HE22 GLN 85 2HE2 GLN 85 6.594 -17.040 -4.215 575 H TYR 86 H TYR 86 0.367 -14.643 -5.073 576 HA TYR 86 HA TYR 86 1.309 -12.022 -5.063 577 HB3 TYR 86 2HB TYR 86 0.826 -11.827 -7.386 578 HD1 TYR 86 1HD TYR 86 -2.568 -12.510 -5.969 579 HD2 TYR 86 2HD TYR 86 0.209 -13.226 -9.112 580 HE1 TYR 86 1HE TYR 86 -4.255 -13.862 -7.143 581 HE2 TYR 86 2HE TYR 86 -1.470 -14.578 -10.295 582 HH TYR 86 HH TYR 86 -3.965 -14.769 -10.364 583 H VAL 87 H VAL 87 -0.311 -10.468 -4.187 584 HA VAL 87 HA VAL 87 -2.076 -11.875 -2.331 585 HB VAL 87 HB VAL 87 -2.099 -9.914 -1.003 586 HG11 VAL 87 1HG1 VAL 87 0.646 -10.291 -2.193 587 HG12 VAL 87 2HG1 VAL 87 0.312 -9.414 -0.698 588 HG13 VAL 87 3HG1 VAL 87 -0.037 -11.140 -0.807 589 HG21 VAL 87 3HG2 VAL 87 -1.409 -8.584 -3.541 590 HG22 VAL 87 1HG2 VAL 87 -2.418 -8.031 -2.204 591 HG23 VAL 87 2HG2 VAL 87 -0.662 -7.909 -2.092 592 H ALA 88 H ALA 88 -4.260 -11.566 -2.211 593 HA ALA 88 HA ALA 88 -5.519 -10.409 -4.562 594 HB1 ALA 88 1HB ALA 88 -6.912 -11.769 -2.269 595 HB2 ALA 88 2HB ALA 88 -7.478 -11.561 -3.927 596 HB3 ALA 88 3HB ALA 88 -6.142 -12.660 -3.582 597 H SER 89 H SER 89 -5.538 -9.971 -1.046 598 HA SER 89 HA SER 89 -6.822 -7.352 -1.467 599 HB3 SER 89 2HB SER 89 -7.095 -8.901 1.098 600 HG SER 89 HG SER 89 -8.905 -7.595 1.305 601 H TYR 90 H TYR 90 -6.018 -5.609 -0.342 602 HA TYR 90 HA TYR 90 -3.987 -5.925 1.673 603 HB3 TYR 90 2HB TYR 90 -2.611 -6.249 -0.303 604 HD1 TYR 90 2HD TYR 90 -3.030 -2.602 -0.654 605 HD2 TYR 90 1HD TYR 90 -3.522 -6.402 -2.506 606 HE1 TYR 90 2HE TYR 90 -3.446 -1.492 -2.809 607 HE2 TYR 90 1HE TYR 90 -3.938 -5.302 -4.666 608 HH TYR 90 HH TYR 90 -3.647 -3.279 -5.788 609 H LYS 91 H LYS 91 -3.233 -3.817 2.503 610 HA LYS 91 HA LYS 91 -5.240 -1.707 2.047 611 HB3 LYS 91 2HB LYS 91 -4.006 -1.411 4.606 612 HG3 LYS 91 2HG LYS 91 -6.544 -2.331 5.104 613 HD3 LYS 91 2HD LYS 91 -5.952 0.495 4.260 614 HE3 LYS 91 2HE LYS 91 -8.167 -0.736 5.426 615 HZ1 LYS 91 3HZ LYS 91 -6.453 0.554 7.437 616 HZ2 LYS 91 1HZ LYS 91 -7.428 -0.821 7.583 617 HZ3 LYS 91 2HZ LYS 91 -8.133 0.717 7.554 618 H VAL 92 H VAL 92 -4.521 0.287 1.577 619 HA VAL 92 HA VAL 92 -1.626 0.792 1.820 620 HB VAL 92 HB VAL 92 -2.111 0.545 -0.512 621 HG11 VAL 92 1HG1 VAL 92 -3.899 2.682 -1.053 622 HG12 VAL 92 2HG1 VAL 92 -4.130 0.955 -1.337 623 HG13 VAL 92 3HG1 VAL 92 -4.618 1.670 0.200 624 HG21 VAL 92 3HG2 VAL 92 -1.455 2.716 -1.370 625 HG22 VAL 92 1HG2 VAL 92 -1.967 3.489 0.131 626 HG23 VAL 92 2HG2 VAL 92 -0.597 2.379 0.134 627 H ALA 93 H ALA 93 -1.292 2.246 3.363 628 HA ALA 93 HA ALA 93 -3.121 4.552 3.530 629 HB1 ALA 93 1HB ALA 93 -3.334 4.363 5.761 630 HB2 ALA 93 2HB ALA 93 -2.895 2.680 5.467 631 HB3 ALA 93 3HB ALA 93 -1.666 3.834 5.982 632 H HIS 94 H HIS 94 -2.219 6.564 3.791 633 HA HIS 94 HA HIS 94 0.722 6.690 3.654 634 HB3 HIS 94 2HB HIS 94 0.395 8.828 2.389 635 HD1 HIS 94 1HD HIS 94 1.099 8.495 0.029 636 HD2 HIS 94 2HD HIS 94 -1.307 5.396 1.397 637 HE1 HIS 94 1HE HIS 94 1.089 6.786 -1.816 638 H SER 95 H SER 95 1.786 8.197 4.896 639 HA SER 95 HA SER 95 0.129 9.751 6.773 640 HB3 SER 95 2HB SER 95 1.196 8.905 8.577 641 HG SER 95 HG SER 95 1.991 7.042 6.594 642 H ASP 96 H ASP 96 0.535 11.859 6.793 643 HA ASP 96 HA ASP 96 2.854 12.857 5.329 644 HB3 ASP 96 2HB ASP 96 0.297 14.116 6.293 645 H ASP 97 H ASP 97 1.477 12.836 8.554 646 HA ASP 97 HA ASP 97 3.655 14.509 9.560 647 HB3 ASP 97 2HB ASP 97 1.603 13.383 11.396 648 H GLY 98 H GLY 98 2.749 11.226 9.275 649 HA2 GLY 98 2HA GLY 98 4.426 9.534 9.649 650 HA3 GLY 98 3HA GLY 98 5.012 10.480 11.009 651 H VAL 99 H VAL 99 2.348 11.011 12.060 652 HA VAL 99 HA VAL 99 1.903 8.395 13.310 653 HB VAL 99 HB VAL 99 2.373 10.174 14.878 654 HG11 VAL 99 1HG1 VAL 99 0.871 11.751 13.096 655 HG12 VAL 99 2HG1 VAL 99 0.015 11.774 14.639 656 HG13 VAL 99 3HG1 VAL 99 1.707 12.267 14.559 657 HG21 VAL 99 3HG2 VAL 99 0.678 9.734 16.390 658 HG22 VAL 99 1HG2 VAL 99 -0.577 9.778 15.153 659 HG23 VAL 99 2HG2 VAL 99 0.512 8.395 15.255 660 H GLN 100 H GLN 100 0.321 10.884 11.438 661 HA GLN 100 HA GLN 100 -2.296 9.672 11.721 662 HB3 GLN 100 2HB GLN 100 -3.081 11.473 10.298 663 HG3 GLN 100 2HG GLN 100 -1.025 12.558 12.211 664 HE21 GLN 100 1HE2 GLN 100 -1.408 14.666 12.918 665 HE22 GLN 100 2HE2 GLN 100 -2.356 15.779 11.996 666 H TRP 101 H TRP 101 -2.473 7.747 10.729 667 HA TRP 101 HA TRP 101 -1.352 7.398 8.052 668 HB3 TRP 101 2HB TRP 101 -1.640 5.060 8.360 669 HD1 TRP 101 HD TRP 101 0.609 7.127 9.508 670 HE1 TRP 101 1HE TRP 101 2.075 6.338 11.471 671 HE3 TRP 101 3HE TRP 101 -2.387 3.398 11.309 672 HZ2 TRP 101 2HZ TRP 101 1.974 4.391 13.512 673 HZ3 TRP 101 3HZ TRP 101 -1.629 2.119 13.270 674 HH2 TRP 101 HH TRP 101 0.507 2.607 14.347 675 H THR 102 H THR 102 -2.643 8.196 6.510 676 HA THR 102 HA THR 102 -5.531 8.019 6.743 677 HB THR 102 HB THR 102 -3.788 9.214 4.581 678 HG1 THR 102 1HG THR 102 -3.792 10.382 6.549 679 HG21 THR 102 3HG2 THR 102 -5.980 10.312 3.904 680 HG22 THR 102 1HG2 THR 102 -6.780 9.089 4.890 681 HG23 THR 102 2HG2 THR 102 -5.802 8.603 3.505 682 H VAL 103 H VAL 103 -6.537 6.216 6.162 683 HA VAL 103 HA VAL 103 -5.359 4.509 4.091 684 HB VAL 103 HB VAL 103 -6.948 2.791 4.852 685 HG11 VAL 103 1HG1 VAL 103 -4.893 2.591 5.910 686 HG12 VAL 103 2HG1 VAL 103 -5.104 4.087 6.822 687 HG13 VAL 103 3HG1 VAL 103 -6.023 2.647 7.263 688 HG21 VAL 103 3HG2 VAL 103 -7.869 3.689 7.295 689 HG22 VAL 103 1HG2 VAL 103 -8.117 5.069 6.225 690 HG23 VAL 103 2HG2 VAL 103 -8.827 3.505 5.826 691 H TYR 104 H TYR 104 -6.209 4.358 2.118 692 HA TYR 104 HA TYR 104 -8.483 5.972 1.416 693 HB3 TYR 104 2HB TYR 104 -8.031 5.192 -0.886 694 HD1 TYR 104 1HD TYR 104 -7.539 7.674 0.463 695 HD2 TYR 104 2HD TYR 104 -4.725 4.791 -0.909 696 HE1 TYR 104 1HE TYR 104 -5.830 9.434 0.289 697 HE2 TYR 104 2HE TYR 104 -3.008 6.543 -1.086 698 HH TYR 104 HH TYR 104 -2.643 8.772 -1.074 699 H GLU 105 H GLU 105 -10.328 5.129 2.294 700 HA GLU 105 HA GLU 105 -11.031 2.437 2.458 701 HB3 GLU 105 2HB GLU 105 -12.286 3.966 3.748 702 HG3 GLU 105 2HG GLU 105 -12.195 5.637 1.453 703 H GLU 106 H GLU 106 -13.271 1.774 1.299 704 HA GLU 106 HA GLU 106 -12.912 2.194 -1.592 705 HB3 GLU 106 2HB GLU 106 -13.972 -0.429 -0.986 706 HG3 GLU 106 2HG GLU 106 -11.567 -0.871 -2.157 707 H GLN 107 H GLN 107 -15.186 0.418 0.501 708 HA GLN 107 HA GLN 107 -17.363 2.045 -0.623 709 HB3 GLN 107 2HB GLN 107 -16.961 -0.832 -0.802 710 HG3 GLN 107 2HG GLN 107 -19.581 0.160 0.291 711 HE21 GLN 107 1HE2 GLN 107 -18.694 -3.120 0.418 712 HE22 GLN 107 2HE2 GLN 107 -19.796 -3.710 -0.776 713 H GLY 108 H GLY 108 -16.438 -0.195 1.982 714 HA2 GLY 108 2HA GLY 108 -18.580 0.688 3.692 715 HA3 GLY 108 3HA GLY 108 -17.280 -0.409 4.128 716 H SER 109 H SER 109 -16.975 2.869 2.844 717 HA SER 109 HA SER 109 -15.725 4.627 3.612 718 HB3 SER 109 2HB SER 109 -16.483 5.503 5.782 719 HG SER 109 HG SER 109 -18.892 5.015 5.271 720 H SER 110 H SER 110 -14.532 1.934 3.930 721 HA SER 110 HA SER 110 -12.121 2.527 5.053 722 HB3 SER 110 2HB SER 110 -12.829 2.875 7.231 723 HG SER 110 HG SER 110 -14.707 0.787 6.822 724 H LYS 111 H LYS 111 -13.199 0.957 2.989 725 HA LYS 111 HA LYS 111 -12.617 -1.806 3.769 726 HB3 LYS 111 2HB LYS 111 -13.318 -1.491 0.990 727 HG3 LYS 111 2HG LYS 111 -13.698 -3.552 2.211 728 HD3 LYS 111 2HD LYS 111 -14.804 -1.820 4.167 729 HE3 LYS 111 2HE LYS 111 -16.739 -3.875 3.102 730 HZ1 LYS 111 3HZ LYS 111 -16.345 -3.184 5.719 731 HZ2 LYS 111 1HZ LYS 111 -17.731 -3.910 5.073 732 HZ3 LYS 111 2HZ LYS 111 -17.656 -2.229 5.243 733 H VAL 112 H VAL 112 -10.856 -2.893 3.077 734 HA VAL 112 HA VAL 112 -8.621 -1.477 2.107 735 HB VAL 112 HB VAL 112 -7.442 -3.526 2.117 736 HG11 VAL 112 1HG1 VAL 112 -7.611 -3.979 4.316 737 HG12 VAL 112 2HG1 VAL 112 -8.777 -2.654 4.302 738 HG13 VAL 112 3HG1 VAL 112 -9.337 -4.325 4.221 739 HG21 VAL 112 3HG2 VAL 112 -8.960 -5.676 2.487 740 HG22 VAL 112 1HG2 VAL 112 -10.111 -4.701 1.573 741 HG23 VAL 112 2HG2 VAL 112 -8.538 -5.092 0.876 742 H PHE 113 H PHE 113 -7.340 -2.511 0.167 743 HA PHE 113 HA PHE 113 -9.161 -2.452 -2.143 744 HB3 PHE 113 2HB PHE 113 -6.654 -2.044 -3.180 745 HD1 PHE 113 2HD PHE 113 -8.911 0.067 -1.081 746 HD2 PHE 113 1HD PHE 113 -7.080 -0.567 -4.871 747 HE1 PHE 113 2HE PHE 113 -10.066 2.049 -1.968 748 HE2 PHE 113 1HE PHE 113 -8.232 1.415 -5.763 749 HZ PHE 113 HZ PHE 113 -9.729 2.725 -4.311 750 H GLN 114 H GLN 114 -9.467 -4.303 -3.173 751 HA GLN 114 HA GLN 114 -7.276 -6.263 -3.247 752 HB3 GLN 114 2HB GLN 114 -8.793 -7.153 -1.648 753 HG3 GLN 114 2HG GLN 114 -10.747 -5.719 -2.286 754 HE21 GLN 114 1HE2 GLN 114 -10.581 -8.737 -4.141 755 HE22 GLN 114 2HE2 GLN 114 -11.572 -8.191 -5.446 756 H GLY 115 H GLY 115 -7.448 -7.818 -5.038 757 HA2 GLY 115 2HA GLY 115 -8.582 -8.402 -7.133 758 HA3 GLY 115 3HA GLY 115 -8.933 -6.692 -7.330 759 H ASN 116 H ASN 116 -6.716 -9.212 -7.932 760 HA ASN 116 HA ASN 116 -4.863 -7.281 -9.163 761 HB3 ASN 116 2HB ASN 116 -3.052 -8.983 -8.714 762 HD21 ASN 116 1HD2 ASN 116 -5.344 -8.312 -6.089 763 HD22 ASN 116 2HD2 ASN 116 -4.289 -7.264 -5.208 764 H LEU 117 H LEU 117 -5.116 -7.419 -11.292 765 HA LEU 117 HA LEU 117 -6.332 -9.421 -12.733 766 HB3 LEU 117 2HB LEU 117 -5.324 -8.481 -14.703 767 HG LEU 117 HG LEU 117 -6.309 -6.610 -12.665 768 HD11 LEU 117 1HD1 LEU 117 -4.981 -5.419 -15.072 769 HD12 LEU 117 2HD1 LEU 117 -4.114 -5.615 -13.549 770 HD13 LEU 117 3HD1 LEU 117 -5.567 -4.618 -13.614 771 HD21 LEU 117 3HD2 LEU 117 -6.823 -7.209 -15.562 772 HD22 LEU 117 1HD2 LEU 117 -7.550 -5.819 -14.754 773 HD23 LEU 117 2HD2 LEU 117 -7.888 -7.451 -14.177 774 H ASP 118 H ASP 118 -2.946 -9.137 -11.802 775 HA ASP 118 HA ASP 118 -2.431 -11.855 -11.741 776 HB3 ASP 118 2HB ASP 118 -0.881 -11.162 -14.073 777 H ASN 119 H ASN 119 0.193 -12.082 -12.431 778 HA ASN 119 HA ASN 119 1.438 -10.287 -10.509 779 HB3 ASN 119 2HB ASN 119 1.840 -12.728 -10.373 780 HD21 ASN 119 1HD2 ASN 119 4.682 -12.854 -11.836 781 HD22 ASN 119 2HD2 ASN 119 4.279 -13.741 -13.263 782 H ASN 120 H ASN 120 1.398 -10.914 -13.932 783 HA ASN 120 HA ASN 120 3.759 -9.362 -14.494 784 HB3 ASN 120 2HB ASN 120 2.704 -9.574 -16.909 785 HD21 ASN 120 1HD2 ASN 120 2.454 -12.744 -16.483 786 HD22 ASN 120 2HD2 ASN 120 4.116 -13.210 -16.525 787 H SER 121 H SER 121 0.323 -8.951 -15.373 788 HA SER 121 HA SER 121 0.464 -6.375 -16.345 789 HB3 SER 121 2HB SER 121 -1.567 -7.595 -16.628 790 HG SER 121 HG SER 121 -2.526 -8.624 -15.049 791 H HIS 122 H HIS 122 0.800 -4.426 -15.494 792 HA HIS 122 HA HIS 122 0.931 -4.203 -12.567 793 HB3 HIS 122 2HB HIS 122 2.952 -3.666 -14.058 794 HD1 HIS 122 1HD HIS 122 1.000 -2.882 -16.283 795 HD2 HIS 122 2HD HIS 122 3.180 -0.146 -14.043 796 HE1 HIS 122 1HE HIS 122 1.138 -0.810 -17.702 797 H LYS 123 H LYS 123 -0.336 -2.817 -11.467 798 HA LYS 123 HA LYS 123 -1.495 -0.474 -12.394 799 HB3 LYS 123 2HB LYS 123 -3.910 -1.919 -12.269 800 HG3 LYS 123 2HG LYS 123 -3.114 -1.383 -14.985 801 HD3 LYS 123 2HD LYS 123 -5.040 0.016 -13.127 802 HE3 LYS 123 2HE LYS 123 -4.275 1.056 -15.408 803 HZ1 LYS 123 3HZ LYS 123 -4.579 -0.671 -16.909 804 HZ2 LYS 123 1HZ LYS 123 -5.970 0.269 -17.127 805 HZ3 LYS 123 2HZ LYS 123 -6.047 -1.160 -16.226 806 H LYS 124 H LYS 124 -3.414 0.209 -10.979 807 HA LYS 124 HA LYS 124 -3.985 -1.132 -8.573 808 HB3 LYS 124 2HB LYS 124 -2.227 1.224 -8.016 809 HG3 LYS 124 2HG LYS 124 -2.851 -1.315 -6.524 810 HD3 LYS 124 2HD LYS 124 -1.203 0.976 -5.497 811 HE3 LYS 124 2HE LYS 124 -1.674 -1.874 -4.651 812 HZ1 LYS 124 3HZ LYS 124 0.340 -1.875 -3.761 813 HZ2 LYS 124 1HZ LYS 124 -0.126 -0.587 -2.768 814 HZ3 LYS 124 2HZ LYS 124 0.636 -0.282 -4.247 815 H ASN 125 H ASN 125 -3.247 2.284 -9.285 816 HA ASN 125 HA ASN 125 -5.920 3.056 -9.724 817 HB3 ASN 125 2HB ASN 125 -5.223 4.320 -7.183 818 HD21 ASN 125 1HD2 ASN 125 -7.429 1.753 -8.242 819 HD22 ASN 125 2HD2 ASN 125 -8.876 2.666 -8.006 820 H ILE 126 H ILE 126 -6.167 5.416 -9.861 821 HA ILE 126 HA ILE 126 -3.618 6.655 -10.609 822 HB ILE 126 HB ILE 126 -6.137 8.067 -11.223 823 HG13 ILE 126 2HG1 ILE 126 -5.584 5.286 -12.113 824 HG21 ILE 126 1HG2 ILE 126 -3.626 8.468 -11.945 825 HG22 ILE 126 2HG2 ILE 126 -4.070 7.346 -13.230 826 HG23 ILE 126 3HG2 ILE 126 -4.971 8.848 -13.021 827 HD11 ILE 126 3HD1 ILE 126 -7.722 4.939 -11.642 828 HD12 ILE 126 1HD1 ILE 126 -7.705 6.530 -10.881 829 HD13 ILE 126 2HD1 ILE 126 -8.236 6.359 -12.554 830 H PHE 127 H PHE 127 -4.802 9.330 -10.572 831 HA PHE 127 HA PHE 127 -4.128 10.017 -7.873 832 HB3 PHE 127 2HB PHE 127 -3.415 11.584 -9.478 833 HD1 PHE 127 1HD PHE 127 -6.921 12.592 -9.852 834 HD2 PHE 127 2HD PHE 127 -3.513 10.916 -11.774 835 HE1 PHE 127 1HE PHE 127 -8.005 12.902 -12.039 836 HE2 PHE 127 2HE PHE 127 -4.592 11.225 -13.963 837 HZ PHE 127 HZ PHE 127 -6.840 12.220 -14.098 838 H GLU 128 H GLU 128 -6.151 8.402 -7.468 839 HA GLU 128 HA GLU 128 -8.747 9.465 -7.569 840 HB3 GLU 128 2HB GLU 128 -7.672 7.510 -5.532 841 HG3 GLU 128 2HG GLU 128 -10.405 8.242 -6.439 842 H LYS 129 H LYS 129 -6.099 10.080 -5.447 843 HA LYS 129 HA LYS 129 -7.361 12.304 -4.250 844 HB3 LYS 129 2HB LYS 129 -6.951 10.992 -1.869 845 HG3 LYS 129 2HG LYS 129 -9.656 10.536 -2.533 846 HD3 LYS 129 2HD LYS 129 -8.148 12.631 -1.000 847 HE3 LYS 129 2HE LYS 129 -11.127 12.406 -1.399 848 HZ1 LYS 129 3HZ LYS 129 -10.601 14.523 0.254 849 HZ2 LYS 129 1HZ LYS 129 -9.656 13.271 0.885 850 HZ3 LYS 129 2HZ LYS 129 -11.323 13.060 0.700 851 HA PRO 130 HA PRO 130 -2.748 12.237 -4.183 852 HB3 PRO 130 2HB PRO 130 -2.677 13.360 -6.186 853 HG3 PRO 130 2HG PRO 130 -4.473 14.652 -6.902 854 HD3 PRO 130 2HD PRO 130 -5.577 12.701 -6.363 855 H PHE 131 H PHE 131 -1.303 13.417 -2.849 856 HA PHE 131 HA PHE 131 -1.878 15.685 -1.362 857 HB3 PHE 131 2HB PHE 131 -2.059 13.939 0.828 858 HD1 PHE 131 1HD PHE 131 -2.166 16.730 0.751 859 HD2 PHE 131 2HD PHE 131 -5.344 13.982 0.072 860 HE1 PHE 131 1HE PHE 131 -3.792 18.452 1.417 861 HE2 PHE 131 2HE PHE 131 -6.975 15.699 0.736 862 HZ PHE 131 HZ PHE 131 -6.201 17.938 1.409 863 H MET 132 H MET 132 -0.362 15.994 0.485 864 HA MET 132 HA MET 132 2.234 15.048 -0.240 865 HB3 MET 132 2HB MET 132 1.961 17.300 0.614 866 HG3 MET 132 2HG MET 132 1.594 16.564 3.413 867 HE1 MET 132 3HE MET 132 -0.020 19.761 0.616 868 HE2 MET 132 1HE MET 132 0.017 18.015 0.367 869 HE3 MET 132 2HE MET 132 -1.295 18.745 1.291 870 H ALA 133 H ALA 133 3.663 13.780 0.988 871 HA ALA 133 HA ALA 133 2.808 12.483 3.401 872 HB1 ALA 133 1HB ALA 133 3.393 10.299 1.669 873 HB2 ALA 133 2HB ALA 133 1.919 10.625 2.584 874 HB3 ALA 133 3HB ALA 133 2.102 11.264 0.951 875 H ARG 134 H ARG 134 4.489 11.435 4.472 876 HA ARG 134 HA ARG 134 7.128 11.617 3.175 877 HB3 ARG 134 2HB ARG 134 6.708 13.360 4.944 878 HG3 ARG 134 2HG ARG 134 6.160 10.975 6.542 879 HD3 ARG 134 2HD ARG 134 7.105 12.336 8.573 880 HE ARG 134 HE ARG 134 9.244 10.909 7.251 881 HH11 ARG 134 1HH1 ARG 134 6.311 10.688 9.114 882 HH12 ARG 134 2HH1 ARG 134 6.655 9.097 9.709 883 HH21 ARG 134 1HH2 ARG 134 9.708 8.814 8.028 884 HH22 ARG 134 2HH2 ARG 134 8.588 8.033 9.092 885 H TYR 135 H TYR 135 4.857 9.684 4.784 886 HA TYR 135 HA TYR 135 6.571 7.381 4.607 887 HB3 TYR 135 2HB TYR 135 5.782 8.522 7.276 888 HD1 TYR 135 2HD TYR 135 7.776 5.510 6.453 889 HD2 TYR 135 1HD TYR 135 4.289 7.041 8.351 890 HE1 TYR 135 2HE TYR 135 7.380 3.312 7.485 891 HE2 TYR 135 1HE TYR 135 3.885 4.848 9.390 892 HH TYR 135 HH TYR 135 6.217 2.357 9.391 893 H VAL 136 H VAL 136 5.337 5.798 3.866 894 HA VAL 136 HA VAL 136 2.486 5.760 4.619 895 HB VAL 136 HB VAL 136 1.881 4.962 2.483 896 HG11 VAL 136 1HG1 VAL 136 3.983 7.095 2.129 897 HG12 VAL 136 2HG1 VAL 136 2.740 6.686 0.945 898 HG13 VAL 136 3HG1 VAL 136 2.282 7.349 2.514 899 HG21 VAL 136 3HG2 VAL 136 4.050 4.793 0.838 900 HG22 VAL 136 1HG2 VAL 136 4.693 4.156 2.351 901 HG23 VAL 136 2HG2 VAL 136 3.267 3.420 1.620 902 H ARG 137 H ARG 137 1.516 3.757 5.000 903 HA ARG 137 HA ARG 137 3.366 1.478 5.251 904 HB3 ARG 137 2HB ARG 137 1.165 2.231 7.182 905 HG3 ARG 137 2HG ARG 137 2.976 -0.120 7.010 906 HD3 ARG 137 2HD ARG 137 2.123 1.284 9.522 907 HE ARG 137 HE ARG 137 3.154 -1.338 9.944 908 HH11 ARG 137 1HH1 ARG 137 0.241 0.447 9.277 909 HH12 ARG 137 2HH1 ARG 137 -0.804 -0.736 9.994 910 HH21 ARG 137 1HH2 ARG 137 1.791 -2.902 10.890 911 HH22 ARG 137 2HH2 ARG 137 0.080 -2.640 10.912 912 H VAL 138 H VAL 138 2.568 -0.537 4.741 913 HA VAL 138 HA VAL 138 -0.211 -0.667 3.779 914 HB VAL 138 HB VAL 138 0.858 -2.364 2.053 915 HG11 VAL 138 1HG1 VAL 138 1.177 -0.295 0.505 916 HG12 VAL 138 2HG1 VAL 138 -0.420 -0.656 1.164 917 HG13 VAL 138 3HG1 VAL 138 0.572 0.607 1.894 918 HG21 VAL 138 3HG2 VAL 138 3.094 -0.385 2.490 919 HG22 VAL 138 1HG2 VAL 138 3.141 -2.093 2.923 920 HG23 VAL 138 2HG2 VAL 138 3.019 -1.616 1.229 921 H LEU 139 H LEU 139 -1.263 -2.618 4.058 922 HA LEU 139 HA LEU 139 0.212 -4.830 5.275 923 HB3 LEU 139 2HB LEU 139 -2.264 -3.603 6.480 924 HG LEU 139 HG LEU 139 -0.864 -6.137 7.097 925 HD11 LEU 139 1HD1 LEU 139 -0.206 -5.316 9.105 926 HD12 LEU 139 2HD1 LEU 139 -1.878 -5.692 9.517 927 HD13 LEU 139 3HD1 LEU 139 -1.421 -4.038 9.108 928 HD21 LEU 139 3HD2 LEU 139 -2.945 -6.923 7.037 929 HD22 LEU 139 1HD2 LEU 139 -3.442 -5.332 6.459 930 HD23 LEU 139 2HD2 LEU 139 -3.513 -5.705 8.180 931 HA PRO 140 HA PRO 140 -2.420 -6.813 2.251 932 HB3 PRO 140 2HB PRO 140 -0.553 -7.989 1.611 933 HG3 PRO 140 2HG PRO 140 1.147 -8.461 3.126 934 HD3 PRO 140 2HD PRO 140 0.905 -6.198 3.492 935 H VAL 141 H VAL 141 -4.301 -7.929 2.403 936 HA VAL 141 HA VAL 141 -5.007 -8.994 5.056 937 HB VAL 141 HB VAL 141 -6.816 -8.007 2.845 938 HG11 VAL 141 1HG1 VAL 141 -8.360 -8.180 5.078 939 HG12 VAL 141 2HG1 VAL 141 -8.292 -9.402 3.807 940 HG13 VAL 141 3HG1 VAL 141 -7.317 -9.590 5.265 941 HG21 VAL 141 3HG2 VAL 141 -7.374 -6.398 4.879 942 HG22 VAL 141 1HG2 VAL 141 -5.708 -6.779 5.311 943 HG23 VAL 141 2HG2 VAL 141 -6.069 -6.049 3.746 944 H SER 142 H SER 142 -5.355 -9.614 1.578 945 HA SER 142 HA SER 142 -5.743 -12.465 2.217 946 HB3 SER 142 2HB SER 142 -7.274 -12.707 0.429 947 HG SER 142 HG SER 142 -8.687 -11.726 1.625 948 H TRP 143 H TRP 143 -4.295 -13.820 1.381 949 HA TRP 143 HA TRP 143 -2.552 -12.825 -0.778 950 HB3 TRP 143 2HB TRP 143 -1.265 -13.067 1.240 951 HD1 TRP 143 HD TRP 143 -1.071 -16.797 1.052 952 HE1 TRP 143 1HE TRP 143 -1.950 -17.830 3.239 953 HE3 TRP 143 3HE TRP 143 -3.171 -12.626 3.134 954 HZ2 TRP 143 2HZ TRP 143 -3.349 -16.989 5.542 955 HZ3 TRP 143 3HZ TRP 143 -4.260 -12.826 5.331 956 HH2 TRP 143 HH TRP 143 -4.347 -14.963 6.509 957 H HIS 144 H HIS 144 -1.880 -14.305 -2.382 958 HA HIS 144 HA HIS 144 -3.463 -16.784 -2.524 959 HB3 HIS 144 2HB HIS 144 -3.057 -16.088 -5.158 960 HD1 HIS 144 1HD HIS 144 -5.459 -15.574 -2.296 961 HD2 HIS 144 2HD HIS 144 -5.511 -16.330 -6.382 962 HE1 HIS 144 1HE HIS 144 -7.855 -16.097 -2.853 963 H ASN 145 H ASN 145 -2.131 -18.461 -2.433 964 HA ASN 145 HA ASN 145 -0.456 -19.901 -3.028 965 HB3 ASN 145 2HB ASN 145 0.875 -17.891 -4.795 966 HD21 ASN 145 1HD2 ASN 145 -0.106 -19.811 -6.944 967 HD22 ASN 145 2HD2 ASN 145 0.981 -21.148 -6.825 968 H ARG 146 H ARG 146 0.823 -16.569 -2.982 969 HA ARG 146 HA ARG 146 2.178 -16.880 -0.534 970 HB3 ARG 146 2HB ARG 146 4.445 -16.544 -2.160 971 HG3 ARG 146 2HG ARG 146 5.048 -18.850 -1.321 972 HD3 ARG 146 2HD ARG 146 4.068 -17.168 0.946 973 HE ARG 146 HE ARG 146 6.799 -17.937 0.936 974 HH11 ARG 146 1HH1 ARG 146 3.581 -19.179 1.406 975 HH12 ARG 146 2HH1 ARG 146 4.088 -20.459 2.458 976 HH21 ARG 146 1HH2 ARG 146 7.479 -19.618 2.319 977 HH22 ARG 146 2HH2 ARG 146 6.305 -20.707 2.977 978 H ILE 147 H ILE 147 2.535 -14.906 0.265 979 HA ILE 147 HA ILE 147 1.792 -12.583 -1.079 980 HB ILE 147 HB ILE 147 3.570 -12.905 1.339 981 HG13 ILE 147 2HG1 ILE 147 0.631 -12.662 0.876 982 HG21 ILE 147 1HG2 ILE 147 4.125 -10.768 0.850 983 HG22 ILE 147 2HG2 ILE 147 2.691 -10.506 -0.141 984 HG23 ILE 147 3HG2 ILE 147 2.572 -10.434 1.617 985 HD11 ILE 147 3HD1 ILE 147 0.633 -14.623 1.887 986 HD12 ILE 147 1HD1 ILE 147 2.374 -14.516 2.148 987 HD13 ILE 147 2HD1 ILE 147 1.260 -13.856 3.346 988 H THR 148 H THR 148 2.818 -12.396 -3.063 989 HA THR 148 HA THR 148 5.573 -11.413 -2.916 990 HB THR 148 HB THR 148 4.891 -13.120 -5.263 991 HG1 THR 148 1HG THR 148 4.353 -14.320 -3.287 992 HG21 THR 148 3HG2 THR 148 7.170 -13.294 -5.513 993 HG22 THR 148 1HG2 THR 148 7.481 -13.140 -3.785 994 HG23 THR 148 2HG2 THR 148 7.058 -11.715 -4.735 995 H LEU 149 H LEU 149 5.158 -9.335 -3.434 996 HA LEU 149 HA LEU 149 4.461 -8.708 -6.134 997 HB3 LEU 149 2HB LEU 149 2.239 -9.090 -5.013 998 HG LEU 149 HG LEU 149 3.007 -6.612 -3.492 999 HD11 LEU 149 1HD1 LEU 149 0.255 -7.615 -4.193 1000 HD12 LEU 149 2HD1 LEU 149 0.954 -6.038 -4.559 1001 HD13 LEU 149 3HD1 LEU 149 0.587 -6.473 -2.890 1002 HD21 LEU 149 3HD2 LEU 149 2.308 -9.400 -2.858 1003 HD22 LEU 149 1HD2 LEU 149 1.553 -8.175 -1.838 1004 HD23 LEU 149 2HD2 LEU 149 3.310 -8.248 -1.975 1005 H ARG 150 H ARG 150 3.838 -6.060 -5.935 1006 HA ARG 150 HA ARG 150 5.770 -4.810 -4.147 1007 HB3 ARG 150 2HB ARG 150 7.132 -5.283 -6.081 1008 HG3 ARG 150 2HG ARG 150 4.842 -4.997 -7.591 1009 HD3 ARG 150 2HD ARG 150 6.488 -2.551 -7.721 1010 HE ARG 150 HE ARG 150 6.433 -4.042 -10.025 1011 HH11 ARG 150 1HH1 ARG 150 5.196 -0.952 -9.007 1012 HH12 ARG 150 2HH1 ARG 150 5.292 -0.246 -10.587 1013 HH21 ARG 150 1HH2 ARG 150 6.564 -3.126 -12.109 1014 HH22 ARG 150 2HH2 ARG 150 6.069 -1.484 -12.351 1015 H LEU 151 H LEU 151 5.112 -2.855 -3.458 1016 HA LEU 151 HA LEU 151 2.729 -1.706 -4.747 1017 HB3 LEU 151 2HB LEU 151 2.177 -0.723 -2.612 1018 HG LEU 151 HG LEU 151 1.750 -3.294 -2.995 1019 HD11 LEU 151 1HD1 LEU 151 2.890 -3.981 -0.504 1020 HD12 LEU 151 2HD1 LEU 151 4.174 -3.298 -1.499 1021 HD13 LEU 151 3HD1 LEU 151 3.234 -4.667 -2.091 1022 HD21 LEU 151 3HD2 LEU 151 1.437 -2.627 -0.152 1023 HD22 LEU 151 1HD2 LEU 151 0.230 -3.082 -1.356 1024 HD23 LEU 151 2HD2 LEU 151 0.811 -1.419 -1.276 1025 H GLU 152 H GLU 152 3.682 -0.353 -6.228 1026 HA GLU 152 HA GLU 152 5.631 1.604 -5.257 1027 HB3 GLU 152 2HB GLU 152 5.805 2.184 -7.721 1028 HG3 GLU 152 2HG GLU 152 7.064 0.198 -8.369 1029 H LEU 153 H LEU 153 5.292 3.805 -5.351 1030 HA LEU 153 HA LEU 153 2.515 4.640 -5.869 1031 HB3 LEU 153 2HB LEU 153 3.439 4.731 -3.486 1032 HG LEU 153 HG LEU 153 4.668 6.636 -2.772 1033 HD11 LEU 153 1HD1 LEU 153 6.217 5.631 -5.138 1034 HD12 LEU 153 2HD1 LEU 153 5.900 4.623 -3.727 1035 HD13 LEU 153 3HD1 LEU 153 6.816 6.119 -3.553 1036 HD21 LEU 153 3HD2 LEU 153 3.708 7.889 -4.985 1037 HD22 LEU 153 1HD2 LEU 153 5.397 7.642 -5.428 1038 HD23 LEU 153 2HD2 LEU 153 4.992 8.517 -3.951 1039 H LEU 154 H LEU 154 2.190 6.766 -6.737 1040 HA LEU 154 HA LEU 154 4.523 7.806 -8.205 1041 HB3 LEU 154 2HB LEU 154 3.269 8.133 -10.127 1042 HG LEU 154 HG LEU 154 2.172 5.598 -8.924 1043 HD11 LEU 154 1HD1 LEU 154 1.362 5.010 -11.120 1044 HD12 LEU 154 2HD1 LEU 154 1.918 6.551 -11.773 1045 HD13 LEU 154 3HD1 LEU 154 0.606 6.515 -10.595 1046 HD21 LEU 154 3HD2 LEU 154 3.852 4.496 -10.054 1047 HD22 LEU 154 1HD2 LEU 154 4.668 5.981 -9.566 1048 HD23 LEU 154 2HD2 LEU 154 4.075 5.802 -11.217 1049 H GLY 155 H GLY 155 4.644 10.053 -8.507 1050 HA2 GLY 155 2HA GLY 155 2.666 11.674 -7.054 1051 HA3 GLY 155 3HA GLY 155 4.369 11.827 -6.643 1052 H CYS 156 H CYS 156 2.793 13.973 -7.520 1053 HA CYS 156 HA CYS 156 3.165 14.447 -10.309 1054 HB3 CYS 156 2HB CYS 156 2.887 16.862 -8.721 1055 H LEU 157 H LEU 157 5.089 14.923 -7.470 1056 HA LEU 157 HA LEU 157 7.219 15.651 -7.155 1057 HB3 LEU 157 2HB LEU 157 8.076 15.984 -9.877 1058 HG LEU 157 HG LEU 157 9.638 14.239 -9.468 1059 HD11 LEU 157 1HD1 LEU 157 10.849 15.259 -7.849 1060 HD12 LEU 157 2HD1 LEU 157 9.496 15.324 -6.719 1061 HD13 LEU 157 3HD1 LEU 157 9.598 16.488 -8.039 1062 HD21 LEU 157 3HD2 LEU 157 7.811 12.765 -8.391 1063 HD22 LEU 157 1HD2 LEU 157 8.313 13.523 -6.880 1064 HD23 LEU 157 2HD2 LEU 157 9.476 12.600 -7.833 1065 H GLU 158 H GLU 158 4.971 17.525 -7.709 1066 HA GLU 158 HA GLU 158 6.555 19.853 -8.577 1067 HB3 GLU 158 2HB GLU 158 3.577 19.960 -8.533 1068 HG3 GLU 158 2HG GLU 158 4.789 20.885 -10.941 Start of MODEL 8 1 H1 MET -5 H MET -5 10.869 28.297 -9.377 2 HA MET -5 HA MET -5 11.040 25.620 -10.467 3 HB3 MET -5 2HB MET -5 8.501 25.487 -9.449 4 HG3 MET -5 2HG MET -5 11.027 24.437 -8.203 5 HE1 MET -5 3HE MET -5 10.831 24.686 -6.097 6 HE2 MET -5 1HE MET -5 9.294 24.941 -5.269 7 HE3 MET -5 2HE MET -5 10.138 23.400 -5.108 8 H LYS -4 H LYS -4 10.097 25.527 -12.413 9 HA LYS -4 HA LYS -4 8.019 27.488 -13.084 10 HB3 LYS -4 2HB LYS -4 9.533 27.163 -15.422 11 HG3 LYS -4 2HG LYS -4 9.318 29.426 -13.463 12 HD3 LYS -4 2HD LYS -4 10.197 30.771 -15.479 13 HE3 LYS -4 2HE LYS -4 11.527 29.500 -13.288 14 HZ1 LYS -4 3HZ LYS -4 13.777 30.115 -14.660 15 HZ2 LYS -4 1HZ LYS -4 12.876 29.266 -15.812 16 HZ3 LYS -4 2HZ LYS -4 13.237 28.548 -14.325 17 H SER -3 H SER -3 6.355 26.081 -13.270 18 HA SER -3 HA SER -3 5.051 24.388 -14.059 19 HB3 SER -3 2HB SER -3 6.613 24.105 -16.562 20 HG SER -3 HG SER -3 3.950 24.969 -16.308 21 H GLY -2 H GLY -2 5.381 22.161 -15.510 22 HA2 GLY -2 2HA GLY -2 7.787 20.772 -14.630 23 HA3 GLY -2 3HA GLY -2 6.272 20.209 -13.940 24 H HIS -1 H HIS -1 8.193 18.837 -15.702 25 HA HIS -1 HA HIS -1 7.299 18.633 -18.333 26 HB3 HIS -1 2HB HIS -1 8.326 16.337 -18.272 27 HD1 HIS -1 1HD HIS -1 11.054 16.092 -18.095 28 HD2 HIS -1 2HD HIS -1 9.443 19.895 -17.644 29 HE1 HIS -1 1HE HIS -1 12.962 17.682 -18.492 30 H GLY 0 H GLY 0 6.245 16.894 -15.429 31 HA2 GLY 0 2HA GLY 0 3.596 16.624 -16.129 32 HA3 GLY 0 3HA GLY 0 4.394 15.220 -16.820 33 H CYS 1 H CYS 1 2.383 15.412 -14.675 34 HA CYS 1 HA CYS 1 3.795 14.696 -12.254 35 HB3 CYS 1 2HB CYS 1 1.554 14.431 -11.285 36 H SER 2 H SER 2 2.404 12.687 -11.145 37 HA SER 2 HA SER 2 2.220 10.422 -11.027 38 HB3 SER 2 2HB SER 2 1.134 9.330 -12.752 39 HG SER 2 HG SER 2 -0.330 10.741 -13.376 40 H GLU 3 H GLU 3 4.627 10.881 -10.557 41 HA GLU 3 HA GLU 3 6.310 9.468 -12.516 42 HB3 GLU 3 2HB GLU 3 8.226 10.565 -11.427 43 HG3 GLU 3 2HG GLU 3 7.655 12.966 -11.924 44 HA PRO 4 HA PRO 4 6.907 6.100 -9.766 45 HB3 PRO 4 2HB PRO 4 8.085 5.087 -11.458 46 HG3 PRO 4 2HG PRO 4 9.465 6.321 -12.865 47 HD3 PRO 4 2HD PRO 4 7.542 7.587 -12.984 48 H LEU 5 H LEU 5 10.272 6.994 -9.772 49 HA LEU 5 HA LEU 5 10.341 8.545 -7.427 50 HB3 LEU 5 2HB LEU 5 9.622 6.703 -6.176 51 HG LEU 5 HG LEU 5 10.561 5.018 -8.140 52 HD11 LEU 5 1HD1 LEU 5 12.693 5.341 -6.369 53 HD12 LEU 5 2HD1 LEU 5 12.500 4.089 -7.595 54 HD13 LEU 5 3HD1 LEU 5 11.958 3.795 -5.942 55 HD21 LEU 5 3HD2 LEU 5 9.470 4.595 -5.382 56 HD22 LEU 5 1HD2 LEU 5 9.866 3.227 -6.424 57 HD23 LEU 5 2HD2 LEU 5 8.664 4.411 -6.940 58 H GLY 6 H GLY 6 12.128 5.890 -9.004 59 HA2 GLY 6 2HA GLY 6 14.388 7.741 -9.342 60 HA3 GLY 6 3HA GLY 6 14.667 6.175 -8.596 61 H LEU 7 H LEU 7 12.357 6.595 -11.175 62 HA LEU 7 HA LEU 7 14.127 5.024 -12.927 63 HB3 LEU 7 2HB LEU 7 12.012 4.369 -14.087 64 HG LEU 7 HG LEU 7 12.413 3.596 -11.226 65 HD11 LEU 7 1HD1 LEU 7 10.166 2.638 -12.992 66 HD12 LEU 7 2HD1 LEU 7 9.992 3.630 -11.545 67 HD13 LEU 7 3HD1 LEU 7 10.600 1.980 -11.414 68 HD21 LEU 7 3HD2 LEU 7 12.770 2.349 -13.920 69 HD22 LEU 7 1HD2 LEU 7 12.586 1.338 -12.487 70 HD23 LEU 7 2HD2 LEU 7 13.919 2.489 -12.588 71 H LYS 8 H LYS 8 13.328 8.094 -12.464 72 HA LYS 8 HA LYS 8 13.023 8.731 -15.320 73 HB3 LYS 8 2HB LYS 8 12.749 10.907 -13.346 74 HG3 LYS 8 2HG LYS 8 12.177 11.083 -15.785 75 HD3 LYS 8 2HD LYS 8 9.508 10.129 -15.578 76 HE3 LYS 8 2HE LYS 8 11.844 9.177 -17.234 77 HZ1 LYS 8 3HZ LYS 8 10.124 8.452 -18.783 78 HZ2 LYS 8 1HZ LYS 8 8.923 8.868 -17.666 79 HZ3 LYS 8 2HZ LYS 8 10.012 7.623 -17.312 80 H ASN 9 H ASN 9 14.900 9.465 -12.421 81 HA ASN 9 HA ASN 9 17.312 9.820 -13.777 82 HB3 ASN 9 2HB ASN 9 17.041 12.496 -12.917 83 HD21 ASN 9 1HD2 ASN 9 19.115 12.068 -13.919 84 HD22 ASN 9 2HD2 ASN 9 19.270 12.225 -15.633 85 H ASN 10 H ASN 10 15.310 10.522 -11.008 86 HA ASN 10 HA ASN 10 17.241 11.296 -9.157 87 HB3 ASN 10 2HB ASN 10 15.611 10.163 -7.480 88 HD21 ASN 10 1HD2 ASN 10 15.136 12.209 -10.315 89 HD22 ASN 10 2HD2 ASN 10 14.454 13.544 -9.457 90 H THR 11 H THR 11 16.481 8.159 -10.457 91 HA THR 11 HA THR 11 17.338 6.073 -10.103 92 HB THR 11 HB THR 11 19.696 5.895 -10.059 93 HG1 THR 11 1HG THR 11 20.680 7.042 -8.581 94 HG21 THR 11 3HG2 THR 11 19.855 8.535 -11.260 95 HG22 THR 11 1HG2 THR 11 18.424 7.649 -11.789 96 HG23 THR 11 2HG2 THR 11 20.027 6.946 -12.006 97 H ILE 12 H ILE 12 16.024 7.314 -7.830 98 HA ILE 12 HA ILE 12 17.293 7.083 -5.403 99 HB ILE 12 HB ILE 12 14.450 6.235 -5.972 100 HG13 ILE 12 2HG1 ILE 12 14.837 8.478 -6.811 101 HG21 ILE 12 1HG2 ILE 12 15.331 5.544 -3.770 102 HG22 ILE 12 2HG2 ILE 12 15.696 7.232 -3.415 103 HG23 ILE 12 3HG2 ILE 12 14.024 6.720 -3.646 104 HD11 ILE 12 3HD1 ILE 12 13.181 9.648 -5.736 105 HD12 ILE 12 1HD1 ILE 12 12.800 7.987 -5.281 106 HD13 ILE 12 2HD1 ILE 12 13.639 9.044 -4.144 107 HA PRO 13 HA PRO 13 18.381 2.807 -5.102 108 HB3 PRO 13 2HB PRO 13 20.035 3.498 -3.665 109 HG3 PRO 13 2HG PRO 13 19.722 5.330 -2.268 110 HD3 PRO 13 2HD PRO 13 19.062 6.246 -4.277 111 H ASP 14 H ASP 14 17.981 1.123 -3.085 112 HA ASP 14 HA ASP 14 15.071 0.883 -2.990 113 HB3 ASP 14 2HB ASP 14 16.075 -1.098 -3.790 114 H SER 15 H SER 15 16.726 2.693 -1.250 115 HA SER 15 HA SER 15 16.265 1.542 1.396 116 HB3 SER 15 2HB SER 15 17.466 4.244 0.780 117 HG SER 15 HG SER 15 18.369 3.974 2.808 118 H GLN 16 H GLN 16 13.947 2.073 -0.064 119 HA GLN 16 HA GLN 16 12.835 4.377 1.401 120 HB3 GLN 16 2HB GLN 16 12.766 4.947 -0.900 121 HG3 GLN 16 2HG GLN 16 11.402 2.342 -1.523 122 HE21 GLN 16 1HE2 GLN 16 13.209 5.119 -2.788 123 HE22 GLN 16 2HE2 GLN 16 12.349 5.216 -4.284 124 H MET 17 H MET 17 12.028 1.219 -0.025 125 HA MET 17 HA MET 17 9.680 0.998 1.673 126 HB3 MET 17 2HB MET 17 9.490 -1.264 0.497 127 HG3 MET 17 2HG MET 17 9.156 1.388 -0.691 128 HE1 MET 17 3HE MET 17 8.083 1.973 -2.628 129 HE2 MET 17 1HE MET 17 8.977 1.714 -4.126 130 HE3 MET 17 2HE MET 17 7.491 0.815 -3.819 131 H SER 18 H SER 18 9.326 -0.919 3.006 132 HA SER 18 HA SER 18 11.405 -2.666 3.761 133 HB3 SER 18 2HB SER 18 11.346 -1.492 6.218 134 HG SER 18 HG SER 18 13.306 -0.344 4.802 135 H ALA 19 H ALA 19 10.374 -4.409 4.454 136 HA ALA 19 HA ALA 19 7.756 -4.071 5.762 137 HB1 ALA 19 1HB ALA 19 6.992 -5.554 4.304 138 HB2 ALA 19 2HB ALA 19 8.602 -5.727 3.605 139 HB3 ALA 19 3HB ALA 19 8.110 -6.755 4.950 140 H SER 20 H SER 20 7.191 -5.877 7.301 141 HA SER 20 HA SER 20 8.861 -5.889 9.489 142 HB3 SER 20 2HB SER 20 7.084 -8.251 8.953 143 HG SER 20 HG SER 20 8.143 -8.036 10.980 144 H SER 21 H SER 21 8.640 -8.288 6.896 145 HA SER 21 HA SER 21 11.348 -9.021 7.063 146 HB3 SER 21 2HB SER 21 9.438 -11.014 8.310 147 HG SER 21 HG SER 21 12.091 -11.488 8.584 148 H SER 22 H SER 22 11.895 -10.805 5.610 149 HA SER 22 HA SER 22 9.828 -11.158 3.540 150 HB3 SER 22 2HB SER 22 11.433 -10.154 2.287 151 HG SER 22 HG SER 22 13.794 -10.843 3.163 152 H TYR 23 H TYR 23 10.236 -13.181 2.169 153 HA TYR 23 HA TYR 23 9.791 -15.448 3.673 154 HB3 TYR 23 2HB TYR 23 9.377 -15.136 1.197 155 HD1 TYR 23 1HD TYR 23 11.127 -13.364 0.427 156 HD2 TYR 23 2HD TYR 23 11.882 -17.549 0.558 157 HE1 TYR 23 1HE TYR 23 12.971 -13.076 -1.176 158 HE2 TYR 23 2HE TYR 23 13.729 -17.272 -1.042 159 HH TYR 23 HH TYR 23 14.746 -14.074 -2.139 160 H LYS 24 H LYS 24 11.032 -17.190 4.340 161 HA LYS 24 HA LYS 24 13.709 -16.578 5.119 162 HB3 LYS 24 2HB LYS 24 13.715 -18.829 6.099 163 HG3 LYS 24 2HG LYS 24 10.948 -18.079 6.740 164 HD3 LYS 24 2HD LYS 24 12.139 -17.871 9.026 165 HE3 LYS 24 2HE LYS 24 12.482 -20.634 8.041 166 HZ1 LYS 24 3HZ LYS 24 11.661 -21.150 10.051 167 HZ2 LYS 24 1HZ LYS 24 10.480 -19.940 10.018 168 HZ3 LYS 24 2HZ LYS 24 12.071 -19.556 10.442 169 H THR 25 H THR 25 15.540 -18.094 4.698 170 HA THR 25 HA THR 25 15.634 -19.845 2.525 171 HB THR 25 HB THR 25 15.230 -18.053 1.021 172 HG1 THR 25 1HG THR 25 17.353 -17.895 -0.025 173 HG21 THR 25 3HG2 THR 25 17.236 -16.183 1.271 174 HG22 THR 25 1HG2 THR 25 16.802 -16.524 2.946 175 HG23 THR 25 2HG2 THR 25 15.568 -15.981 1.807 176 H TRP 26 H TRP 26 17.381 -21.056 2.845 177 HA TRP 26 HA TRP 26 19.391 -20.231 4.723 178 HB3 TRP 26 2HB TRP 26 20.384 -22.490 4.198 179 HD1 TRP 26 HD TRP 26 16.510 -22.649 4.216 180 HE1 TRP 26 1HE TRP 26 15.767 -23.585 6.496 181 HE3 TRP 26 3HE TRP 26 21.079 -22.979 6.487 182 HZ2 TRP 26 2HZ TRP 26 16.959 -24.360 8.934 183 HZ3 TRP 26 3HZ TRP 26 21.190 -23.826 8.794 184 HH2 TRP 26 HH TRP 26 19.172 -24.502 9.991 185 H ASN 27 H ASN 27 20.479 -18.501 3.783 186 HA ASN 27 HA ASN 27 22.507 -19.265 1.856 187 HB3 ASN 27 2HB ASN 27 20.524 -18.422 0.531 188 HD21 ASN 27 1HD2 ASN 27 19.229 -17.434 2.426 189 HD22 ASN 27 2HD2 ASN 27 19.053 -15.715 2.372 190 H LEU 28 H LEU 28 24.155 -17.536 1.583 191 HA LEU 28 HA LEU 28 24.412 -15.989 4.074 192 HB3 LEU 28 2HB LEU 28 26.866 -16.241 2.590 193 HG LEU 28 HG LEU 28 27.776 -17.272 4.589 194 HD11 LEU 28 1HD1 LEU 28 26.121 -15.247 5.893 195 HD12 LEU 28 2HD1 LEU 28 26.844 -14.716 4.375 196 HD13 LEU 28 3HD1 LEU 28 27.871 -15.320 5.674 197 HD21 LEU 28 3HD2 LEU 28 25.955 -18.723 5.207 198 HD22 LEU 28 1HD2 LEU 28 24.913 -17.338 5.532 199 HD23 LEU 28 2HD2 LEU 28 26.318 -17.644 6.555 200 H ARG 29 H ARG 29 25.502 -15.864 0.677 201 HA ARG 29 HA ARG 29 26.125 -13.146 0.631 202 HB3 ARG 29 2HB ARG 29 26.883 -14.578 -1.138 203 HG3 ARG 29 2HG ARG 29 24.535 -14.876 -2.729 204 HD3 ARG 29 2HD ARG 29 25.191 -17.292 -2.554 205 HE ARG 29 HE ARG 29 26.566 -15.351 -3.888 206 HH11 ARG 29 1HH1 ARG 29 27.424 -18.352 -2.346 207 HH12 ARG 29 2HH1 ARG 29 28.751 -18.671 -3.412 208 HH21 ARG 29 1HH2 ARG 29 28.310 -15.760 -5.298 209 HH22 ARG 29 2HH2 ARG 29 29.255 -17.196 -5.092 210 H ALA 30 H ALA 30 25.001 -11.307 0.064 211 HA ALA 30 HA ALA 30 22.263 -11.206 0.750 212 HB1 ALA 30 1HB ALA 30 22.705 -8.868 -0.601 213 HB2 ALA 30 2HB ALA 30 23.033 -9.138 1.111 214 HB3 ALA 30 3HB ALA 30 24.328 -9.313 -0.074 215 H PHE 31 H PHE 31 23.802 -10.498 -2.395 216 HA PHE 31 HA PHE 31 23.032 -10.647 -4.530 217 HB3 PHE 31 2HB PHE 31 21.099 -12.777 -3.682 218 HD1 PHE 31 2HD PHE 31 24.036 -12.133 -5.899 219 HD2 PHE 31 1HD PHE 31 20.071 -13.634 -5.532 220 HE1 PHE 31 2HE PHE 31 24.030 -12.692 -8.295 221 HE2 PHE 31 1HE PHE 31 20.058 -14.197 -7.927 222 HZ PHE 31 HZ PHE 31 22.039 -13.725 -9.313 223 H GLY 32 H GLY 32 21.854 -8.643 -3.064 224 HA2 GLY 32 2HA GLY 32 20.094 -7.172 -3.167 225 HA3 GLY 32 3HA GLY 32 19.563 -8.056 -4.590 226 H TRP 33 H TRP 33 19.415 -7.956 -1.070 227 HA TRP 33 HA TRP 33 17.056 -9.708 -1.153 228 HB3 TRP 33 2HB TRP 33 18.973 -10.321 0.355 229 HD1 TRP 33 HD TRP 33 20.722 -8.204 0.675 230 HE1 TRP 33 1HE TRP 33 21.048 -6.654 2.704 231 HE3 TRP 33 3HE TRP 33 16.287 -9.056 3.071 232 HZ2 TRP 33 2HZ TRP 33 19.616 -5.893 5.015 233 HZ3 TRP 33 3HZ TRP 33 15.842 -7.878 5.186 234 HH2 TRP 33 HH TRP 33 17.474 -6.330 6.135 235 H TYR 34 H TYR 34 18.130 -6.491 -0.451 236 HA TYR 34 HA TYR 34 16.122 -5.543 1.202 237 HB3 TYR 34 2HB TYR 34 16.545 -3.349 -0.244 238 HD1 TYR 34 1HD TYR 34 19.531 -5.263 0.873 239 HD2 TYR 34 2HD TYR 34 16.699 -2.228 1.807 240 HE1 TYR 34 1HE TYR 34 20.851 -4.650 2.856 241 HE2 TYR 34 2HE TYR 34 18.012 -1.606 3.792 242 HH TYR 34 HH TYR 34 20.343 -1.791 4.590 243 HA PRO 35 HA PRO 35 12.394 -5.391 -1.105 244 HB3 PRO 35 2HB PRO 35 11.412 -4.413 0.728 245 HG3 PRO 35 2HG PRO 35 12.560 -2.854 2.015 246 HD3 PRO 35 2HD PRO 35 14.135 -4.535 1.930 247 H HIS 36 H HIS 36 10.998 -3.382 -2.236 248 HA HIS 36 HA HIS 36 10.815 -2.070 -4.086 249 HB3 HIS 36 2HB HIS 36 13.731 -1.384 -3.706 250 HD1 HIS 36 1HD HIS 36 14.467 0.534 -5.125 251 HD2 HIS 36 2HD HIS 36 10.345 0.020 -5.177 252 HE1 HIS 36 1HE HIS 36 13.612 2.132 -6.869 253 H LEU 37 H LEU 37 11.202 -4.721 -4.564 254 HA LEU 37 HA LEU 37 13.257 -4.968 -6.619 255 HB3 LEU 37 2HB LEU 37 12.615 -7.334 -6.674 256 HG LEU 37 HG LEU 37 13.733 -7.984 -4.836 257 HD11 LEU 37 1HD1 LEU 37 13.983 -5.061 -4.200 258 HD12 LEU 37 2HD1 LEU 37 14.752 -5.790 -5.609 259 HD13 LEU 37 3HD1 LEU 37 15.179 -6.339 -3.988 260 HD21 LEU 37 3HD2 LEU 37 13.213 -7.122 -2.540 261 HD22 LEU 37 1HD2 LEU 37 11.878 -7.948 -3.344 262 HD23 LEU 37 2HD2 LEU 37 11.901 -6.186 -3.259 263 H GLY 38 H GLY 38 9.795 -4.705 -6.268 264 HA2 GLY 38 2HA GLY 38 9.050 -5.588 -8.849 265 HA3 GLY 38 3HA GLY 38 8.099 -4.540 -7.807 266 H ARG 39 H ARG 39 10.759 -2.833 -7.903 267 HA ARG 39 HA ARG 39 9.861 -0.793 -9.500 268 HB3 ARG 39 2HB ARG 39 11.738 -0.591 -7.918 269 HG3 ARG 39 2HG ARG 39 13.133 -2.307 -9.915 270 HD3 ARG 39 2HD ARG 39 14.178 0.152 -9.144 271 HE ARG 39 HE ARG 39 14.718 -1.433 -6.997 272 HH11 ARG 39 1HH1 ARG 39 16.644 0.034 -9.498 273 HH12 ARG 39 2HH1 ARG 39 18.050 0.202 -8.498 274 HH21 ARG 39 1HH2 ARG 39 16.561 -1.217 -5.671 275 HH22 ARG 39 2HH2 ARG 39 18.002 -0.512 -6.322 276 H LEU 40 H LEU 40 10.772 0.038 -11.555 277 HA LEU 40 HA LEU 40 10.749 -2.072 -13.544 278 HB3 LEU 40 2HB LEU 40 10.819 0.930 -13.813 279 HG LEU 40 HG LEU 40 11.389 -0.856 -15.862 280 HD11 LEU 40 1HD1 LEU 40 9.328 -1.701 -16.330 281 HD12 LEU 40 2HD1 LEU 40 9.254 -0.225 -17.290 282 HD13 LEU 40 3HD1 LEU 40 8.479 -0.286 -15.707 283 HD21 LEU 40 3HD2 LEU 40 11.484 1.052 -17.190 284 HD22 LEU 40 1HD2 LEU 40 11.742 1.677 -15.562 285 HD23 LEU 40 2HD2 LEU 40 10.161 1.839 -16.327 286 H ASP 41 H ASP 41 12.899 -2.806 -12.605 287 HA ASP 41 HA ASP 41 14.940 -2.342 -14.434 288 HB3 ASP 41 2HB ASP 41 16.058 -1.202 -11.988 289 H ASN 42 H ASN 42 13.668 -4.476 -13.002 290 HA ASN 42 HA ASN 42 15.593 -5.494 -11.102 291 HB3 ASN 42 2HB ASN 42 13.016 -5.863 -11.119 292 HD21 ASN 42 1HD2 ASN 42 12.243 -5.811 -13.333 293 HD22 ASN 42 2HD2 ASN 42 11.976 -7.302 -14.164 294 H GLN 43 H GLN 43 17.129 -7.011 -11.451 295 HA GLN 43 HA GLN 43 17.398 -8.034 -14.200 296 HB3 GLN 43 2HB GLN 43 19.235 -6.637 -13.976 297 HG3 GLN 43 2HG GLN 43 19.585 -7.590 -11.143 298 HE21 GLN 43 1HE2 GLN 43 21.015 -5.930 -9.991 299 HE22 GLN 43 2HE2 GLN 43 22.492 -5.529 -10.791 300 H GLY 44 H GLY 44 17.131 -8.809 -10.881 301 HA2 GLY 44 2HA GLY 44 18.396 -11.366 -10.942 302 HA3 GLY 44 3HA GLY 44 17.288 -10.785 -9.708 303 H LYS 45 H LYS 45 15.105 -11.255 -9.854 304 HA LYS 45 HA LYS 45 13.801 -12.342 -12.077 305 HB3 LYS 45 2HB LYS 45 15.332 -14.238 -11.754 306 HG3 LYS 45 2HG LYS 45 14.880 -15.746 -9.780 307 HD3 LYS 45 2HD LYS 45 16.080 -13.257 -8.703 308 HE3 LYS 45 2HE LYS 45 16.256 -15.544 -7.662 309 HZ1 LYS 45 3HZ LYS 45 18.444 -16.335 -9.305 310 HZ2 LYS 45 1HZ LYS 45 17.000 -16.310 -10.185 311 HZ3 LYS 45 2HZ LYS 45 17.116 -17.241 -8.778 312 H ILE 46 H ILE 46 14.085 -12.021 -8.623 313 HA ILE 46 HA ILE 46 11.490 -12.797 -7.875 314 HB ILE 46 HB ILE 46 13.049 -10.624 -6.494 315 HG13 ILE 46 2HG1 ILE 46 13.774 -13.424 -6.924 316 HG21 ILE 46 1HG2 ILE 46 11.483 -12.788 -5.162 317 HG22 ILE 46 2HG2 ILE 46 11.840 -11.153 -4.605 318 HG23 ILE 46 3HG2 ILE 46 10.642 -11.410 -5.874 319 HD11 ILE 46 3HD1 ILE 46 15.131 -11.098 -6.955 320 HD12 ILE 46 1HD1 ILE 46 15.523 -11.684 -5.338 321 HD13 ILE 46 2HD1 ILE 46 15.879 -12.682 -6.749 322 H ASN 47 H ASN 47 12.812 -9.592 -8.672 323 HA ASN 47 HA ASN 47 11.758 -7.573 -8.982 324 HB3 ASN 47 2HB ASN 47 11.549 -8.649 -11.173 325 HD21 ASN 47 1HD2 ASN 47 11.078 -10.514 -12.055 326 HD22 ASN 47 2HD2 ASN 47 9.627 -11.422 -11.820 327 H ALA 48 H ALA 48 10.911 -8.746 -6.586 328 HA ALA 48 HA ALA 48 8.672 -7.235 -5.945 329 HB1 ALA 48 1HB ALA 48 7.548 -9.880 -5.699 330 HB2 ALA 48 2HB ALA 48 6.866 -8.432 -6.442 331 HB3 ALA 48 3HB ALA 48 7.910 -9.496 -7.383 332 H TRP 49 H TRP 49 8.089 -7.394 -3.747 333 HA TRP 49 HA TRP 49 10.093 -8.765 -2.128 334 HB3 TRP 49 2HB TRP 49 8.069 -6.614 -1.507 335 HD1 TRP 49 HD TRP 49 6.994 -7.607 0.710 336 HE1 TRP 49 1HE TRP 49 7.933 -7.995 3.076 337 HE3 TRP 49 3HE TRP 49 11.981 -7.134 -0.309 338 HZ2 TRP 49 2HZ TRP 49 10.454 -8.088 4.342 339 HZ3 TRP 49 3HZ TRP 49 13.590 -7.385 1.535 340 HH2 TRP 49 HH TRP 49 12.840 -7.853 3.812 341 H THR 50 H THR 50 9.687 -10.536 -0.972 342 HA THR 50 HA THR 50 6.929 -11.528 -0.886 343 HB THR 50 HB THR 50 9.132 -13.271 0.049 344 HG1 THR 50 1HG THR 50 9.048 -12.125 -2.499 345 HG21 THR 50 3HG2 THR 50 6.925 -14.184 -0.090 346 HG22 THR 50 1HG2 THR 50 7.877 -14.897 -1.392 347 HG23 THR 50 2HG2 THR 50 6.730 -13.604 -1.744 348 H ALA 51 H ALA 51 6.238 -12.681 1.086 349 HA ALA 51 HA ALA 51 6.936 -11.116 3.438 350 HB1 ALA 51 1HB ALA 51 4.986 -12.178 4.468 351 HB2 ALA 51 2HB ALA 51 4.579 -11.436 2.920 352 HB3 ALA 51 3HB ALA 51 4.779 -13.185 3.035 353 H GLN 52 H GLN 52 7.270 -12.184 5.526 354 HA GLN 52 HA GLN 52 9.119 -14.406 5.234 355 HB3 GLN 52 2HB GLN 52 8.382 -12.767 7.666 356 HG3 GLN 52 2HG GLN 52 10.983 -13.810 7.869 357 HE21 GLN 52 1HE2 GLN 52 9.192 -16.201 9.140 358 HE22 GLN 52 2HE2 GLN 52 8.817 -15.519 10.681 359 H SER 53 H SER 53 6.352 -13.656 7.360 360 HA SER 53 HA SER 53 6.060 -16.455 8.043 361 HB3 SER 53 2HB SER 53 5.074 -15.653 9.889 362 HG SER 53 HG SER 53 6.413 -13.886 9.745 363 H ASN 54 H ASN 54 5.288 -14.817 5.382 364 HA ASN 54 HA ASN 54 3.626 -14.881 3.801 365 HB3 ASN 54 2HB ASN 54 4.771 -17.071 3.568 366 HD21 ASN 54 1HD2 ASN 54 5.446 -18.140 5.407 367 HD22 ASN 54 2HD2 ASN 54 4.464 -19.310 6.214 368 H SER 55 H SER 55 2.633 -14.030 6.301 369 HA SER 55 HA SER 55 -0.119 -15.064 6.143 370 HB3 SER 55 2HB SER 55 0.866 -14.055 8.767 371 HG SER 55 HG SER 55 -0.806 -16.214 7.984 372 H ALA 56 H ALA 56 -1.603 -13.460 7.462 373 HA ALA 56 HA ALA 56 -1.433 -10.952 6.100 374 HB1 ALA 56 1HB ALA 56 -3.590 -10.628 6.730 375 HB2 ALA 56 2HB ALA 56 -3.508 -12.374 6.971 376 HB3 ALA 56 3HB ALA 56 -3.334 -11.285 8.347 377 H LYS 57 H LYS 57 -0.200 -12.124 9.038 378 HA LYS 57 HA LYS 57 -0.278 -9.769 10.604 379 HB3 LYS 57 2HB LYS 57 1.429 -10.854 11.978 380 HG3 LYS 57 2HG LYS 57 -1.004 -12.214 11.184 381 HD3 LYS 57 2HD LYS 57 1.076 -13.916 11.014 382 HE3 LYS 57 2HE LYS 57 0.256 -13.826 13.910 383 HZ1 LYS 57 3HZ LYS 57 1.789 -15.855 13.987 384 HZ2 LYS 57 1HZ LYS 57 1.444 -16.023 12.340 385 HZ3 LYS 57 2HZ LYS 57 0.193 -16.088 13.476 386 H GLU 58 H GLU 58 1.483 -10.563 7.828 387 HA GLU 58 HA GLU 58 3.820 -8.989 8.399 388 HB3 GLU 58 2HB GLU 58 3.684 -10.965 6.792 389 HG3 GLU 58 2HG GLU 58 1.695 -9.613 5.560 390 H TRP 59 H TRP 59 4.381 -6.996 7.475 391 HA TRP 59 HA TRP 59 2.349 -5.511 6.017 392 HB3 TRP 59 2HB TRP 59 1.659 -4.939 8.212 393 HD1 TRP 59 HD TRP 59 5.370 -3.796 8.468 394 HE1 TRP 59 1HE TRP 59 6.195 -4.344 10.844 395 HE3 TRP 59 3HE TRP 59 1.146 -6.015 10.304 396 HZ2 TRP 59 2HZ TRP 59 5.189 -5.557 13.186 397 HZ3 TRP 59 3HZ TRP 59 1.161 -6.843 12.621 398 HH2 TRP 59 HH TRP 59 3.142 -6.618 14.030 399 H LEU 60 H LEU 60 3.166 -3.815 4.808 400 HA LEU 60 HA LEU 60 6.102 -3.567 4.813 401 HB3 LEU 60 2HB LEU 60 4.122 -3.472 2.551 402 HG LEU 60 HG LEU 60 6.524 -1.992 2.595 403 HD11 LEU 60 1HD1 LEU 60 7.604 -4.219 2.178 404 HD12 LEU 60 2HD1 LEU 60 7.888 -3.000 0.935 405 HD13 LEU 60 3HD1 LEU 60 6.713 -4.287 0.658 406 HD21 LEU 60 3HD2 LEU 60 4.378 -2.684 0.670 407 HD22 LEU 60 1HD2 LEU 60 5.855 -1.970 0.024 408 HD23 LEU 60 2HD2 LEU 60 4.921 -1.107 1.247 409 H GLN 61 H GLN 61 6.934 -1.612 5.169 410 HA GLN 61 HA GLN 61 5.154 0.723 4.923 411 HB3 GLN 61 2HB GLN 61 5.565 0.234 7.269 412 HG3 GLN 61 2HG GLN 61 8.064 0.799 7.960 413 HE21 GLN 61 1HE2 GLN 61 9.431 -1.204 8.449 414 HE22 GLN 61 2HE2 GLN 61 8.549 -2.634 8.855 415 H VAL 62 H VAL 62 5.994 2.591 4.050 416 HA VAL 62 HA VAL 62 8.753 2.440 3.025 417 HB VAL 62 HB VAL 62 6.468 3.699 1.510 418 HG11 VAL 62 1HG1 VAL 62 9.236 2.884 0.629 419 HG12 VAL 62 2HG1 VAL 62 8.016 3.698 -0.351 420 HG13 VAL 62 3HG1 VAL 62 8.740 4.529 1.027 421 HG21 VAL 62 3HG2 VAL 62 7.507 0.896 1.482 422 HG22 VAL 62 1HG2 VAL 62 5.843 1.477 1.416 423 HG23 VAL 62 2HG2 VAL 62 6.884 1.618 -0.001 424 H ASP 63 H ASP 63 9.959 4.046 3.765 425 HA ASP 63 HA ASP 63 8.650 6.603 4.426 426 HB3 ASP 63 2HB ASP 63 10.087 6.891 6.277 427 H LEU 64 H LEU 64 9.352 8.340 3.368 428 HA LEU 64 HA LEU 64 11.931 8.155 1.951 429 HB3 LEU 64 2HB LEU 64 10.635 8.382 0.138 430 HG LEU 64 HG LEU 64 8.478 9.370 1.948 431 HD11 LEU 64 1HD1 LEU 64 8.926 10.248 -0.805 432 HD12 LEU 64 2HD1 LEU 64 7.880 10.917 0.446 433 HD13 LEU 64 3HD1 LEU 64 7.334 9.546 -0.519 434 HD21 LEU 64 3HD2 LEU 64 8.120 7.480 -0.321 435 HD22 LEU 64 1HD2 LEU 64 7.352 7.502 1.267 436 HD23 LEU 64 2HD2 LEU 64 9.012 6.929 1.099 437 H GLY 65 H GLY 65 9.887 10.023 4.041 438 HA2 GLY 65 2HA GLY 65 10.221 11.992 5.180 439 HA3 GLY 65 3HA GLY 65 11.915 11.523 5.172 440 H THR 66 H THR 66 10.219 12.087 2.191 441 HA THR 66 HA THR 66 11.857 14.497 1.784 442 HB THR 66 HB THR 66 12.254 12.645 0.189 443 HG1 THR 66 1HG THR 66 10.968 14.789 -1.157 444 HG21 THR 66 3HG2 THR 66 9.624 12.142 0.286 445 HG22 THR 66 1HG2 THR 66 10.638 11.663 -1.074 446 HG23 THR 66 2HG2 THR 66 9.668 13.134 -1.172 447 H GLN 67 H GLN 67 8.733 13.546 2.445 448 HA GLN 67 HA GLN 67 6.679 14.522 2.285 449 HB3 GLN 67 2HB GLN 67 8.006 17.188 2.002 450 HG3 GLN 67 2HG GLN 67 5.578 16.110 3.280 451 HE21 GLN 67 1HE2 GLN 67 4.520 17.155 4.984 452 HE22 GLN 67 2HE2 GLN 67 5.391 18.035 6.189 453 H ARG 68 H ARG 68 6.595 13.522 0.088 454 HA ARG 68 HA ARG 68 6.512 15.579 -2.019 455 HB3 ARG 68 2HB ARG 68 6.427 13.291 -3.430 456 HG3 ARG 68 2HG ARG 68 8.883 13.398 -3.680 457 HD3 ARG 68 2HD ARG 68 7.079 15.717 -3.928 458 HE ARG 68 HE ARG 68 9.900 16.161 -3.626 459 HH11 ARG 68 1HH1 ARG 68 6.996 17.219 -5.229 460 HH12 ARG 68 2HH1 ARG 68 7.577 18.829 -5.502 461 HH21 ARG 68 1HH2 ARG 68 10.676 18.277 -3.978 462 HH22 ARG 68 2HH2 ARG 68 9.671 19.429 -4.790 463 H GLN 69 H GLN 69 4.745 15.591 -3.466 464 HA GLN 69 HA GLN 69 2.268 14.693 -2.245 465 HB3 GLN 69 2HB GLN 69 2.942 16.542 -4.514 466 HG3 GLN 69 2HG GLN 69 0.286 15.323 -3.900 467 HE21 GLN 69 1HE2 GLN 69 -1.458 16.520 -3.717 468 HE22 GLN 69 2HE2 GLN 69 -1.615 18.174 -4.187 469 H VAL 70 H VAL 70 1.427 12.783 -2.719 470 HA VAL 70 HA VAL 70 2.281 11.320 -5.063 471 HB VAL 70 HB VAL 70 0.977 9.473 -4.190 472 HG11 VAL 70 1HG1 VAL 70 2.095 9.172 -2.029 473 HG12 VAL 70 2HG1 VAL 70 3.193 9.827 -3.245 474 HG13 VAL 70 3HG1 VAL 70 2.510 10.884 -2.009 475 HG21 VAL 70 3HG2 VAL 70 -0.993 10.451 -3.372 476 HG22 VAL 70 1HG2 VAL 70 -0.178 9.827 -1.939 477 HG23 VAL 70 2HG2 VAL 70 -0.111 11.549 -2.311 478 H THR 71 H THR 71 0.971 10.623 -6.750 479 HA THR 71 HA THR 71 -1.748 11.692 -6.907 480 HB THR 71 HB THR 71 0.092 12.024 -9.261 481 HG1 THR 71 1HG THR 71 -0.047 14.360 -8.368 482 HG21 THR 71 3HG2 THR 71 -2.625 12.969 -8.460 483 HG22 THR 71 1HG2 THR 71 -2.072 12.312 -10.000 484 HG23 THR 71 2HG2 THR 71 -1.654 13.965 -9.545 485 H GLY 72 H GLY 72 -0.586 9.011 -6.589 486 HA2 GLY 72 2HA GLY 72 -2.277 7.467 -8.058 487 HA3 GLY 72 3HA GLY 72 -0.888 7.664 -9.117 488 H ILE 73 H ILE 73 -1.580 5.161 -8.337 489 HA ILE 73 HA ILE 73 0.779 4.353 -6.870 490 HB ILE 73 HB ILE 73 -0.656 2.805 -5.406 491 HG13 ILE 73 2HG1 ILE 73 -2.722 3.928 -6.835 492 HG21 ILE 73 1HG2 ILE 73 0.686 4.743 -4.620 493 HG22 ILE 73 2HG2 ILE 73 -0.745 5.756 -4.803 494 HG23 ILE 73 3HG2 ILE 73 -0.746 4.428 -3.641 495 HD11 ILE 73 3HD1 ILE 73 -3.629 2.151 -5.874 496 HD12 ILE 73 1HD1 ILE 73 -2.482 2.198 -4.536 497 HD13 ILE 73 2HD1 ILE 73 -3.948 3.178 -4.476 498 H ILE 74 H ILE 74 1.354 2.190 -7.211 499 HA ILE 74 HA ILE 74 -0.380 0.484 -8.788 500 HB ILE 74 HB ILE 74 0.838 1.939 -10.441 501 HG13 ILE 74 2HG1 ILE 74 0.403 -0.865 -10.427 502 HG21 ILE 74 1HG2 ILE 74 3.266 0.343 -9.663 503 HG22 ILE 74 2HG2 ILE 74 3.165 1.682 -10.804 504 HG23 ILE 74 3HG2 ILE 74 2.958 1.977 -9.078 505 HD11 ILE 74 3HD1 ILE 74 -0.607 0.837 -11.959 506 HD12 ILE 74 1HD1 ILE 74 0.915 0.834 -12.849 507 HD13 ILE 74 2HD1 ILE 74 -0.046 -0.641 -12.738 508 H THR 75 H THR 75 0.166 -1.684 -8.686 509 HA THR 75 HA THR 75 2.520 -2.364 -7.052 510 HB THR 75 HB THR 75 0.211 -2.496 -5.869 511 HG1 THR 75 1HG THR 75 2.245 -3.459 -5.154 512 HG21 THR 75 3HG2 THR 75 -0.030 -5.256 -6.833 513 HG22 THR 75 1HG2 THR 75 -0.446 -4.031 -8.031 514 HG23 THR 75 2HG2 THR 75 -1.282 -4.067 -6.478 515 H GLN 76 H GLN 76 3.342 -4.527 -7.362 516 HA GLN 76 HA GLN 76 2.446 -5.882 -9.798 517 HB3 GLN 76 2HB GLN 76 5.365 -5.800 -9.512 518 HG3 GLN 76 2HG GLN 76 3.404 -5.446 -11.744 519 HE21 GLN 76 1HE2 GLN 76 4.750 -3.164 -11.455 520 HE22 GLN 76 2HE2 GLN 76 6.001 -3.021 -12.638 521 H GLY 77 H GLY 77 2.476 -8.055 -9.655 522 HA2 GLY 77 2HA GLY 77 3.318 -9.210 -7.114 523 HA3 GLY 77 3HA GLY 77 2.355 -10.003 -8.353 524 H ALA 78 H ALA 78 4.136 -11.605 -7.405 525 HA ALA 78 HA ALA 78 6.281 -11.636 -9.418 526 HB1 ALA 78 1HB ALA 78 7.827 -11.439 -7.840 527 HB2 ALA 78 2HB ALA 78 6.593 -11.437 -6.580 528 HB3 ALA 78 3HB ALA 78 7.271 -12.963 -7.146 529 H ARG 79 H ARG 79 7.104 -13.764 -9.924 530 HA ARG 79 HA ARG 79 5.291 -15.960 -9.191 531 HB3 ARG 79 2HB ARG 79 4.771 -15.022 -11.466 532 HG3 ARG 79 2HG ARG 79 7.431 -16.226 -12.202 533 HD3 ARG 79 2HD ARG 79 5.267 -14.952 -13.872 534 HE ARG 79 HE ARG 79 7.959 -14.964 -14.458 535 HH11 ARG 79 1HH1 ARG 79 5.050 -16.257 -15.870 536 HH12 ARG 79 2HH1 ARG 79 5.648 -16.179 -17.494 537 HH21 ARG 79 1HH2 ARG 79 8.758 -14.857 -16.592 538 HH22 ARG 79 2HH2 ARG 79 7.758 -15.383 -17.902 539 H ASP 80 H ASP 80 6.209 -18.038 -9.180 540 HA ASP 80 HA ASP 80 9.155 -18.049 -9.162 541 HB3 ASP 80 2HB ASP 80 7.614 -20.160 -7.733 542 H PHE 81 H PHE 81 7.742 -18.417 -11.556 543 HA PHE 81 HA PHE 81 7.690 -19.780 -13.376 544 HB3 PHE 81 2HB PHE 81 9.337 -21.504 -13.571 545 HD1 PHE 81 2HD PHE 81 10.350 -19.609 -14.727 546 HD2 PHE 81 1HD PHE 81 10.788 -20.142 -10.527 547 HE1 PHE 81 2HE PHE 81 12.208 -17.997 -14.720 548 HE2 PHE 81 1HE PHE 81 12.646 -18.530 -10.512 549 HZ PHE 81 HZ PHE 81 13.360 -17.456 -12.611 550 H GLY 82 H GLY 82 5.523 -20.325 -13.259 551 HA2 GLY 82 2HA GLY 82 3.957 -22.067 -13.463 552 HA3 GLY 82 3HA GLY 82 5.013 -23.099 -12.510 553 H HIS 83 H HIS 83 5.400 -21.436 -10.289 554 HA HIS 83 HA HIS 83 2.780 -21.704 -9.027 555 HB3 HIS 83 2HB HIS 83 4.238 -21.188 -6.926 556 HD1 HIS 83 1HD HIS 83 4.928 -23.965 -9.449 557 HD2 HIS 83 2HD HIS 83 3.716 -23.419 -5.512 558 HE1 HIS 83 1HE HIS 83 4.507 -26.275 -8.548 559 H ILE 84 H ILE 84 3.118 -19.535 -10.817 560 HA ILE 84 HA ILE 84 3.871 -17.098 -9.955 561 HB ILE 84 HB ILE 84 1.196 -17.679 -11.232 562 HG13 ILE 84 2HG1 ILE 84 3.814 -18.093 -12.200 563 HG21 ILE 84 1HG2 ILE 84 1.016 -15.476 -10.567 564 HG22 ILE 84 2HG2 ILE 84 2.738 -15.163 -10.775 565 HG23 ILE 84 3HG2 ILE 84 1.693 -15.313 -12.187 566 HD11 ILE 84 3HD1 ILE 84 1.912 -17.825 -14.337 567 HD12 ILE 84 1HD1 ILE 84 2.725 -19.265 -13.726 568 HD13 ILE 84 2HD1 ILE 84 1.221 -18.720 -12.983 569 H GLN 85 H GLN 85 3.451 -15.755 -8.322 570 HA GLN 85 HA GLN 85 1.081 -16.300 -6.657 571 HB3 GLN 85 2HB GLN 85 2.331 -15.590 -4.719 572 HG3 GLN 85 2HG GLN 85 2.853 -17.924 -5.965 573 HE21 GLN 85 1HE2 GLN 85 5.607 -17.769 -4.223 574 HE22 GLN 85 2HE2 GLN 85 6.767 -17.698 -5.502 575 H TYR 86 H TYR 86 0.329 -14.379 -5.398 576 HA TYR 86 HA TYR 86 1.004 -11.749 -6.052 577 HB3 TYR 86 2HB TYR 86 0.239 -12.075 -8.272 578 HD1 TYR 86 2HD TYR 86 -0.053 -14.392 -8.950 579 HD2 TYR 86 1HD TYR 86 -3.176 -12.288 -6.969 580 HE1 TYR 86 2HE TYR 86 -1.649 -16.140 -9.619 581 HE2 TYR 86 1HE TYR 86 -4.779 -14.030 -7.632 582 HH TYR 86 HH TYR 86 -4.364 -16.113 -9.983 583 H VAL 87 H VAL 87 -0.337 -10.202 -5.023 584 HA VAL 87 HA VAL 87 -1.986 -11.362 -2.908 585 HB VAL 87 HB VAL 87 -1.174 -8.472 -3.179 586 HG11 VAL 87 1HG1 VAL 87 -2.621 -10.071 -1.211 587 HG12 VAL 87 2HG1 VAL 87 -1.316 -9.107 -0.518 588 HG13 VAL 87 3HG1 VAL 87 -2.591 -8.325 -1.453 589 HG21 VAL 87 3HG2 VAL 87 0.673 -9.028 -1.609 590 HG22 VAL 87 1HG2 VAL 87 0.313 -10.736 -1.855 591 HG23 VAL 87 2HG2 VAL 87 0.863 -9.748 -3.208 592 H ALA 88 H ALA 88 -4.119 -10.861 -2.574 593 HA ALA 88 HA ALA 88 -5.496 -9.629 -4.849 594 HB1 ALA 88 1HB ALA 88 -6.533 -11.636 -4.526 595 HB2 ALA 88 2HB ALA 88 -6.263 -11.624 -2.783 596 HB3 ALA 88 3HB ALA 88 -7.528 -10.616 -3.486 597 H SER 89 H SER 89 -6.119 -9.750 -1.337 598 HA SER 89 HA SER 89 -7.182 -7.034 -1.474 599 HB3 SER 89 2HB SER 89 -8.246 -7.463 0.586 600 HG SER 89 HG SER 89 -9.474 -9.003 -0.136 601 H TYR 90 H TYR 90 -6.049 -5.319 -0.867 602 HA TYR 90 HA TYR 90 -3.929 -5.611 1.128 603 HB3 TYR 90 2HB TYR 90 -3.149 -3.816 -1.043 604 HD1 TYR 90 2HD TYR 90 -1.889 -3.696 1.390 605 HD2 TYR 90 1HD TYR 90 -1.384 -6.714 -1.566 606 HE1 TYR 90 2HE TYR 90 0.333 -4.216 2.308 607 HE2 TYR 90 1HE TYR 90 0.838 -7.243 -0.656 608 HH TYR 90 HH TYR 90 2.598 -5.407 1.084 609 H LYS 91 H LYS 91 -3.561 -3.796 2.366 610 HA LYS 91 HA LYS 91 -5.546 -1.657 2.058 611 HB3 LYS 91 2HB LYS 91 -4.213 -1.358 4.516 612 HG3 LYS 91 2HG LYS 91 -6.502 -2.765 5.128 613 HD3 LYS 91 2HD LYS 91 -5.580 -0.028 5.086 614 HE3 LYS 91 2HE LYS 91 -7.800 1.029 5.182 615 HZ1 LYS 91 3HZ LYS 91 -8.117 -0.001 2.572 616 HZ2 LYS 91 1HZ LYS 91 -6.471 0.230 2.886 617 HZ3 LYS 91 2HZ LYS 91 -7.552 1.520 3.051 618 H VAL 92 H VAL 92 -4.943 0.312 1.441 619 HA VAL 92 HA VAL 92 -2.070 0.939 1.398 620 HB VAL 92 HB VAL 92 -3.038 1.029 -0.799 621 HG11 VAL 92 1HG1 VAL 92 -4.852 3.198 -0.646 622 HG12 VAL 92 2HG1 VAL 92 -5.180 1.525 -1.101 623 HG13 VAL 92 3HG1 VAL 92 -5.316 2.024 0.585 624 HG21 VAL 92 3HG2 VAL 92 -2.267 3.114 -1.463 625 HG22 VAL 92 1HG2 VAL 92 -2.887 3.915 -0.020 626 HG23 VAL 92 2HG2 VAL 92 -1.460 2.884 0.088 627 H ALA 93 H ALA 93 -1.383 2.231 2.960 628 HA ALA 93 HA ALA 93 -3.182 4.360 3.920 629 HB1 ALA 93 1HB ALA 93 -1.139 3.458 5.815 630 HB2 ALA 93 2HB ALA 93 -2.846 3.819 6.069 631 HB3 ALA 93 3HB ALA 93 -2.363 2.249 5.430 632 H HIS 94 H HIS 94 -2.310 6.375 4.247 633 HA HIS 94 HA HIS 94 0.530 6.714 3.537 634 HB3 HIS 94 2HB HIS 94 -0.095 8.846 2.426 635 HD1 HIS 94 1HD HIS 94 0.421 8.446 0.052 636 HD2 HIS 94 2HD HIS 94 -2.203 5.595 1.552 637 HE1 HIS 94 1HE HIS 94 -0.001 6.854 -1.848 638 H SER 95 H SER 95 1.694 8.206 4.693 639 HA SER 95 HA SER 95 0.272 9.590 6.870 640 HB3 SER 95 2HB SER 95 1.729 8.835 8.468 641 HG SER 95 HG SER 95 1.612 6.920 6.434 642 H ASP 96 H ASP 96 0.428 11.706 6.599 643 HA ASP 96 HA ASP 96 2.591 12.842 5.032 644 HB3 ASP 96 2HB ASP 96 0.449 13.748 4.543 645 H ASP 97 H ASP 97 1.456 12.811 8.359 646 HA ASP 97 HA ASP 97 3.630 14.587 9.174 647 HB3 ASP 97 2HB ASP 97 2.176 13.688 11.431 648 H GLY 98 H GLY 98 2.909 11.274 8.938 649 HA2 GLY 98 2HA GLY 98 4.602 9.623 9.243 650 HA3 GLY 98 3HA GLY 98 5.339 10.649 10.464 651 H VAL 99 H VAL 99 2.759 11.171 11.782 652 HA VAL 99 HA VAL 99 2.596 8.638 13.254 653 HB VAL 99 HB VAL 99 3.139 10.552 14.630 654 HG11 VAL 99 1HG1 VAL 99 1.291 11.893 12.941 655 HG12 VAL 99 2HG1 VAL 99 0.725 12.044 14.606 656 HG13 VAL 99 3HG1 VAL 99 2.350 12.575 14.174 657 HG21 VAL 99 3HG2 VAL 99 1.379 8.717 15.298 658 HG22 VAL 99 1HG2 VAL 99 1.694 10.095 16.353 659 HG23 VAL 99 2HG2 VAL 99 0.273 10.091 15.308 660 H GLN 100 H GLN 100 0.760 10.767 11.242 661 HA GLN 100 HA GLN 100 -1.766 9.489 11.945 662 HB3 GLN 100 2HB GLN 100 -2.805 11.147 10.506 663 HG3 GLN 100 2HG GLN 100 -0.656 12.488 12.130 664 HE21 GLN 100 1HE2 GLN 100 -0.573 14.514 11.464 665 HE22 GLN 100 2HE2 GLN 100 -1.933 15.520 11.110 666 H TRP 101 H TRP 101 -1.811 7.469 11.106 667 HA TRP 101 HA TRP 101 -1.008 7.051 8.330 668 HB3 TRP 101 2HB TRP 101 -0.989 4.736 8.796 669 HD1 TRP 101 HD TRP 101 1.162 7.005 9.587 670 HE1 TRP 101 1HE TRP 101 2.832 6.509 11.482 671 HE3 TRP 101 3HE TRP 101 -1.396 3.273 11.967 672 HZ2 TRP 101 2HZ TRP 101 3.039 4.766 13.692 673 HZ3 TRP 101 3HZ TRP 101 -0.392 2.243 13.963 674 HH2 TRP 101 HH TRP 101 1.779 2.975 14.806 675 H THR 102 H THR 102 -2.615 7.870 7.065 676 HA THR 102 HA THR 102 -5.393 7.238 7.620 677 HB THR 102 HB THR 102 -4.128 8.811 5.369 678 HG1 THR 102 1HG THR 102 -4.115 10.254 6.923 679 HG21 THR 102 3HG2 THR 102 -6.188 7.857 4.565 680 HG22 THR 102 1HG2 THR 102 -6.459 9.564 4.912 681 HG23 THR 102 2HG2 THR 102 -7.033 8.333 6.038 682 H VAL 103 H VAL 103 -5.952 5.191 7.168 683 HA VAL 103 HA VAL 103 -4.876 3.836 4.834 684 HB VAL 103 HB VAL 103 -6.054 1.866 5.631 685 HG11 VAL 103 1HG1 VAL 103 -4.395 3.431 7.557 686 HG12 VAL 103 2HG1 VAL 103 -5.076 1.881 8.054 687 HG13 VAL 103 3HG1 VAL 103 -3.996 1.965 6.662 688 HG21 VAL 103 3HG2 VAL 103 -7.860 1.947 6.931 689 HG22 VAL 103 1HG2 VAL 103 -7.011 2.894 8.153 690 HG23 VAL 103 2HG2 VAL 103 -7.796 3.704 6.797 691 H TYR 104 H TYR 104 -7.527 5.784 5.566 692 HA TYR 104 HA TYR 104 -9.413 6.368 4.437 693 HB3 TYR 104 2HB TYR 104 -9.435 6.030 2.000 694 HD1 TYR 104 1HD TYR 104 -9.104 8.454 2.682 695 HD2 TYR 104 2HD TYR 104 -5.864 5.750 2.142 696 HE1 TYR 104 1HE TYR 104 -7.561 10.356 2.460 697 HE2 TYR 104 2HE TYR 104 -4.312 7.645 1.919 698 HH TYR 104 HH TYR 104 -5.421 10.900 1.602 699 H GLU 105 H GLU 105 -10.901 5.169 5.577 700 HA GLU 105 HA GLU 105 -11.676 2.596 4.366 701 HB3 GLU 105 2HB GLU 105 -12.549 1.955 6.594 702 HG3 GLU 105 2HG GLU 105 -9.673 2.527 6.184 703 H GLU 106 H GLU 106 -13.952 2.083 4.413 704 HA GLU 106 HA GLU 106 -15.573 4.277 3.632 705 HB3 GLU 106 2HB GLU 106 -16.514 1.500 4.352 706 HG3 GLU 106 2HG GLU 106 -17.597 3.599 2.491 707 H GLN 107 H GLN 107 -15.740 2.093 6.443 708 HA GLN 107 HA GLN 107 -16.594 4.223 8.158 709 HB3 GLN 107 2HB GLN 107 -18.751 3.878 7.272 710 HG3 GLN 107 2HG GLN 107 -18.522 0.914 7.706 711 HE21 GLN 107 1HE2 GLN 107 -20.017 0.140 5.627 712 HE22 GLN 107 2HE2 GLN 107 -21.634 0.730 5.771 713 H GLY 108 H GLY 108 -16.608 0.676 7.802 714 HA2 GLY 108 2HA GLY 108 -14.819 0.386 10.038 715 HA3 GLY 108 3HA GLY 108 -16.459 -0.133 10.400 716 H SER 109 H SER 109 -15.463 -0.508 7.147 717 HA SER 109 HA SER 109 -14.960 -3.373 7.619 718 HB3 SER 109 2HB SER 109 -16.061 -3.826 5.453 719 HG SER 109 HG SER 109 -18.005 -3.769 6.330 720 H SER 110 H SER 110 -13.774 -0.477 6.389 721 HA SER 110 HA SER 110 -11.849 0.076 5.305 722 HB3 SER 110 2HB SER 110 -10.051 -1.235 5.734 723 HG SER 110 HG SER 110 -10.410 -2.391 7.493 724 H LYS 111 H LYS 111 -11.587 0.551 3.221 725 HA LYS 111 HA LYS 111 -12.999 -1.039 1.240 726 HB3 LYS 111 2HB LYS 111 -13.328 1.350 1.147 727 HG3 LYS 111 2HG LYS 111 -10.935 1.810 2.089 728 HD3 LYS 111 2HD LYS 111 -10.429 1.211 -0.703 729 HE3 LYS 111 2HE LYS 111 -8.681 3.224 -0.626 730 HZ1 LYS 111 3HZ LYS 111 -10.157 4.439 -2.096 731 HZ2 LYS 111 1HZ LYS 111 -11.477 3.513 -1.584 732 HZ3 LYS 111 2HZ LYS 111 -10.214 2.784 -2.442 733 H VAL 112 H VAL 112 -10.365 -1.811 2.558 734 HA VAL 112 HA VAL 112 -8.096 -1.744 1.248 735 HB VAL 112 HB VAL 112 -7.590 -3.948 1.822 736 HG11 VAL 112 1HG1 VAL 112 -8.112 -3.937 4.013 737 HG12 VAL 112 2HG1 VAL 112 -8.849 -2.380 3.627 738 HG13 VAL 112 3HG1 VAL 112 -9.846 -3.834 3.707 739 HG21 VAL 112 3HG2 VAL 112 -10.454 -4.503 1.179 740 HG22 VAL 112 1HG2 VAL 112 -8.996 -5.303 0.592 741 HG23 VAL 112 2HG2 VAL 112 -9.564 -5.599 2.236 742 H PHE 113 H PHE 113 -7.228 -2.085 -0.714 743 HA PHE 113 HA PHE 113 -8.933 -2.456 -2.958 744 HB3 PHE 113 2HB PHE 113 -6.622 -2.640 -4.157 745 HD1 PHE 113 2HD PHE 113 -6.985 -0.056 -1.502 746 HD2 PHE 113 1HD PHE 113 -7.252 -0.995 -5.646 747 HE1 PHE 113 2HE PHE 113 -7.404 2.315 -2.009 748 HE2 PHE 113 1HE PHE 113 -7.671 1.375 -6.159 749 HZ PHE 113 HZ PHE 113 -7.749 3.032 -4.340 750 H GLN 114 H GLN 114 -9.744 -4.326 -3.612 751 HA GLN 114 HA GLN 114 -8.213 -6.788 -3.113 752 HB3 GLN 114 2HB GLN 114 -11.170 -6.317 -3.485 753 HG3 GLN 114 2HG GLN 114 -10.731 -8.958 -2.659 754 HE21 GLN 114 1HE2 GLN 114 -11.261 -6.873 -5.455 755 HE22 GLN 114 2HE2 GLN 114 -12.694 -7.668 -6.002 756 H GLY 115 H GLY 115 -7.718 -8.171 -4.758 757 HA2 GLY 115 2HA GLY 115 -7.931 -9.060 -6.949 758 HA3 GLY 115 3HA GLY 115 -8.759 -7.588 -7.436 759 H ASN 116 H ASN 116 -6.342 -9.102 -8.471 760 HA ASN 116 HA ASN 116 -4.692 -6.728 -8.868 761 HB3 ASN 116 2HB ASN 116 -3.441 -9.376 -8.125 762 HD21 ASN 116 1HD2 ASN 116 -1.394 -9.448 -8.667 763 HD22 ASN 116 2HD2 ASN 116 -0.368 -8.091 -8.969 764 H LEU 117 H LEU 117 -3.072 -7.076 -10.634 765 HA LEU 117 HA LEU 117 -4.329 -8.628 -12.770 766 HB3 LEU 117 2HB LEU 117 -2.883 -7.328 -14.271 767 HG LEU 117 HG LEU 117 -4.201 -5.408 -12.358 768 HD11 LEU 117 1HD1 LEU 117 -2.755 -4.367 -14.016 769 HD12 LEU 117 2HD1 LEU 117 -4.451 -4.024 -14.357 770 HD13 LEU 117 3HD1 LEU 117 -3.589 -5.235 -15.305 771 HD21 LEU 117 3HD2 LEU 117 -5.364 -7.087 -14.568 772 HD22 LEU 117 1HD2 LEU 117 -6.151 -5.642 -13.935 773 HD23 LEU 117 2HD2 LEU 117 -5.857 -7.021 -12.875 774 H ASP 118 H ASP 118 -2.730 -9.881 -10.646 775 HA ASP 118 HA ASP 118 -1.220 -11.571 -10.440 776 HB3 ASP 118 2HB ASP 118 -0.710 -12.910 -12.343 777 H ASN 119 H ASN 119 1.089 -12.234 -11.738 778 HA ASN 119 HA ASN 119 2.766 -9.956 -11.086 779 HB3 ASN 119 2HB ASN 119 3.105 -12.534 -10.517 780 HD21 ASN 119 1HD2 ASN 119 5.799 -11.758 -12.479 781 HD22 ASN 119 2HD2 ASN 119 5.648 -13.067 -13.596 782 H ASN 120 H ASN 120 1.180 -10.889 -13.776 783 HA ASN 120 HA ASN 120 3.268 -10.504 -15.726 784 HB3 ASN 120 2HB ASN 120 1.128 -10.391 -17.263 785 HD21 ASN 120 1HD2 ASN 120 -0.026 -13.094 -16.147 786 HD22 ASN 120 2HD2 ASN 120 1.133 -14.240 -16.718 787 H SER 121 H SER 121 0.471 -8.659 -14.561 788 HA SER 121 HA SER 121 1.695 -6.244 -15.723 789 HB3 SER 121 2HB SER 121 -0.164 -5.813 -16.896 790 HG SER 121 HG SER 121 -1.264 -8.170 -15.758 791 H HIS 122 H HIS 122 1.190 -4.246 -14.610 792 HA HIS 122 HA HIS 122 0.825 -4.692 -11.728 793 HB3 HIS 122 2HB HIS 122 2.956 -3.656 -12.404 794 HD1 HIS 122 1HD HIS 122 0.513 -2.492 -14.642 795 HD2 HIS 122 2HD HIS 122 3.879 -0.764 -12.927 796 HE1 HIS 122 1HE HIS 122 1.104 -0.553 -16.130 797 H LYS 123 H LYS 123 -0.308 -2.994 -10.508 798 HA LYS 123 HA LYS 123 -1.897 -1.005 -11.597 799 HB3 LYS 123 2HB LYS 123 -4.015 -2.809 -11.031 800 HG3 LYS 123 2HG LYS 123 -3.438 -2.253 -13.859 801 HD3 LYS 123 2HD LYS 123 -5.781 -1.461 -12.138 802 HE3 LYS 123 2HE LYS 123 -6.623 -2.196 -14.672 803 HZ1 LYS 123 3HZ LYS 123 -7.625 -0.251 -14.433 804 HZ2 LYS 123 1HZ LYS 123 -6.162 0.590 -14.544 805 HZ3 LYS 123 2HZ LYS 123 -6.707 0.038 -13.041 806 H LYS 124 H LYS 124 -3.626 -0.266 -10.085 807 HA LYS 124 HA LYS 124 -3.961 -1.348 -7.517 808 HB3 LYS 124 2HB LYS 124 -2.216 1.081 -7.365 809 HG3 LYS 124 2HG LYS 124 -3.378 0.189 -5.342 810 HD3 LYS 124 2HD LYS 124 -1.680 -1.856 -4.573 811 HE3 LYS 124 2HE LYS 124 -4.280 -2.589 -5.795 812 HZ1 LYS 124 3HZ LYS 124 -3.086 -2.995 -3.106 813 HZ2 LYS 124 1HZ LYS 124 -3.135 -4.133 -4.356 814 HZ3 LYS 124 2HZ LYS 124 -4.570 -3.626 -3.618 815 H ASN 125 H ASN 125 -3.380 1.986 -8.648 816 HA ASN 125 HA ASN 125 -6.092 2.659 -8.955 817 HB3 ASN 125 2HB ASN 125 -5.105 4.042 -6.518 818 HD21 ASN 125 1HD2 ASN 125 -6.717 5.118 -5.568 819 HD22 ASN 125 2HD2 ASN 125 -8.378 5.028 -6.038 820 H ILE 126 H ILE 126 -6.411 5.008 -9.256 821 HA ILE 126 HA ILE 126 -3.996 6.186 -10.405 822 HB ILE 126 HB ILE 126 -6.526 7.654 -10.700 823 HG13 ILE 126 2HG1 ILE 126 -7.497 5.461 -10.771 824 HG21 ILE 126 1HG2 ILE 126 -4.127 7.721 -11.908 825 HG22 ILE 126 2HG2 ILE 126 -4.998 6.663 -13.018 826 HG23 ILE 126 3HG2 ILE 126 -5.616 8.278 -12.670 827 HD11 ILE 126 3HD1 ILE 126 -8.282 5.226 -13.023 828 HD12 ILE 126 1HD1 ILE 126 -8.198 6.940 -12.616 829 HD13 ILE 126 2HD1 ILE 126 -6.952 6.212 -13.631 830 H PHE 127 H PHE 127 -4.647 8.861 -10.368 831 HA PHE 127 HA PHE 127 -3.549 9.817 -8.063 832 HB3 PHE 127 2HB PHE 127 -3.815 11.274 -9.946 833 HD1 PHE 127 2HD PHE 127 -5.073 10.135 -11.756 834 HD2 PHE 127 1HD PHE 127 -7.020 12.353 -8.690 835 HE1 PHE 127 2HE PHE 127 -7.108 10.247 -13.135 836 HE2 PHE 127 1HE PHE 127 -9.060 12.467 -10.063 837 HZ PHE 127 HZ PHE 127 -9.105 11.415 -12.289 838 H GLU 128 H GLU 128 -7.034 9.538 -8.731 839 HA GLU 128 HA GLU 128 -8.855 9.593 -7.359 840 HB3 GLU 128 2HB GLU 128 -6.858 8.164 -5.606 841 HG3 GLU 128 2HG GLU 128 -8.489 8.840 -4.061 842 H LYS 129 H LYS 129 -6.520 9.851 -4.724 843 HA LYS 129 HA LYS 129 -7.376 12.624 -4.265 844 HB3 LYS 129 2HB LYS 129 -7.203 11.932 -1.741 845 HG3 LYS 129 2HG LYS 129 -9.601 10.939 -3.260 846 HD3 LYS 129 2HD LYS 129 -9.750 12.448 -0.712 847 HE3 LYS 129 2HE LYS 129 -11.589 10.913 -0.294 848 HZ1 LYS 129 3HZ LYS 129 -13.044 11.641 -1.967 849 HZ2 LYS 129 1HZ LYS 129 -11.811 11.772 -3.118 850 HZ3 LYS 129 2HZ LYS 129 -11.888 12.868 -1.831 851 HA PRO 130 HA PRO 130 -2.783 12.364 -4.210 852 HB3 PRO 130 2HB PRO 130 -2.700 13.285 -6.314 853 HG3 PRO 130 2HG PRO 130 -4.451 14.584 -7.124 854 HD3 PRO 130 2HD PRO 130 -5.630 12.748 -6.383 855 H PHE 131 H PHE 131 -1.285 13.533 -2.962 856 HA PHE 131 HA PHE 131 -1.677 15.982 -1.724 857 HB3 PHE 131 2HB PHE 131 -2.011 14.504 0.634 858 HD1 PHE 131 1HD PHE 131 -1.911 17.279 0.206 859 HD2 PHE 131 2HD PHE 131 -5.276 14.695 -0.129 860 HE1 PHE 131 1HE PHE 131 -3.409 19.178 0.654 861 HE2 PHE 131 2HE PHE 131 -6.780 16.590 0.318 862 HZ PHE 131 HZ PHE 131 -5.847 18.836 0.710 863 H MET 132 H MET 132 -0.170 16.322 0.152 864 HA MET 132 HA MET 132 2.376 15.266 -0.474 865 HB3 MET 132 2HB MET 132 2.997 16.397 1.763 866 HG3 MET 132 2HG MET 132 2.301 17.552 -0.768 867 HE1 MET 132 3HE MET 132 1.064 18.972 -1.618 868 HE2 MET 132 1HE MET 132 0.007 20.166 -0.867 869 HE3 MET 132 2HE MET 132 1.651 20.610 -1.326 870 H ALA 133 H ALA 133 3.763 13.960 0.807 871 HA ALA 133 HA ALA 133 2.729 12.530 3.079 872 HB1 ALA 133 1HB ALA 133 2.536 11.379 0.413 873 HB2 ALA 133 2HB ALA 133 3.421 10.355 1.544 874 HB3 ALA 133 3HB ALA 133 1.779 10.873 1.923 875 H ARG 134 H ARG 134 4.327 11.425 4.226 876 HA ARG 134 HA ARG 134 7.072 11.846 3.240 877 HB3 ARG 134 2HB ARG 134 6.479 13.262 5.181 878 HG3 ARG 134 2HG ARG 134 5.790 10.641 6.392 879 HD3 ARG 134 2HD ARG 134 6.099 11.641 8.644 880 HE ARG 134 HE ARG 134 8.177 10.584 7.085 881 HH11 ARG 134 1HH1 ARG 134 7.691 12.429 9.996 882 HH12 ARG 134 2HH1 ARG 134 9.144 11.864 10.753 883 HH21 ARG 134 1HH2 ARG 134 10.093 9.833 8.069 884 HH22 ARG 134 2HH2 ARG 134 10.510 10.388 9.655 885 H TYR 135 H TYR 135 4.775 9.618 4.521 886 HA TYR 135 HA TYR 135 6.451 7.388 3.899 887 HB3 TYR 135 2HB TYR 135 6.489 8.408 6.595 888 HD1 TYR 135 2HD TYR 135 6.311 4.787 5.777 889 HD2 TYR 135 1HD TYR 135 4.789 7.976 8.147 890 HE1 TYR 135 2HE TYR 135 5.035 3.171 7.123 891 HE2 TYR 135 1HE TYR 135 3.509 6.369 9.499 892 HH TYR 135 HH TYR 135 3.834 2.888 9.010 893 H VAL 136 H VAL 136 5.192 5.771 3.244 894 HA VAL 136 HA VAL 136 2.361 5.800 4.064 895 HB VAL 136 HB VAL 136 1.741 4.896 1.978 896 HG11 VAL 136 1HG1 VAL 136 2.390 7.304 1.973 897 HG12 VAL 136 2HG1 VAL 136 3.960 6.828 1.324 898 HG13 VAL 136 3HG1 VAL 136 2.491 6.525 0.394 899 HG21 VAL 136 3HG2 VAL 136 3.087 3.233 1.274 900 HG22 VAL 136 1HG2 VAL 136 3.868 4.513 0.347 901 HG23 VAL 136 2HG2 VAL 136 4.544 4.008 1.896 902 H ARG 137 H ARG 137 1.344 3.870 4.608 903 HA ARG 137 HA ARG 137 3.114 1.546 4.980 904 HB3 ARG 137 2HB ARG 137 0.933 2.392 6.889 905 HG3 ARG 137 2HG ARG 137 3.220 0.588 7.544 906 HD3 ARG 137 2HD ARG 137 1.584 1.666 9.225 907 HE ARG 137 HE ARG 137 -0.342 0.391 7.724 908 HH11 ARG 137 1HH1 ARG 137 0.704 0.381 11.044 909 HH12 ARG 137 2HH1 ARG 137 -0.864 0.003 11.674 910 HH21 ARG 137 1HH2 ARG 137 -2.412 -0.108 8.541 911 HH22 ARG 137 2HH2 ARG 137 -2.637 -0.276 10.249 912 H VAL 138 H VAL 138 2.310 -0.407 4.410 913 HA VAL 138 HA VAL 138 -0.526 -0.546 3.629 914 HB VAL 138 HB VAL 138 0.432 -2.268 1.871 915 HG11 VAL 138 1HG1 VAL 138 0.788 -0.120 0.346 916 HG12 VAL 138 2HG1 VAL 138 -0.807 -0.616 0.913 917 HG13 VAL 138 3HG1 VAL 138 0.065 0.673 1.744 918 HG21 VAL 138 3HG2 VAL 138 2.760 -2.041 2.614 919 HG22 VAL 138 1HG2 VAL 138 2.562 -1.552 0.931 920 HG23 VAL 138 2HG2 VAL 138 2.723 -0.330 2.191 921 H LEU 139 H LEU 139 -1.519 -2.591 3.812 922 HA LEU 139 HA LEU 139 -0.003 -4.729 5.090 923 HB3 LEU 139 2HB LEU 139 -2.599 -3.813 6.289 924 HG LEU 139 HG LEU 139 -0.548 -5.788 7.093 925 HD11 LEU 139 1HD1 LEU 139 -1.083 -5.488 9.477 926 HD12 LEU 139 2HD1 LEU 139 -1.942 -4.000 9.080 927 HD13 LEU 139 3HD1 LEU 139 -0.204 -4.116 8.803 928 HD21 LEU 139 3HD2 LEU 139 -2.371 -7.046 6.995 929 HD22 LEU 139 1HD2 LEU 139 -3.377 -5.625 6.710 930 HD23 LEU 139 2HD2 LEU 139 -3.036 -6.148 8.360 931 HA PRO 140 HA PRO 140 -2.572 -6.860 2.127 932 HB3 PRO 140 2HB PRO 140 -0.692 -8.068 1.592 933 HG3 PRO 140 2HG PRO 140 0.962 -8.476 3.175 934 HD3 PRO 140 2HD PRO 140 0.718 -6.199 3.434 935 H VAL 141 H VAL 141 -4.438 -8.021 2.258 936 HA VAL 141 HA VAL 141 -5.179 -9.059 4.917 937 HB VAL 141 HB VAL 141 -7.006 -7.896 2.809 938 HG11 VAL 141 1HG1 VAL 141 -7.520 -9.184 5.468 939 HG12 VAL 141 2HG1 VAL 141 -8.655 -8.026 4.771 940 HG13 VAL 141 3HG1 VAL 141 -8.276 -9.518 3.910 941 HG21 VAL 141 3HG2 VAL 141 -5.858 -6.089 3.789 942 HG22 VAL 141 1HG2 VAL 141 -7.398 -6.177 4.645 943 HG23 VAL 141 2HG2 VAL 141 -5.932 -6.808 5.398 944 H SER 142 H SER 142 -5.281 -9.578 1.447 945 HA SER 142 HA SER 142 -5.745 -12.422 1.923 946 HB3 SER 142 2HB SER 142 -7.620 -12.629 0.568 947 HG SER 142 HG SER 142 -8.840 -11.523 1.855 948 H TRP 143 H TRP 143 -4.010 -13.332 1.047 949 HA TRP 143 HA TRP 143 -2.958 -12.241 -1.475 950 HB3 TRP 143 2HB TRP 143 -1.325 -12.257 0.324 951 HD1 TRP 143 HD TRP 143 -0.684 -15.941 -0.158 952 HE1 TRP 143 1HE TRP 143 -0.897 -17.151 2.104 953 HE3 TRP 143 3HE TRP 143 -2.681 -12.135 2.610 954 HZ2 TRP 143 2HZ TRP 143 -1.794 -16.568 4.716 955 HZ3 TRP 143 3HZ TRP 143 -3.188 -12.544 4.983 956 HH2 TRP 143 HH TRP 143 -2.754 -14.715 6.012 957 H HIS 144 H HIS 144 -1.806 -14.025 -2.816 958 HA HIS 144 HA HIS 144 -3.425 -16.476 -2.850 959 HB3 HIS 144 2HB HIS 144 -2.792 -15.782 -5.537 960 HD1 HIS 144 1HD HIS 144 -5.949 -14.318 -5.177 961 HD2 HIS 144 2HD HIS 144 -4.553 -18.210 -4.779 962 HE1 HIS 144 1HE HIS 144 -7.974 -15.787 -5.430 963 H ASN 145 H ASN 145 -2.184 -18.223 -2.829 964 HA ASN 145 HA ASN 145 -0.477 -19.668 -3.310 965 HB3 ASN 145 2HB ASN 145 0.994 -17.578 -4.877 966 HD21 ASN 145 1HD2 ASN 145 -0.244 -20.076 -6.680 967 HD22 ASN 145 2HD2 ASN 145 1.119 -21.139 -6.642 968 H ARG 146 H ARG 146 0.893 -16.381 -3.066 969 HA ARG 146 HA ARG 146 1.958 -16.755 -0.488 970 HB3 ARG 146 2HB ARG 146 4.339 -16.546 -2.120 971 HG3 ARG 146 2HG ARG 146 4.816 -18.742 -0.783 972 HD3 ARG 146 2HD ARG 146 4.607 -16.744 1.253 973 HE ARG 146 HE ARG 146 7.148 -16.974 0.011 974 HH11 ARG 146 1HH1 ARG 146 4.806 -18.755 1.871 975 HH12 ARG 146 2HH1 ARG 146 5.980 -19.818 2.575 976 HH21 ARG 146 1HH2 ARG 146 8.703 -18.367 0.932 977 HH22 ARG 146 2HH2 ARG 146 8.196 -19.595 2.041 978 H ILE 147 H ILE 147 2.443 -14.816 0.365 979 HA ILE 147 HA ILE 147 1.873 -12.446 -0.970 980 HB ILE 147 HB ILE 147 3.618 -12.819 1.467 981 HG13 ILE 147 2HG1 ILE 147 0.693 -12.779 1.001 982 HG21 ILE 147 1HG2 ILE 147 4.084 -10.652 1.150 983 HG22 ILE 147 2HG2 ILE 147 2.787 -10.449 -0.025 984 HG23 ILE 147 3HG2 ILE 147 2.434 -10.369 1.701 985 HD11 ILE 147 3HD1 ILE 147 1.624 -13.681 3.585 986 HD12 ILE 147 1HD1 ILE 147 0.694 -14.535 2.354 987 HD13 ILE 147 2HD1 ILE 147 2.455 -14.491 2.257 988 H THR 148 H THR 148 2.955 -12.228 -2.907 989 HA THR 148 HA THR 148 5.759 -11.424 -2.671 990 HB THR 148 HB THR 148 5.046 -13.026 -5.079 991 HG1 THR 148 1HG THR 148 4.395 -14.487 -3.567 992 HG21 THR 148 3HG2 THR 148 7.254 -11.789 -4.596 993 HG22 THR 148 1HG2 THR 148 7.343 -13.448 -5.184 994 HG23 THR 148 2HG2 THR 148 7.578 -13.108 -3.469 995 H LEU 149 H LEU 149 5.345 -9.296 -3.071 996 HA LEU 149 HA LEU 149 4.922 -8.514 -5.773 997 HB3 LEU 149 2HB LEU 149 2.593 -9.003 -5.020 998 HG LEU 149 HG LEU 149 1.397 -7.743 -3.500 999 HD11 LEU 149 1HD1 LEU 149 4.129 -7.863 -2.234 1000 HD12 LEU 149 2HD1 LEU 149 3.027 -9.231 -2.384 1001 HD13 LEU 149 3HD1 LEU 149 2.572 -7.838 -1.404 1002 HD21 LEU 149 3HD2 LEU 149 1.696 -5.560 -3.059 1003 HD22 LEU 149 1HD2 LEU 149 2.780 -5.614 -4.449 1004 HD23 LEU 149 2HD2 LEU 149 3.434 -5.741 -2.815 1005 H ARG 150 H ARG 150 4.554 -5.977 -5.796 1006 HA ARG 150 HA ARG 150 6.093 -4.764 -3.608 1007 HB3 ARG 150 2HB ARG 150 6.575 -4.267 -6.551 1008 HG3 ARG 150 2HG ARG 150 8.707 -3.408 -4.872 1009 HD3 ARG 150 2HD ARG 150 8.429 -2.547 -7.072 1010 HE ARG 150 HE ARG 150 5.673 -2.063 -6.344 1011 HH11 ARG 150 1HH1 ARG 150 8.252 -1.402 -8.586 1012 HH12 ARG 150 2HH1 ARG 150 7.190 -0.933 -9.872 1013 HH21 ARG 150 1HH2 ARG 150 4.263 -1.448 -8.030 1014 HH22 ARG 150 2HH2 ARG 150 4.921 -0.959 -9.554 1015 H LEU 151 H LEU 151 5.282 -2.892 -2.886 1016 HA LEU 151 HA LEU 151 3.021 -1.734 -4.356 1017 HB3 LEU 151 2HB LEU 151 3.505 -0.689 -1.687 1018 HG LEU 151 HG LEU 151 1.203 -1.318 -1.227 1019 HD11 LEU 151 1HD1 LEU 151 0.206 0.251 -2.591 1020 HD12 LEU 151 2HD1 LEU 151 1.145 -0.223 -4.006 1021 HD13 LEU 151 3HD1 LEU 151 1.908 0.697 -2.710 1022 HD21 LEU 151 3HD2 LEU 151 0.500 -2.241 -3.879 1023 HD22 LEU 151 1HD2 LEU 151 0.115 -2.933 -2.303 1024 HD23 LEU 151 2HD2 LEU 151 1.644 -3.327 -3.088 1025 H GLU 152 H GLU 152 3.719 -0.190 -5.705 1026 HA GLU 152 HA GLU 152 5.686 1.754 -4.697 1027 HB3 GLU 152 2HB GLU 152 4.954 0.957 -7.516 1028 HG3 GLU 152 2HG GLU 152 6.779 3.150 -6.573 1029 H LEU 153 H LEU 153 5.278 3.939 -4.806 1030 HA LEU 153 HA LEU 153 2.501 4.681 -5.451 1031 HB3 LEU 153 2HB LEU 153 3.239 4.824 -3.043 1032 HG LEU 153 HG LEU 153 4.954 7.047 -4.111 1033 HD11 LEU 153 1HD1 LEU 153 4.496 8.368 -2.393 1034 HD12 LEU 153 2HD1 LEU 153 4.773 7.052 -1.252 1035 HD13 LEU 153 3HD1 LEU 153 3.173 7.287 -1.956 1036 HD21 LEU 153 3HD2 LEU 153 5.332 4.598 -2.463 1037 HD22 LEU 153 1HD2 LEU 153 6.367 5.992 -2.158 1038 HD23 LEU 153 2HD2 LEU 153 6.332 5.255 -3.760 1039 H LEU 154 H LEU 154 2.115 6.437 -6.728 1040 HA LEU 154 HA LEU 154 4.471 7.622 -8.027 1041 HB3 LEU 154 2HB LEU 154 3.158 7.994 -9.938 1042 HG LEU 154 HG LEU 154 2.373 5.338 -8.771 1043 HD11 LEU 154 1HD1 LEU 154 0.595 6.232 -10.299 1044 HD12 LEU 154 2HD1 LEU 154 1.343 4.723 -10.821 1045 HD13 LEU 154 3HD1 LEU 154 1.803 6.245 -11.584 1046 HD21 LEU 154 3HD2 LEU 154 4.474 4.941 -9.439 1047 HD22 LEU 154 1HD2 LEU 154 4.535 6.396 -10.436 1048 HD23 LEU 154 2HD2 LEU 154 3.792 4.926 -11.066 1049 H GLY 155 H GLY 155 4.607 9.859 -8.361 1050 HA2 GLY 155 2HA GLY 155 2.607 11.535 -7.020 1051 HA3 GLY 155 3HA GLY 155 4.277 11.644 -6.483 1052 H CYS 156 H CYS 156 2.635 13.737 -7.619 1053 HA CYS 156 HA CYS 156 3.294 14.202 -10.328 1054 HB3 CYS 156 2HB CYS 156 2.542 16.146 -8.136 1055 H LEU 157 H LEU 157 5.045 14.624 -7.384 1056 HA LEU 157 HA LEU 157 7.168 15.303 -6.935 1057 HB3 LEU 157 2HB LEU 157 8.217 15.677 -9.569 1058 HG LEU 157 HG LEU 157 9.622 13.774 -9.134 1059 HD11 LEU 157 1HD1 LEU 157 10.532 14.425 -6.893 1060 HD12 LEU 157 2HD1 LEU 157 9.163 15.523 -6.728 1061 HD13 LEU 157 3HD1 LEU 157 10.328 15.758 -8.031 1062 HD21 LEU 157 3HD2 LEU 157 7.787 12.357 -8.183 1063 HD22 LEU 157 1HD2 LEU 157 7.981 13.236 -6.667 1064 HD23 LEU 157 2HD2 LEU 157 9.316 12.276 -7.307 1065 H GLU 158 H GLU 158 4.973 17.225 -7.634 1066 HA GLU 158 HA GLU 158 6.628 19.595 -7.634 1067 HB3 GLU 158 2HB GLU 158 4.456 19.475 -9.707 1068 HG3 GLU 158 2HG GLU 158 6.814 21.015 -10.330 Start of MODEL 9 1 H1 MET -5 H MET -5 17.485 19.745 -21.272 2 HA MET -5 HA MET -5 17.228 21.408 -18.941 3 HB3 MET -5 2HB MET -5 19.593 21.789 -19.646 4 HG3 MET -5 2HG MET -5 18.600 23.365 -21.964 5 HE1 MET -5 3HE MET -5 21.692 21.622 -23.662 6 HE2 MET -5 1HE MET -5 22.345 20.992 -22.150 7 HE3 MET -5 2HE MET -5 20.677 20.642 -22.602 8 H LYS -4 H LYS -4 15.895 23.245 -19.295 9 HA LYS -4 HA LYS -4 14.131 24.356 -20.204 10 HB3 LYS -4 2HB LYS -4 15.093 23.597 -22.945 11 HG3 LYS -4 2HG LYS -4 13.373 25.637 -21.838 12 HD3 LYS -4 2HD LYS -4 14.229 27.431 -23.375 13 HE3 LYS -4 2HE LYS -4 16.460 27.132 -21.513 14 HZ1 LYS -4 3HZ LYS -4 14.524 29.075 -20.825 15 HZ2 LYS -4 1HZ LYS -4 14.833 29.146 -22.486 16 HZ3 LYS -4 2HZ LYS -4 16.105 29.300 -21.383 17 H SER -3 H SER -3 12.761 22.666 -19.351 18 HA SER -3 HA SER -3 10.979 21.631 -21.294 19 HB3 SER -3 2HB SER -3 11.993 19.294 -19.845 20 HG SER -3 HG SER -3 11.413 18.360 -21.672 21 H GLY -2 H GLY -2 9.445 19.933 -20.131 22 HA2 GLY -2 2HA GLY -2 9.202 20.271 -17.283 23 HA3 GLY -2 3HA GLY -2 8.019 21.203 -18.187 24 H HIS -1 H HIS -1 9.043 18.034 -17.212 25 HA HIS -1 HA HIS -1 7.361 16.452 -18.784 26 HB3 HIS -1 2HB HIS -1 9.066 15.371 -17.522 27 HD1 HIS -1 1HD HIS -1 6.745 16.244 -14.634 28 HD2 HIS -1 2HD HIS -1 10.781 16.229 -15.616 29 HE1 HIS -1 1HE HIS -1 7.949 16.932 -12.536 30 H GLY 0 H GLY 0 5.584 15.038 -17.575 31 HA2 GLY 0 2HA GLY 0 3.614 16.991 -16.591 32 HA3 GLY 0 3HA GLY 0 3.229 15.471 -17.384 33 H CYS 1 H CYS 1 1.868 14.766 -15.747 34 HA CYS 1 HA CYS 1 2.898 14.541 -13.041 35 HB3 CYS 1 2HB CYS 1 0.569 13.329 -12.798 36 H SER 2 H SER 2 2.054 12.273 -12.020 37 HA SER 2 HA SER 2 2.492 10.053 -11.781 38 HB3 SER 2 2HB SER 2 1.968 8.652 -13.537 39 HG SER 2 HG SER 2 0.462 9.715 -14.850 40 H GLU 3 H GLU 3 4.600 11.255 -11.104 41 HA GLU 3 HA GLU 3 6.849 10.358 -12.769 42 HB3 GLU 3 2HB GLU 3 6.681 12.783 -12.088 43 HG3 GLU 3 2HG GLU 3 6.387 11.698 -9.505 44 HA PRO 4 HA PRO 4 8.018 7.228 -9.925 45 HB3 PRO 4 2HB PRO 4 9.654 6.642 -11.428 46 HG3 PRO 4 2HG PRO 4 10.796 8.259 -12.648 47 HD3 PRO 4 2HD PRO 4 8.624 8.925 -13.043 48 H LEU 5 H LEU 5 10.187 6.972 -8.331 49 HA LEU 5 HA LEU 5 10.275 9.369 -6.641 50 HB3 LEU 5 2HB LEU 5 8.553 7.683 -5.860 51 HG LEU 5 HG LEU 5 9.117 5.728 -4.737 52 HD11 LEU 5 1HD1 LEU 5 9.342 5.627 -7.254 53 HD12 LEU 5 2HD1 LEU 5 10.136 4.340 -6.348 54 HD13 LEU 5 3HD1 LEU 5 11.088 5.671 -7.007 55 HD21 LEU 5 3HD2 LEU 5 11.065 5.291 -3.689 56 HD22 LEU 5 1HD2 LEU 5 11.311 7.028 -3.871 57 HD23 LEU 5 2HD2 LEU 5 12.046 5.908 -5.018 58 H GLY 6 H GLY 6 11.985 7.271 -8.396 59 HA2 GLY 6 2HA GLY 6 14.475 7.988 -7.324 60 HA3 GLY 6 3HA GLY 6 14.062 6.392 -6.716 61 H LEU 7 H LEU 7 13.130 7.585 -9.881 62 HA LEU 7 HA LEU 7 15.142 5.836 -11.118 63 HB3 LEU 7 2HB LEU 7 13.644 4.641 -12.321 64 HG LEU 7 HG LEU 7 11.809 5.526 -10.094 65 HD11 LEU 7 1HD1 LEU 7 11.004 4.322 -12.388 66 HD12 LEU 7 2HD1 LEU 7 10.220 4.120 -10.821 67 HD13 LEU 7 3HD1 LEU 7 11.388 2.925 -11.382 68 HD21 LEU 7 3HD2 LEU 7 12.604 2.892 -9.728 69 HD22 LEU 7 1HD2 LEU 7 13.173 4.301 -8.833 70 HD23 LEU 7 2HD2 LEU 7 14.072 3.728 -10.238 71 H LYS 8 H LYS 8 14.601 8.831 -10.740 72 HA LYS 8 HA LYS 8 15.094 9.544 -13.547 73 HB3 LYS 8 2HB LYS 8 13.844 11.781 -12.503 74 HG3 LYS 8 2HG LYS 8 11.768 10.543 -13.746 75 HD3 LYS 8 2HD LYS 8 14.120 11.769 -15.182 76 HE3 LYS 8 2HE LYS 8 12.194 12.731 -16.552 77 HZ1 LYS 8 3HZ LYS 8 12.566 11.129 -18.048 78 HZ2 LYS 8 1HZ LYS 8 12.071 9.885 -17.014 79 HZ3 LYS 8 2HZ LYS 8 13.644 10.497 -16.907 80 H ASN 9 H ASN 9 14.850 11.436 -10.548 81 HA ASN 9 HA ASN 9 17.691 12.151 -10.871 82 HB3 ASN 9 2HB ASN 9 16.666 14.299 -9.547 83 HD21 ASN 9 1HD2 ASN 9 18.223 15.487 -10.408 84 HD22 ASN 9 2HD2 ASN 9 18.434 15.796 -12.095 85 H ASN 10 H ASN 10 15.013 11.661 -8.627 86 HA ASN 10 HA ASN 10 16.327 12.112 -6.221 87 HB3 ASN 10 2HB ASN 10 14.648 10.286 -5.376 88 HD21 ASN 10 1HD2 ASN 10 14.314 13.054 -7.549 89 HD22 ASN 10 2HD2 ASN 10 13.275 13.966 -6.512 90 H THR 11 H THR 11 15.966 9.051 -8.001 91 HA THR 11 HA THR 11 17.057 7.054 -7.831 92 HB THR 11 HB THR 11 19.418 7.130 -7.962 93 HG1 THR 11 1HG THR 11 20.437 8.323 -6.553 94 HG21 THR 11 3HG2 THR 11 19.147 9.847 -8.998 95 HG22 THR 11 1HG2 THR 11 17.856 8.768 -9.524 96 HG23 THR 11 2HG2 THR 11 19.540 8.350 -9.842 97 H ILE 12 H ILE 12 15.701 7.736 -5.489 98 HA ILE 12 HA ILE 12 17.094 7.690 -3.110 99 HB ILE 12 HB ILE 12 14.484 6.285 -3.695 100 HG13 ILE 12 2HG1 ILE 12 14.383 8.648 -4.269 101 HG21 ILE 12 1HG2 ILE 12 15.593 7.231 -1.057 102 HG22 ILE 12 2HG2 ILE 12 14.059 6.406 -1.324 103 HG23 ILE 12 3HG2 ILE 12 15.577 5.554 -1.603 104 HD11 ILE 12 3HD1 ILE 12 13.116 8.987 -1.681 105 HD12 ILE 12 1HD1 ILE 12 12.419 9.011 -3.301 106 HD13 ILE 12 2HD1 ILE 12 12.673 7.474 -2.473 107 HA PRO 13 HA PRO 13 19.143 3.771 -3.117 108 HB3 PRO 13 2HB PRO 13 20.654 4.744 -1.684 109 HG3 PRO 13 2HG PRO 13 19.989 6.374 -0.164 110 HD3 PRO 13 2HD PRO 13 19.053 7.223 -2.092 111 H ASP 14 H ASP 14 19.229 1.971 -1.120 112 HA ASP 14 HA ASP 14 16.535 0.905 -1.135 113 HB3 ASP 14 2HB ASP 14 17.814 -1.011 0.136 114 H SER 15 H SER 15 16.373 3.088 0.354 115 HA SER 15 HA SER 15 16.123 2.034 3.086 116 HB3 SER 15 2HB SER 15 16.770 4.919 2.837 117 HG SER 15 HG SER 15 18.263 3.879 4.608 118 H GLN 16 H GLN 16 14.291 2.555 0.746 119 HA GLN 16 HA GLN 16 12.501 4.545 1.951 120 HB3 GLN 16 2HB GLN 16 12.915 5.016 -0.350 121 HG3 GLN 16 2HG GLN 16 12.015 2.231 -1.043 122 HE21 GLN 16 1HE2 GLN 16 11.168 2.182 -2.985 123 HE22 GLN 16 2HE2 GLN 16 11.543 3.244 -4.295 124 H MET 17 H MET 17 12.469 1.264 0.577 125 HA MET 17 HA MET 17 9.861 0.768 1.786 126 HB3 MET 17 2HB MET 17 11.386 -1.325 0.295 127 HG3 MET 17 2HG MET 17 8.490 -0.509 0.220 128 HE1 MET 17 3HE MET 17 8.009 -0.396 -1.956 129 HE2 MET 17 1HE MET 17 9.421 -0.813 -2.926 130 HE3 MET 17 2HE MET 17 7.919 -1.713 -3.125 131 H SER 18 H SER 18 9.480 -1.058 3.157 132 HA SER 18 HA SER 18 11.539 -2.659 4.234 133 HB3 SER 18 2HB SER 18 11.213 -1.524 6.620 134 HG SER 18 HG SER 18 13.223 -0.878 6.341 135 H ALA 19 H ALA 19 10.394 -4.444 4.536 136 HA ALA 19 HA ALA 19 7.727 -4.220 5.772 137 HB1 ALA 19 1HB ALA 19 6.925 -5.621 4.244 138 HB2 ALA 19 2HB ALA 19 8.450 -5.427 3.379 139 HB3 ALA 19 3HB ALA 19 8.239 -6.768 4.504 140 H SER 20 H SER 20 7.118 -6.438 6.841 141 HA SER 20 HA SER 20 8.573 -6.723 9.163 142 HB3 SER 20 2HB SER 20 6.807 -8.761 7.785 143 HG SER 20 HG SER 20 7.478 -10.011 9.333 144 H SER 21 H SER 21 8.451 -9.285 6.688 145 HA SER 21 HA SER 21 11.302 -9.556 6.606 146 HB3 SER 21 2HB SER 21 9.662 -11.646 8.052 147 HG SER 21 HG SER 21 12.399 -11.953 7.773 148 H SER 22 H SER 22 12.007 -11.152 5.069 149 HA SER 22 HA SER 22 9.987 -11.624 3.012 150 HB3 SER 22 2HB SER 22 12.813 -11.028 3.016 151 HG SER 22 HG SER 22 13.434 -12.497 1.422 152 H TYR 23 H TYR 23 10.179 -13.705 1.766 153 HA TYR 23 HA TYR 23 9.549 -15.881 3.327 154 HB3 TYR 23 2HB TYR 23 9.245 -15.557 0.800 155 HD1 TYR 23 1HD TYR 23 11.389 -14.134 0.151 156 HD2 TYR 23 2HD TYR 23 11.240 -18.384 0.267 157 HE1 TYR 23 1HE TYR 23 13.315 -14.237 -1.376 158 HE2 TYR 23 2HE TYR 23 13.165 -18.500 -1.259 159 HH TYR 23 HH TYR 23 14.122 -16.592 -3.159 160 H LYS 24 H LYS 24 12.694 -14.746 2.329 161 HA LYS 24 HA LYS 24 14.276 -16.972 2.721 162 HB3 LYS 24 2HB LYS 24 15.024 -14.173 3.576 163 HG3 LYS 24 2HG LYS 24 16.813 -16.142 2.209 164 HD3 LYS 24 2HD LYS 24 18.493 -14.809 3.594 165 HE3 LYS 24 2HE LYS 24 18.107 -12.718 2.039 166 HZ1 LYS 24 3HZ LYS 24 19.847 -14.061 1.424 167 HZ2 LYS 24 1HZ LYS 24 18.816 -14.254 0.096 168 HZ3 LYS 24 2HZ LYS 24 18.892 -15.451 1.289 169 H THR 25 H THR 25 14.968 -18.121 4.424 170 HA THR 25 HA THR 25 14.063 -17.267 7.088 171 HB THR 25 HB THR 25 13.192 -19.443 6.320 172 HG1 THR 25 1HG THR 25 13.824 -20.581 8.220 173 HG21 THR 25 3HG2 THR 25 14.480 -21.179 5.606 174 HG22 THR 25 1HG2 THR 25 15.848 -20.728 6.624 175 HG23 THR 25 2HG2 THR 25 15.542 -19.858 5.121 176 H TRP 26 H TRP 26 16.853 -18.020 5.187 177 HA TRP 26 HA TRP 26 18.590 -17.061 7.274 178 HB3 TRP 26 2HB TRP 26 19.215 -19.811 6.228 179 HD1 TRP 26 HD TRP 26 21.559 -17.905 6.637 180 HE1 TRP 26 1HE TRP 26 23.186 -18.135 8.618 181 HE3 TRP 26 3HE TRP 26 18.584 -20.576 9.823 182 HZ2 TRP 26 2HZ TRP 26 23.205 -19.296 11.190 183 HZ3 TRP 26 3HZ TRP 26 19.483 -21.207 12.025 184 HH2 TRP 26 HH TRP 26 21.746 -20.580 12.692 185 H ASN 27 H ASN 27 18.748 -19.002 4.280 186 HA ASN 27 HA ASN 27 20.029 -16.854 2.861 187 HB3 ASN 27 2HB ASN 27 21.676 -19.343 2.941 188 HD21 ASN 27 1HD2 ASN 27 23.300 -19.067 1.606 189 HD22 ASN 27 2HD2 ASN 27 23.963 -17.553 1.105 190 H LEU 28 H LEU 28 19.817 -17.061 0.676 191 HA LEU 28 HA LEU 28 18.847 -19.631 -0.366 192 HB3 LEU 28 2HB LEU 28 17.572 -17.667 -1.876 193 HG LEU 28 HG LEU 28 15.477 -18.432 -0.985 194 HD11 LEU 28 1HD1 LEU 28 16.883 -19.928 -2.467 195 HD12 LEU 28 2HD1 LEU 28 15.616 -20.719 -1.529 196 HD13 LEU 28 3HD1 LEU 28 17.297 -20.823 -1.005 197 HD21 LEU 28 3HD2 LEU 28 16.745 -18.550 1.427 198 HD22 LEU 28 1HD2 LEU 28 16.591 -20.258 1.012 199 HD23 LEU 28 2HD2 LEU 28 15.155 -19.236 1.081 200 H ARG 29 H ARG 29 18.750 -19.462 -2.889 201 HA ARG 29 HA ARG 29 21.358 -18.416 -3.734 202 HB3 ARG 29 2HB ARG 29 20.911 -19.945 -5.747 203 HG3 ARG 29 2HG ARG 29 21.188 -22.081 -4.227 204 HD3 ARG 29 2HD ARG 29 23.604 -21.295 -3.806 205 HE ARG 29 HE ARG 29 22.372 -21.971 -6.255 206 HH11 ARG 29 1HH1 ARG 29 25.314 -20.629 -4.964 207 HH12 ARG 29 2HH1 ARG 29 26.295 -21.171 -6.285 208 HH21 ARG 29 1HH2 ARG 29 23.654 -22.691 -7.999 209 HH22 ARG 29 2HH2 ARG 29 25.350 -22.343 -8.011 210 H ALA 30 H ALA 30 20.342 -16.247 -3.810 211 HA ALA 30 HA ALA 30 19.616 -15.605 -6.500 212 HB1 ALA 30 1HB ALA 30 17.410 -15.999 -6.169 213 HB2 ALA 30 2HB ALA 30 17.515 -15.766 -4.424 214 HB3 ALA 30 3HB ALA 30 17.470 -14.369 -5.498 215 H PHE 31 H PHE 31 18.987 -13.161 -6.597 216 HA PHE 31 HA PHE 31 20.688 -11.719 -4.669 217 HB3 PHE 31 2HB PHE 31 21.261 -10.161 -6.479 218 HD1 PHE 31 1HD PHE 31 23.347 -11.144 -5.601 219 HD2 PHE 31 2HD PHE 31 21.033 -13.079 -8.604 220 HE1 PHE 31 1HE PHE 31 25.273 -12.569 -6.161 221 HE2 PHE 31 2HE PHE 31 22.955 -14.508 -9.169 222 HZ PHE 31 HZ PHE 31 25.078 -14.255 -7.946 223 H GLY 32 H GLY 32 17.846 -12.208 -4.432 224 HA2 GLY 32 2HA GLY 32 16.740 -9.516 -4.896 225 HA3 GLY 32 3HA GLY 32 15.787 -10.973 -4.661 226 H TRP 33 H TRP 33 18.508 -10.533 -2.608 227 HA TRP 33 HA TRP 33 17.049 -10.701 -0.245 228 HB3 TRP 33 2HB TRP 33 19.519 -11.112 -0.531 229 HD1 TRP 33 HD TRP 33 20.125 -9.307 -2.742 230 HE1 TRP 33 1HE TRP 33 21.752 -7.315 -2.630 231 HE3 TRP 33 3HE TRP 33 20.160 -8.571 2.317 232 HZ2 TRP 33 2HZ TRP 33 22.899 -5.654 -0.658 233 HZ3 TRP 33 3HZ TRP 33 21.548 -6.760 3.236 234 HH2 TRP 33 HH TRP 33 22.889 -5.333 1.777 235 H TYR 34 H TYR 34 16.388 -9.201 1.290 236 HA TYR 34 HA TYR 34 15.533 -7.246 2.075 237 HB3 TYR 34 2HB TYR 34 16.831 -5.183 0.763 238 HD1 TYR 34 1HD TYR 34 17.673 -7.841 3.250 239 HD2 TYR 34 2HD TYR 34 17.449 -3.678 2.405 240 HE1 TYR 34 1HE TYR 34 18.296 -7.343 5.576 241 HE2 TYR 34 2HE TYR 34 18.072 -3.167 4.728 242 HH TYR 34 HH TYR 34 19.128 -4.160 6.613 243 HA PRO 35 HA PRO 35 12.441 -5.868 -0.715 244 HB3 PRO 35 2HB PRO 35 11.425 -4.837 1.069 245 HG3 PRO 35 2HG PRO 35 12.678 -3.776 2.715 246 HD3 PRO 35 2HD PRO 35 13.768 -5.805 2.633 247 H HIS 36 H HIS 36 11.834 -3.416 -1.712 248 HA HIS 36 HA HIS 36 12.396 -1.801 -3.231 249 HB3 HIS 36 2HB HIS 36 14.573 -0.916 -3.327 250 HD1 HIS 36 1HD HIS 36 16.229 -2.365 -0.594 251 HD2 HIS 36 2HD HIS 36 12.815 -0.026 -0.957 252 HE1 HIS 36 1HE HIS 36 15.864 -1.352 1.678 253 H LEU 37 H LEU 37 12.082 -4.698 -3.784 254 HA LEU 37 HA LEU 37 13.833 -5.329 -5.964 255 HB3 LEU 37 2HB LEU 37 12.231 -7.207 -6.343 256 HG LEU 37 HG LEU 37 12.757 -8.529 -4.483 257 HD11 LEU 37 1HD1 LEU 37 15.001 -8.367 -4.528 258 HD12 LEU 37 2HD1 LEU 37 14.998 -6.667 -4.062 259 HD13 LEU 37 3HD1 LEU 37 14.684 -7.123 -5.737 260 HD21 LEU 37 3HD2 LEU 37 11.797 -6.555 -2.946 261 HD22 LEU 37 1HD2 LEU 37 13.525 -6.321 -2.676 262 HD23 LEU 37 2HD2 LEU 37 12.780 -7.879 -2.316 263 H GLY 38 H GLY 38 10.657 -3.887 -5.612 264 HA2 GLY 38 2HA GLY 38 9.932 -4.053 -8.365 265 HA3 GLY 38 3HA GLY 38 9.182 -3.023 -7.155 266 H ARG 39 H ARG 39 12.290 -2.246 -6.858 267 HA ARG 39 HA ARG 39 12.118 0.297 -7.898 268 HB3 ARG 39 2HB ARG 39 13.887 -0.648 -6.339 269 HG3 ARG 39 2HG ARG 39 15.307 -1.289 -8.913 270 HD3 ARG 39 2HD ARG 39 16.647 -2.456 -6.821 271 HE ARG 39 HE ARG 39 17.711 0.102 -7.435 272 HH11 ARG 39 1HH1 ARG 39 16.939 -2.983 -8.852 273 HH12 ARG 39 2HH1 ARG 39 18.139 -2.860 -10.095 274 HH21 ARG 39 1HH2 ARG 39 19.295 0.276 -9.069 275 HH22 ARG 39 2HH2 ARG 39 19.479 -1.006 -10.217 276 H LEU 40 H LEU 40 13.565 1.206 -9.673 277 HA LEU 40 HA LEU 40 12.701 0.258 -12.155 278 HB3 LEU 40 2HB LEU 40 14.887 2.138 -11.330 279 HG LEU 40 HG LEU 40 15.547 1.176 -13.538 280 HD11 LEU 40 1HD1 LEU 40 13.342 2.624 -14.867 281 HD12 LEU 40 2HD1 LEU 40 12.941 1.077 -14.121 282 HD13 LEU 40 3HD1 LEU 40 14.200 1.162 -15.353 283 HD21 LEU 40 3HD2 LEU 40 16.267 3.199 -14.317 284 HD22 LEU 40 1HD2 LEU 40 15.787 3.660 -12.684 285 HD23 LEU 40 2HD2 LEU 40 14.711 3.986 -14.043 286 H ASP 41 H ASP 41 13.796 -0.775 -13.858 287 HA ASP 41 HA ASP 41 15.291 -2.182 -14.866 288 HB3 ASP 41 2HB ASP 41 17.214 -2.357 -12.650 289 H ASN 42 H ASN 42 15.359 -2.787 -11.348 290 HA ASN 42 HA ASN 42 15.331 -4.802 -10.221 291 HB3 ASN 42 2HB ASN 42 12.978 -4.136 -10.363 292 HD21 ASN 42 1HD2 ASN 42 12.320 -3.026 -12.190 293 HD22 ASN 42 2HD2 ASN 42 11.608 -3.821 -13.548 294 H GLN 43 H GLN 43 17.050 -5.056 -12.382 295 HA GLN 43 HA GLN 43 16.585 -7.098 -14.185 296 HB3 GLN 43 2HB GLN 43 18.596 -5.592 -14.098 297 HG3 GLN 43 2HG GLN 43 20.060 -7.573 -12.483 298 HE21 GLN 43 1HE2 GLN 43 21.872 -6.813 -13.518 299 HE22 GLN 43 2HE2 GLN 43 22.488 -5.215 -13.285 300 H GLY 44 H GLY 44 16.666 -9.297 -14.149 301 HA2 GLY 44 2HA GLY 44 17.731 -11.218 -12.829 302 HA3 GLY 44 3HA GLY 44 16.849 -10.525 -11.475 303 H LYS 45 H LYS 45 14.696 -10.939 -11.238 304 HA LYS 45 HA LYS 45 12.957 -11.842 -13.236 305 HB3 LYS 45 2HB LYS 45 14.402 -13.837 -13.238 306 HG3 LYS 45 2HG LYS 45 14.198 -15.404 -11.281 307 HD3 LYS 45 2HD LYS 45 15.655 -13.011 -10.300 308 HE3 LYS 45 2HE LYS 45 15.774 -15.580 -9.623 309 HZ1 LYS 45 3HZ LYS 45 18.165 -15.643 -11.220 310 HZ2 LYS 45 1HZ LYS 45 16.747 -15.760 -12.136 311 HZ3 LYS 45 2HZ LYS 45 17.048 -16.871 -10.898 312 H ILE 46 H ILE 46 13.853 -11.758 -9.862 313 HA ILE 46 HA ILE 46 11.301 -12.329 -8.776 314 HB ILE 46 HB ILE 46 13.552 -10.722 -7.559 315 HG13 ILE 46 2HG1 ILE 46 13.118 -13.598 -7.982 316 HG21 ILE 46 1HG2 ILE 46 10.906 -11.144 -6.672 317 HG22 ILE 46 2HG2 ILE 46 11.960 -12.126 -5.655 318 HG23 ILE 46 3HG2 ILE 46 12.241 -10.391 -5.801 319 HD11 ILE 46 3HD1 ILE 46 15.208 -11.913 -8.355 320 HD12 ILE 46 1HD1 ILE 46 15.639 -12.676 -6.824 321 HD13 ILE 46 2HD1 ILE 46 15.333 -13.668 -8.250 322 H ASN 47 H ASN 47 13.008 -9.193 -8.871 323 HA ASN 47 HA ASN 47 12.171 -7.061 -8.697 324 HB3 ASN 47 2HB ASN 47 12.042 -7.527 -11.107 325 HD21 ASN 47 1HD2 ASN 47 8.668 -7.070 -10.837 326 HD22 ASN 47 2HD2 ASN 47 8.178 -8.564 -11.553 327 H ALA 48 H ALA 48 11.019 -8.739 -6.761 328 HA ALA 48 HA ALA 48 8.754 -7.204 -6.024 329 HB1 ALA 48 1HB ALA 48 7.813 -9.968 -6.254 330 HB2 ALA 48 2HB ALA 48 6.982 -8.451 -6.599 331 HB3 ALA 48 3HB ALA 48 8.069 -9.154 -7.797 332 H TRP 49 H TRP 49 8.597 -7.215 -3.867 333 HA TRP 49 HA TRP 49 10.325 -8.961 -2.355 334 HB3 TRP 49 2HB TRP 49 8.526 -6.657 -1.625 335 HD1 TRP 49 HD TRP 49 7.214 -7.695 0.450 336 HE1 TRP 49 1HE TRP 49 7.966 -8.336 2.826 337 HE3 TRP 49 3HE TRP 49 12.276 -7.680 -0.270 338 HZ2 TRP 49 2HZ TRP 49 10.385 -8.777 4.213 339 HZ3 TRP 49 3HZ TRP 49 13.738 -8.222 1.633 340 HH2 TRP 49 HH TRP 49 12.810 -8.758 3.827 341 H THR 50 H THR 50 9.755 -10.631 -1.063 342 HA THR 50 HA THR 50 6.930 -11.446 -1.134 343 HB THR 50 HB THR 50 9.002 -13.387 -0.270 344 HG1 THR 50 1HG THR 50 9.965 -13.512 -2.174 345 HG21 THR 50 3HG2 THR 50 7.588 -14.830 -1.821 346 HG22 THR 50 1HG2 THR 50 6.498 -13.449 -1.940 347 HG23 THR 50 2HG2 THR 50 6.791 -14.209 -0.376 348 H ALA 51 H ALA 51 6.234 -12.774 0.798 349 HA ALA 51 HA ALA 51 6.964 -11.310 3.215 350 HB1 ALA 51 1HB ALA 51 4.722 -13.278 2.770 351 HB2 ALA 51 2HB ALA 51 4.952 -12.251 4.186 352 HB3 ALA 51 3HB ALA 51 4.588 -11.526 2.620 353 H GLN 52 H GLN 52 7.186 -12.513 5.262 354 HA GLN 52 HA GLN 52 8.903 -14.834 4.861 355 HB3 GLN 52 2HB GLN 52 8.388 -13.066 7.253 356 HG3 GLN 52 2HG GLN 52 10.667 -14.434 7.838 357 HE21 GLN 52 1HE2 GLN 52 9.270 -16.809 8.985 358 HE22 GLN 52 2HE2 GLN 52 8.339 -16.182 10.298 359 H SER 53 H SER 53 6.324 -13.937 7.161 360 HA SER 53 HA SER 53 5.848 -16.649 7.914 361 HB3 SER 53 2HB SER 53 4.402 -15.798 9.481 362 HG SER 53 HG SER 53 5.084 -13.696 10.063 363 H ASN 54 H ASN 54 5.014 -14.892 5.198 364 HA ASN 54 HA ASN 54 3.496 -15.145 3.516 365 HB3 ASN 54 2HB ASN 54 3.366 -17.293 2.668 366 HD21 ASN 54 1HD2 ASN 54 4.862 -18.873 5.241 367 HD22 ASN 54 2HD2 ASN 54 6.499 -18.723 4.707 368 H SER 55 H SER 55 2.419 -14.389 6.083 369 HA SER 55 HA SER 55 -0.317 -15.425 5.755 370 HB3 SER 55 2HB SER 55 0.244 -14.524 8.465 371 HG SER 55 HG SER 55 -1.486 -15.958 7.533 372 H ALA 56 H ALA 56 -1.799 -13.872 7.242 373 HA ALA 56 HA ALA 56 -1.673 -11.325 5.938 374 HB1 ALA 56 1HB ALA 56 -3.819 -11.020 6.628 375 HB2 ALA 56 2HB ALA 56 -3.731 -12.775 6.771 376 HB3 ALA 56 3HB ALA 56 -3.538 -11.763 8.202 377 H LYS 57 H LYS 57 -0.400 -12.584 8.823 378 HA LYS 57 HA LYS 57 -0.462 -10.279 10.461 379 HB3 LYS 57 2HB LYS 57 0.007 -12.619 11.239 380 HG3 LYS 57 2HG LYS 57 2.878 -12.393 10.898 381 HD3 LYS 57 2HD LYS 57 2.404 -14.795 10.041 382 HE3 LYS 57 2HE LYS 57 2.780 -13.719 12.556 383 HZ1 LYS 57 3HZ LYS 57 1.372 -15.399 13.861 384 HZ2 LYS 57 1HZ LYS 57 0.350 -15.386 12.514 385 HZ3 LYS 57 2HZ LYS 57 0.643 -13.956 13.367 386 H GLU 58 H GLU 58 1.279 -10.997 7.646 387 HA GLU 58 HA GLU 58 3.629 -9.460 8.222 388 HB3 GLU 58 2HB GLU 58 2.883 -9.838 5.397 389 HG3 GLU 58 2HG GLU 58 5.207 -9.340 6.531 390 H TRP 59 H TRP 59 4.233 -7.575 6.800 391 HA TRP 59 HA TRP 59 2.219 -5.959 5.632 392 HB3 TRP 59 2HB TRP 59 1.398 -5.402 7.748 393 HD1 TRP 59 HD TRP 59 5.188 -4.778 8.393 394 HE1 TRP 59 1HE TRP 59 5.699 -5.508 10.807 395 HE3 TRP 59 3HE TRP 59 0.522 -6.346 9.773 396 HZ2 TRP 59 2HZ TRP 59 4.308 -6.604 13.006 397 HZ3 TRP 59 3HZ TRP 59 0.196 -7.221 12.049 398 HH2 TRP 59 HH TRP 59 2.053 -7.347 13.630 399 H LEU 60 H LEU 60 3.062 -4.107 4.627 400 HA LEU 60 HA LEU 60 6.001 -3.915 4.696 401 HB3 LEU 60 2HB LEU 60 4.338 -3.099 2.342 402 HG LEU 60 HG LEU 60 7.205 -3.564 2.782 403 HD11 LEU 60 1HD1 LEU 60 5.716 -5.044 0.724 404 HD12 LEU 60 2HD1 LEU 60 7.299 -5.359 1.433 405 HD13 LEU 60 3HD1 LEU 60 7.130 -4.160 0.152 406 HD21 LEU 60 3HD2 LEU 60 7.222 -1.558 1.838 407 HD22 LEU 60 1HD2 LEU 60 5.476 -1.648 1.603 408 HD23 LEU 60 2HD2 LEU 60 6.567 -2.243 0.351 409 H GLN 61 H GLN 61 6.889 -1.982 5.106 410 HA GLN 61 HA GLN 61 5.109 0.367 5.138 411 HB3 GLN 61 2HB GLN 61 6.115 1.161 7.113 412 HG3 GLN 61 2HG GLN 61 4.937 -1.331 7.174 413 HE21 GLN 61 1HE2 GLN 61 6.169 -3.137 6.851 414 HE22 GLN 61 2HE2 GLN 61 7.326 -3.714 7.997 415 H VAL 62 H VAL 62 5.838 2.223 4.221 416 HA VAL 62 HA VAL 62 8.592 2.231 3.174 417 HB VAL 62 HB VAL 62 6.144 3.234 1.715 418 HG11 VAL 62 1HG1 VAL 62 9.041 3.145 0.880 419 HG12 VAL 62 2HG1 VAL 62 7.690 3.617 -0.154 420 HG13 VAL 62 3HG1 VAL 62 8.107 4.592 1.256 421 HG21 VAL 62 3HG2 VAL 62 7.583 0.670 1.699 422 HG22 VAL 62 1HG2 VAL 62 5.925 1.047 1.230 423 HG23 VAL 62 2HG2 VAL 62 7.251 1.354 0.108 424 H ASP 63 H ASP 63 9.734 3.972 3.705 425 HA ASP 63 HA ASP 63 8.302 6.445 4.407 426 HB3 ASP 63 2HB ASP 63 9.088 5.167 6.437 427 H LEU 64 H LEU 64 9.124 8.279 3.571 428 HA LEU 64 HA LEU 64 11.703 8.084 2.158 429 HB3 LEU 64 2HB LEU 64 10.358 8.395 0.372 430 HG LEU 64 HG LEU 64 8.342 9.487 2.251 431 HD11 LEU 64 1HD1 LEU 64 8.096 11.316 0.932 432 HD12 LEU 64 2HD1 LEU 64 7.141 10.180 -0.020 433 HD13 LEU 64 3HD1 LEU 64 8.806 10.535 -0.481 434 HD21 LEU 64 3HD2 LEU 64 7.178 7.714 1.560 435 HD22 LEU 64 1HD2 LEU 64 8.673 7.169 0.798 436 HD23 LEU 64 2HD2 LEU 64 7.483 8.072 -0.141 437 H GLY 65 H GLY 65 9.609 10.019 4.189 438 HA2 GLY 65 2HA GLY 65 10.015 11.874 5.478 439 HA3 GLY 65 3HA GLY 65 11.693 11.351 5.479 440 H THR 66 H THR 66 10.261 11.995 2.423 441 HA THR 66 HA THR 66 11.840 14.470 2.241 442 HB THR 66 HB THR 66 12.440 12.616 0.673 443 HG1 THR 66 1HG THR 66 12.888 14.771 0.090 444 HG21 THR 66 3HG2 THR 66 10.348 13.056 -1.233 445 HG22 THR 66 1HG2 THR 66 9.644 12.518 0.291 446 HG23 THR 66 2HG2 THR 66 10.881 11.542 -0.501 447 H GLN 67 H GLN 67 8.731 13.474 2.661 448 HA GLN 67 HA GLN 67 6.668 14.383 2.322 449 HB3 GLN 67 2HB GLN 67 7.942 17.072 2.013 450 HG3 GLN 67 2HG GLN 67 5.463 15.976 3.182 451 HE21 GLN 67 1HE2 GLN 67 5.941 19.306 3.448 452 HE22 GLN 67 2HE2 GLN 67 6.058 19.403 5.169 453 H ARG 68 H ARG 68 6.446 13.378 0.243 454 HA ARG 68 HA ARG 68 6.619 15.293 -1.991 455 HB3 ARG 68 2HB ARG 68 6.479 12.883 -3.237 456 HG3 ARG 68 2HG ARG 68 8.921 12.972 -3.525 457 HD3 ARG 68 2HD ARG 68 7.128 15.272 -3.920 458 HE ARG 68 HE ARG 68 9.957 15.739 -3.656 459 HH11 ARG 68 1HH1 ARG 68 7.014 16.719 -5.236 460 HH12 ARG 68 2HH1 ARG 68 7.577 18.321 -5.578 461 HH21 ARG 68 1HH2 ARG 68 10.710 17.846 -4.101 462 HH22 ARG 68 2HH2 ARG 68 9.680 18.961 -4.933 463 H GLN 69 H GLN 69 4.903 15.368 -3.462 464 HA GLN 69 HA GLN 69 2.351 14.552 -2.337 465 HB3 GLN 69 2HB GLN 69 3.153 16.355 -4.609 466 HG3 GLN 69 2HG GLN 69 0.354 15.536 -3.867 467 HE21 GLN 69 1HE2 GLN 69 -0.561 17.490 -3.478 468 HE22 GLN 69 2HE2 GLN 69 -0.633 18.768 -4.637 469 H VAL 70 H VAL 70 1.459 12.677 -2.849 470 HA VAL 70 HA VAL 70 2.322 11.251 -5.236 471 HB VAL 70 HB VAL 70 1.067 9.352 -4.345 472 HG11 VAL 70 1HG1 VAL 70 3.383 9.773 -3.598 473 HG12 VAL 70 2HG1 VAL 70 2.749 10.648 -2.202 474 HG13 VAL 70 3HG1 VAL 70 2.420 8.925 -2.389 475 HG21 VAL 70 3HG2 VAL 70 -0.751 9.850 -3.137 476 HG22 VAL 70 1HG2 VAL 70 0.360 10.002 -1.776 477 HG23 VAL 70 2HG2 VAL 70 -0.125 11.435 -2.683 478 H THR 71 H THR 71 1.021 10.703 -6.940 479 HA THR 71 HA THR 71 -1.775 11.573 -6.903 480 HB THR 71 HB THR 71 -0.278 12.165 -9.399 481 HG1 THR 71 1HG THR 71 -0.203 13.929 -7.162 482 HG21 THR 71 3HG2 THR 71 -2.237 13.129 -9.840 483 HG22 THR 71 1HG2 THR 71 -1.945 14.280 -8.537 484 HG23 THR 71 2HG2 THR 71 -2.805 12.776 -8.208 485 H GLY 72 H GLY 72 -0.167 8.995 -6.983 486 HA2 GLY 72 2HA GLY 72 -1.904 7.456 -8.505 487 HA3 GLY 72 3HA GLY 72 -0.534 7.821 -9.542 488 H ILE 73 H ILE 73 -1.325 5.226 -8.655 489 HA ILE 73 HA ILE 73 1.202 4.383 -7.508 490 HB ILE 73 HB ILE 73 -0.112 2.848 -5.890 491 HG13 ILE 73 2HG1 ILE 73 -2.280 4.084 -7.017 492 HG21 ILE 73 1HG2 ILE 73 1.225 5.229 -5.592 493 HG22 ILE 73 2HG2 ILE 73 -0.299 5.527 -4.758 494 HG23 ILE 73 3HG2 ILE 73 0.714 4.164 -4.283 495 HD11 ILE 73 3HD1 ILE 73 -1.832 2.417 -4.685 496 HD12 ILE 73 1HD1 ILE 73 -3.248 3.454 -4.528 497 HD13 ILE 73 2HD1 ILE 73 -3.109 2.353 -5.899 498 H ILE 74 H ILE 74 1.656 2.166 -7.832 499 HA ILE 74 HA ILE 74 -0.279 0.531 -9.247 500 HB ILE 74 HB ILE 74 0.631 1.660 -11.134 501 HG13 ILE 74 2HG1 ILE 74 1.198 -0.169 -12.398 502 HG21 ILE 74 1HG2 ILE 74 3.261 1.226 -9.772 503 HG22 ILE 74 2HG2 ILE 74 3.178 1.506 -11.511 504 HG23 ILE 74 3HG2 ILE 74 2.560 2.720 -10.390 505 HD11 ILE 74 3HD1 ILE 74 2.556 -2.106 -11.215 506 HD12 ILE 74 1HD1 ILE 74 3.352 -0.757 -12.025 507 HD13 ILE 74 2HD1 ILE 74 3.169 -0.750 -10.270 508 H THR 75 H THR 75 0.123 -1.648 -9.090 509 HA THR 75 HA THR 75 2.594 -2.449 -7.704 510 HB THR 75 HB THR 75 0.412 -2.366 -6.274 511 HG1 THR 75 1HG THR 75 1.835 -3.414 -5.115 512 HG21 THR 75 3HG2 THR 75 -1.167 -3.980 -6.543 513 HG22 THR 75 1HG2 THR 75 -0.013 -5.158 -7.168 514 HG23 THR 75 2HG2 THR 75 -0.631 -3.884 -8.220 515 H GLN 76 H GLN 76 3.014 -4.822 -7.875 516 HA GLN 76 HA GLN 76 1.765 -6.206 -10.087 517 HB3 GLN 76 2HB GLN 76 4.566 -6.383 -10.596 518 HG3 GLN 76 2HG GLN 76 3.824 -5.125 -12.734 519 HE21 GLN 76 1HE2 GLN 76 5.180 -7.158 -12.753 520 HE22 GLN 76 2HE2 GLN 76 4.398 -8.604 -13.285 521 H GLY 77 H GLY 77 1.882 -8.383 -9.871 522 HA2 GLY 77 2HA GLY 77 3.065 -9.394 -7.425 523 HA3 GLY 77 3HA GLY 77 2.044 -10.289 -8.541 524 H ALA 78 H ALA 78 4.063 -11.685 -7.622 525 HA ALA 78 HA ALA 78 5.891 -11.840 -9.910 526 HB1 ALA 78 1HB ALA 78 7.445 -10.899 -8.559 527 HB2 ALA 78 2HB ALA 78 6.631 -11.410 -7.079 528 HB3 ALA 78 3HB ALA 78 7.604 -12.563 -7.992 529 H ARG 79 H ARG 79 7.085 -13.957 -9.938 530 HA ARG 79 HA ARG 79 5.326 -16.096 -8.931 531 HB3 ARG 79 2HB ARG 79 5.212 -16.095 -11.303 532 HG3 ARG 79 2HG ARG 79 8.051 -15.404 -11.172 533 HD3 ARG 79 2HD ARG 79 7.114 -17.117 -13.458 534 HE ARG 79 HE ARG 79 9.368 -15.541 -13.185 535 HH11 ARG 79 1HH1 ARG 79 8.645 -18.886 -13.828 536 HH12 ARG 79 2HH1 ARG 79 10.069 -19.146 -14.780 537 HH21 ARG 79 1HH2 ARG 79 11.246 -15.872 -14.436 538 HH22 ARG 79 2HH2 ARG 79 11.549 -17.432 -15.125 539 H ASP 80 H ASP 80 6.430 -18.203 -8.573 540 HA ASP 80 HA ASP 80 9.090 -17.756 -7.389 541 HB3 ASP 80 2HB ASP 80 8.103 -20.120 -6.313 542 H PHE 81 H PHE 81 10.162 -18.203 -9.372 543 HA PHE 81 HA PHE 81 10.955 -19.507 -11.101 544 HB3 PHE 81 2HB PHE 81 12.507 -20.094 -9.403 545 HD1 PHE 81 1HD PHE 81 11.793 -19.582 -7.144 546 HD2 PHE 81 2HD PHE 81 10.739 -23.259 -9.009 547 HE1 PHE 81 1HE PHE 81 11.156 -20.505 -4.954 548 HE2 PHE 81 2HE PHE 81 10.100 -24.188 -6.824 549 HZ PHE 81 HZ PHE 81 10.307 -22.811 -4.792 550 H GLY 82 H GLY 82 8.213 -19.660 -11.164 551 HA2 GLY 82 2HA GLY 82 7.434 -21.496 -12.846 552 HA3 GLY 82 3HA GLY 82 7.564 -22.511 -11.417 553 H HIS 83 H HIS 83 6.213 -21.969 -9.567 554 HA HIS 83 HA HIS 83 3.535 -21.532 -10.305 555 HB3 HIS 83 2HB HIS 83 3.165 -21.375 -7.795 556 HD1 HIS 83 1HD HIS 83 4.141 -23.781 -6.274 557 HD2 HIS 83 2HD HIS 83 3.542 -23.806 -10.385 558 HE1 HIS 83 1HE HIS 83 3.809 -26.197 -6.890 559 H ILE 84 H ILE 84 2.559 -19.693 -10.803 560 HA ILE 84 HA ILE 84 3.773 -17.150 -10.271 561 HB ILE 84 HB ILE 84 1.052 -17.785 -11.420 562 HG13 ILE 84 2HG1 ILE 84 3.011 -18.653 -12.713 563 HG21 ILE 84 1HG2 ILE 84 0.958 -15.567 -10.637 564 HG22 ILE 84 2HG2 ILE 84 2.599 -15.221 -11.180 565 HG23 ILE 84 3HG2 ILE 84 1.308 -15.440 -12.361 566 HD11 ILE 84 3HD1 ILE 84 2.366 -17.886 -14.833 567 HD12 ILE 84 1HD1 ILE 84 0.906 -17.833 -13.845 568 HD13 ILE 84 2HD1 ILE 84 1.792 -16.347 -14.190 569 H GLN 85 H GLN 85 3.401 -15.792 -8.637 570 HA GLN 85 HA GLN 85 1.100 -16.333 -6.878 571 HB3 GLN 85 2HB GLN 85 2.457 -15.591 -4.984 572 HG3 GLN 85 2HG GLN 85 3.454 -17.838 -6.649 573 HE21 GLN 85 1HE2 GLN 85 4.483 -19.325 -4.557 574 HE22 GLN 85 2HE2 GLN 85 6.014 -18.672 -4.098 575 H TYR 86 H TYR 86 0.385 -14.429 -5.608 576 HA TYR 86 HA TYR 86 1.107 -11.801 -6.169 577 HB3 TYR 86 2HB TYR 86 0.411 -11.997 -8.413 578 HD1 TYR 86 2HD TYR 86 -2.990 -12.482 -7.051 579 HD2 TYR 86 1HD TYR 86 0.130 -14.128 -9.431 580 HE1 TYR 86 2HE TYR 86 -4.533 -14.216 -7.864 581 HE2 TYR 86 1HE TYR 86 -1.405 -15.866 -10.252 582 HH TYR 86 HH TYR 86 -3.603 -16.458 -10.403 583 H VAL 87 H VAL 87 -0.228 -10.266 -5.124 584 HA VAL 87 HA VAL 87 -1.971 -11.463 -3.107 585 HB VAL 87 HB VAL 87 -1.160 -8.568 -3.214 586 HG11 VAL 87 1HG1 VAL 87 -2.687 -8.711 -1.533 587 HG12 VAL 87 2HG1 VAL 87 -2.349 -10.414 -1.219 588 HG13 VAL 87 3HG1 VAL 87 -1.247 -9.171 -0.628 589 HG21 VAL 87 3HG2 VAL 87 0.965 -9.384 -3.191 590 HG22 VAL 87 1HG2 VAL 87 0.607 -9.528 -1.471 591 HG23 VAL 87 2HG2 VAL 87 0.479 -10.941 -2.519 592 H ALA 88 H ALA 88 -4.014 -10.460 -2.564 593 HA ALA 88 HA ALA 88 -5.306 -9.207 -4.900 594 HB1 ALA 88 1HB ALA 88 -7.406 -10.268 -3.629 595 HB2 ALA 88 2HB ALA 88 -6.475 -11.145 -4.843 596 HB3 ALA 88 3HB ALA 88 -6.162 -11.413 -3.129 597 H SER 89 H SER 89 -6.247 -9.668 -1.498 598 HA SER 89 HA SER 89 -7.226 -6.943 -1.394 599 HB3 SER 89 2HB SER 89 -7.170 -8.713 1.015 600 HG SER 89 HG SER 89 -9.531 -7.623 0.336 601 H TYR 90 H TYR 90 -6.052 -5.278 -0.746 602 HA TYR 90 HA TYR 90 -3.968 -5.681 1.273 603 HB3 TYR 90 2HB TYR 90 -3.098 -3.739 -0.683 604 HD1 TYR 90 1HD TYR 90 -1.655 -3.833 1.509 605 HD2 TYR 90 2HD TYR 90 -1.726 -6.892 -1.446 606 HE1 TYR 90 1HE TYR 90 0.523 -4.647 2.309 607 HE2 TYR 90 2HE TYR 90 0.452 -7.716 -0.655 608 HH TYR 90 HH TYR 90 2.234 -6.033 1.898 609 H LYS 91 H LYS 91 -3.317 -3.712 2.353 610 HA LYS 91 HA LYS 91 -5.429 -1.660 2.281 611 HB3 LYS 91 2HB LYS 91 -3.625 -2.146 4.636 612 HG3 LYS 91 2HG LYS 91 -6.493 -1.421 4.859 613 HD3 LYS 91 2HD LYS 91 -4.369 -0.023 6.348 614 HE3 LYS 91 2HE LYS 91 -7.101 -0.490 6.603 615 HZ1 LYS 91 3HZ LYS 91 -7.176 -2.399 7.769 616 HZ2 LYS 91 1HZ LYS 91 -6.786 -1.395 9.074 617 HZ3 LYS 91 2HZ LYS 91 -5.574 -2.287 8.302 618 H VAL 92 H VAL 92 -4.876 0.366 1.792 619 HA VAL 92 HA VAL 92 -2.007 1.019 1.661 620 HB VAL 92 HB VAL 92 -3.008 1.128 -0.522 621 HG11 VAL 92 1HG1 VAL 92 -5.152 1.621 -0.809 622 HG12 VAL 92 2HG1 VAL 92 -5.287 2.035 0.901 623 HG13 VAL 92 3HG1 VAL 92 -4.854 3.275 -0.276 624 HG21 VAL 92 3HG2 VAL 92 -2.715 3.935 0.545 625 HG22 VAL 92 1HG2 VAL 92 -1.375 2.878 0.098 626 HG23 VAL 92 2HG2 VAL 92 -2.521 3.417 -1.130 627 H ALA 93 H ALA 93 -1.332 2.272 3.261 628 HA ALA 93 HA ALA 93 -3.135 4.385 4.248 629 HB1 ALA 93 1HB ALA 93 -1.086 3.186 6.050 630 HB2 ALA 93 2HB ALA 93 -2.621 3.959 6.445 631 HB3 ALA 93 3HB ALA 93 -2.602 2.328 5.777 632 H HIS 94 H HIS 94 -2.262 6.390 4.594 633 HA HIS 94 HA HIS 94 0.596 6.723 3.965 634 HB3 HIS 94 2HB HIS 94 -0.015 8.882 2.865 635 HD1 HIS 94 1HD HIS 94 0.597 8.561 0.500 636 HD2 HIS 94 2HD HIS 94 -1.920 5.548 1.859 637 HE1 HIS 94 1HE HIS 94 0.342 6.974 -1.435 638 H SER 95 H SER 95 1.733 8.184 5.176 639 HA SER 95 HA SER 95 0.248 9.601 7.289 640 HB3 SER 95 2HB SER 95 3.010 8.579 7.823 641 HG SER 95 HG SER 95 1.374 9.896 9.220 642 H ASP 96 H ASP 96 0.540 11.717 7.186 643 HA ASP 96 HA ASP 96 2.711 12.817 5.607 644 HB3 ASP 96 2HB ASP 96 0.582 13.836 5.246 645 H ASP 97 H ASP 97 1.658 12.726 8.967 646 HA ASP 97 HA ASP 97 3.963 14.326 9.783 647 HB3 ASP 97 2HB ASP 97 2.110 13.193 11.809 648 H GLY 98 H GLY 98 2.908 11.058 9.606 649 HA2 GLY 98 2HA GLY 98 4.614 9.335 9.739 650 HA3 GLY 98 3HA GLY 98 5.340 10.237 11.061 651 H VAL 99 H VAL 99 2.760 10.778 12.338 652 HA VAL 99 HA VAL 99 2.412 8.148 13.589 653 HB VAL 99 HB VAL 99 3.010 9.912 15.132 654 HG11 VAL 99 1HG1 VAL 99 0.577 11.339 14.067 655 HG12 VAL 99 2HG1 VAL 99 1.475 11.830 15.505 656 HG13 VAL 99 3HG1 VAL 99 2.258 11.850 13.924 657 HG21 VAL 99 3HG2 VAL 99 1.337 8.134 15.774 658 HG22 VAL 99 1HG2 VAL 99 1.313 9.598 16.759 659 HG23 VAL 99 2HG2 VAL 99 0.078 9.344 15.524 660 H GLN 100 H GLN 100 0.715 10.618 11.817 661 HA GLN 100 HA GLN 100 -1.889 9.444 12.323 662 HB3 GLN 100 2HB GLN 100 -2.739 11.225 10.869 663 HG3 GLN 100 2HG GLN 100 -0.658 12.479 12.628 664 HE21 GLN 100 1HE2 GLN 100 -0.913 14.591 12.779 665 HE22 GLN 100 2HE2 GLN 100 -2.307 15.482 12.283 666 H TRP 101 H TRP 101 -2.113 7.489 11.388 667 HA TRP 101 HA TRP 101 -1.202 7.081 8.647 668 HB3 TRP 101 2HB TRP 101 -1.524 4.759 9.014 669 HD1 TRP 101 HD TRP 101 0.843 6.763 9.992 670 HE1 TRP 101 1HE TRP 101 2.383 5.977 11.899 671 HE3 TRP 101 3HE TRP 101 -2.179 3.192 12.053 672 HZ2 TRP 101 2HZ TRP 101 2.322 4.093 14.000 673 HZ3 TRP 101 3HZ TRP 101 -1.364 1.943 14.009 674 HH2 TRP 101 HH TRP 101 0.842 2.385 14.961 675 H THR 102 H THR 102 -2.546 7.791 7.121 676 HA THR 102 HA THR 102 -5.440 7.540 7.527 677 HB THR 102 HB THR 102 -3.859 9.162 5.528 678 HG1 THR 102 1HG THR 102 -3.900 10.420 7.252 679 HG21 THR 102 3HG2 THR 102 -5.891 8.394 4.460 680 HG22 THR 102 1HG2 THR 102 -6.054 10.102 4.861 681 HG23 THR 102 2HG2 THR 102 -6.848 8.882 5.857 682 H VAL 103 H VAL 103 -6.343 5.764 6.735 683 HA VAL 103 HA VAL 103 -5.133 4.432 4.425 684 HB VAL 103 HB VAL 103 -6.718 2.571 4.981 685 HG11 VAL 103 1HG1 VAL 103 -4.567 3.542 6.792 686 HG12 VAL 103 2HG1 VAL 103 -5.517 2.140 7.291 687 HG13 VAL 103 3HG1 VAL 103 -4.623 2.105 5.771 688 HG21 VAL 103 3HG2 VAL 103 -7.868 2.580 7.104 689 HG22 VAL 103 1HG2 VAL 103 -7.229 4.180 7.481 690 HG23 VAL 103 2HG2 VAL 103 -8.379 3.978 6.159 691 H TYR 104 H TYR 104 -6.121 4.249 2.488 692 HA TYR 104 HA TYR 104 -8.144 6.042 1.756 693 HB3 TYR 104 2HB TYR 104 -8.279 4.382 -0.296 694 HD1 TYR 104 1HD TYR 104 -5.437 6.066 1.439 695 HD2 TYR 104 2HD TYR 104 -7.579 5.517 -2.196 696 HE1 TYR 104 1HE TYR 104 -4.075 7.818 0.378 697 HE2 TYR 104 2HE TYR 104 -6.221 7.267 -3.267 698 HH TYR 104 HH TYR 104 -3.626 8.921 -1.494 699 H GLU 105 H GLU 105 -10.008 5.868 2.931 700 HA GLU 105 HA GLU 105 -11.313 3.446 3.552 701 HB3 GLU 105 2HB GLU 105 -11.836 5.354 4.867 702 HG3 GLU 105 2HG GLU 105 -12.308 6.694 2.266 703 H GLU 106 H GLU 106 -12.982 2.356 2.582 704 HA GLU 106 HA GLU 106 -13.267 2.764 -0.268 705 HB3 GLU 106 2HB GLU 106 -15.005 0.731 0.427 706 HG3 GLU 106 2HG GLU 106 -12.492 -0.489 0.160 707 H GLN 107 H GLN 107 -15.057 3.421 2.615 708 HA GLN 107 HA GLN 107 -16.897 5.100 1.309 709 HB3 GLN 107 2HB GLN 107 -18.029 3.216 0.462 710 HG3 GLN 107 2HG GLN 107 -17.977 1.966 3.198 711 HE21 GLN 107 1HE2 GLN 107 -17.613 -0.387 1.119 712 HE22 GLN 107 2HE2 GLN 107 -19.253 -0.828 0.799 713 H GLY 108 H GLY 108 -15.301 5.553 3.429 714 HA2 GLY 108 2HA GLY 108 -15.478 6.648 5.460 715 HA3 GLY 108 3HA GLY 108 -17.200 6.298 5.457 716 H SER 109 H SER 109 -14.981 3.687 5.010 717 HA SER 109 HA SER 109 -15.542 2.791 7.762 718 HB3 SER 109 2HB SER 109 -16.643 1.247 6.388 719 HG SER 109 HG SER 109 -16.145 1.334 4.352 720 H SER 110 H SER 110 -13.126 3.441 5.395 721 HA SER 110 HA SER 110 -10.853 3.472 5.475 722 HB3 SER 110 2HB SER 110 -9.945 4.188 7.429 723 HG SER 110 HG SER 110 -11.707 5.362 7.766 724 H LYS 111 H LYS 111 -12.034 1.080 4.766 725 HA LYS 111 HA LYS 111 -10.504 -1.001 6.147 726 HB3 LYS 111 2HB LYS 111 -12.058 -2.150 4.096 727 HG3 LYS 111 2HG LYS 111 -13.464 -3.005 5.924 728 HD3 LYS 111 2HD LYS 111 -11.516 -3.934 7.333 729 HE3 LYS 111 2HE LYS 111 -10.605 -4.777 4.824 730 HZ1 LYS 111 3HZ LYS 111 -12.131 -5.792 6.988 731 HZ2 LYS 111 1HZ LYS 111 -11.123 -6.621 5.912 732 HZ3 LYS 111 2HZ LYS 111 -12.748 -6.366 5.520 733 H VAL 112 H VAL 112 -10.050 -2.865 4.304 734 HA VAL 112 HA VAL 112 -7.952 -1.686 2.706 735 HB VAL 112 HB VAL 112 -7.158 -3.859 2.321 736 HG11 VAL 112 1HG1 VAL 112 -7.667 -3.004 4.883 737 HG12 VAL 112 2HG1 VAL 112 -8.280 -4.660 4.889 738 HG13 VAL 112 3HG1 VAL 112 -6.606 -4.339 4.433 739 HG21 VAL 112 3HG2 VAL 112 -8.722 -5.269 1.528 740 HG22 VAL 112 1HG2 VAL 112 -8.866 -5.766 3.213 741 HG23 VAL 112 2HG2 VAL 112 -9.996 -4.590 2.541 742 H PHE 113 H PHE 113 -7.761 -3.134 0.473 743 HA PHE 113 HA PHE 113 -10.318 -2.858 -0.944 744 HB3 PHE 113 2HB PHE 113 -9.084 -0.819 -1.407 745 HD1 PHE 113 1HD PHE 113 -7.011 -0.547 -0.146 746 HD2 PHE 113 2HD PHE 113 -7.136 -2.776 -3.769 747 HE1 PHE 113 1HE PHE 113 -4.557 -0.434 -0.297 748 HE2 PHE 113 2HE PHE 113 -4.684 -2.667 -3.926 749 HZ PHE 113 HZ PHE 113 -3.390 -1.495 -2.187 750 H GLN 114 H GLN 114 -10.793 -4.570 -2.158 751 HA GLN 114 HA GLN 114 -8.909 -6.737 -2.365 752 HB3 GLN 114 2HB GLN 114 -11.168 -7.346 -1.920 753 HG3 GLN 114 2HG GLN 114 -12.545 -6.752 -4.316 754 HE21 GLN 114 1HE2 GLN 114 -11.965 -5.566 -1.030 755 HE22 GLN 114 2HE2 GLN 114 -13.609 -5.683 -0.511 756 H GLY 115 H GLY 115 -7.817 -7.430 -4.135 757 HA2 GLY 115 2HA GLY 115 -8.443 -6.396 -6.769 758 HA3 GLY 115 3HA GLY 115 -6.925 -5.818 -6.098 759 H ASN 116 H ASN 116 -5.833 -6.850 -7.847 760 HA ASN 116 HA ASN 116 -4.697 -9.304 -7.239 761 HB3 ASN 116 2HB ASN 116 -6.479 -10.647 -7.744 762 HD21 ASN 116 1HD2 ASN 116 -8.589 -10.841 -8.175 763 HD22 ASN 116 2HD2 ASN 116 -9.539 -9.658 -9.002 764 H LEU 117 H LEU 117 -5.888 -8.438 -10.457 765 HA LEU 117 HA LEU 117 -4.830 -7.756 -12.351 766 HB3 LEU 117 2HB LEU 117 -3.280 -6.053 -12.203 767 HG LEU 117 HG LEU 117 -4.326 -5.945 -9.378 768 HD11 LEU 117 1HD1 LEU 117 -2.845 -4.227 -9.429 769 HD12 LEU 117 2HD1 LEU 117 -4.218 -3.413 -10.179 770 HD13 LEU 117 3HD1 LEU 117 -2.923 -4.063 -11.184 771 HD21 LEU 117 3HD2 LEU 117 -6.294 -6.116 -10.552 772 HD22 LEU 117 1HD2 LEU 117 -5.620 -5.373 -12.003 773 HD23 LEU 117 2HD2 LEU 117 -6.019 -4.374 -10.606 774 H ASP 118 H ASP 118 -4.004 -10.260 -10.699 775 HA ASP 118 HA ASP 118 -2.528 -11.992 -10.862 776 HB3 ASP 118 2HB ASP 118 -1.986 -12.676 -13.095 777 H ASN 119 H ASN 119 -0.214 -12.428 -12.259 778 HA ASN 119 HA ASN 119 1.603 -10.591 -10.907 779 HB3 ASN 119 2HB ASN 119 1.695 -13.225 -10.922 780 HD21 ASN 119 1HD2 ASN 119 4.575 -13.371 -12.125 781 HD22 ASN 119 2HD2 ASN 119 4.280 -14.005 -13.705 782 H ASN 120 H ASN 120 0.199 -10.845 -13.894 783 HA ASN 120 HA ASN 120 2.523 -9.805 -15.344 784 HB3 ASN 120 2HB ASN 120 -0.051 -10.193 -16.759 785 HD21 ASN 120 1HD2 ASN 120 2.868 -12.133 -16.816 786 HD22 ASN 120 2HD2 ASN 120 3.431 -11.578 -18.352 787 H SER 121 H SER 121 -0.967 -9.061 -15.248 788 HA SER 121 HA SER 121 -0.733 -6.462 -16.251 789 HB3 SER 121 2HB SER 121 -3.005 -6.193 -15.735 790 HG SER 121 HG SER 121 -3.131 -8.952 -15.540 791 H HIS 122 H HIS 122 -0.004 -4.636 -15.395 792 HA HIS 122 HA HIS 122 0.456 -4.540 -12.493 793 HB3 HIS 122 2HB HIS 122 2.396 -4.255 -14.120 794 HD1 HIS 122 1HD HIS 122 2.864 -0.860 -13.918 795 HD2 HIS 122 2HD HIS 122 0.614 -3.197 -16.513 796 HE1 HIS 122 1HE HIS 122 2.537 0.546 -15.977 797 H LYS 123 H LYS 123 -0.550 -3.081 -11.249 798 HA LYS 123 HA LYS 123 -1.411 -0.544 -11.976 799 HB3 LYS 123 2HB LYS 123 -3.966 -1.857 -11.713 800 HG3 LYS 123 2HG LYS 123 -3.513 -0.736 -14.313 801 HD3 LYS 123 2HD LYS 123 -4.949 0.814 -12.261 802 HE3 LYS 123 2HE LYS 123 -5.005 0.521 -15.020 803 HZ1 LYS 123 3HZ LYS 123 -7.235 -0.929 -13.764 804 HZ2 LYS 123 1HZ LYS 123 -6.378 -1.296 -15.175 805 HZ3 LYS 123 2HZ LYS 123 -7.511 -0.040 -15.178 806 H LYS 124 H LYS 124 -3.341 0.165 -10.421 807 HA LYS 124 HA LYS 124 -3.703 -1.216 -7.995 808 HB3 LYS 124 2HB LYS 124 -1.763 1.085 -7.765 809 HG3 LYS 124 2HG LYS 124 -3.274 0.229 -5.798 810 HD3 LYS 124 2HD LYS 124 -1.558 -2.034 -6.346 811 HE3 LYS 124 2HE LYS 124 -0.050 -1.227 -4.705 812 HZ1 LYS 124 3HZ LYS 124 -2.453 -0.245 -3.413 813 HZ2 LYS 124 1HZ LYS 124 -0.888 0.397 -3.424 814 HZ3 LYS 124 2HZ LYS 124 -1.275 -0.866 -2.369 815 H ASN 125 H ASN 125 -3.102 2.187 -8.897 816 HA ASN 125 HA ASN 125 -5.845 2.888 -8.907 817 HB3 ASN 125 2HB ASN 125 -4.551 4.271 -6.627 818 HD21 ASN 125 1HD2 ASN 125 -6.663 2.883 -4.992 819 HD22 ASN 125 2HD2 ASN 125 -8.129 3.697 -5.410 820 H ILE 126 H ILE 126 -6.174 5.214 -9.216 821 HA ILE 126 HA ILE 126 -3.856 6.399 -10.561 822 HB ILE 126 HB ILE 126 -6.485 7.731 -10.767 823 HG13 ILE 126 2HG1 ILE 126 -6.041 4.890 -11.517 824 HG21 ILE 126 1HG2 ILE 126 -4.839 6.868 -13.084 825 HG22 ILE 126 2HG2 ILE 126 -5.724 8.369 -12.821 826 HG23 ILE 126 3HG2 ILE 126 -4.182 8.101 -12.009 827 HD11 ILE 126 3HD1 ILE 126 -7.835 4.765 -10.216 828 HD12 ILE 126 1HD1 ILE 126 -8.142 6.498 -10.323 829 HD13 ILE 126 2HD1 ILE 126 -8.730 5.417 -11.587 830 H PHE 127 H PHE 127 -5.051 9.062 -10.521 831 HA PHE 127 HA PHE 127 -3.858 9.997 -8.093 832 HB3 PHE 127 2HB PHE 127 -3.531 11.461 -9.876 833 HD1 PHE 127 1HD PHE 127 -7.146 12.143 -9.794 834 HD2 PHE 127 2HD PHE 127 -3.882 10.643 -12.077 835 HE1 PHE 127 1HE PHE 127 -8.553 12.160 -11.813 836 HE2 PHE 127 2HE PHE 127 -5.283 10.659 -14.099 837 HZ PHE 127 HZ PHE 127 -7.621 11.419 -13.969 838 H GLU 128 H GLU 128 -5.632 8.447 -7.042 839 HA GLU 128 HA GLU 128 -8.215 9.627 -6.660 840 HB3 GLU 128 2HB GLU 128 -6.800 7.395 -5.193 841 HG3 GLU 128 2HG GLU 128 -9.398 8.656 -4.709 842 H LYS 129 H LYS 129 -7.552 11.759 -5.985 843 HA LYS 129 HA LYS 129 -7.383 13.369 -4.382 844 HB3 LYS 129 2HB LYS 129 -7.928 12.873 -2.139 845 HG3 LYS 129 2HG LYS 129 -9.253 10.505 -3.367 846 HD3 LYS 129 2HD LYS 129 -10.508 12.795 -1.893 847 HE3 LYS 129 2HE LYS 129 -11.811 10.659 -1.056 848 HZ1 LYS 129 3HZ LYS 129 -12.345 12.592 -2.866 849 HZ2 LYS 129 1HZ LYS 129 -13.451 11.428 -2.333 850 HZ3 LYS 129 2HZ LYS 129 -12.596 11.184 -3.772 851 HA PRO 130 HA PRO 130 -2.857 12.424 -4.176 852 HB3 PRO 130 2HB PRO 130 -2.535 13.266 -6.290 853 HG3 PRO 130 2HG PRO 130 -4.036 14.780 -7.219 854 HD3 PRO 130 2HD PRO 130 -5.504 13.151 -6.507 855 H PHE 131 H PHE 131 -1.209 13.513 -2.975 856 HA PHE 131 HA PHE 131 -1.432 15.998 -1.751 857 HB3 PHE 131 2HB PHE 131 -1.926 14.165 0.475 858 HD1 PHE 131 1HD PHE 131 -3.483 16.952 -1.461 859 HD2 PHE 131 2HD PHE 131 -2.235 15.470 2.329 860 HE1 PHE 131 1HE PHE 131 -4.170 19.068 -0.412 861 HE2 PHE 131 2HE PHE 131 -2.921 17.584 3.385 862 HZ PHE 131 HZ PHE 131 -3.891 19.386 2.015 863 H MET 132 H MET 132 0.120 16.261 0.089 864 HA MET 132 HA MET 132 2.570 14.966 -0.544 865 HB3 MET 132 2HB MET 132 2.529 17.271 0.242 866 HG3 MET 132 2HG MET 132 2.163 16.647 3.066 867 HE1 MET 132 3HE MET 132 0.085 19.969 0.662 868 HE2 MET 132 1HE MET 132 1.189 18.884 -0.184 869 HE3 MET 132 2HE MET 132 -0.259 18.240 0.591 870 H ALA 133 H ALA 133 3.854 13.615 0.779 871 HA ALA 133 HA ALA 133 2.632 12.400 3.121 872 HB1 ALA 133 1HB ALA 133 3.625 10.324 1.343 873 HB2 ALA 133 2HB ALA 133 2.115 10.412 2.251 874 HB3 ALA 133 3HB ALA 133 2.243 11.194 0.676 875 H ARG 134 H ARG 134 4.106 11.361 4.480 876 HA ARG 134 HA ARG 134 6.932 11.831 3.797 877 HB3 ARG 134 2HB ARG 134 6.362 11.374 6.620 878 HG3 ARG 134 2HG ARG 134 7.313 14.012 5.929 879 HD3 ARG 134 2HD ARG 134 7.702 13.002 8.086 880 HE ARG 134 HE ARG 134 8.451 10.682 6.671 881 HH11 ARG 134 1HH1 ARG 134 9.315 12.537 9.487 882 HH12 ARG 134 2HH1 ARG 134 9.942 11.174 10.353 883 HH21 ARG 134 1HH2 ARG 134 9.274 8.879 7.801 884 HH22 ARG 134 2HH2 ARG 134 9.919 9.094 9.394 885 H TYR 135 H TYR 135 4.655 9.554 5.226 886 HA TYR 135 HA TYR 135 6.390 7.353 4.512 887 HB3 TYR 135 2HB TYR 135 6.204 8.333 7.246 888 HD1 TYR 135 1HD TYR 135 6.462 4.761 6.230 889 HD2 TYR 135 2HD TYR 135 4.527 7.626 8.711 890 HE1 TYR 135 1HE TYR 135 5.320 2.943 7.430 891 HE2 TYR 135 2HE TYR 135 3.380 5.816 9.917 892 HH TYR 135 HH TYR 135 2.690 3.367 9.336 893 H VAL 136 H VAL 136 5.135 5.867 3.622 894 HA VAL 136 HA VAL 136 2.317 5.710 4.464 895 HB VAL 136 HB VAL 136 1.719 4.969 2.310 896 HG11 VAL 136 1HG1 VAL 136 2.255 7.381 2.483 897 HG12 VAL 136 2HG1 VAL 136 3.870 7.035 1.861 898 HG13 VAL 136 3HG1 VAL 136 2.453 6.740 0.852 899 HG21 VAL 136 3HG2 VAL 136 3.435 4.480 0.555 900 HG22 VAL 136 1HG2 VAL 136 4.666 4.573 1.816 901 HG23 VAL 136 2HG2 VAL 136 3.414 3.333 1.895 902 H ARG 137 H ARG 137 1.410 3.757 4.991 903 HA ARG 137 HA ARG 137 3.217 1.432 5.048 904 HB3 ARG 137 2HB ARG 137 1.125 1.776 7.153 905 HG3 ARG 137 2HG ARG 137 3.462 0.927 8.325 906 HD3 ARG 137 2HD ARG 137 1.395 -0.905 7.130 907 HE ARG 137 HE ARG 137 2.698 -2.306 8.400 908 HH11 ARG 137 1HH1 ARG 137 2.037 0.609 10.183 909 HH12 ARG 137 2HH1 ARG 137 2.677 -0.002 11.674 910 HH21 ARG 137 1HH2 ARG 137 3.544 -3.123 10.355 911 HH22 ARG 137 2HH2 ARG 137 3.535 -2.125 11.770 912 H VAL 138 H VAL 138 2.339 -0.545 4.554 913 HA VAL 138 HA VAL 138 -0.521 -0.607 3.862 914 HB VAL 138 HB VAL 138 0.196 -2.201 1.971 915 HG11 VAL 138 1HG1 VAL 138 0.227 0.738 2.080 916 HG12 VAL 138 2HG1 VAL 138 0.979 0.025 0.650 917 HG13 VAL 138 3HG1 VAL 138 -0.698 -0.351 1.048 918 HG21 VAL 138 3HG2 VAL 138 2.565 -2.331 2.788 919 HG22 VAL 138 1HG2 VAL 138 2.391 -1.945 1.076 920 HG23 VAL 138 2HG2 VAL 138 2.780 -0.672 2.232 921 H LEU 139 H LEU 139 -1.530 -2.657 3.997 922 HA LEU 139 HA LEU 139 0.010 -4.827 5.204 923 HB3 LEU 139 2HB LEU 139 -1.599 -5.145 6.984 924 HG LEU 139 HG LEU 139 0.264 -3.250 7.181 925 HD11 LEU 139 1HD1 LEU 139 -2.362 -1.795 7.386 926 HD12 LEU 139 2HD1 LEU 139 -0.996 -1.422 6.336 927 HD13 LEU 139 3HD1 LEU 139 -0.856 -1.194 8.079 928 HD21 LEU 139 3HD2 LEU 139 0.045 -3.597 9.387 929 HD22 LEU 139 1HD2 LEU 139 -1.214 -4.739 8.909 930 HD23 LEU 139 2HD2 LEU 139 -1.649 -3.101 9.401 931 HA PRO 140 HA PRO 140 -2.478 -6.991 2.220 932 HB3 PRO 140 2HB PRO 140 -0.615 -8.279 1.836 933 HG3 PRO 140 2HG PRO 140 0.922 -8.700 3.530 934 HD3 PRO 140 2HD PRO 140 0.747 -6.409 3.713 935 H VAL 141 H VAL 141 -4.252 -8.402 2.213 936 HA VAL 141 HA VAL 141 -5.205 -9.315 4.843 937 HB VAL 141 HB VAL 141 -6.848 -7.868 2.761 938 HG11 VAL 141 1HG1 VAL 141 -8.426 -9.330 3.493 939 HG12 VAL 141 2HG1 VAL 141 -7.611 -9.613 5.033 940 HG13 VAL 141 3HG1 VAL 141 -8.552 -8.141 4.790 941 HG21 VAL 141 3HG2 VAL 141 -5.874 -6.175 3.961 942 HG22 VAL 141 1HG2 VAL 141 -7.300 -6.481 4.953 943 HG23 VAL 141 2HG2 VAL 141 -5.737 -7.143 5.428 944 H SER 142 H SER 142 -5.351 -9.625 1.336 945 HA SER 142 HA SER 142 -5.925 -12.473 1.655 946 HB3 SER 142 2HB SER 142 -7.810 -12.516 0.285 947 HG SER 142 HG SER 142 -8.936 -11.511 1.734 948 H TRP 143 H TRP 143 -4.139 -13.308 0.779 949 HA TRP 143 HA TRP 143 -3.153 -12.184 -1.753 950 HB3 TRP 143 2HB TRP 143 -1.502 -12.211 0.047 951 HD1 TRP 143 HD TRP 143 -0.771 -15.852 -0.619 952 HE1 TRP 143 1HE TRP 143 -0.908 -17.169 1.588 953 HE3 TRP 143 3HE TRP 143 -2.810 -12.232 2.362 954 HZ2 TRP 143 2HZ TRP 143 -1.767 -16.731 4.241 955 HZ3 TRP 143 3HZ TRP 143 -3.259 -12.763 4.721 956 HH2 TRP 143 HH TRP 143 -2.748 -14.967 5.640 957 H HIS 144 H HIS 144 -1.950 -13.990 -3.079 958 HA HIS 144 HA HIS 144 -3.572 -16.437 -3.128 959 HB3 HIS 144 2HB HIS 144 -3.142 -15.983 -5.795 960 HD1 HIS 144 1HD HIS 144 -5.597 -14.955 -3.096 961 HD2 HIS 144 2HD HIS 144 -5.557 -16.495 -6.954 962 HE1 HIS 144 1HE HIS 144 -7.988 -15.539 -3.612 963 H ASN 145 H ASN 145 -2.345 -18.196 -3.183 964 HA ASN 145 HA ASN 145 -0.625 -19.625 -3.653 965 HB3 ASN 145 2HB ASN 145 0.875 -19.192 -5.437 966 HD21 ASN 145 1HD2 ASN 145 -0.784 -16.432 -6.450 967 HD22 ASN 145 2HD2 ASN 145 -1.969 -17.207 -7.441 968 H ARG 146 H ARG 146 0.765 -16.341 -3.450 969 HA ARG 146 HA ARG 146 1.879 -16.763 -0.879 970 HB3 ARG 146 2HB ARG 146 4.196 -16.385 -2.572 971 HG3 ARG 146 2HG ARG 146 4.711 -18.685 -1.340 972 HD3 ARG 146 2HD ARG 146 4.662 -16.490 0.593 973 HE ARG 146 HE ARG 146 6.519 -17.736 1.037 974 HH11 ARG 146 1HH1 ARG 146 6.316 -17.232 -2.402 975 HH12 ARG 146 2HH1 ARG 146 7.845 -17.976 -2.733 976 HH21 ARG 146 1HH2 ARG 146 8.535 -18.716 0.614 977 HH22 ARG 146 2HH2 ARG 146 9.106 -18.820 -1.017 978 H ILE 147 H ILE 147 2.606 -14.870 0.022 979 HA ILE 147 HA ILE 147 1.820 -12.451 -1.219 980 HB ILE 147 HB ILE 147 3.568 -12.859 1.211 981 HG13 ILE 147 2HG1 ILE 147 0.635 -12.881 0.745 982 HG21 ILE 147 1HG2 ILE 147 3.955 -10.664 0.931 983 HG22 ILE 147 2HG2 ILE 147 2.597 -10.463 -0.175 984 HG23 ILE 147 3HG2 ILE 147 2.321 -10.475 1.567 985 HD11 ILE 147 3HD1 ILE 147 2.478 -14.607 1.914 986 HD12 ILE 147 1HD1 ILE 147 1.537 -13.949 3.252 987 HD13 ILE 147 2HD1 ILE 147 0.721 -14.755 1.912 988 H THR 148 H THR 148 2.990 -12.463 -3.209 989 HA THR 148 HA THR 148 5.719 -11.422 -2.908 990 HB THR 148 HB THR 148 5.237 -13.051 -5.330 991 HG1 THR 148 1HG THR 148 4.462 -14.586 -3.999 992 HG21 THR 148 3HG2 THR 148 7.607 -13.833 -4.294 993 HG22 THR 148 1HG2 THR 148 7.467 -12.227 -3.582 994 HG23 THR 148 2HG2 THR 148 7.410 -12.423 -5.334 995 H LEU 149 H LEU 149 5.544 -9.375 -3.564 996 HA LEU 149 HA LEU 149 4.917 -8.744 -6.253 997 HB3 LEU 149 2HB LEU 149 2.640 -9.080 -5.110 998 HG LEU 149 HG LEU 149 3.235 -6.310 -4.067 999 HD11 LEU 149 1HD1 LEU 149 1.068 -6.011 -4.587 1000 HD12 LEU 149 2HD1 LEU 149 0.791 -6.959 -3.126 1001 HD13 LEU 149 3HD1 LEU 149 0.744 -7.741 -4.705 1002 HD21 LEU 149 3HD2 LEU 149 3.104 -8.984 -2.820 1003 HD22 LEU 149 1HD2 LEU 149 2.272 -7.682 -1.969 1004 HD23 LEU 149 2HD2 LEU 149 3.993 -7.541 -2.330 1005 H ARG 150 H ARG 150 4.453 -6.122 -6.237 1006 HA ARG 150 HA ARG 150 6.170 -4.826 -4.278 1007 HB3 ARG 150 2HB ARG 150 7.525 -5.691 -6.323 1008 HG3 ARG 150 2HG ARG 150 7.697 -3.932 -8.097 1009 HD3 ARG 150 2HD ARG 150 5.002 -4.815 -8.594 1010 HE ARG 150 HE ARG 150 7.028 -6.298 -9.893 1011 HH11 ARG 150 1HH1 ARG 150 5.747 -3.073 -9.625 1012 HH12 ARG 150 2HH1 ARG 150 6.250 -2.601 -11.215 1013 HH21 ARG 150 1HH2 ARG 150 7.697 -5.689 -11.987 1014 HH22 ARG 150 2HH2 ARG 150 7.359 -4.089 -12.557 1015 H LEU 151 H LEU 151 5.583 -2.757 -3.880 1016 HA LEU 151 HA LEU 151 3.407 -1.659 -5.529 1017 HB3 LEU 151 2HB LEU 151 4.087 -1.399 -2.621 1018 HG LEU 151 HG LEU 151 2.528 0.552 -4.226 1019 HD11 LEU 151 1HD1 LEU 151 0.857 0.908 -2.679 1020 HD12 LEU 151 2HD1 LEU 151 1.720 0.066 -1.392 1021 HD13 LEU 151 3HD1 LEU 151 0.964 -0.852 -2.694 1022 HD21 LEU 151 3HD2 LEU 151 3.735 2.048 -3.078 1023 HD22 LEU 151 1HD2 LEU 151 4.756 0.673 -2.655 1024 HD23 LEU 151 2HD2 LEU 151 3.496 1.210 -1.544 1025 H GLU 152 H GLU 152 3.642 0.264 -6.511 1026 HA GLU 152 HA GLU 152 6.080 1.810 -5.915 1027 HB3 GLU 152 2HB GLU 152 5.064 2.340 -8.555 1028 HG3 GLU 152 2HG GLU 152 7.618 1.301 -7.410 1029 H LEU 153 H LEU 153 5.919 4.017 -5.768 1030 HA LEU 153 HA LEU 153 3.181 5.098 -5.763 1031 HB3 LEU 153 2HB LEU 153 4.208 5.104 -3.572 1032 HG LEU 153 HG LEU 153 6.607 5.903 -4.867 1033 HD11 LEU 153 1HD1 LEU 153 6.049 8.195 -4.593 1034 HD12 LEU 153 2HD1 LEU 153 7.207 7.787 -3.327 1035 HD13 LEU 153 3HD1 LEU 153 5.492 7.928 -2.941 1036 HD21 LEU 153 3HD2 LEU 153 6.350 4.247 -3.061 1037 HD22 LEU 153 1HD2 LEU 153 5.976 5.555 -1.939 1038 HD23 LEU 153 2HD2 LEU 153 7.570 5.467 -2.689 1039 H LEU 154 H LEU 154 2.702 6.889 -6.926 1040 HA LEU 154 HA LEU 154 4.905 8.163 -8.410 1041 HB3 LEU 154 2HB LEU 154 3.635 8.256 -10.360 1042 HG LEU 154 HG LEU 154 3.037 5.609 -9.066 1043 HD11 LEU 154 1HD1 LEU 154 2.478 6.326 -11.936 1044 HD12 LEU 154 2HD1 LEU 154 1.239 6.245 -10.684 1045 HD13 LEU 154 3HD1 LEU 154 2.148 4.798 -11.120 1046 HD21 LEU 154 3HD2 LEU 154 5.150 6.753 -10.748 1047 HD22 LEU 154 1HD2 LEU 154 4.563 5.175 -11.273 1048 HD23 LEU 154 2HD2 LEU 154 5.194 5.380 -9.639 1049 H GLY 155 H GLY 155 4.724 10.389 -8.830 1050 HA2 GLY 155 2HA GLY 155 2.609 11.770 -7.297 1051 HA3 GLY 155 3HA GLY 155 4.289 12.275 -7.213 1052 H CYS 156 H CYS 156 2.745 14.245 -7.854 1053 HA CYS 156 HA CYS 156 2.568 14.403 -10.778 1054 HB3 CYS 156 2HB CYS 156 1.519 16.758 -9.739 1055 H LEU 157 H LEU 157 4.441 15.453 -8.127 1056 HA LEU 157 HA LEU 157 6.155 16.936 -7.884 1057 HB3 LEU 157 2HB LEU 157 6.779 16.987 -10.755 1058 HG LEU 157 HG LEU 157 8.968 16.258 -10.129 1059 HD11 LEU 157 1HD1 LEU 157 8.525 18.605 -9.767 1060 HD12 LEU 157 2HD1 LEU 157 9.602 18.000 -8.509 1061 HD13 LEU 157 3HD1 LEU 157 7.895 18.267 -8.155 1062 HD21 LEU 157 3HD2 LEU 157 7.640 14.954 -8.033 1063 HD22 LEU 157 1HD2 LEU 157 8.716 16.127 -7.273 1064 HD23 LEU 157 2HD2 LEU 157 9.367 14.932 -8.395 1065 H GLU 158 H GLU 158 3.565 18.081 -8.404 1066 HA GLU 158 HA GLU 158 4.276 20.495 -9.926 1067 HB3 GLU 158 2HB GLU 158 1.529 20.523 -9.228 1068 HG3 GLU 158 2HG GLU 158 2.528 19.660 -11.909 Start of MODEL 10 1 H1 MET -5 H MET -5 9.477 31.843 -16.278 2 HA MET -5 HA MET -5 10.174 29.798 -17.129 3 HB3 MET -5 2HB MET -5 11.615 28.302 -15.817 4 HG3 MET -5 2HG MET -5 12.669 31.102 -15.550 5 HE1 MET -5 3HE MET -5 15.190 29.944 -17.669 6 HE2 MET -5 1HE MET -5 15.254 31.276 -16.515 7 HE3 MET -5 2HE MET -5 16.407 29.949 -16.391 8 H LYS -4 H LYS -4 9.312 27.657 -16.988 9 HA LYS -4 HA LYS -4 7.391 27.224 -14.807 10 HB3 LYS -4 2HB LYS -4 6.402 26.216 -17.341 11 HG3 LYS -4 2HG LYS -4 5.121 26.673 -15.181 12 HD3 LYS -4 2HD LYS -4 5.619 29.427 -16.184 13 HE3 LYS -4 2HE LYS -4 3.045 28.651 -16.180 14 HZ1 LYS -4 3HZ LYS -4 2.061 29.457 -14.099 15 HZ2 LYS -4 1HZ LYS -4 3.604 29.574 -13.414 16 HZ3 LYS -4 2HZ LYS -4 2.991 28.063 -13.864 17 H SER -3 H SER -3 6.988 25.078 -14.275 18 HA SER -3 HA SER -3 8.686 23.087 -15.630 19 HB3 SER -3 2HB SER -3 9.717 22.561 -13.706 20 HG SER -3 HG SER -3 9.968 24.273 -12.512 21 H GLY -2 H GLY -2 7.907 20.818 -14.361 22 HA2 GLY -2 2HA GLY -2 6.243 19.235 -14.235 23 HA3 GLY -2 3HA GLY -2 5.097 20.553 -14.043 24 H HIS -1 H HIS -1 6.801 18.547 -16.366 25 HA HIS -1 HA HIS -1 5.164 19.576 -18.552 26 HB3 HIS -1 2HB HIS -1 6.574 18.020 -19.948 27 HD1 HIS -1 1HD HIS -1 7.523 19.873 -21.279 28 HD2 HIS -1 2HD HIS -1 8.668 20.091 -17.291 29 HE1 HIS -1 1HE HIS -1 9.115 21.815 -21.142 30 H GLY 0 H GLY 0 5.630 16.669 -16.629 31 HA2 GLY 0 2HA GLY 0 3.050 15.684 -17.588 32 HA3 GLY 0 3HA GLY 0 4.442 14.639 -17.827 33 H CYS 1 H CYS 1 2.016 14.240 -16.208 34 HA CYS 1 HA CYS 1 2.966 14.338 -13.465 35 HB3 CYS 1 2HB CYS 1 0.665 13.017 -13.220 36 H SER 2 H SER 2 2.144 12.140 -12.254 37 HA SER 2 HA SER 2 2.632 9.966 -11.790 38 HB3 SER 2 2HB SER 2 2.322 8.384 -13.451 39 HG SER 2 HG SER 2 0.654 9.130 -14.558 40 H GLU 3 H GLU 3 4.614 11.114 -10.951 41 HA GLU 3 HA GLU 3 7.030 10.352 -12.441 42 HB3 GLU 3 2HB GLU 3 8.169 11.890 -10.759 43 HG3 GLU 3 2HG GLU 3 7.402 13.987 -11.807 44 HA PRO 4 HA PRO 4 8.118 7.218 -9.570 45 HB3 PRO 4 2HB PRO 4 9.938 6.786 -10.905 46 HG3 PRO 4 2HG PRO 4 11.096 8.511 -11.948 47 HD3 PRO 4 2HD PRO 4 8.941 9.058 -12.555 48 H LEU 5 H LEU 5 10.014 6.984 -7.720 49 HA LEU 5 HA LEU 5 9.465 9.193 -5.853 50 HB3 LEU 5 2HB LEU 5 8.526 7.398 -4.810 51 HG LEU 5 HG LEU 5 9.191 5.661 -6.483 52 HD11 LEU 5 1HD1 LEU 5 11.252 4.313 -5.551 53 HD12 LEU 5 2HD1 LEU 5 11.744 5.907 -4.979 54 HD13 LEU 5 3HD1 LEU 5 11.463 5.635 -6.699 55 HD21 LEU 5 3HD2 LEU 5 9.478 3.858 -4.569 56 HD22 LEU 5 1HD2 LEU 5 7.955 4.713 -4.818 57 HD23 LEU 5 2HD2 LEU 5 9.061 5.233 -3.545 58 H GLY 6 H GLY 6 11.924 7.376 -7.444 59 HA2 GLY 6 2HA GLY 6 13.948 9.185 -6.471 60 HA3 GLY 6 3HA GLY 6 14.141 7.538 -5.889 61 H LEU 7 H LEU 7 13.062 8.749 -9.050 62 HA LEU 7 HA LEU 7 15.428 7.484 -10.256 63 HB3 LEU 7 2HB LEU 7 14.173 6.462 -11.937 64 HG LEU 7 HG LEU 7 12.396 6.204 -9.512 65 HD11 LEU 7 1HD1 LEU 7 12.642 4.412 -11.922 66 HD12 LEU 7 2HD1 LEU 7 11.307 5.522 -11.615 67 HD13 LEU 7 3HD1 LEU 7 11.594 4.166 -10.524 68 HD21 LEU 7 3HD2 LEU 7 13.805 3.902 -9.694 69 HD22 LEU 7 1HD2 LEU 7 14.259 5.267 -8.673 70 HD23 LEU 7 2HD2 LEU 7 15.001 5.068 -10.261 71 H LYS 8 H LYS 8 13.948 10.296 -9.710 72 HA LYS 8 HA LYS 8 14.729 11.428 -12.317 73 HB3 LYS 8 2HB LYS 8 13.129 13.319 -11.654 74 HG3 LYS 8 2HG LYS 8 11.058 11.666 -12.031 75 HD3 LYS 8 2HD LYS 8 12.017 13.449 -13.550 76 HE3 LYS 8 2HE LYS 8 13.561 11.061 -14.550 77 HZ1 LYS 8 3HZ LYS 8 13.714 11.991 -16.548 78 HZ2 LYS 8 1HZ LYS 8 13.993 13.534 -15.915 79 HZ3 LYS 8 2HZ LYS 8 12.409 12.976 -16.114 80 H ASN 9 H ASN 9 14.034 12.852 -9.133 81 HA ASN 9 HA ASN 9 16.722 14.058 -9.192 82 HB3 ASN 9 2HB ASN 9 15.349 15.751 -7.585 83 HD21 ASN 9 1HD2 ASN 9 14.134 15.783 -10.824 84 HD22 ASN 9 2HD2 ASN 9 15.221 16.976 -11.442 85 H ASN 10 H ASN 10 14.187 12.633 -7.218 86 HA ASN 10 HA ASN 10 15.371 12.916 -4.701 87 HB3 ASN 10 2HB ASN 10 14.029 10.699 -4.261 88 HD21 ASN 10 1HD2 ASN 10 13.107 13.668 -5.965 89 HD22 ASN 10 2HD2 ASN 10 11.986 14.210 -4.768 90 H THR 11 H THR 11 15.660 10.312 -7.094 91 HA THR 11 HA THR 11 17.093 8.543 -7.264 92 HB THR 11 HB THR 11 19.404 9.036 -7.099 93 HG1 THR 11 1HG THR 11 18.998 11.398 -5.627 94 HG21 THR 11 3HG2 THR 11 19.590 11.287 -8.112 95 HG22 THR 11 1HG2 THR 11 17.910 11.597 -7.678 96 HG23 THR 11 2HG2 THR 11 18.302 10.323 -8.833 97 H ILE 12 H ILE 12 15.489 8.562 -4.897 98 HA ILE 12 HA ILE 12 16.885 8.022 -2.541 99 HB ILE 12 HB ILE 12 14.215 7.018 -3.514 100 HG13 ILE 12 2HG1 ILE 12 14.780 9.503 -2.874 101 HG21 ILE 12 1HG2 ILE 12 15.518 6.621 -0.827 102 HG22 ILE 12 2HG2 ILE 12 13.805 6.358 -1.150 103 HG23 ILE 12 3HG2 ILE 12 15.018 5.372 -1.967 104 HD11 ILE 12 3HD1 ILE 12 12.591 9.810 -2.771 105 HD12 ILE 12 1HD1 ILE 12 12.425 8.055 -2.841 106 HD13 ILE 12 2HD1 ILE 12 12.458 8.878 -1.280 107 HA PRO 13 HA PRO 13 18.876 4.187 -3.521 108 HB3 PRO 13 2HB PRO 13 20.468 4.811 -1.985 109 HG3 PRO 13 2HG PRO 13 19.903 6.083 -0.123 110 HD3 PRO 13 2HD PRO 13 18.906 7.339 -1.779 111 H ASP 14 H ASP 14 19.008 2.007 -1.934 112 HA ASP 14 HA ASP 14 16.461 0.814 -2.275 113 HB3 ASP 14 2HB ASP 14 18.313 -0.633 -2.490 114 H SER 15 H SER 15 17.689 2.771 0.164 115 HA SER 15 HA SER 15 16.276 1.588 2.374 116 HB3 SER 15 2HB SER 15 17.592 4.301 2.085 117 HG SER 15 HG SER 15 16.532 4.636 3.879 118 H GLN 16 H GLN 16 14.391 1.754 0.544 119 HA GLN 16 HA GLN 16 12.782 4.096 1.324 120 HB3 GLN 16 2HB GLN 16 13.228 4.377 -0.980 121 HG3 GLN 16 2HG GLN 16 12.345 1.553 -1.519 122 HE21 GLN 16 1HE2 GLN 16 12.030 1.114 -3.594 123 HE22 GLN 16 2HE2 GLN 16 12.372 2.181 -4.909 124 H MET 17 H MET 17 12.592 0.718 0.221 125 HA MET 17 HA MET 17 9.943 0.464 1.413 126 HB3 MET 17 2HB MET 17 10.815 -2.031 0.415 127 HG3 MET 17 2HG MET 17 9.036 0.056 -0.821 128 HE1 MET 17 3HE MET 17 10.277 -0.167 -2.858 129 HE2 MET 17 1HE MET 17 10.165 -1.482 -4.028 130 HE3 MET 17 2HE MET 17 8.776 -0.434 -3.746 131 H SER 18 H SER 18 9.458 -1.380 2.814 132 HA SER 18 HA SER 18 11.378 -2.960 4.082 133 HB3 SER 18 2HB SER 18 12.430 -1.364 5.310 134 HG SER 18 HG SER 18 11.592 0.667 5.675 135 H ALA 19 H ALA 19 10.227 -4.614 4.801 136 HA ALA 19 HA ALA 19 7.493 -4.109 5.783 137 HB1 ALA 19 1HB ALA 19 7.877 -6.853 5.101 138 HB2 ALA 19 2HB ALA 19 6.770 -5.677 4.392 139 HB3 ALA 19 3HB ALA 19 8.406 -5.843 3.753 140 H SER 20 H SER 20 6.713 -5.866 7.313 141 HA SER 20 HA SER 20 8.161 -5.824 9.661 142 HB3 SER 20 2HB SER 20 6.459 -8.217 9.230 143 HG SER 20 HG SER 20 7.110 -7.518 11.312 144 H SER 21 H SER 21 8.190 -8.233 7.088 145 HA SER 21 HA SER 21 10.810 -9.077 7.603 146 HB3 SER 21 2HB SER 21 10.090 -10.148 9.596 147 HG SER 21 HG SER 21 8.088 -10.713 9.804 148 H SER 22 H SER 22 11.555 -9.981 5.793 149 HA SER 22 HA SER 22 9.619 -10.784 3.758 150 HB3 SER 22 2HB SER 22 11.485 -9.129 3.280 151 HG SER 22 HG SER 22 13.145 -11.387 3.029 152 H TYR 23 H TYR 23 10.277 -12.654 2.334 153 HA TYR 23 HA TYR 23 10.233 -15.031 3.701 154 HB3 TYR 23 2HB TYR 23 9.756 -14.738 1.270 155 HD1 TYR 23 1HD TYR 23 10.920 -12.585 0.499 156 HD2 TYR 23 2HD TYR 23 12.839 -16.382 0.551 157 HE1 TYR 23 1HE TYR 23 12.595 -11.754 -1.098 158 HE2 TYR 23 2HE TYR 23 14.521 -15.560 -1.043 159 HH TYR 23 HH TYR 23 14.285 -12.331 -2.462 160 H LYS 24 H LYS 24 11.792 -16.693 4.055 161 HA LYS 24 HA LYS 24 14.089 -15.926 5.375 162 HB3 LYS 24 2HB LYS 24 13.144 -18.126 5.684 163 HG3 LYS 24 2HG LYS 24 14.140 -19.618 3.523 164 HD3 LYS 24 2HD LYS 24 11.370 -18.880 4.447 165 HE3 LYS 24 2HE LYS 24 12.199 -20.242 2.021 166 HZ1 LYS 24 3HZ LYS 24 10.094 -21.674 3.487 167 HZ2 LYS 24 1HZ LYS 24 11.710 -22.102 3.746 168 HZ3 LYS 24 2HZ LYS 24 11.049 -22.200 2.193 169 H THR 25 H THR 25 16.330 -16.112 4.861 170 HA THR 25 HA THR 25 17.144 -16.427 2.112 171 HB THR 25 HB THR 25 16.391 -14.076 2.126 172 HG1 THR 25 1HG THR 25 18.037 -14.364 0.720 173 HG21 THR 25 3HG2 THR 25 17.775 -12.433 3.424 174 HG22 THR 25 1HG2 THR 25 18.456 -13.797 4.309 175 HG23 THR 25 2HG2 THR 25 16.730 -13.452 4.412 176 H TRP 26 H TRP 26 19.560 -16.008 1.898 177 HA TRP 26 HA TRP 26 20.926 -17.534 3.835 178 HB3 TRP 26 2HB TRP 26 22.966 -16.366 2.533 179 HD1 TRP 26 HD TRP 26 23.020 -19.147 3.277 180 HE1 TRP 26 1HE TRP 26 22.887 -21.153 1.669 181 HE3 TRP 26 3HE TRP 26 20.886 -16.823 -0.746 182 HZ2 TRP 26 2HZ TRP 26 21.995 -21.680 -0.957 183 HZ3 TRP 26 3HZ TRP 26 20.426 -18.149 -2.767 184 HH2 TRP 26 HH TRP 26 20.971 -20.527 -2.869 185 H ASN 27 H ASN 27 20.236 -14.170 3.610 186 HA ASN 27 HA ASN 27 22.315 -12.984 4.978 187 HB3 ASN 27 2HB ASN 27 19.685 -11.998 5.816 188 HD21 ASN 27 1HD2 ASN 27 22.158 -11.385 3.342 189 HD22 ASN 27 2HD2 ASN 27 22.570 -9.804 3.905 190 H LEU 28 H LEU 28 22.163 -12.077 7.265 191 HA LEU 28 HA LEU 28 21.534 -14.302 9.075 192 HB3 LEU 28 2HB LEU 28 23.052 -12.049 10.158 193 HG LEU 28 HG LEU 28 23.500 -15.018 10.082 194 HD11 LEU 28 1HD1 LEU 28 25.378 -13.298 11.583 195 HD12 LEU 28 2HD1 LEU 28 25.590 -13.378 9.834 196 HD13 LEU 28 3HD1 LEU 28 25.641 -14.855 10.797 197 HD21 LEU 28 3HD2 LEU 28 21.938 -14.274 11.745 198 HD22 LEU 28 1HD2 LEU 28 23.042 -13.005 12.278 199 HD23 LEU 28 2HD2 LEU 28 23.451 -14.700 12.547 200 H ARG 29 H ARG 29 19.591 -12.313 8.048 201 HA ARG 29 HA ARG 29 17.789 -11.161 8.821 202 HB3 ARG 29 2HB ARG 29 17.865 -11.443 11.610 203 HG3 ARG 29 2HG ARG 29 16.282 -12.422 9.411 204 HD3 ARG 29 2HD ARG 29 17.176 -14.603 10.250 205 HE ARG 29 HE ARG 29 17.295 -14.697 12.537 206 HH11 ARG 29 1HH1 ARG 29 14.160 -13.512 11.595 207 HH12 ARG 29 2HH1 ARG 29 13.506 -13.587 13.198 208 HH21 ARG 29 1HH2 ARG 29 16.445 -14.801 14.650 209 HH22 ARG 29 2HH2 ARG 29 14.806 -14.320 14.935 210 H ALA 30 H ALA 30 18.333 -9.074 8.414 211 HA ALA 30 HA ALA 30 20.056 -7.639 10.279 212 HB1 ALA 30 1HB ALA 30 19.596 -7.468 7.514 213 HB2 ALA 30 2HB ALA 30 18.986 -5.968 8.213 214 HB3 ALA 30 3HB ALA 30 20.655 -6.458 8.499 215 H PHE 31 H PHE 31 19.103 -5.102 10.187 216 HA PHE 31 HA PHE 31 16.350 -5.232 11.197 217 HB3 PHE 31 2HB PHE 31 17.020 -3.689 13.056 218 HD1 PHE 31 1HD PHE 31 15.705 -6.111 13.178 219 HD2 PHE 31 2HD PHE 31 19.816 -5.380 13.996 220 HE1 PHE 31 1HE PHE 31 15.772 -8.111 14.611 221 HE2 PHE 31 2HE PHE 31 19.891 -7.379 15.428 222 HZ PHE 31 HZ PHE 31 17.868 -8.748 15.737 223 H GLY 32 H GLY 32 16.550 -4.381 8.769 224 HA2 GLY 32 2HA GLY 32 15.689 -1.702 8.816 225 HA3 GLY 32 3HA GLY 32 17.364 -1.740 8.285 226 H TRP 33 H TRP 33 17.765 -2.096 6.194 227 HA TRP 33 HA TRP 33 15.617 -2.269 4.345 228 HB3 TRP 33 2HB TRP 33 17.257 -2.119 2.645 229 HD1 TRP 33 HD TRP 33 16.226 0.113 4.744 230 HE1 TRP 33 1HE TRP 33 17.698 2.185 5.148 231 HE3 TRP 33 3HE TRP 33 20.709 -1.750 3.141 232 HZ2 TRP 33 2HZ TRP 33 20.402 2.931 4.830 233 HZ3 TRP 33 3HZ TRP 33 22.690 -0.292 3.223 234 HH2 TRP 33 HH TRP 33 22.537 2.000 4.050 235 H TYR 34 H TYR 34 15.467 -3.928 2.624 236 HA TYR 34 HA TYR 34 16.597 -6.472 2.799 237 HB3 TYR 34 2HB TYR 34 13.963 -7.177 3.604 238 HD1 TYR 34 2HD TYR 34 16.283 -8.735 2.864 239 HD2 TYR 34 1HD TYR 34 15.204 -7.173 6.673 240 HE1 TYR 34 2HE TYR 34 17.577 -10.519 3.957 241 HE2 TYR 34 1HE TYR 34 16.496 -8.952 7.775 242 HH TYR 34 HH TYR 34 17.394 -11.681 6.421 243 HA PRO 35 HA PRO 35 12.689 -6.722 -0.019 244 HB3 PRO 35 2HB PRO 35 10.818 -6.041 1.127 245 HG3 PRO 35 2HG PRO 35 10.931 -4.336 2.704 246 HD3 PRO 35 2HD PRO 35 12.679 -5.658 3.422 247 H HIS 36 H HIS 36 12.111 -3.331 -0.201 248 HA HIS 36 HA HIS 36 12.415 -1.922 -1.997 249 HB3 HIS 36 2HB HIS 36 14.312 -1.414 -0.535 250 HD1 HIS 36 1HD HIS 36 15.360 -3.424 0.751 251 HD2 HIS 36 2HD HIS 36 16.746 -2.945 -3.136 252 HE1 HIS 36 1HE HIS 36 17.417 -4.863 0.588 253 H LEU 37 H LEU 37 11.725 -4.399 -2.971 254 HA LEU 37 HA LEU 37 13.606 -5.010 -5.123 255 HB3 LEU 37 2HB LEU 37 11.833 -6.823 -5.594 256 HG LEU 37 HG LEU 37 12.949 -8.360 -4.386 257 HD11 LEU 37 1HD1 LEU 37 14.639 -5.974 -3.651 258 HD12 LEU 37 2HD1 LEU 37 14.672 -6.795 -5.212 259 HD13 LEU 37 3HD1 LEU 37 15.164 -7.655 -3.753 260 HD21 LEU 37 3HD2 LEU 37 12.210 -8.416 -2.273 261 HD22 LEU 37 1HD2 LEU 37 12.131 -6.658 -2.152 262 HD23 LEU 37 2HD2 LEU 37 13.664 -7.491 -1.896 263 H GLY 38 H GLY 38 10.519 -3.514 -4.552 264 HA2 GLY 38 2HA GLY 38 9.479 -3.602 -7.169 265 HA3 GLY 38 3HA GLY 38 9.056 -2.420 -5.939 266 H ARG 39 H ARG 39 12.180 -1.956 -5.977 267 HA ARG 39 HA ARG 39 12.243 0.484 -7.177 268 HB3 ARG 39 2HB ARG 39 14.080 -0.448 -5.821 269 HG3 ARG 39 2HG ARG 39 14.374 -2.259 -8.140 270 HD3 ARG 39 2HD ARG 39 16.822 -2.532 -7.192 271 HE ARG 39 HE ARG 39 15.937 -1.538 -9.528 272 HH11 ARG 39 1HH1 ARG 39 18.476 -0.545 -7.363 273 HH12 ARG 39 2HH1 ARG 39 19.466 0.118 -8.620 274 HH21 ARG 39 1HH2 ARG 39 17.232 -0.669 -11.193 275 HH22 ARG 39 2HH2 ARG 39 18.758 0.049 -10.797 276 H LEU 40 H LEU 40 12.988 1.294 -9.194 277 HA LEU 40 HA LEU 40 12.002 -0.161 -11.438 278 HB3 LEU 40 2HB LEU 40 13.670 2.350 -11.414 279 HG LEU 40 HG LEU 40 12.397 0.952 -13.595 280 HD11 LEU 40 1HD1 LEU 40 10.913 2.459 -14.433 281 HD12 LEU 40 2HD1 LEU 40 11.664 3.828 -13.616 282 HD13 LEU 40 3HD1 LEU 40 10.636 2.718 -12.711 283 HD21 LEU 40 3HD2 LEU 40 14.627 1.795 -13.756 284 HD22 LEU 40 1HD2 LEU 40 14.098 3.428 -13.346 285 HD23 LEU 40 2HD2 LEU 40 13.622 2.706 -14.884 286 H ASP 41 H ASP 41 13.184 -0.806 -13.309 287 HA ASP 41 HA ASP 41 14.828 -2.005 -14.334 288 HB3 ASP 41 2HB ASP 41 16.602 -0.010 -12.910 289 H ASN 42 H ASN 42 14.014 -3.568 -12.506 290 HA ASN 42 HA ASN 42 15.540 -4.195 -10.286 291 HB3 ASN 42 2HB ASN 42 13.314 -5.188 -10.895 292 HD21 ASN 42 1HD2 ASN 42 12.867 -5.090 -13.142 293 HD22 ASN 42 2HD2 ASN 42 13.142 -6.462 -14.154 294 H GLN 43 H GLN 43 17.517 -4.985 -9.992 295 HA GLN 43 HA GLN 43 19.181 -5.604 -12.240 296 HB3 GLN 43 2HB GLN 43 20.149 -4.450 -10.356 297 HG3 GLN 43 2HG GLN 43 20.201 -6.724 -8.524 298 HE21 GLN 43 1HE2 GLN 43 18.224 -4.699 -7.097 299 HE22 GLN 43 2HE2 GLN 43 19.328 -3.551 -6.429 300 H GLY 44 H GLY 44 17.388 -7.433 -9.874 301 HA2 GLY 44 2HA GLY 44 18.671 -9.932 -10.692 302 HA3 GLY 44 3HA GLY 44 17.524 -9.737 -9.374 303 H LYS 45 H LYS 45 15.322 -9.828 -9.786 304 HA LYS 45 HA LYS 45 14.121 -9.819 -12.311 305 HB3 LYS 45 2HB LYS 45 15.402 -11.875 -12.689 306 HG3 LYS 45 2HG LYS 45 14.650 -13.942 -11.441 307 HD3 LYS 45 2HD LYS 45 16.054 -12.200 -9.493 308 HE3 LYS 45 2HE LYS 45 17.729 -14.126 -9.811 309 HZ1 LYS 45 3HZ LYS 45 15.058 -14.375 -8.600 310 HZ2 LYS 45 1HZ LYS 45 16.562 -14.218 -7.843 311 HZ3 LYS 45 2HZ LYS 45 16.126 -15.686 -8.563 312 H ILE 46 H ILE 46 14.118 -10.906 -8.996 313 HA ILE 46 HA ILE 46 11.529 -11.688 -8.575 314 HB ILE 46 HB ILE 46 13.033 -9.861 -6.704 315 HG13 ILE 46 2HG1 ILE 46 13.614 -12.572 -7.604 316 HG21 ILE 46 1HG2 ILE 46 11.316 -12.086 -5.769 317 HG22 ILE 46 2HG2 ILE 46 11.602 -10.499 -5.058 318 HG23 ILE 46 3HG2 ILE 46 10.512 -10.665 -6.434 319 HD11 ILE 46 3HD1 ILE 46 15.219 -11.087 -5.581 320 HD12 ILE 46 1HD1 ILE 46 15.753 -12.158 -6.876 321 HD13 ILE 46 2HD1 ILE 46 15.179 -10.532 -7.254 322 H ASN 47 H ASN 47 12.692 -8.334 -8.190 323 HA ASN 47 HA ASN 47 11.597 -6.336 -8.248 324 HB3 ASN 47 2HB ASN 47 9.876 -7.692 -10.333 325 HD21 ASN 47 1HD2 ASN 47 8.738 -6.342 -11.621 326 HD22 ASN 47 2HD2 ASN 47 8.618 -4.638 -11.368 327 H ALA 48 H ALA 48 10.681 -8.187 -6.278 328 HA ALA 48 HA ALA 48 8.338 -6.891 -5.419 329 HB1 ALA 48 1HB ALA 48 7.924 -9.190 -7.139 330 HB2 ALA 48 2HB ALA 48 7.168 -9.392 -5.558 331 HB3 ALA 48 3HB ALA 48 6.770 -7.992 -6.553 332 H TRP 49 H TRP 49 8.485 -6.942 -3.283 333 HA TRP 49 HA TRP 49 10.219 -8.795 -1.955 334 HB3 TRP 49 2HB TRP 49 8.822 -6.325 -1.299 335 HD1 TRP 49 HD TRP 49 10.245 -8.176 1.676 336 HE1 TRP 49 1HE TRP 49 8.405 -8.475 3.451 337 HE3 TRP 49 3HE TRP 49 6.212 -6.657 -1.073 338 HZ2 TRP 49 2HZ TRP 49 5.613 -8.115 3.658 339 HZ3 TRP 49 3HZ TRP 49 3.991 -6.665 -0.012 340 HH2 TRP 49 HH TRP 49 3.700 -7.380 2.303 341 H THR 50 H THR 50 9.725 -10.545 -0.733 342 HA THR 50 HA THR 50 6.933 -11.451 -0.817 343 HB THR 50 HB THR 50 9.102 -13.287 0.065 344 HG1 THR 50 1HG THR 50 9.976 -12.193 -1.785 345 HG21 THR 50 3HG2 THR 50 7.738 -14.787 -1.516 346 HG22 THR 50 1HG2 THR 50 6.559 -13.475 -1.526 347 HG23 THR 50 2HG2 THR 50 6.977 -14.274 -0.010 348 H ALA 51 H ALA 51 6.264 -12.837 1.089 349 HA ALA 51 HA ALA 51 6.732 -11.315 3.511 350 HB1 ALA 51 1HB ALA 51 4.468 -11.806 3.159 351 HB2 ALA 51 2HB ALA 51 4.804 -13.494 2.770 352 HB3 ALA 51 3HB ALA 51 4.975 -12.920 4.429 353 H GLN 52 H GLN 52 7.057 -12.481 5.593 354 HA GLN 52 HA GLN 52 9.238 -14.382 5.289 355 HB3 GLN 52 2HB GLN 52 8.185 -12.808 7.633 356 HG3 GLN 52 2HG GLN 52 9.735 -15.225 7.720 357 HE21 GLN 52 1HE2 GLN 52 11.784 -14.591 6.805 358 HE22 GLN 52 2HE2 GLN 52 12.954 -13.798 7.799 359 H SER 53 H SER 53 6.119 -14.150 6.969 360 HA SER 53 HA SER 53 6.234 -17.039 7.491 361 HB3 SER 53 2HB SER 53 4.462 -16.657 9.131 362 HG SER 53 HG SER 53 6.784 -15.100 9.220 363 H ASN 54 H ASN 54 5.406 -15.389 4.986 364 HA ASN 54 HA ASN 54 3.739 -15.376 3.407 365 HB3 ASN 54 2HB ASN 54 4.831 -17.570 3.097 366 HD21 ASN 54 1HD2 ASN 54 5.548 -18.647 4.925 367 HD22 ASN 54 2HD2 ASN 54 4.585 -19.836 5.730 368 H SER 55 H SER 55 2.719 -14.459 5.805 369 HA SER 55 HA SER 55 -0.017 -15.544 5.727 370 HB3 SER 55 2HB SER 55 0.582 -14.334 8.282 371 HG SER 55 HG SER 55 -0.292 -16.254 8.999 372 H ALA 56 H ALA 56 -1.368 -13.793 7.218 373 HA ALA 56 HA ALA 56 -1.201 -11.357 5.633 374 HB1 ALA 56 1HB ALA 56 -3.403 -11.779 5.657 375 HB2 ALA 56 2HB ALA 56 -3.300 -12.768 7.114 376 HB3 ALA 56 3HB ALA 56 -3.366 -11.010 7.244 377 H LYS 57 H LYS 57 -0.362 -12.480 8.750 378 HA LYS 57 HA LYS 57 -0.631 -10.182 10.309 379 HB3 LYS 57 2HB LYS 57 -0.064 -12.397 11.220 380 HG3 LYS 57 2HG LYS 57 2.815 -12.069 10.682 381 HD3 LYS 57 2HD LYS 57 2.620 -14.560 10.507 382 HE3 LYS 57 2HE LYS 57 1.342 -14.323 13.037 383 HZ1 LYS 57 3HZ LYS 57 3.851 -14.361 13.686 384 HZ2 LYS 57 1HZ LYS 57 4.078 -14.694 12.043 385 HZ3 LYS 57 2HZ LYS 57 3.129 -15.724 12.992 386 H GLU 58 H GLU 58 1.627 -10.956 7.803 387 HA GLU 58 HA GLU 58 3.655 -9.097 8.520 388 HB3 GLU 58 2HB GLU 58 4.493 -9.438 6.243 389 HG3 GLU 58 2HG GLU 58 4.344 -12.042 6.196 390 H TRP 59 H TRP 59 4.251 -7.243 7.042 391 HA TRP 59 HA TRP 59 2.092 -5.906 5.685 392 HB3 TRP 59 2HB TRP 59 1.449 -5.216 7.864 393 HD1 TRP 59 HD TRP 59 5.093 -3.851 7.885 394 HE1 TRP 59 1HE TRP 59 6.038 -4.175 10.258 395 HE3 TRP 59 3HE TRP 59 1.081 -6.168 10.046 396 HZ2 TRP 59 2HZ TRP 59 5.194 -5.269 12.719 397 HZ3 TRP 59 3HZ TRP 59 1.231 -6.821 12.413 398 HH2 TRP 59 HH TRP 59 3.245 -6.380 13.721 399 H LEU 60 H LEU 60 2.792 -4.201 4.383 400 HA LEU 60 HA LEU 60 5.714 -4.001 4.125 401 HB3 LEU 60 2HB LEU 60 3.734 -3.180 2.028 402 HG LEU 60 HG LEU 60 5.484 -3.897 0.436 403 HD11 LEU 60 1HD1 LEU 60 6.947 -1.958 2.078 404 HD12 LEU 60 2HD1 LEU 60 5.262 -1.541 1.763 405 HD13 LEU 60 3HD1 LEU 60 6.364 -1.835 0.418 406 HD21 LEU 60 3HD2 LEU 60 7.479 -4.774 1.043 407 HD22 LEU 60 1HD2 LEU 60 6.558 -5.302 2.451 408 HD23 LEU 60 2HD2 LEU 60 7.555 -3.850 2.544 409 H GLN 61 H GLN 61 6.671 -2.143 4.616 410 HA GLN 61 HA GLN 61 5.035 0.307 4.661 411 HB3 GLN 61 2HB GLN 61 6.073 1.037 6.626 412 HG3 GLN 61 2HG GLN 61 5.896 -1.952 6.928 413 HE21 GLN 61 1HE2 GLN 61 7.771 -1.794 8.330 414 HE22 GLN 61 2HE2 GLN 61 7.563 -1.245 9.955 415 H VAL 62 H VAL 62 5.922 2.170 3.842 416 HA VAL 62 HA VAL 62 8.605 1.946 2.646 417 HB VAL 62 HB VAL 62 6.303 3.397 1.347 418 HG11 VAL 62 1HG1 VAL 62 8.358 4.287 0.606 419 HG12 VAL 62 2HG1 VAL 62 9.096 2.688 0.487 420 HG13 VAL 62 3HG1 VAL 62 7.842 3.169 -0.656 421 HG21 VAL 62 3HG2 VAL 62 5.574 1.214 1.148 422 HG22 VAL 62 1HG2 VAL 62 6.546 1.401 -0.312 423 HG23 VAL 62 2HG2 VAL 62 7.212 0.561 1.091 424 H ASP 63 H ASP 63 9.927 3.425 3.446 425 HA ASP 63 HA ASP 63 8.795 5.898 4.554 426 HB3 ASP 63 2HB ASP 63 10.709 6.063 5.942 427 H LEU 64 H LEU 64 9.064 7.753 3.511 428 HA LEU 64 HA LEU 64 11.030 7.860 1.330 429 HB3 LEU 64 2HB LEU 64 9.595 10.018 0.840 430 HG LEU 64 HG LEU 64 9.638 8.140 -0.730 431 HD11 LEU 64 1HD1 LEU 64 7.422 6.972 0.945 432 HD12 LEU 64 2HD1 LEU 64 9.081 6.376 0.908 433 HD13 LEU 64 3HD1 LEU 64 8.088 6.307 -0.547 434 HD21 LEU 64 3HD2 LEU 64 7.725 8.747 -1.844 435 HD22 LEU 64 1HD2 LEU 64 7.880 10.083 -0.704 436 HD23 LEU 64 2HD2 LEU 64 6.745 8.773 -0.377 437 H GLY 65 H GLY 65 9.633 9.996 3.829 438 HA2 GLY 65 2HA GLY 65 10.659 11.538 5.201 439 HA3 GLY 65 3HA GLY 65 12.207 10.889 4.684 440 H THR 66 H THR 66 10.420 11.691 1.993 441 HA THR 66 HA THR 66 11.853 14.249 1.749 442 HB THR 66 HB THR 66 12.396 12.474 0.073 443 HG1 THR 66 1HG THR 66 12.714 14.049 -1.320 444 HG21 THR 66 3HG2 THR 66 9.756 11.934 0.021 445 HG22 THR 66 1HG2 THR 66 10.858 11.522 -1.292 446 HG23 THR 66 2HG2 THR 66 9.880 12.986 -1.388 447 H GLN 67 H GLN 67 8.776 12.910 2.125 448 HA GLN 67 HA GLN 67 6.651 13.713 1.941 449 HB3 GLN 67 2HB GLN 67 8.071 16.358 2.296 450 HG3 GLN 67 2HG GLN 67 5.341 15.757 3.329 451 HE21 GLN 67 1HE2 GLN 67 5.390 18.389 1.373 452 HE22 GLN 67 2HE2 GLN 67 5.736 19.614 2.540 453 H ARG 68 H ARG 68 6.377 13.091 -0.246 454 HA ARG 68 HA ARG 68 6.468 15.343 -2.146 455 HB3 ARG 68 2HB ARG 68 6.406 13.220 -3.797 456 HG3 ARG 68 2HG ARG 68 8.881 13.319 -3.942 457 HD3 ARG 68 2HD ARG 68 7.509 15.997 -3.723 458 HE ARG 68 HE ARG 68 9.581 15.681 -5.677 459 HH11 ARG 68 1HH1 ARG 68 8.905 16.505 -2.363 460 HH12 ARG 68 2HH1 ARG 68 10.333 17.467 -2.174 461 HH21 ARG 68 1HH2 ARG 68 11.466 16.944 -5.440 462 HH22 ARG 68 2HH2 ARG 68 11.789 17.716 -3.926 463 H GLN 69 H GLN 69 4.755 15.512 -3.657 464 HA GLN 69 HA GLN 69 2.217 14.650 -2.586 465 HB3 GLN 69 2HB GLN 69 3.145 16.597 -4.607 466 HG3 GLN 69 2HG GLN 69 0.395 15.386 -4.766 467 HE21 GLN 69 1HE2 GLN 69 0.465 17.948 -3.926 468 HE22 GLN 69 2HE2 GLN 69 0.038 19.020 -5.212 469 H VAL 70 H VAL 70 1.308 12.778 -3.081 470 HA VAL 70 HA VAL 70 2.143 11.350 -5.486 471 HB VAL 70 HB VAL 70 1.017 9.414 -4.550 472 HG11 VAL 70 1HG1 VAL 70 3.315 9.991 -3.805 473 HG12 VAL 70 2HG1 VAL 70 2.616 10.785 -2.392 474 HG13 VAL 70 3HG1 VAL 70 2.406 9.049 -2.624 475 HG21 VAL 70 3HG2 VAL 70 0.310 10.138 -1.961 476 HG22 VAL 70 1HG2 VAL 70 -0.341 11.424 -2.978 477 HG23 VAL 70 2HG2 VAL 70 -0.787 9.747 -3.285 478 H THR 71 H THR 71 0.826 10.868 -7.173 479 HA THR 71 HA THR 71 -1.951 11.851 -7.043 480 HB THR 71 HB THR 71 -0.793 11.871 -9.726 481 HG1 THR 71 1HG THR 71 0.256 13.637 -7.746 482 HG21 THR 71 3HG2 THR 71 -2.713 13.315 -8.117 483 HG22 THR 71 1HG2 THR 71 -2.586 13.194 -9.871 484 HG23 THR 71 2HG2 THR 71 -1.663 14.420 -9.003 485 H GLY 72 H GLY 72 -0.288 9.144 -7.056 486 HA2 GLY 72 2HA GLY 72 -2.345 7.498 -7.963 487 HA3 GLY 72 3HA GLY 72 -1.217 7.689 -9.298 488 H ILE 73 H ILE 73 -1.934 5.315 -7.681 489 HA ILE 73 HA ILE 73 0.791 4.625 -6.797 490 HB ILE 73 HB ILE 73 -0.287 3.039 -5.165 491 HG13 ILE 73 2HG1 ILE 73 -2.596 3.595 -6.480 492 HG21 ILE 73 1HG2 ILE 73 0.324 5.744 -4.944 493 HG22 ILE 73 2HG2 ILE 73 -1.219 5.559 -4.113 494 HG23 ILE 73 3HG2 ILE 73 0.165 4.581 -3.628 495 HD11 ILE 73 3HD1 ILE 73 -3.422 3.037 -3.842 496 HD12 ILE 73 1HD1 ILE 73 -3.269 1.927 -5.204 497 HD13 ILE 73 2HD1 ILE 73 -1.903 2.184 -4.117 498 H ILE 74 H ILE 74 1.473 2.494 -7.180 499 HA ILE 74 HA ILE 74 -0.282 0.737 -8.707 500 HB ILE 74 HB ILE 74 0.715 1.945 -10.501 501 HG13 ILE 74 2HG1 ILE 74 1.478 0.169 -11.736 502 HG21 ILE 74 1HG2 ILE 74 2.517 3.075 -9.498 503 HG22 ILE 74 2HG2 ILE 74 3.286 1.570 -8.995 504 HG23 ILE 74 3HG2 ILE 74 3.248 2.014 -10.701 505 HD11 ILE 74 3HD1 ILE 74 2.850 -1.710 -10.510 506 HD12 ILE 74 1HD1 ILE 74 3.634 -0.276 -11.175 507 HD13 ILE 74 2HD1 ILE 74 3.285 -0.370 -9.449 508 H THR 75 H THR 75 0.237 -1.419 -8.552 509 HA THR 75 HA THR 75 2.614 -2.099 -6.952 510 HB THR 75 HB THR 75 0.735 -2.277 -5.456 511 HG1 THR 75 1HG THR 75 0.765 -4.710 -5.241 512 HG21 THR 75 3HG2 THR 75 -1.115 -2.417 -6.955 513 HG22 THR 75 1HG2 THR 75 -1.122 -3.893 -5.990 514 HG23 THR 75 2HG2 THR 75 -0.520 -3.925 -7.648 515 H GLN 76 H GLN 76 3.408 -4.276 -7.243 516 HA GLN 76 HA GLN 76 2.447 -5.684 -9.617 517 HB3 GLN 76 2HB GLN 76 5.358 -5.603 -9.535 518 HG3 GLN 76 2HG GLN 76 3.306 -4.972 -11.635 519 HE21 GLN 76 1HE2 GLN 76 5.017 -2.954 -11.362 520 HE22 GLN 76 2HE2 GLN 76 6.230 -2.988 -12.592 521 H GLY 77 H GLY 77 2.579 -7.860 -9.458 522 HA2 GLY 77 2HA GLY 77 3.569 -8.931 -6.927 523 HA3 GLY 77 3HA GLY 77 2.544 -9.770 -8.082 524 H ALA 78 H ALA 78 4.442 -11.291 -7.172 525 HA ALA 78 HA ALA 78 6.485 -11.313 -9.295 526 HB1 ALA 78 1HB ALA 78 7.574 -12.684 -7.118 527 HB2 ALA 78 2HB ALA 78 8.055 -11.106 -7.739 528 HB3 ALA 78 3HB ALA 78 6.862 -11.217 -6.445 529 H ARG 79 H ARG 79 7.098 -13.335 -10.097 530 HA ARG 79 HA ARG 79 5.408 -15.596 -9.254 531 HB3 ARG 79 2HB ARG 79 4.683 -14.604 -11.427 532 HG3 ARG 79 2HG ARG 79 7.464 -14.731 -12.035 533 HD3 ARG 79 2HD ARG 79 5.820 -16.758 -13.337 534 HE ARG 79 HE ARG 79 5.820 -15.763 -15.389 535 HH11 ARG 79 1HH1 ARG 79 8.798 -14.973 -13.769 536 HH12 ARG 79 2HH1 ARG 79 9.484 -14.169 -15.143 537 HH21 ARG 79 1HH2 ARG 79 6.711 -14.707 -17.204 538 HH22 ARG 79 2HH2 ARG 79 8.296 -14.019 -17.095 539 H ASP 80 H ASP 80 6.325 -17.670 -9.410 540 HA ASP 80 HA ASP 80 9.265 -17.664 -9.594 541 HB3 ASP 80 2HB ASP 80 9.031 -19.789 -8.161 542 H PHE 81 H PHE 81 7.664 -17.919 -11.898 543 HA PHE 81 HA PHE 81 7.512 -19.177 -13.786 544 HB3 PHE 81 2HB PHE 81 9.138 -20.895 -14.175 545 HD1 PHE 81 1HD PHE 81 9.983 -18.867 -15.297 546 HD2 PHE 81 2HD PHE 81 10.877 -19.727 -11.226 547 HE1 PHE 81 1HE PHE 81 11.830 -17.244 -15.364 548 HE2 PHE 81 2HE PHE 81 12.724 -18.104 -11.285 549 HZ PHE 81 HZ PHE 81 13.204 -16.859 -13.356 550 H GLY 82 H GLY 82 5.337 -19.696 -13.468 551 HA2 GLY 82 2HA GLY 82 3.765 -21.444 -13.691 552 HA3 GLY 82 3HA GLY 82 4.885 -22.524 -12.874 553 H HIS 83 H HIS 83 5.431 -21.004 -10.593 554 HA HIS 83 HA HIS 83 2.907 -21.345 -9.167 555 HB3 HIS 83 2HB HIS 83 5.308 -20.599 -7.630 556 HD1 HIS 83 1HD HIS 83 2.664 -23.276 -8.161 557 HD2 HIS 83 2HD HIS 83 4.816 -21.462 -5.104 558 HE1 HIS 83 1HE HIS 83 1.715 -24.207 -6.026 559 H ILE 84 H ILE 84 3.100 -19.082 -10.855 560 HA ILE 84 HA ILE 84 3.904 -16.686 -9.967 561 HB ILE 84 HB ILE 84 1.106 -17.245 -10.959 562 HG13 ILE 84 2HG1 ILE 84 3.667 -17.431 -12.230 563 HG21 ILE 84 1HG2 ILE 84 2.653 -14.727 -10.533 564 HG22 ILE 84 2HG2 ILE 84 1.471 -14.822 -11.839 565 HG23 ILE 84 3HG2 ILE 84 0.964 -15.082 -10.170 566 HD11 ILE 84 3HD1 ILE 84 1.553 -18.804 -12.611 567 HD12 ILE 84 1HD1 ILE 84 1.037 -17.481 -13.657 568 HD13 ILE 84 2HD1 ILE 84 2.516 -18.369 -14.022 569 H GLN 85 H GLN 85 3.590 -15.339 -8.297 570 HA GLN 85 HA GLN 85 1.445 -15.995 -6.386 571 HB3 GLN 85 2HB GLN 85 2.872 -15.515 -4.555 572 HG3 GLN 85 2HG GLN 85 4.459 -17.055 -6.593 573 HE21 GLN 85 1HE2 GLN 85 6.039 -15.378 -5.350 574 HE22 GLN 85 2HE2 GLN 85 6.900 -16.126 -4.053 575 H TYR 86 H TYR 86 0.536 -14.235 -5.218 576 HA TYR 86 HA TYR 86 1.241 -11.550 -5.508 577 HB3 TYR 86 2HB TYR 86 0.712 -11.634 -7.819 578 HD1 TYR 86 1HD TYR 86 -2.626 -12.469 -6.361 579 HD2 TYR 86 2HD TYR 86 0.310 -13.357 -9.310 580 HE1 TYR 86 1HE TYR 86 -4.145 -14.121 -7.367 581 HE2 TYR 86 2HE TYR 86 -1.202 -15.011 -10.324 582 HH TYR 86 HH TYR 86 -3.237 -16.470 -9.375 583 H VAL 87 H VAL 87 -0.125 -10.168 -4.359 584 HA VAL 87 HA VAL 87 -2.032 -11.549 -2.634 585 HB VAL 87 HB VAL 87 -1.130 -8.682 -2.398 586 HG11 VAL 87 1HG1 VAL 87 -1.592 -9.467 0.102 587 HG12 VAL 87 2HG1 VAL 87 -2.869 -8.835 -0.940 588 HG13 VAL 87 3HG1 VAL 87 -2.683 -10.577 -0.728 589 HG21 VAL 87 3HG2 VAL 87 0.126 -11.139 -1.175 590 HG22 VAL 87 1HG2 VAL 87 0.845 -10.104 -2.409 591 HG23 VAL 87 2HG2 VAL 87 0.549 -9.471 -0.789 592 H ALA 88 H ALA 88 -4.109 -10.590 -2.144 593 HA ALA 88 HA ALA 88 -5.221 -9.106 -4.436 594 HB1 ALA 88 1HB ALA 88 -6.258 -11.409 -2.876 595 HB2 ALA 88 2HB ALA 88 -7.420 -10.225 -3.472 596 HB3 ALA 88 3HB ALA 88 -6.364 -11.070 -4.604 597 H SER 89 H SER 89 -6.542 -9.847 -1.227 598 HA SER 89 HA SER 89 -7.431 -7.116 -0.936 599 HB3 SER 89 2HB SER 89 -8.644 -7.868 0.966 600 HG SER 89 HG SER 89 -9.875 -9.189 -0.111 601 H TYR 90 H TYR 90 -6.361 -5.542 0.051 602 HA TYR 90 HA TYR 90 -4.613 -6.081 2.289 603 HB3 TYR 90 2HB TYR 90 -3.021 -6.458 0.541 604 HD1 TYR 90 1HD TYR 90 -3.826 -2.854 -0.023 605 HD2 TYR 90 2HD TYR 90 -3.174 -6.684 -1.759 606 HE1 TYR 90 1HE TYR 90 -3.982 -1.857 -2.266 607 HE2 TYR 90 2HE TYR 90 -3.327 -5.697 -4.007 608 HH TYR 90 HH TYR 90 -4.303 -2.378 -4.494 609 H LYS 91 H LYS 91 -3.978 -4.167 3.422 610 HA LYS 91 HA LYS 91 -5.847 -1.959 2.981 611 HB3 LYS 91 2HB LYS 91 -4.206 -1.727 5.359 612 HG3 LYS 91 2HG LYS 91 -7.040 -2.452 5.630 613 HD3 LYS 91 2HD LYS 91 -5.504 -0.010 6.508 614 HE3 LYS 91 2HE LYS 91 -8.191 -1.140 7.069 615 HZ1 LYS 91 3HZ LYS 91 -6.451 0.109 9.106 616 HZ2 LYS 91 1HZ LYS 91 -7.387 -1.294 9.240 617 HZ3 LYS 91 2HZ LYS 91 -8.137 0.221 9.190 618 H VAL 92 H VAL 92 -5.213 -0.033 2.248 619 HA VAL 92 HA VAL 92 -2.320 0.491 2.062 620 HB VAL 92 HB VAL 92 -4.495 1.711 0.360 621 HG11 VAL 92 1HG1 VAL 92 -1.561 1.604 -0.251 622 HG12 VAL 92 2HG1 VAL 92 -2.798 2.664 -0.928 623 HG13 VAL 92 3HG1 VAL 92 -2.249 2.897 0.732 624 HG21 VAL 92 3HG2 VAL 92 -3.018 -0.831 0.119 625 HG22 VAL 92 1HG2 VAL 92 -4.597 -0.368 -0.517 626 HG23 VAL 92 2HG2 VAL 92 -3.126 0.143 -1.346 627 H ALA 93 H ALA 93 -1.680 1.838 3.609 628 HA ALA 93 HA ALA 93 -3.393 4.155 4.237 629 HB1 ALA 93 1HB ALA 93 -2.775 2.198 5.995 630 HB2 ALA 93 2HB ALA 93 -1.450 3.326 6.283 631 HB3 ALA 93 3HB ALA 93 -3.120 3.866 6.451 632 H HIS 94 H HIS 94 -2.439 6.154 4.380 633 HA HIS 94 HA HIS 94 0.426 6.290 3.700 634 HB3 HIS 94 2HB HIS 94 -0.110 8.397 2.467 635 HD1 HIS 94 1HD HIS 94 0.314 7.941 0.075 636 HD2 HIS 94 2HD HIS 94 -2.121 5.045 1.793 637 HE1 HIS 94 1HE HIS 94 -0.059 6.223 -1.724 638 H SER 95 H SER 95 1.667 7.811 4.739 639 HA SER 95 HA SER 95 0.326 9.393 6.832 640 HB3 SER 95 2HB SER 95 1.686 8.596 8.460 641 HG SER 95 HG SER 95 1.077 6.702 6.935 642 H ASP 96 H ASP 96 0.614 11.493 6.555 643 HA ASP 96 HA ASP 96 2.726 12.458 4.809 644 HB3 ASP 96 2HB ASP 96 0.476 13.927 6.200 645 H ASP 97 H ASP 97 1.873 12.453 8.197 646 HA ASP 97 HA ASP 97 4.093 14.243 8.841 647 HB3 ASP 97 2HB ASP 97 2.956 13.433 11.237 648 H GLY 98 H GLY 98 3.337 10.914 8.695 649 HA2 GLY 98 2HA GLY 98 5.128 9.309 8.795 650 HA3 GLY 98 3HA GLY 98 5.895 10.304 10.024 651 H VAL 99 H VAL 99 3.535 10.737 11.597 652 HA VAL 99 HA VAL 99 3.374 8.093 12.857 653 HB VAL 99 HB VAL 99 2.602 9.266 14.861 654 HG11 VAL 99 1HG1 VAL 99 5.023 8.951 14.424 655 HG12 VAL 99 2HG1 VAL 99 5.075 10.576 13.738 656 HG13 VAL 99 3HG1 VAL 99 4.671 10.348 15.441 657 HG21 VAL 99 3HG2 VAL 99 1.405 11.102 13.813 658 HG22 VAL 99 1HG2 VAL 99 2.614 11.726 14.936 659 HG23 VAL 99 2HG2 VAL 99 2.919 11.766 13.199 660 H GLN 100 H GLN 100 1.442 10.559 11.341 661 HA GLN 100 HA GLN 100 -1.064 9.364 12.174 662 HB3 GLN 100 2HB GLN 100 -2.125 11.156 10.943 663 HG3 GLN 100 2HG GLN 100 0.299 12.161 12.412 664 HE21 GLN 100 1HE2 GLN 100 0.350 14.312 12.939 665 HE22 GLN 100 2HE2 GLN 100 -0.656 15.494 12.181 666 H TRP 101 H TRP 101 -1.558 7.477 11.249 667 HA TRP 101 HA TRP 101 -0.930 7.040 8.427 668 HB3 TRP 101 2HB TRP 101 -1.314 4.719 8.826 669 HD1 TRP 101 HD TRP 101 1.213 6.715 9.511 670 HE1 TRP 101 1HE TRP 101 3.003 5.837 11.138 671 HE3 TRP 101 3HE TRP 101 -1.516 3.062 11.822 672 HZ2 TRP 101 2HZ TRP 101 3.228 3.856 13.136 673 HZ3 TRP 101 3HZ TRP 101 -0.438 1.720 13.580 674 HH2 TRP 101 HH TRP 101 1.884 2.110 14.222 675 H THR 102 H THR 102 -2.405 7.495 6.945 676 HA THR 102 HA THR 102 -5.233 7.578 7.719 677 HB THR 102 HB THR 102 -3.842 8.721 5.289 678 HG1 THR 102 1HG THR 102 -3.416 10.134 6.858 679 HG21 THR 102 3HG2 THR 102 -6.099 9.911 5.045 680 HG22 THR 102 1HG2 THR 102 -6.734 8.658 6.110 681 HG23 THR 102 2HG2 THR 102 -6.019 8.217 4.559 682 H VAL 103 H VAL 103 -6.223 5.684 7.412 683 HA VAL 103 HA VAL 103 -5.461 3.962 5.189 684 HB VAL 103 HB VAL 103 -6.859 2.278 6.181 685 HG11 VAL 103 1HG1 VAL 103 -5.214 3.785 8.204 686 HG12 VAL 103 2HG1 VAL 103 -5.878 2.175 8.488 687 HG13 VAL 103 3HG1 VAL 103 -4.709 2.432 7.193 688 HG21 VAL 103 3HG2 VAL 103 -7.806 3.325 8.573 689 HG22 VAL 103 1HG2 VAL 103 -8.170 4.566 7.373 690 HG23 VAL 103 2HG2 VAL 103 -8.763 2.920 7.147 691 H TYR 104 H TYR 104 -7.724 2.698 4.489 692 HA TYR 104 HA TYR 104 -9.510 4.819 3.495 693 HB3 TYR 104 2HB TYR 104 -9.681 2.976 1.517 694 HD1 TYR 104 1HD TYR 104 -10.210 5.745 1.598 695 HD2 TYR 104 2HD TYR 104 -6.557 3.818 0.580 696 HE1 TYR 104 1HE TYR 104 -9.555 7.705 0.265 697 HE2 TYR 104 2HE TYR 104 -5.890 5.773 -0.755 698 HH TYR 104 HH TYR 104 -8.093 8.348 -1.469 699 H GLU 105 H GLU 105 -10.851 4.232 5.326 700 HA GLU 105 HA GLU 105 -12.188 1.631 5.074 701 HB3 GLU 105 2HB GLU 105 -11.395 1.983 7.289 702 HG3 GLU 105 2HG GLU 105 -12.794 4.647 7.255 703 H GLU 106 H GLU 106 -14.606 1.972 6.071 704 HA GLU 106 HA GLU 106 -15.844 4.093 4.442 705 HB3 GLU 106 2HB GLU 106 -16.352 2.118 3.276 706 HG3 GLU 106 2HG GLU 106 -17.002 0.824 5.915 707 H GLN 107 H GLN 107 -16.198 1.987 7.267 708 HA GLN 107 HA GLN 107 -17.339 4.128 8.799 709 HB3 GLN 107 2HB GLN 107 -19.353 3.432 7.650 710 HG3 GLN 107 2HG GLN 107 -19.162 0.699 8.841 711 HE21 GLN 107 1HE2 GLN 107 -20.107 2.440 5.891 712 HE22 GLN 107 2HE2 GLN 107 -21.701 1.779 5.810 713 H GLY 108 H GLY 108 -15.072 3.056 9.440 714 HA2 GLY 108 2HA GLY 108 -13.945 2.076 11.186 715 HA3 GLY 108 3HA GLY 108 -15.500 1.875 11.978 716 H SER 109 H SER 109 -15.169 0.508 8.844 717 HA SER 109 HA SER 109 -14.947 -2.165 10.060 718 HB3 SER 109 2HB SER 109 -16.233 -2.993 8.112 719 HG SER 109 HG SER 109 -17.365 -0.904 9.649 720 H SER 110 H SER 110 -13.652 0.040 7.756 721 HA SER 110 HA SER 110 -11.830 -0.029 6.396 722 HB3 SER 110 2HB SER 110 -11.260 -2.068 8.464 723 HG SER 110 HG SER 110 -9.875 -3.183 7.339 724 H LYS 111 H LYS 111 -12.675 -0.389 4.410 725 HA LYS 111 HA LYS 111 -13.409 -3.089 3.602 726 HB3 LYS 111 2HB LYS 111 -14.903 -1.297 2.944 727 HG3 LYS 111 2HG LYS 111 -12.855 0.368 2.723 728 HD3 LYS 111 2HD LYS 111 -12.688 -1.128 0.322 729 HE3 LYS 111 2HE LYS 111 -12.686 1.137 -1.088 730 HZ1 LYS 111 3HZ LYS 111 -14.159 -1.116 -1.121 731 HZ2 LYS 111 1HZ LYS 111 -14.294 0.138 -2.249 732 HZ3 LYS 111 2HZ LYS 111 -15.357 0.063 -0.936 733 H VAL 112 H VAL 112 -10.568 -1.816 4.001 734 HA VAL 112 HA VAL 112 -8.556 -1.723 2.844 735 HB VAL 112 HB VAL 112 -7.762 -3.941 2.320 736 HG11 VAL 112 1HG1 VAL 112 -9.096 -3.256 4.754 737 HG12 VAL 112 2HG1 VAL 112 -9.249 -4.991 4.470 738 HG13 VAL 112 3HG1 VAL 112 -7.654 -4.242 4.516 739 HG21 VAL 112 3HG2 VAL 112 -10.679 -4.691 2.301 740 HG22 VAL 112 1HG2 VAL 112 -9.521 -4.816 0.978 741 HG23 VAL 112 2HG2 VAL 112 -9.372 -5.872 2.383 742 H PHE 113 H PHE 113 -7.775 -3.392 0.644 743 HA PHE 113 HA PHE 113 -9.440 -2.476 -1.576 744 HB3 PHE 113 2HB PHE 113 -6.975 -1.945 -2.600 745 HD1 PHE 113 1HD PHE 113 -8.560 0.077 0.094 746 HD2 PHE 113 2HD PHE 113 -7.879 -0.424 -4.077 747 HE1 PHE 113 1HE PHE 113 -9.661 2.234 -0.341 748 HE2 PHE 113 2HE PHE 113 -8.978 1.733 -4.520 749 HZ PHE 113 HZ PHE 113 -9.869 3.065 -2.650 750 H GLN 114 H GLN 114 -9.134 -3.632 -3.520 751 HA GLN 114 HA GLN 114 -7.846 -6.239 -3.120 752 HB3 GLN 114 2HB GLN 114 -9.307 -7.091 -4.837 753 HG3 GLN 114 2HG GLN 114 -10.717 -5.351 -2.845 754 HE21 GLN 114 1HE2 GLN 114 -11.688 -4.879 -5.290 755 HE22 GLN 114 2HE2 GLN 114 -13.189 -5.700 -5.532 756 H GLY 115 H GLY 115 -6.533 -7.157 -4.745 757 HA2 GLY 115 2HA GLY 115 -5.232 -5.133 -6.440 758 HA3 GLY 115 3HA GLY 115 -4.490 -6.626 -5.887 759 H ASN 116 H ASN 116 -4.005 -7.728 -7.680 760 HA ASN 116 HA ASN 116 -6.205 -8.364 -9.513 761 HB3 ASN 116 2HB ASN 116 -4.568 -8.194 -11.425 762 HD21 ASN 116 1HD2 ASN 116 -3.390 -5.334 -10.705 763 HD22 ASN 116 2HD2 ASN 116 -4.751 -4.316 -11.018 764 H LEU 117 H LEU 117 -5.211 -10.101 -11.177 765 HA LEU 117 HA LEU 117 -3.885 -12.137 -9.510 766 HB3 LEU 117 2HB LEU 117 -5.112 -13.830 -10.721 767 HG LEU 117 HG LEU 117 -6.689 -11.725 -9.372 768 HD11 LEU 117 1HD1 LEU 117 -8.811 -12.859 -9.903 769 HD12 LEU 117 2HD1 LEU 117 -7.968 -13.833 -11.106 770 HD13 LEU 117 3HD1 LEU 117 -8.083 -12.086 -11.311 771 HD21 LEU 117 3HD2 LEU 117 -5.896 -14.524 -9.006 772 HD22 LEU 117 1HD2 LEU 117 -7.549 -14.157 -8.512 773 HD23 LEU 117 2HD2 LEU 117 -6.201 -13.261 -7.811 774 H ASP 118 H ASP 118 -2.392 -10.309 -10.993 775 HA ASP 118 HA ASP 118 -1.046 -12.134 -12.826 776 HB3 ASP 118 2HB ASP 118 -0.809 -10.309 -14.529 777 H ASN 119 H ASN 119 1.060 -12.137 -12.416 778 HA ASN 119 HA ASN 119 2.195 -10.220 -10.605 779 HB3 ASN 119 2HB ASN 119 2.734 -12.753 -10.831 780 HD21 ASN 119 1HD2 ASN 119 2.539 -13.613 -12.927 781 HD22 ASN 119 2HD2 ASN 119 3.884 -13.645 -14.010 782 H ASN 120 H ASN 120 2.323 -10.849 -14.052 783 HA ASN 120 HA ASN 120 4.487 -9.074 -14.596 784 HB3 ASN 120 2HB ASN 120 4.110 -10.764 -16.210 785 HD21 ASN 120 1HD2 ASN 120 1.686 -9.223 -17.899 786 HD22 ASN 120 2HD2 ASN 120 0.407 -10.350 -17.617 787 H SER 121 H SER 121 0.968 -8.819 -15.096 788 HA SER 121 HA SER 121 0.955 -6.182 -16.031 789 HB3 SER 121 2HB SER 121 -0.949 -8.124 -15.641 790 HG SER 121 HG SER 121 -1.187 -7.385 -13.445 791 H HIS 122 H HIS 122 1.379 -4.323 -15.056 792 HA HIS 122 HA HIS 122 1.414 -4.250 -12.117 793 HB3 HIS 122 2HB HIS 122 3.492 -3.682 -13.548 794 HD1 HIS 122 1HD HIS 122 1.740 -2.694 -15.789 795 HD2 HIS 122 2HD HIS 122 3.686 -0.136 -13.155 796 HE1 HIS 122 1HE HIS 122 1.931 -0.499 -17.001 797 H LYS 123 H LYS 123 0.127 -2.899 -11.002 798 HA LYS 123 HA LYS 123 -0.918 -0.473 -11.784 799 HB3 LYS 123 2HB LYS 123 -3.366 -1.883 -11.994 800 HG3 LYS 123 2HG LYS 123 -2.397 -0.994 -14.552 801 HD3 LYS 123 2HD LYS 123 -4.553 -0.272 -12.613 802 HE3 LYS 123 2HE LYS 123 -5.333 1.392 -14.351 803 HZ1 LYS 123 3HZ LYS 123 -4.257 3.144 -13.323 804 HZ2 LYS 123 1HZ LYS 123 -2.803 2.299 -13.140 805 HZ3 LYS 123 2HZ LYS 123 -4.129 1.919 -12.163 806 H LYS 124 H LYS 124 -3.103 -0.012 -10.533 807 HA LYS 124 HA LYS 124 -3.719 -1.556 -8.256 808 HB3 LYS 124 2HB LYS 124 -2.186 0.927 -7.530 809 HG3 LYS 124 2HG LYS 124 -2.873 -1.588 -6.024 810 HD3 LYS 124 2HD LYS 124 -1.137 0.761 -5.288 811 HE3 LYS 124 2HE LYS 124 -2.083 -1.406 -3.427 812 HZ1 LYS 124 3HZ LYS 124 -0.772 -0.450 -1.918 813 HZ2 LYS 124 1HZ LYS 124 -1.207 1.120 -2.374 814 HZ3 LYS 124 2HZ LYS 124 0.006 0.300 -3.220 815 H ASN 125 H ASN 125 -3.301 1.955 -8.725 816 HA ASN 125 HA ASN 125 -5.948 2.526 -9.406 817 HB3 ASN 125 2HB ASN 125 -5.710 3.466 -6.630 818 HD21 ASN 125 1HD2 ASN 125 -7.665 4.026 -5.904 819 HD22 ASN 125 2HD2 ASN 125 -9.152 3.712 -6.726 820 H ILE 126 H ILE 126 -6.340 4.763 -9.638 821 HA ILE 126 HA ILE 126 -3.891 6.374 -9.545 822 HB ILE 126 HB ILE 126 -5.296 6.061 -11.687 823 HG13 ILE 126 2HG1 ILE 126 -4.117 8.551 -10.566 824 HG21 ILE 126 1HG2 ILE 126 -7.456 6.549 -10.552 825 HG22 ILE 126 2HG2 ILE 126 -6.935 8.225 -10.381 826 HG23 ILE 126 3HG2 ILE 126 -7.165 7.533 -11.987 827 HD11 ILE 126 3HD1 ILE 126 -2.752 8.420 -12.629 828 HD12 ILE 126 1HD1 ILE 126 -2.606 7.009 -11.582 829 HD13 ILE 126 2HD1 ILE 126 -3.595 6.927 -13.040 830 H PHE 127 H PHE 127 -3.848 8.435 -8.642 831 HA PHE 127 HA PHE 127 -5.919 8.905 -6.622 832 HB3 PHE 127 2HB PHE 127 -3.705 10.712 -6.386 833 HD1 PHE 127 1HD PHE 127 -5.113 7.480 -5.203 834 HD2 PHE 127 2HD PHE 127 -3.396 11.232 -4.154 835 HE1 PHE 127 1HE PHE 127 -5.571 7.022 -2.829 836 HE2 PHE 127 2HE PHE 127 -3.850 10.778 -1.779 837 HZ PHE 127 HZ PHE 127 -4.938 8.671 -1.113 838 H GLU 128 H GLU 128 -7.497 9.884 -7.895 839 HA GLU 128 HA GLU 128 -7.216 11.837 -9.801 840 HB3 GLU 128 2HB GLU 128 -9.399 11.584 -7.726 841 HG3 GLU 128 2HG GLU 128 -9.471 13.773 -8.856 842 H LYS 129 H LYS 129 -6.974 12.144 -6.333 843 HA LYS 129 HA LYS 129 -6.415 15.020 -6.665 844 HB3 LYS 129 2HB LYS 129 -6.944 14.797 -4.014 845 HG3 LYS 129 2HG LYS 129 -9.488 15.068 -5.227 846 HD3 LYS 129 2HD LYS 129 -8.934 17.543 -4.792 847 HE3 LYS 129 2HE LYS 129 -8.591 15.661 -2.464 848 HZ1 LYS 129 3HZ LYS 129 -8.552 18.283 -2.362 849 HZ2 LYS 129 1HZ LYS 129 -9.301 17.355 -1.160 850 HZ3 LYS 129 2HZ LYS 129 -10.231 18.076 -2.376 851 HA PRO 130 HA PRO 130 -2.317 14.026 -5.337 852 HB3 PRO 130 2HB PRO 130 -1.665 15.911 -6.477 853 HG3 PRO 130 2HG PRO 130 -3.058 17.768 -6.621 854 HD3 PRO 130 2HD PRO 130 -4.531 16.116 -7.260 855 H PHE 131 H PHE 131 -1.217 13.730 -3.437 856 HA PHE 131 HA PHE 131 -2.027 15.130 -1.032 857 HB3 PHE 131 2HB PHE 131 -2.047 12.152 -0.817 858 HD1 PHE 131 1HD PHE 131 -1.314 12.673 1.494 859 HD2 PHE 131 2HD PHE 131 -4.978 14.133 -0.104 860 HE1 PHE 131 1HE PHE 131 -2.111 13.153 3.771 861 HE2 PHE 131 2HE PHE 131 -5.783 14.616 2.171 862 HZ PHE 131 HZ PHE 131 -4.348 14.127 4.112 863 H MET 132 H MET 132 -0.183 15.713 -0.115 864 HA MET 132 HA MET 132 2.317 14.555 -0.751 865 HB3 MET 132 2HB MET 132 2.289 16.844 -0.107 866 HG3 MET 132 2HG MET 132 1.823 17.024 2.590 867 HE1 MET 132 3HE MET 132 2.144 18.833 -0.218 868 HE2 MET 132 1HE MET 132 1.225 20.198 0.417 869 HE3 MET 132 2HE MET 132 2.331 19.316 1.468 870 H ALA 133 H ALA 133 3.542 13.051 0.263 871 HA ALA 133 HA ALA 133 2.718 12.042 2.876 872 HB1 ALA 133 1HB ALA 133 3.247 9.693 1.573 873 HB2 ALA 133 2HB ALA 133 1.641 10.319 1.943 874 HB3 ALA 133 3HB ALA 133 2.357 10.610 0.358 875 H ARG 134 H ARG 134 4.358 10.991 4.026 876 HA ARG 134 HA ARG 134 7.043 11.227 2.834 877 HB3 ARG 134 2HB ARG 134 6.509 12.846 4.689 878 HG3 ARG 134 2HG ARG 134 5.698 10.480 6.043 879 HD3 ARG 134 2HD ARG 134 6.914 10.895 8.175 880 HE ARG 134 HE ARG 134 7.789 9.298 6.201 881 HH11 ARG 134 1HH1 ARG 134 9.454 11.365 8.453 882 HH12 ARG 134 2HH1 ARG 134 10.881 10.385 8.500 883 HH21 ARG 134 1HH2 ARG 134 9.663 7.998 6.253 884 HH22 ARG 134 2HH2 ARG 134 10.999 8.470 7.247 885 H TYR 135 H TYR 135 4.750 9.179 4.304 886 HA TYR 135 HA TYR 135 6.400 6.880 3.937 887 HB3 TYR 135 2HB TYR 135 5.959 7.955 6.701 888 HD1 TYR 135 2HD TYR 135 4.238 6.509 7.626 889 HD2 TYR 135 1HD TYR 135 7.770 4.874 5.907 890 HE1 TYR 135 2HE TYR 135 3.735 4.338 8.668 891 HE2 TYR 135 1HE TYR 135 7.277 2.699 6.943 892 HH TYR 135 HH TYR 135 5.345 2.228 9.396 893 H VAL 136 H VAL 136 5.095 5.289 3.332 894 HA VAL 136 HA VAL 136 2.303 5.328 4.278 895 HB VAL 136 HB VAL 136 1.537 4.529 2.197 896 HG11 VAL 136 1HG1 VAL 136 2.217 6.945 2.296 897 HG12 VAL 136 2HG1 VAL 136 3.697 6.490 1.450 898 HG13 VAL 136 3HG1 VAL 136 2.129 6.258 0.675 899 HG21 VAL 136 3HG2 VAL 136 3.108 3.938 0.346 900 HG22 VAL 136 1HG2 VAL 136 4.430 4.049 1.508 901 HG23 VAL 136 2HG2 VAL 136 3.165 2.840 1.725 902 H ARG 137 H ARG 137 1.384 3.425 4.943 903 HA ARG 137 HA ARG 137 3.107 1.038 4.930 904 HB3 ARG 137 2HB ARG 137 1.444 2.120 7.206 905 HG3 ARG 137 2HG ARG 137 2.719 0.097 8.359 906 HD3 ARG 137 2HD ARG 137 0.487 -1.216 7.428 907 HE ARG 137 HE ARG 137 1.115 0.241 9.781 908 HH11 ARG 137 1HH1 ARG 137 -1.537 -1.169 8.023 909 HH12 ARG 137 2HH1 ARG 137 -2.513 -1.414 9.433 910 HH21 ARG 137 1HH2 ARG 137 -0.161 -0.075 11.647 911 HH22 ARG 137 2HH2 ARG 137 -1.730 -0.789 11.494 912 H VAL 138 H VAL 138 2.103 -0.928 4.640 913 HA VAL 138 HA VAL 138 -0.808 -0.894 4.216 914 HB VAL 138 HB VAL 138 -0.715 -1.932 2.159 915 HG11 VAL 138 1HG1 VAL 138 1.900 -0.527 1.854 916 HG12 VAL 138 2HG1 VAL 138 0.493 -0.529 0.789 917 HG13 VAL 138 3HG1 VAL 138 0.463 0.398 2.290 918 HG21 VAL 138 3HG2 VAL 138 1.967 -2.918 3.043 919 HG22 VAL 138 1HG2 VAL 138 0.565 -3.831 2.482 920 HG23 VAL 138 2HG2 VAL 138 1.543 -2.919 1.331 921 H LEU 139 H LEU 139 -1.881 -2.872 4.565 922 HA LEU 139 HA LEU 139 -0.286 -5.019 5.776 923 HB3 LEU 139 2HB LEU 139 -2.881 -4.026 6.938 924 HG LEU 139 HG LEU 139 -1.003 -6.163 7.742 925 HD11 LEU 139 1HD1 LEU 139 -0.562 -4.519 9.474 926 HD12 LEU 139 2HD1 LEU 139 -1.508 -5.860 10.120 927 HD13 LEU 139 3HD1 LEU 139 -2.292 -4.323 9.753 928 HD21 LEU 139 3HD2 LEU 139 -3.863 -5.682 7.489 929 HD22 LEU 139 1HD2 LEU 139 -3.430 -6.503 8.989 930 HD23 LEU 139 2HD2 LEU 139 -2.958 -7.196 7.437 931 HA PRO 140 HA PRO 140 -2.961 -6.988 2.695 932 HB3 PRO 140 2HB PRO 140 -1.056 -7.694 1.622 933 HG3 PRO 140 2HG PRO 140 0.937 -7.988 2.784 934 HD3 PRO 140 2HD PRO 140 0.368 -5.873 3.500 935 H VAL 141 H VAL 141 -4.531 -8.514 2.933 936 HA VAL 141 HA VAL 141 -4.479 -10.122 5.404 937 HB VAL 141 HB VAL 141 -7.004 -9.992 5.315 938 HG11 VAL 141 1HG1 VAL 141 -7.088 -7.790 6.392 939 HG12 VAL 141 2HG1 VAL 141 -5.699 -8.733 6.939 940 HG13 VAL 141 3HG1 VAL 141 -5.477 -7.429 5.770 941 HG21 VAL 141 3HG2 VAL 141 -6.335 -7.888 3.270 942 HG22 VAL 141 1HG2 VAL 141 -7.413 -9.273 3.099 943 HG23 VAL 141 2HG2 VAL 141 -7.869 -7.925 4.140 944 H SER 142 H SER 142 -5.761 -9.923 2.099 945 HA SER 142 HA SER 142 -5.860 -12.869 2.053 946 HB3 SER 142 2HB SER 142 -7.779 -12.826 0.728 947 HG SER 142 HG SER 142 -9.200 -11.507 1.805 948 H TRP 143 H TRP 143 -4.332 -13.735 0.835 949 HA TRP 143 HA TRP 143 -3.483 -12.306 -1.596 950 HB3 TRP 143 2HB TRP 143 -1.763 -12.131 0.174 951 HD1 TRP 143 HD TRP 143 -0.285 -15.423 -0.794 952 HE1 TRP 143 1HE TRP 143 -0.111 -16.949 1.271 953 HE3 TRP 143 3HE TRP 143 -3.130 -12.702 2.468 954 HZ2 TRP 143 2HZ TRP 143 -1.054 -16.993 3.931 955 HZ3 TRP 143 3HZ TRP 143 -3.445 -13.557 4.753 956 HH2 TRP 143 HH TRP 143 -2.429 -15.659 5.468 957 H HIS 144 H HIS 144 -2.081 -13.945 -2.976 958 HA HIS 144 HA HIS 144 -3.430 -16.558 -2.995 959 HB3 HIS 144 2HB HIS 144 -3.174 -16.268 -5.608 960 HD1 HIS 144 1HD HIS 144 -5.301 -17.297 -3.632 961 HD2 HIS 144 2HD HIS 144 -5.736 -13.891 -5.969 962 HE1 HIS 144 1HE HIS 144 -7.781 -16.933 -3.835 963 H ASN 145 H ASN 145 -2.087 -18.237 -3.151 964 HA ASN 145 HA ASN 145 -0.238 -19.497 -3.621 965 HB3 ASN 145 2HB ASN 145 1.333 -17.363 -4.913 966 HD21 ASN 145 1HD2 ASN 145 -0.314 -19.311 -7.066 967 HD22 ASN 145 2HD2 ASN 145 0.866 -20.561 -7.244 968 H ARG 146 H ARG 146 0.912 -16.150 -3.142 969 HA ARG 146 HA ARG 146 1.815 -16.532 -0.519 970 HB3 ARG 146 2HB ARG 146 4.306 -16.278 -1.979 971 HG3 ARG 146 2HG ARG 146 4.464 -18.609 -0.561 972 HD3 ARG 146 2HD ARG 146 5.012 -16.687 1.326 973 HE ARG 146 HE ARG 146 7.146 -16.942 -0.516 974 HH11 ARG 146 1HH1 ARG 146 5.139 -18.807 1.632 975 HH12 ARG 146 2HH1 ARG 146 6.335 -20.032 1.898 976 HH21 ARG 146 1HH2 ARG 146 8.729 -18.548 -0.174 977 HH22 ARG 146 2HH2 ARG 146 8.377 -19.882 0.870 978 H ILE 147 H ILE 147 2.358 -14.609 0.392 979 HA ILE 147 HA ILE 147 1.788 -12.227 -0.952 980 HB ILE 147 HB ILE 147 3.415 -12.605 1.565 981 HG13 ILE 147 2HG1 ILE 147 0.519 -12.612 0.958 982 HG21 ILE 147 1HG2 ILE 147 3.850 -10.427 1.352 983 HG22 ILE 147 2HG2 ILE 147 2.685 -10.240 0.041 984 HG23 ILE 147 3HG2 ILE 147 2.144 -10.166 1.718 985 HD11 ILE 147 3HD1 ILE 147 1.167 -14.601 1.902 986 HD12 ILE 147 1HD1 ILE 147 2.316 -13.832 2.996 987 HD13 ILE 147 2HD1 ILE 147 0.584 -13.710 3.307 988 H THR 148 H THR 148 2.954 -11.928 -2.814 989 HA THR 148 HA THR 148 5.729 -11.100 -2.437 990 HB THR 148 HB THR 148 5.294 -12.641 -4.917 991 HG1 THR 148 1HG THR 148 4.268 -14.005 -3.393 992 HG21 THR 148 3HG2 THR 148 7.507 -12.380 -4.875 993 HG22 THR 148 1HG2 THR 148 7.564 -13.505 -3.518 994 HG23 THR 148 2HG2 THR 148 7.451 -11.770 -3.221 995 H LEU 149 H LEU 149 5.427 -8.997 -2.934 996 HA LEU 149 HA LEU 149 5.004 -8.275 -5.658 997 HB3 LEU 149 2HB LEU 149 2.685 -8.587 -5.049 998 HG LEU 149 HG LEU 149 3.040 -7.968 -2.543 999 HD11 LEU 149 1HD1 LEU 149 3.796 -5.791 -2.543 1000 HD12 LEU 149 2HD1 LEU 149 2.069 -5.572 -2.263 1001 HD13 LEU 149 3HD1 LEU 149 2.740 -5.311 -3.872 1002 HD21 LEU 149 3HD2 LEU 149 0.556 -6.918 -3.869 1003 HD22 LEU 149 1HD2 LEU 149 0.718 -7.698 -2.295 1004 HD23 LEU 149 2HD2 LEU 149 0.917 -8.643 -3.772 1005 H ARG 150 H ARG 150 4.448 -5.634 -5.492 1006 HA ARG 150 HA ARG 150 6.060 -4.413 -3.416 1007 HB3 ARG 150 2HB ARG 150 7.772 -5.036 -5.020 1008 HG3 ARG 150 2HG ARG 150 5.957 -4.771 -6.991 1009 HD3 ARG 150 2HD ARG 150 7.162 -2.150 -6.612 1010 HE ARG 150 HE ARG 150 8.301 -3.379 -8.732 1011 HH11 ARG 150 1HH1 ARG 150 5.936 -0.841 -8.434 1012 HH12 ARG 150 2HH1 ARG 150 6.399 -0.058 -9.909 1013 HH21 ARG 150 1HH2 ARG 150 8.920 -2.357 -10.675 1014 HH22 ARG 150 2HH2 ARG 150 8.096 -0.923 -11.183 1015 H LEU 151 H LEU 151 5.167 -2.541 -2.852 1016 HA LEU 151 HA LEU 151 3.170 -1.353 -4.629 1017 HB3 LEU 151 2HB LEU 151 2.364 -1.800 -2.435 1018 HG LEU 151 HG LEU 151 4.916 -1.153 -1.459 1019 HD11 LEU 151 1HD1 LEU 151 4.675 1.050 -0.997 1020 HD12 LEU 151 2HD1 LEU 151 3.882 0.408 0.441 1021 HD13 LEU 151 3HD1 LEU 151 2.915 0.960 -0.926 1022 HD21 LEU 151 3HD2 LEU 151 2.328 -2.137 -0.408 1023 HD22 LEU 151 1HD2 LEU 151 3.512 -1.571 0.770 1024 HD23 LEU 151 2HD2 LEU 151 3.932 -2.869 -0.348 1025 H GLU 152 H GLU 152 3.579 0.435 -5.744 1026 HA GLU 152 HA GLU 152 5.789 2.169 -4.850 1027 HB3 GLU 152 2HB GLU 152 5.565 2.624 -7.563 1028 HG3 GLU 152 2HG GLU 152 7.517 0.743 -7.518 1029 H LEU 153 H LEU 153 5.494 4.369 -4.966 1030 HA LEU 153 HA LEU 153 2.762 5.255 -5.621 1031 HB3 LEU 153 2HB LEU 153 3.204 5.459 -3.265 1032 HG LEU 153 HG LEU 153 5.832 6.000 -3.809 1033 HD11 LEU 153 1HD1 LEU 153 4.620 8.441 -4.143 1034 HD12 LEU 153 2HD1 LEU 153 6.321 8.175 -3.761 1035 HD13 LEU 153 3HD1 LEU 153 5.168 8.496 -2.467 1036 HD21 LEU 153 3HD2 LEU 153 4.082 6.165 -1.413 1037 HD22 LEU 153 1HD2 LEU 153 5.736 6.764 -1.282 1038 HD23 LEU 153 2HD2 LEU 153 5.440 5.091 -1.755 1039 H LEU 154 H LEU 154 2.476 6.990 -6.939 1040 HA LEU 154 HA LEU 154 4.909 8.264 -8.008 1041 HB3 LEU 154 2HB LEU 154 4.100 8.182 -10.162 1042 HG LEU 154 HG LEU 154 4.052 5.730 -8.919 1043 HD11 LEU 154 1HD1 LEU 154 2.002 4.896 -8.869 1044 HD12 LEU 154 2HD1 LEU 154 1.868 5.124 -10.611 1045 HD13 LEU 154 3HD1 LEU 154 1.356 6.406 -9.514 1046 HD21 LEU 154 3HD2 LEU 154 3.432 5.985 -11.831 1047 HD22 LEU 154 1HD2 LEU 154 4.552 4.895 -11.012 1048 HD23 LEU 154 2HD2 LEU 154 4.957 6.603 -11.195 1049 H GLY 155 H GLY 155 4.782 10.468 -8.563 1050 HA2 GLY 155 2HA GLY 155 2.462 11.868 -7.383 1051 HA3 GLY 155 3HA GLY 155 4.110 12.463 -7.258 1052 H CYS 156 H CYS 156 2.865 14.394 -8.144 1053 HA CYS 156 HA CYS 156 2.765 14.251 -11.085 1054 HB3 CYS 156 2HB CYS 156 1.492 16.597 -10.414 1055 H LEU 157 H LEU 157 4.370 15.593 -8.401 1056 HA LEU 157 HA LEU 157 5.988 17.176 -8.148 1057 HB3 LEU 157 2HB LEU 157 6.794 17.100 -10.972 1058 HG LEU 157 HG LEU 157 8.973 16.549 -10.175 1059 HD11 LEU 157 1HD1 LEU 157 7.698 18.548 -8.314 1060 HD12 LEU 157 2HD1 LEU 157 8.306 18.883 -9.936 1061 HD13 LEU 157 3HD1 LEU 157 9.422 18.403 -8.657 1062 HD21 LEU 157 3HD2 LEU 157 9.457 15.533 -8.227 1063 HD22 LEU 157 1HD2 LEU 157 7.754 15.079 -8.263 1064 HD23 LEU 157 2HD2 LEU 157 8.273 16.475 -7.318 1065 H GLU 158 H GLU 158 3.382 18.143 -8.886 1066 HA GLU 158 HA GLU 158 4.006 20.453 -10.584 1067 HB3 GLU 158 2HB GLU 158 1.306 19.562 -9.561 1068 HG3 GLU 158 2HG GLU 158 2.200 21.645 -11.484 Start of MODEL 11 1 H1 MET -5 H MET -5 15.648 25.106 -2.612 2 HA MET -5 HA MET -5 16.771 25.400 -4.591 3 HB3 MET -5 2HB MET -5 19.147 24.348 -4.726 4 HG3 MET -5 2HG MET -5 18.517 26.802 -4.248 5 HE1 MET -5 3HE MET -5 17.893 28.825 -1.603 6 HE2 MET -5 1HE MET -5 17.411 28.086 -3.131 7 HE3 MET -5 2HE MET -5 16.685 27.539 -1.620 8 H LYS -4 H LYS -4 14.877 23.697 -4.741 9 HA LYS -4 HA LYS -4 15.954 21.486 -6.318 10 HB3 LYS -4 2HB LYS -4 13.947 20.138 -5.194 11 HG3 LYS -4 2HG LYS -4 16.593 20.465 -3.793 12 HD3 LYS -4 2HD LYS -4 14.745 18.085 -3.914 13 HE3 LYS -4 2HE LYS -4 17.156 18.665 -2.195 14 HZ1 LYS -4 3HZ LYS -4 15.189 16.491 -2.259 15 HZ2 LYS -4 1HZ LYS -4 15.959 17.209 -0.934 16 HZ3 LYS -4 2HZ LYS -4 16.799 16.108 -1.906 17 H SER -3 H SER -3 14.527 20.687 -7.910 18 HA SER -3 HA SER -3 11.874 21.710 -8.204 19 HB3 SER -3 2HB SER -3 12.370 23.623 -9.271 20 HG SER -3 HG SER -3 14.808 23.472 -10.214 21 H GLY -2 H GLY -2 10.687 20.439 -9.535 22 HA2 GLY -2 2HA GLY -2 12.039 18.750 -11.499 23 HA3 GLY -2 3HA GLY -2 11.197 17.929 -10.193 24 H HIS -1 H HIS -1 10.915 19.262 -13.270 25 HA HIS -1 HA HIS -1 8.074 19.785 -13.148 26 HB3 HIS -1 2HB HIS -1 8.384 20.019 -15.684 27 HD1 HIS -1 1HD HIS -1 11.160 22.041 -15.515 28 HD2 HIS -1 2HD HIS -1 7.489 22.199 -13.577 29 HE1 HIS -1 1HE HIS -1 10.888 24.432 -14.786 30 H GLY 0 H GLY 0 6.445 18.561 -14.083 31 HA2 GLY 0 2HA GLY 0 5.678 16.721 -15.425 32 HA3 GLY 0 3HA GLY 0 7.206 15.911 -15.115 33 H CYS 1 H CYS 1 4.247 15.259 -14.657 34 HA CYS 1 HA CYS 1 4.321 14.756 -11.770 35 HB3 CYS 1 2HB CYS 1 1.890 13.907 -12.387 36 H SER 2 H SER 2 2.844 12.558 -11.437 37 HA SER 2 HA SER 2 3.074 10.295 -11.276 38 HB3 SER 2 2HB SER 2 1.972 10.588 -13.531 39 HG SER 2 HG SER 2 4.436 9.821 -14.644 40 H GLU 3 H GLU 3 5.266 11.198 -10.295 41 HA GLU 3 HA GLU 3 7.568 10.170 -11.771 42 HB3 GLU 3 2HB GLU 3 8.884 11.194 -9.907 43 HG3 GLU 3 2HG GLU 3 8.193 13.597 -10.349 44 HA PRO 4 HA PRO 4 7.867 6.412 -9.521 45 HB3 PRO 4 2HB PRO 4 9.573 5.841 -10.950 46 HG3 PRO 4 2HG PRO 4 11.085 7.437 -11.710 47 HD3 PRO 4 2HD PRO 4 9.103 8.520 -12.166 48 H LEU 5 H LEU 5 10.967 7.555 -8.443 49 HA LEU 5 HA LEU 5 10.285 8.722 -6.002 50 HB3 LEU 5 2HB LEU 5 9.334 6.771 -5.189 51 HG LEU 5 HG LEU 5 10.652 5.326 -7.095 52 HD11 LEU 5 1HD1 LEU 5 11.725 3.575 -5.367 53 HD12 LEU 5 2HD1 LEU 5 12.117 5.086 -4.546 54 HD13 LEU 5 3HD1 LEU 5 12.661 4.816 -6.202 55 HD21 LEU 5 3HD2 LEU 5 9.054 4.573 -4.678 56 HD22 LEU 5 1HD2 LEU 5 9.671 3.333 -5.771 57 HD23 LEU 5 2HD2 LEU 5 8.579 4.578 -6.378 58 H GLY 6 H GLY 6 12.568 6.363 -7.386 59 HA2 GLY 6 2HA GLY 6 14.744 8.227 -6.716 60 HA3 GLY 6 3HA GLY 6 14.872 6.543 -6.229 61 H LEU 7 H LEU 7 13.528 7.789 -9.250 62 HA LEU 7 HA LEU 7 15.752 6.488 -10.679 63 HB3 LEU 7 2HB LEU 7 14.263 5.764 -12.376 64 HG LEU 7 HG LEU 7 12.932 5.238 -9.721 65 HD11 LEU 7 1HD1 LEU 7 11.652 3.533 -10.776 66 HD12 LEU 7 2HD1 LEU 7 12.475 3.781 -12.315 67 HD13 LEU 7 3HD1 LEU 7 11.393 5.021 -11.685 68 HD21 LEU 7 3HD2 LEU 7 14.861 4.078 -9.511 69 HD22 LEU 7 1HD2 LEU 7 15.145 4.019 -11.250 70 HD23 LEU 7 2HD2 LEU 7 13.999 2.904 -10.507 71 H LYS 8 H LYS 8 14.415 9.381 -9.944 72 HA LYS 8 HA LYS 8 14.997 10.585 -12.560 73 HB3 LYS 8 2HB LYS 8 13.716 11.988 -10.223 74 HG3 LYS 8 2HG LYS 8 12.489 12.964 -12.380 75 HD3 LYS 8 2HD LYS 8 15.210 14.047 -11.790 76 HE3 LYS 8 2HE LYS 8 13.498 16.066 -11.429 77 HZ1 LYS 8 3HZ LYS 8 15.137 15.194 -13.517 78 HZ2 LYS 8 1HZ LYS 8 14.635 16.772 -13.174 79 HZ3 LYS 8 2HZ LYS 8 13.717 15.798 -14.208 80 H ASN 9 H ASN 9 15.317 11.653 -9.171 81 HA ASN 9 HA ASN 9 18.109 12.371 -9.731 82 HB3 ASN 9 2HB ASN 9 17.356 14.365 -8.023 83 HD21 ASN 9 1HD2 ASN 9 19.408 14.274 -9.488 84 HD22 ASN 9 2HD2 ASN 9 19.348 15.312 -10.868 85 H ASN 10 H ASN 10 15.606 11.755 -7.318 86 HA ASN 10 HA ASN 10 17.093 11.790 -4.997 87 HB3 ASN 10 2HB ASN 10 15.452 9.856 -4.317 88 HD21 ASN 10 1HD2 ASN 10 15.048 12.945 -5.981 89 HD22 ASN 10 2HD2 ASN 10 14.090 13.685 -4.747 90 H THR 11 H THR 11 16.847 9.244 -7.420 91 HA THR 11 HA THR 11 17.949 7.262 -7.692 92 HB THR 11 HB THR 11 20.323 7.343 -7.532 93 HG1 THR 11 1HG THR 11 20.981 8.093 -5.645 94 HG21 THR 11 3HG2 THR 11 20.460 8.873 -9.145 95 HG22 THR 11 1HG2 THR 11 20.247 10.179 -7.981 96 HG23 THR 11 2HG2 THR 11 18.837 9.416 -8.718 97 H ILE 12 H ILE 12 16.387 7.359 -5.346 98 HA ILE 12 HA ILE 12 17.521 6.658 -2.959 99 HB ILE 12 HB ILE 12 15.039 5.483 -4.212 100 HG13 ILE 12 2HG1 ILE 12 15.079 7.957 -3.893 101 HG21 ILE 12 1HG2 ILE 12 14.445 5.104 -1.741 102 HG22 ILE 12 2HG2 ILE 12 15.557 3.975 -2.514 103 HG23 ILE 12 3HG2 ILE 12 16.180 5.237 -1.453 104 HD11 ILE 12 3HD1 ILE 12 12.929 8.041 -3.315 105 HD12 ILE 12 1HD1 ILE 12 13.033 6.283 -3.244 106 HD13 ILE 12 2HD1 ILE 12 13.211 7.237 -1.772 107 HA PRO 13 HA PRO 13 19.778 2.995 -4.299 108 HB3 PRO 13 2HB PRO 13 21.642 3.933 -3.338 109 HG3 PRO 13 2HG PRO 13 21.456 5.424 -1.563 110 HD3 PRO 13 2HD PRO 13 19.943 6.361 -3.028 111 H ASP 14 H ASP 14 17.591 3.503 -1.734 112 HA ASP 14 HA ASP 14 16.456 1.030 -1.696 113 HB3 ASP 14 2HB ASP 14 18.313 -0.166 -0.987 114 H SER 15 H SER 15 17.229 3.970 -0.175 115 HA SER 15 HA SER 15 15.538 3.710 2.114 116 HB3 SER 15 2HB SER 15 16.535 6.247 0.797 117 HG SER 15 HG SER 15 16.070 7.186 2.705 118 H GLN 16 H GLN 16 13.847 2.779 0.460 119 HA GLN 16 HA GLN 16 11.939 4.949 -0.038 120 HB3 GLN 16 2HB GLN 16 12.628 4.614 -2.228 121 HG3 GLN 16 2HG GLN 16 12.609 1.628 -1.932 122 HE21 GLN 16 1HE2 GLN 16 12.188 0.963 -3.920 123 HE22 GLN 16 2HE2 GLN 16 12.918 1.568 -5.363 124 H MET 17 H MET 17 12.285 1.399 -0.089 125 HA MET 17 HA MET 17 9.606 1.196 1.103 126 HB3 MET 17 2HB MET 17 10.642 -1.360 0.376 127 HG3 MET 17 2HG MET 17 8.432 0.390 -0.597 128 HE1 MET 17 3HE MET 17 9.388 -0.393 -4.112 129 HE2 MET 17 1HE MET 17 7.861 0.262 -3.518 130 HE3 MET 17 2HE MET 17 9.380 0.737 -2.757 131 H SER 18 H SER 18 9.338 -0.687 2.641 132 HA SER 18 HA SER 18 11.475 -1.804 4.054 133 HB3 SER 18 2HB SER 18 12.128 0.276 4.925 134 HG SER 18 HG SER 18 9.434 0.899 5.540 135 H ALA 19 H ALA 19 10.490 -3.624 4.615 136 HA ALA 19 HA ALA 19 7.787 -3.462 5.781 137 HB1 ALA 19 1HB ALA 19 7.148 -5.356 4.689 138 HB2 ALA 19 2HB ALA 19 8.324 -4.740 3.527 139 HB3 ALA 19 3HB ALA 19 8.783 -6.020 4.650 140 H SER 20 H SER 20 7.277 -5.229 7.334 141 HA SER 20 HA SER 20 8.955 -5.206 9.523 142 HB3 SER 20 2HB SER 20 7.407 -7.676 9.369 143 HG SER 20 HG SER 20 7.965 -6.653 11.322 144 H SER 21 H SER 21 8.739 -7.610 6.937 145 HA SER 21 HA SER 21 11.444 -8.349 7.119 146 HB3 SER 21 2HB SER 21 10.920 -9.450 9.185 147 HG SER 21 HG SER 21 8.642 -9.607 8.860 148 H SER 22 H SER 22 12.066 -9.569 5.381 149 HA SER 22 HA SER 22 9.915 -10.317 3.517 150 HB3 SER 22 2HB SER 22 11.962 -8.613 3.047 151 HG SER 22 HG SER 22 13.098 -10.377 1.482 152 H TYR 23 H TYR 23 10.622 -12.115 1.956 153 HA TYR 23 HA TYR 23 10.844 -14.504 3.317 154 HB3 TYR 23 2HB TYR 23 11.567 -13.841 0.460 155 HD1 TYR 23 1HD TYR 23 10.458 -16.752 2.539 156 HD2 TYR 23 2HD TYR 23 12.838 -15.363 -0.703 157 HE1 TYR 23 1HE TYR 23 11.244 -19.048 2.140 158 HE2 TYR 23 2HE TYR 23 13.629 -17.657 -1.112 159 HH TYR 23 HH TYR 23 13.551 -19.774 -0.465 160 H LYS 24 H LYS 24 13.378 -12.430 2.061 161 HA LYS 24 HA LYS 24 15.561 -14.127 2.154 162 HB3 LYS 24 2HB LYS 24 15.602 -11.227 3.001 163 HG3 LYS 24 2HG LYS 24 17.703 -12.885 2.943 164 HD3 LYS 24 2HD LYS 24 18.771 -11.902 0.655 165 HE3 LYS 24 2HE LYS 24 17.744 -14.308 -0.196 166 HZ1 LYS 24 3HZ LYS 24 20.147 -13.414 0.309 167 HZ2 LYS 24 1HZ LYS 24 19.839 -15.071 0.164 168 HZ3 LYS 24 2HZ LYS 24 19.974 -14.368 1.696 169 H THR 25 H THR 25 16.462 -15.254 3.736 170 HA THR 25 HA THR 25 17.141 -15.944 5.797 171 HB THR 25 HB THR 25 16.673 -13.115 6.744 172 HG1 THR 25 1HG THR 25 18.856 -14.261 5.327 173 HG21 THR 25 3HG2 THR 25 17.165 -14.351 8.633 174 HG22 THR 25 1HG2 THR 25 18.775 -13.849 8.118 175 HG23 THR 25 2HG2 THR 25 18.202 -15.477 7.756 176 H TRP 26 H TRP 26 15.222 -17.224 5.950 177 HA TRP 26 HA TRP 26 13.024 -16.113 7.520 178 HB3 TRP 26 2HB TRP 26 13.347 -18.739 6.059 179 HD1 TRP 26 HD TRP 26 10.445 -16.766 7.750 180 HE1 TRP 26 1HE TRP 26 8.854 -18.483 8.821 181 HE3 TRP 26 3HE TRP 26 12.919 -21.060 6.494 182 HZ2 TRP 26 2HZ TRP 26 8.672 -21.286 9.098 183 HZ3 TRP 26 3HZ TRP 26 11.970 -23.218 7.200 184 HH2 TRP 26 HH TRP 26 9.890 -23.326 8.475 185 H ASN 27 H ASN 27 12.641 -16.611 9.599 186 HA ASN 27 HA ASN 27 13.508 -18.975 10.881 187 HB3 ASN 27 2HB ASN 27 14.966 -16.775 12.175 188 HD21 ASN 27 1HD2 ASN 27 16.533 -17.586 13.437 189 HD22 ASN 27 2HD2 ASN 27 16.964 -19.258 13.511 190 H LEU 28 H LEU 28 13.326 -18.688 13.372 191 HA LEU 28 HA LEU 28 10.743 -17.906 13.995 192 HB3 LEU 28 2HB LEU 28 11.352 -18.158 16.311 193 HG LEU 28 HG LEU 28 12.044 -20.183 14.426 194 HD11 LEU 28 1HD1 LEU 28 14.324 -19.539 15.684 195 HD12 LEU 28 2HD1 LEU 28 13.915 -21.183 15.194 196 HD13 LEU 28 3HD1 LEU 28 13.644 -20.666 16.858 197 HD21 LEU 28 3HD2 LEU 28 10.967 -19.954 17.180 198 HD22 LEU 28 1HD2 LEU 28 11.579 -21.528 16.672 199 HD23 LEU 28 2HD2 LEU 28 10.289 -20.747 15.757 200 H ARG 29 H ARG 29 13.778 -16.138 14.540 201 HA ARG 29 HA ARG 29 12.226 -13.651 14.621 202 HB3 ARG 29 2HB ARG 29 13.597 -12.818 16.486 203 HG3 ARG 29 2HG ARG 29 12.850 -15.134 17.942 204 HD3 ARG 29 2HD ARG 29 11.828 -12.355 17.561 205 HE ARG 29 HE ARG 29 10.430 -13.869 19.566 206 HH11 ARG 29 1HH1 ARG 29 10.401 -12.770 16.263 207 HH12 ARG 29 2HH1 ARG 29 8.680 -12.886 16.102 208 HH21 ARG 29 1HH2 ARG 29 8.163 -14.026 19.367 209 HH22 ARG 29 2HH2 ARG 29 7.407 -13.599 17.868 210 H ALA 30 H ALA 30 13.508 -14.514 12.386 211 HA ALA 30 HA ALA 30 16.197 -13.599 12.184 212 HB1 ALA 30 1HB ALA 30 14.146 -14.640 10.335 213 HB2 ALA 30 2HB ALA 30 15.396 -13.618 9.623 214 HB3 ALA 30 3HB ALA 30 15.846 -15.075 10.510 215 H PHE 31 H PHE 31 16.627 -11.970 10.247 216 HA PHE 31 HA PHE 31 14.823 -9.767 10.034 217 HB3 PHE 31 2HB PHE 31 15.556 -9.169 12.218 218 HD1 PHE 31 2HD PHE 31 18.803 -8.479 10.639 219 HD2 PHE 31 1HD PHE 31 16.712 -10.753 13.566 220 HE1 PHE 31 2HE PHE 31 20.948 -9.191 11.613 221 HE2 PHE 31 1HE PHE 31 18.853 -11.468 14.546 222 HZ PHE 31 HZ PHE 31 20.975 -10.688 13.568 223 H GLY 32 H GLY 32 16.328 -11.533 8.302 224 HA2 GLY 32 2HA GLY 32 18.358 -9.778 7.126 225 HA3 GLY 32 3HA GLY 32 18.076 -11.461 6.706 226 H TRP 33 H TRP 33 15.562 -9.018 6.942 227 HA TRP 33 HA TRP 33 14.311 -9.645 4.566 228 HB3 TRP 33 2HB TRP 33 13.236 -8.273 6.254 229 HD1 TRP 33 HD TRP 33 15.470 -5.605 4.514 230 HE1 TRP 33 1HE TRP 33 16.254 -3.942 6.315 231 HE3 TRP 33 3HE TRP 33 13.329 -7.782 8.615 232 HZ2 TRP 33 2HZ TRP 33 15.999 -3.599 9.106 233 HZ3 TRP 33 3HZ TRP 33 13.648 -6.724 10.813 234 HH2 TRP 33 HH TRP 33 14.956 -4.676 11.051 235 H TYR 34 H TYR 34 14.271 -8.700 2.495 236 HA TYR 34 HA TYR 34 16.460 -6.899 1.790 237 HB3 TYR 34 2HB TYR 34 15.987 -9.448 0.239 238 HD1 TYR 34 1HD TYR 34 18.441 -6.748 1.059 239 HD2 TYR 34 2HD TYR 34 17.012 -9.529 -1.827 240 HE1 TYR 34 1HE TYR 34 20.021 -5.838 -0.592 241 HE2 TYR 34 2HE TYR 34 18.588 -8.626 -3.486 242 HH TYR 34 HH TYR 34 20.794 -7.388 -3.445 243 HA PRO 35 HA PRO 35 12.353 -6.067 -0.302 244 HB3 PRO 35 2HB PRO 35 11.523 -4.881 1.482 245 HG3 PRO 35 2HG PRO 35 12.946 -3.934 3.057 246 HD3 PRO 35 2HD PRO 35 13.790 -6.077 2.999 247 H HIS 36 H HIS 36 11.996 -3.594 -1.357 248 HA HIS 36 HA HIS 36 12.628 -2.173 -3.022 249 HB3 HIS 36 2HB HIS 36 14.787 -1.293 -3.036 250 HD1 HIS 36 1HD HIS 36 16.619 -2.363 -0.390 251 HD2 HIS 36 2HD HIS 36 12.800 -0.736 -0.574 252 HE1 HIS 36 1HE HIS 36 16.178 -1.421 1.900 253 H LEU 37 H LEU 37 11.716 -4.322 -4.050 254 HA LEU 37 HA LEU 37 13.718 -5.313 -5.971 255 HB3 LEU 37 2HB LEU 37 12.132 -7.251 -6.251 256 HG LEU 37 HG LEU 37 12.814 -8.527 -4.379 257 HD11 LEU 37 1HD1 LEU 37 14.601 -7.732 -5.926 258 HD12 LEU 37 2HD1 LEU 37 15.169 -8.142 -4.308 259 HD13 LEU 37 3HD1 LEU 37 14.961 -6.452 -4.767 260 HD21 LEU 37 3HD2 LEU 37 12.221 -6.255 -2.904 261 HD22 LEU 37 1HD2 LEU 37 13.961 -6.459 -2.712 262 HD23 LEU 37 2HD2 LEU 37 12.867 -7.775 -2.286 263 H GLY 38 H GLY 38 10.694 -3.712 -5.547 264 HA2 GLY 38 2HA GLY 38 9.980 -3.992 -8.368 265 HA3 GLY 38 3HA GLY 38 8.999 -3.241 -7.117 266 H ARG 39 H ARG 39 12.373 -2.454 -7.538 267 HA ARG 39 HA ARG 39 12.103 0.265 -7.519 268 HB3 ARG 39 2HB ARG 39 14.304 -0.298 -7.370 269 HG3 ARG 39 2HG ARG 39 13.618 -2.497 -9.212 270 HD3 ARG 39 2HD ARG 39 15.477 -1.248 -10.354 271 HE ARG 39 HE ARG 39 16.655 -1.129 -7.863 272 HH11 ARG 39 1HH1 ARG 39 17.531 -2.249 -11.041 273 HH12 ARG 39 2HH1 ARG 39 19.221 -1.929 -10.830 274 HH21 ARG 39 1HH2 ARG 39 18.877 -0.702 -7.574 275 HH22 ARG 39 2HH2 ARG 39 19.985 -1.050 -8.858 276 H LEU 40 H LEU 40 12.997 -1.328 -10.565 277 HA LEU 40 HA LEU 40 10.824 -0.477 -12.098 278 HB3 LEU 40 2HB LEU 40 13.162 1.411 -12.023 279 HG LEU 40 HG LEU 40 11.761 0.774 -14.383 280 HD11 LEU 40 1HD1 LEU 40 10.113 2.439 -13.081 281 HD12 LEU 40 2HD1 LEU 40 10.293 2.428 -14.835 282 HD13 LEU 40 3HD1 LEU 40 11.164 3.617 -13.867 283 HD21 LEU 40 3HD2 LEU 40 13.854 1.536 -14.782 284 HD22 LEU 40 1HD2 LEU 40 13.803 2.700 -13.459 285 HD23 LEU 40 2HD2 LEU 40 13.001 3.068 -14.986 286 H ASP 41 H ASP 41 14.378 -0.622 -12.325 287 HA ASP 41 HA ASP 41 14.153 -2.077 -14.847 288 HB3 ASP 41 2HB ASP 41 16.723 -1.314 -13.474 289 H ASN 42 H ASN 42 13.540 -3.154 -12.064 290 HA ASN 42 HA ASN 42 15.406 -4.969 -11.170 291 HB3 ASN 42 2HB ASN 42 13.536 -4.831 -9.809 292 HD21 ASN 42 1HD2 ASN 42 11.900 -3.476 -9.814 293 HD22 ASN 42 2HD2 ASN 42 10.564 -3.498 -10.909 294 H GLN 43 H GLN 43 16.328 -6.733 -11.982 295 HA GLN 43 HA GLN 43 15.139 -7.938 -14.389 296 HB3 GLN 43 2HB GLN 43 17.284 -7.058 -14.919 297 HG3 GLN 43 2HG GLN 43 19.102 -8.514 -13.342 298 HE21 GLN 43 1HE2 GLN 43 17.401 -5.398 -13.244 299 HE22 GLN 43 2HE2 GLN 43 18.810 -4.428 -13.481 300 H GLY 44 H GLY 44 16.278 -10.322 -14.574 301 HA2 GLY 44 2HA GLY 44 16.605 -12.410 -13.557 302 HA3 GLY 44 3HA GLY 44 16.130 -11.709 -12.017 303 H LYS 45 H LYS 45 13.933 -11.560 -11.482 304 HA LYS 45 HA LYS 45 11.797 -12.210 -13.165 305 HB3 LYS 45 2HB LYS 45 12.825 -14.436 -13.245 306 HG3 LYS 45 2HG LYS 45 12.665 -15.856 -11.164 307 HD3 LYS 45 2HD LYS 45 14.708 -13.763 -10.648 308 HE3 LYS 45 2HE LYS 45 14.371 -16.613 -10.323 309 HZ1 LYS 45 3HZ LYS 45 16.302 -15.850 -12.236 310 HZ2 LYS 45 1HZ LYS 45 15.927 -17.399 -11.664 311 HZ3 LYS 45 2HZ LYS 45 17.082 -16.457 -10.864 312 H ILE 46 H ILE 46 13.173 -12.119 -9.963 313 HA ILE 46 HA ILE 46 10.866 -12.283 -8.406 314 HB ILE 46 HB ILE 46 13.283 -10.564 -7.839 315 HG13 ILE 46 2HG1 ILE 46 12.894 -13.470 -7.888 316 HG21 ILE 46 1HG2 ILE 46 12.358 -10.095 -5.876 317 HG22 ILE 46 2HG2 ILE 46 10.872 -10.850 -6.449 318 HG23 ILE 46 3HG2 ILE 46 12.057 -11.803 -5.556 319 HD11 ILE 46 3HD1 ILE 46 14.990 -13.473 -8.609 320 HD12 ILE 46 1HD1 ILE 46 14.874 -11.713 -8.660 321 HD13 ILE 46 2HD1 ILE 46 15.545 -12.513 -7.238 322 H ASN 47 H ASN 47 12.583 -9.233 -9.078 323 HA ASN 47 HA ASN 47 11.789 -7.076 -9.028 324 HB3 ASN 47 2HB ASN 47 11.476 -7.700 -11.362 325 HD21 ASN 47 1HD2 ASN 47 10.884 -9.391 -12.493 326 HD22 ASN 47 2HD2 ASN 47 9.343 -10.170 -12.436 327 H ALA 48 H ALA 48 10.787 -8.506 -6.848 328 HA ALA 48 HA ALA 48 8.627 -6.872 -6.066 329 HB1 ALA 48 1HB ALA 48 6.775 -8.059 -6.459 330 HB2 ALA 48 2HB ALA 48 7.753 -8.942 -7.631 331 HB3 ALA 48 3HB ALA 48 7.543 -9.580 -6.001 332 H TRP 49 H TRP 49 8.377 -6.885 -3.875 333 HA TRP 49 HA TRP 49 10.294 -8.429 -2.365 334 HB3 TRP 49 2HB TRP 49 8.418 -6.177 -1.753 335 HD1 TRP 49 HD TRP 49 11.111 -7.258 0.708 336 HE1 TRP 49 1HE TRP 49 10.009 -7.787 2.973 337 HE3 TRP 49 3HE TRP 49 6.202 -7.025 -0.704 338 HZ2 TRP 49 2HZ TRP 49 7.403 -8.069 4.022 339 HZ3 TRP 49 3HZ TRP 49 4.467 -7.438 0.991 340 HH2 TRP 49 HH TRP 49 5.057 -7.949 3.304 341 H THR 50 H THR 50 9.906 -10.156 -1.107 342 HA THR 50 HA THR 50 7.143 -11.159 -1.014 343 HB THR 50 HB THR 50 9.417 -12.920 -0.253 344 HG1 THR 50 1HG THR 50 10.238 -11.992 -2.133 345 HG21 THR 50 3HG2 THR 50 6.792 -13.218 -1.690 346 HG22 THR 50 1HG2 THR 50 7.293 -13.933 -0.159 347 HG23 THR 50 2HG2 THR 50 7.999 -14.504 -1.671 348 H ALA 51 H ALA 51 6.626 -12.496 0.959 349 HA ALA 51 HA ALA 51 7.212 -10.916 3.310 350 HB1 ALA 51 1HB ALA 51 4.932 -11.598 2.957 351 HB2 ALA 51 2HB ALA 51 5.407 -13.295 2.902 352 HB3 ALA 51 3HB ALA 51 5.549 -12.388 4.407 353 H GLN 52 H GLN 52 7.892 -11.873 5.339 354 HA GLN 52 HA GLN 52 10.118 -13.659 4.960 355 HB3 GLN 52 2HB GLN 52 8.987 -12.290 7.401 356 HG3 GLN 52 2HG GLN 52 11.566 -12.943 8.027 357 HE21 GLN 52 1HE2 GLN 52 9.711 -12.004 9.518 358 HE22 GLN 52 2HE2 GLN 52 9.063 -13.157 10.629 359 H SER 53 H SER 53 6.959 -13.790 6.534 360 HA SER 53 HA SER 53 7.329 -16.696 6.857 361 HB3 SER 53 2HB SER 53 7.092 -16.170 9.062 362 HG SER 53 HG SER 53 5.318 -14.092 8.959 363 H ASN 54 H ASN 54 5.707 -14.331 5.198 364 HA ASN 54 HA ASN 54 3.696 -14.200 4.092 365 HB3 ASN 54 2HB ASN 54 4.942 -15.613 2.594 366 HD21 ASN 54 1HD2 ASN 54 6.600 -16.796 3.538 367 HD22 ASN 54 2HD2 ASN 54 6.408 -18.456 3.977 368 H SER 55 H SER 55 2.799 -14.163 6.453 369 HA SER 55 HA SER 55 0.711 -16.232 6.592 370 HB3 SER 55 2HB SER 55 1.228 -15.282 9.224 371 HG SER 55 HG SER 55 0.550 -17.310 9.120 372 H ALA 56 H ALA 56 0.871 -13.406 5.570 373 HA ALA 56 HA ALA 56 -0.675 -11.727 5.370 374 HB1 ALA 56 1HB ALA 56 -2.316 -12.384 7.697 375 HB2 ALA 56 2HB ALA 56 -2.779 -12.138 6.013 376 HB3 ALA 56 3HB ALA 56 -2.158 -13.703 6.536 377 H LYS 57 H LYS 57 0.057 -12.577 8.745 378 HA LYS 57 HA LYS 57 -0.257 -10.187 10.009 379 HB3 LYS 57 2HB LYS 57 0.438 -12.181 11.199 380 HG3 LYS 57 2HG LYS 57 3.289 -11.912 10.511 381 HD3 LYS 57 2HD LYS 57 2.908 -14.488 10.524 382 HE3 LYS 57 2HE LYS 57 3.760 -12.757 12.394 383 HZ1 LYS 57 3HZ LYS 57 1.191 -13.795 13.331 384 HZ2 LYS 57 1HZ LYS 57 1.954 -12.325 13.677 385 HZ3 LYS 57 2HZ LYS 57 2.464 -13.743 14.443 386 H GLU 58 H GLU 58 2.476 -11.160 7.988 387 HA GLU 58 HA GLU 58 4.234 -9.093 8.449 388 HB3 GLU 58 2HB GLU 58 4.488 -11.130 6.912 389 HG3 GLU 58 2HG GLU 58 4.280 -10.441 4.469 390 H TRP 59 H TRP 59 4.611 -7.072 7.489 391 HA TRP 59 HA TRP 59 2.458 -5.926 5.875 392 HB3 TRP 59 2HB TRP 59 1.755 -5.270 8.047 393 HD1 TRP 59 HD TRP 59 5.286 -3.644 8.127 394 HE1 TRP 59 1HE TRP 59 6.234 -3.943 10.501 395 HE3 TRP 59 3HE TRP 59 1.463 -6.336 10.195 396 HZ2 TRP 59 2HZ TRP 59 5.464 -5.159 12.929 397 HZ3 TRP 59 3HZ TRP 59 1.646 -7.028 12.549 398 HH2 TRP 59 HH TRP 59 3.606 -6.452 13.885 399 H LEU 60 H LEU 60 3.099 -4.299 4.496 400 HA LEU 60 HA LEU 60 5.993 -3.748 4.439 401 HB3 LEU 60 2HB LEU 60 4.021 -3.908 2.165 402 HG LEU 60 HG LEU 60 6.406 -2.459 2.123 403 HD11 LEU 60 1HD1 LEU 60 7.184 -5.061 1.904 404 HD12 LEU 60 2HD1 LEU 60 8.060 -3.682 1.242 405 HD13 LEU 60 3HD1 LEU 60 6.964 -4.605 0.215 406 HD21 LEU 60 3HD2 LEU 60 4.239 -2.544 0.647 407 HD22 LEU 60 1HD2 LEU 60 5.232 -3.589 -0.371 408 HD23 LEU 60 2HD2 LEU 60 5.760 -1.945 -0.016 409 H GLN 61 H GLN 61 6.600 -1.706 4.704 410 HA GLN 61 HA GLN 61 4.615 0.417 4.222 411 HB3 GLN 61 2HB GLN 61 5.466 1.645 6.092 412 HG3 GLN 61 2HG GLN 61 4.376 -0.945 6.453 413 HE21 GLN 61 1HE2 GLN 61 7.009 -1.572 6.634 414 HE22 GLN 61 2HE2 GLN 61 7.404 -2.026 8.253 415 H VAL 62 H VAL 62 5.394 2.415 3.437 416 HA VAL 62 HA VAL 62 8.015 2.213 2.106 417 HB VAL 62 HB VAL 62 5.762 4.028 1.264 418 HG11 VAL 62 1HG1 VAL 62 7.995 4.624 0.472 419 HG12 VAL 62 2HG1 VAL 62 8.197 3.003 -0.194 420 HG13 VAL 62 3HG1 VAL 62 6.971 4.085 -0.858 421 HG21 VAL 62 3HG2 VAL 62 4.804 1.896 1.033 422 HG22 VAL 62 1HG2 VAL 62 5.437 2.282 -0.567 423 HG23 VAL 62 2HG2 VAL 62 6.320 1.178 0.489 424 H ASP 63 H ASP 63 9.551 3.483 2.886 425 HA ASP 63 HA ASP 63 8.794 5.830 4.471 426 HB3 ASP 63 2HB ASP 63 10.289 4.166 5.527 427 H LEU 64 H LEU 64 9.005 7.805 3.661 428 HA LEU 64 HA LEU 64 10.704 8.166 1.283 429 HB3 LEU 64 2HB LEU 64 9.187 10.303 1.105 430 HG LEU 64 HG LEU 64 9.126 8.478 -0.575 431 HD11 LEU 64 1HD1 LEU 64 7.006 7.330 1.235 432 HD12 LEU 64 2HD1 LEU 64 8.591 6.627 0.912 433 HD13 LEU 64 3HD1 LEU 64 7.403 6.756 -0.386 434 HD21 LEU 64 3HD2 LEU 64 7.463 10.502 -0.333 435 HD22 LEU 64 1HD2 LEU 64 6.290 9.215 -0.051 436 HD23 LEU 64 2HD2 LEU 64 7.210 9.256 -1.556 437 H GLY 65 H GLY 65 9.418 10.084 4.012 438 HA2 GLY 65 2HA GLY 65 10.464 11.578 5.413 439 HA3 GLY 65 3HA GLY 65 11.997 10.899 4.884 440 H THR 66 H THR 66 10.228 11.872 2.226 441 HA THR 66 HA THR 66 11.758 14.381 2.075 442 HB THR 66 HB THR 66 12.349 12.821 0.314 443 HG1 THR 66 1HG THR 66 12.206 14.297 -1.276 444 HG21 THR 66 3HG2 THR 66 10.547 11.385 0.017 445 HG22 THR 66 1HG2 THR 66 10.483 12.380 -1.437 446 HG23 THR 66 2HG2 THR 66 9.384 12.705 -0.096 447 H GLN 67 H GLN 67 8.683 13.236 2.600 448 HA GLN 67 HA GLN 67 6.584 14.123 2.487 449 HB3 GLN 67 2HB GLN 67 7.755 16.871 2.440 450 HG3 GLN 67 2HG GLN 67 5.405 15.540 3.602 451 HE21 GLN 67 1HE2 GLN 67 4.895 15.519 5.660 452 HE22 GLN 67 2HE2 GLN 67 5.494 16.592 6.875 453 H ARG 68 H ARG 68 6.413 13.337 0.264 454 HA ARG 68 HA ARG 68 6.311 15.546 -1.684 455 HB3 ARG 68 2HB ARG 68 6.498 13.686 -3.411 456 HG3 ARG 68 2HG ARG 68 8.925 13.376 -3.165 457 HD3 ARG 68 2HD ARG 68 8.046 16.181 -2.492 458 HE ARG 68 HE ARG 68 10.578 15.147 -3.356 459 HH11 ARG 68 1HH1 ARG 68 8.427 17.882 -3.481 460 HH12 ARG 68 2HH1 ARG 68 9.692 19.028 -3.787 461 HH21 ARG 68 1HH2 ARG 68 12.250 16.645 -3.760 462 HH22 ARG 68 2HH2 ARG 68 11.865 18.323 -3.946 463 H GLN 69 H GLN 69 4.558 15.580 -3.160 464 HA GLN 69 HA GLN 69 2.107 14.539 -2.018 465 HB3 GLN 69 2HB GLN 69 2.741 16.468 -4.231 466 HG3 GLN 69 2HG GLN 69 0.070 15.257 -3.600 467 HE21 GLN 69 1HE2 GLN 69 -0.182 17.516 -2.535 468 HE22 GLN 69 2HE2 GLN 69 -0.842 18.736 -3.565 469 H VAL 70 H VAL 70 1.324 12.622 -2.560 470 HA VAL 70 HA VAL 70 2.294 11.190 -4.856 471 HB VAL 70 HB VAL 70 0.823 9.380 -4.127 472 HG11 VAL 70 1HG1 VAL 70 3.013 9.626 -3.069 473 HG12 VAL 70 2HG1 VAL 70 2.301 10.659 -1.828 474 HG13 VAL 70 3HG1 VAL 70 1.830 8.963 -1.942 475 HG21 VAL 70 3HG2 VAL 70 -0.448 11.559 -2.633 476 HG22 VAL 70 1HG2 VAL 70 -1.124 10.041 -3.226 477 HG23 VAL 70 2HG2 VAL 70 -0.225 10.074 -1.709 478 H THR 71 H THR 71 1.235 10.704 -6.729 479 HA THR 71 HA THR 71 -1.461 11.814 -7.106 480 HB THR 71 HB THR 71 0.118 11.993 -9.534 481 HG1 THR 71 1HG THR 71 1.000 13.418 -7.232 482 HG21 THR 71 3HG2 THR 71 -0.832 14.483 -8.388 483 HG22 THR 71 1HG2 THR 71 -2.075 13.234 -8.368 484 HG23 THR 71 2HG2 THR 71 -1.302 13.684 -9.888 485 H GLY 72 H GLY 72 -0.350 9.073 -6.697 486 HA2 GLY 72 2HA GLY 72 -2.010 7.524 -8.142 487 HA3 GLY 72 3HA GLY 72 -0.678 7.765 -9.263 488 H ILE 73 H ILE 73 -1.254 5.237 -8.536 489 HA ILE 73 HA ILE 73 1.159 4.472 -7.117 490 HB ILE 73 HB ILE 73 -0.217 2.776 -5.758 491 HG13 ILE 73 2HG1 ILE 73 -2.320 3.875 -7.142 492 HG21 ILE 73 1HG2 ILE 73 -0.490 4.364 -3.920 493 HG22 ILE 73 2HG2 ILE 73 1.031 4.623 -4.771 494 HG23 ILE 73 3HG2 ILE 73 -0.331 5.706 -5.054 495 HD11 ILE 73 3HD1 ILE 73 -3.527 2.301 -6.137 496 HD12 ILE 73 1HD1 ILE 73 -2.022 1.841 -5.342 497 HD13 ILE 73 2HD1 ILE 73 -3.158 2.917 -4.527 498 H ILE 74 H ILE 74 1.828 2.342 -7.540 499 HA ILE 74 HA ILE 74 0.221 0.812 -9.458 500 HB ILE 74 HB ILE 74 1.985 2.231 -10.627 501 HG13 ILE 74 2HG1 ILE 74 1.175 -0.489 -11.005 502 HG21 ILE 74 1HG2 ILE 74 3.852 0.177 -9.451 503 HG22 ILE 74 2HG2 ILE 74 4.270 1.482 -10.560 504 HG23 ILE 74 3HG2 ILE 74 3.743 1.854 -8.919 505 HD11 ILE 74 3HD1 ILE 74 1.138 0.034 -13.310 506 HD12 ILE 74 1HD1 ILE 74 0.625 1.484 -12.447 507 HD13 ILE 74 2HD1 ILE 74 2.263 1.374 -13.092 508 H THR 75 H THR 75 0.391 -1.381 -9.283 509 HA THR 75 HA THR 75 2.305 -2.430 -7.306 510 HB THR 75 HB THR 75 -0.602 -3.217 -7.584 511 HG1 THR 75 1HG THR 75 0.666 -2.265 -5.243 512 HG21 THR 75 3HG2 THR 75 1.674 -4.426 -6.042 513 HG22 THR 75 1HG2 THR 75 0.493 -5.224 -7.080 514 HG23 THR 75 2HG2 THR 75 0.004 -4.604 -5.503 515 H GLN 76 H GLN 76 3.179 -4.438 -7.724 516 HA GLN 76 HA GLN 76 2.314 -5.839 -10.145 517 HB3 GLN 76 2HB GLN 76 5.199 -5.867 -9.930 518 HG3 GLN 76 2HG GLN 76 3.232 -5.087 -12.049 519 HE21 GLN 76 1HE2 GLN 76 4.792 -2.996 -11.594 520 HE22 GLN 76 2HE2 GLN 76 6.041 -2.864 -12.779 521 H GLY 77 H GLY 77 2.425 -8.023 -10.014 522 HA2 GLY 77 2HA GLY 77 3.233 -9.126 -7.428 523 HA3 GLY 77 3HA GLY 77 2.253 -9.935 -8.641 524 H ALA 78 H ALA 78 4.270 -11.305 -7.431 525 HA ALA 78 HA ALA 78 6.305 -11.481 -9.557 526 HB1 ALA 78 1HB ALA 78 6.580 -11.460 -6.623 527 HB2 ALA 78 2HB ALA 78 7.561 -12.649 -7.480 528 HB3 ALA 78 3HB ALA 78 7.705 -10.935 -7.875 529 H ARG 79 H ARG 79 6.743 -13.463 -10.409 530 HA ARG 79 HA ARG 79 5.203 -15.736 -9.340 531 HB3 ARG 79 2HB ARG 79 4.327 -14.840 -11.504 532 HG3 ARG 79 2HG ARG 79 7.067 -14.966 -12.279 533 HD3 ARG 79 2HD ARG 79 5.366 -17.056 -13.392 534 HE ARG 79 HE ARG 79 6.877 -15.955 -15.546 535 HH11 ARG 79 1HH1 ARG 79 3.816 -15.790 -13.895 536 HH12 ARG 79 2HH1 ARG 79 2.952 -15.207 -15.279 537 HH21 ARG 79 1HH2 ARG 79 5.750 -15.188 -17.376 538 HH22 ARG 79 2HH2 ARG 79 4.054 -14.866 -17.259 539 H ASP 80 H ASP 80 6.152 -17.800 -9.485 540 HA ASP 80 HA ASP 80 9.076 -17.741 -9.844 541 HB3 ASP 80 2HB ASP 80 7.505 -19.698 -8.160 542 H PHE 81 H PHE 81 7.250 -18.133 -12.005 543 HA PHE 81 HA PHE 81 7.017 -19.455 -13.840 544 HB3 PHE 81 2HB PHE 81 8.686 -21.093 -14.324 545 HD1 PHE 81 1HD PHE 81 9.337 -19.004 -15.494 546 HD2 PHE 81 2HD PHE 81 10.623 -19.879 -11.532 547 HE1 PHE 81 1HE PHE 81 11.115 -17.315 -15.702 548 HE2 PHE 81 2HE PHE 81 12.401 -18.192 -11.733 549 HZ PHE 81 HZ PHE 81 12.649 -16.907 -13.819 550 H GLY 82 H GLY 82 4.891 -20.022 -13.253 551 HA2 GLY 82 2HA GLY 82 3.428 -21.906 -13.354 552 HA3 GLY 82 3HA GLY 82 4.630 -22.845 -12.482 553 H HIS 83 H HIS 83 5.174 -21.282 -10.317 554 HA HIS 83 HA HIS 83 2.670 -21.496 -8.834 555 HB3 HIS 83 2HB HIS 83 4.315 -21.021 -6.867 556 HD1 HIS 83 1HD HIS 83 2.455 -23.052 -6.663 557 HD2 HIS 83 2HD HIS 83 6.180 -23.993 -8.244 558 HE1 HIS 83 1HE HIS 83 2.661 -25.551 -6.459 559 H ILE 84 H ILE 84 2.855 -19.325 -10.626 560 HA ILE 84 HA ILE 84 3.725 -16.903 -9.897 561 HB ILE 84 HB ILE 84 0.854 -17.402 -10.695 562 HG13 ILE 84 2HG1 ILE 84 3.358 -17.773 -12.121 563 HG21 ILE 84 1HG2 ILE 84 2.573 -14.980 -10.540 564 HG22 ILE 84 2HG2 ILE 84 1.398 -15.097 -11.850 565 HG23 ILE 84 3HG2 ILE 84 0.860 -15.175 -10.173 566 HD11 ILE 84 3HD1 ILE 84 1.649 -18.534 -13.916 567 HD12 ILE 84 1HD1 ILE 84 1.869 -19.489 -12.452 568 HD13 ILE 84 2HD1 ILE 84 0.486 -18.404 -12.597 569 H GLN 85 H GLN 85 3.488 -15.449 -8.301 570 HA GLN 85 HA GLN 85 1.433 -15.979 -6.257 571 HB3 GLN 85 2HB GLN 85 2.944 -15.417 -4.524 572 HG3 GLN 85 2HG GLN 85 4.365 -17.095 -6.570 573 HE21 GLN 85 1HE2 GLN 85 6.128 -15.407 -5.786 574 HE22 GLN 85 2HE2 GLN 85 7.126 -15.997 -4.505 575 H TYR 86 H TYR 86 0.541 -14.167 -5.194 576 HA TYR 86 HA TYR 86 1.262 -11.498 -5.688 577 HB3 TYR 86 2HB TYR 86 -1.128 -12.403 -7.304 578 HD1 TYR 86 2HD TYR 86 1.257 -9.663 -6.503 579 HD2 TYR 86 1HD TYR 86 -2.454 -10.742 -8.282 580 HE1 TYR 86 2HE TYR 86 0.704 -7.282 -6.781 581 HE2 TYR 86 1HE TYR 86 -3.017 -8.365 -8.567 582 HH TYR 86 HH TYR 86 -1.822 -6.200 -8.742 583 H VAL 87 H VAL 87 0.004 -10.039 -4.521 584 HA VAL 87 HA VAL 87 -1.765 -11.283 -2.566 585 HB VAL 87 HB VAL 87 -0.888 -8.399 -2.616 586 HG11 VAL 87 1HG1 VAL 87 -2.294 -10.172 -0.717 587 HG12 VAL 87 2HG1 VAL 87 -1.108 -9.061 -0.027 588 HG13 VAL 87 3HG1 VAL 87 -2.453 -8.436 -0.982 589 HG21 VAL 87 3HG2 VAL 87 1.104 -9.805 -2.705 590 HG22 VAL 87 1HG2 VAL 87 0.944 -9.041 -1.124 591 HG23 VAL 87 2HG2 VAL 87 0.518 -10.740 -1.329 592 H ALA 88 H ALA 88 -3.827 -10.376 -2.030 593 HA ALA 88 HA ALA 88 -5.101 -8.975 -4.290 594 HB1 ALA 88 1HB ALA 88 -7.141 -10.248 -2.921 595 HB2 ALA 88 2HB ALA 88 -6.414 -10.768 -4.441 596 HB3 ALA 88 3HB ALA 88 -5.825 -11.422 -2.913 597 H SER 89 H SER 89 -6.251 -9.735 -1.020 598 HA SER 89 HA SER 89 -7.177 -7.012 -0.706 599 HB3 SER 89 2HB SER 89 -8.364 -7.782 1.197 600 HG SER 89 HG SER 89 -8.736 -8.907 -1.010 601 H TYR 90 H TYR 90 -6.106 -5.440 0.287 602 HA TYR 90 HA TYR 90 -4.342 -5.965 2.503 603 HB3 TYR 90 2HB TYR 90 -2.892 -6.401 0.525 604 HD1 TYR 90 1HD TYR 90 -2.470 -2.760 0.705 605 HD2 TYR 90 2HD TYR 90 -3.712 -6.030 -1.719 606 HE1 TYR 90 1HE TYR 90 -2.440 -1.298 -1.274 607 HE2 TYR 90 2HE TYR 90 -3.683 -4.578 -3.703 608 HH TYR 90 HH TYR 90 -2.210 -1.563 -3.755 609 H LYS 91 H LYS 91 -4.278 -4.270 3.862 610 HA LYS 91 HA LYS 91 -5.789 -1.898 3.132 611 HB3 LYS 91 2HB LYS 91 -4.660 -1.777 5.777 612 HG3 LYS 91 2HG LYS 91 -7.003 -1.877 6.496 613 HD3 LYS 91 2HD LYS 91 -5.937 -0.002 4.529 614 HE3 LYS 91 2HE LYS 91 -8.577 0.895 4.881 615 HZ1 LYS 91 3HZ LYS 91 -8.208 1.486 2.790 616 HZ2 LYS 91 1HZ LYS 91 -8.094 -0.122 2.278 617 HZ3 LYS 91 2HZ LYS 91 -6.723 0.680 2.855 618 H VAL 92 H VAL 92 -4.630 -0.482 1.957 619 HA VAL 92 HA VAL 92 -1.889 0.149 2.802 620 HB VAL 92 HB VAL 92 -2.035 -0.414 0.470 621 HG11 VAL 92 1HG1 VAL 92 -3.559 1.705 -0.633 622 HG12 VAL 92 2HG1 VAL 92 -3.878 -0.029 -0.705 623 HG13 VAL 92 3HG1 VAL 92 -4.534 0.935 0.618 624 HG21 VAL 92 3HG2 VAL 92 -0.587 1.515 1.227 625 HG22 VAL 92 1HG2 VAL 92 -0.984 1.476 -0.492 626 HG23 VAL 92 2HG2 VAL 92 -1.832 2.587 0.583 627 H ALA 93 H ALA 93 -1.626 1.864 4.056 628 HA ALA 93 HA ALA 93 -3.446 4.158 3.709 629 HB1 ALA 93 1HB ALA 93 -3.902 4.249 5.896 630 HB2 ALA 93 2HB ALA 93 -3.302 2.591 5.951 631 HB3 ALA 93 3HB ALA 93 -2.227 3.931 6.352 632 H HIS 94 H HIS 94 -2.558 6.211 3.823 633 HA HIS 94 HA HIS 94 0.382 6.301 3.695 634 HB3 HIS 94 2HB HIS 94 0.036 8.425 2.400 635 HD1 HIS 94 1HD HIS 94 0.519 8.118 -0.040 636 HD2 HIS 94 2HD HIS 94 -1.542 4.902 1.595 637 HE1 HIS 94 1HE HIS 94 0.498 6.353 -1.831 638 H SER 95 H SER 95 1.509 7.757 4.916 639 HA SER 95 HA SER 95 -0.052 9.453 6.749 640 HB3 SER 95 2HB SER 95 0.904 8.550 8.581 641 HG SER 95 HG SER 95 2.175 6.526 7.169 642 H ASP 96 H ASP 96 0.558 11.521 6.839 643 HA ASP 96 HA ASP 96 2.889 12.338 5.288 644 HB3 ASP 96 2HB ASP 96 0.741 13.467 4.874 645 H ASP 97 H ASP 97 1.604 12.544 8.568 646 HA ASP 97 HA ASP 97 4.036 13.884 9.479 647 HB3 ASP 97 2HB ASP 97 1.622 13.128 11.128 648 H GLY 98 H GLY 98 2.610 10.770 9.341 649 HA2 GLY 98 2HA GLY 98 4.040 8.852 9.705 650 HA3 GLY 98 3HA GLY 98 4.797 9.732 11.025 651 H VAL 99 H VAL 99 2.093 10.663 11.939 652 HA VAL 99 HA VAL 99 1.423 8.227 13.428 653 HB VAL 99 HB VAL 99 1.985 10.187 14.780 654 HG11 VAL 99 1HG1 VAL 99 -0.416 11.487 13.496 655 HG12 VAL 99 2HG1 VAL 99 0.576 12.168 14.787 656 HG13 VAL 99 3HG1 VAL 99 1.268 11.910 13.186 657 HG21 VAL 99 3HG2 VAL 99 0.351 8.540 15.613 658 HG22 VAL 99 1HG2 VAL 99 0.056 10.159 16.247 659 HG23 VAL 99 2HG2 VAL 99 -0.954 9.523 14.950 660 H GLN 100 H GLN 100 0.033 10.691 11.348 661 HA GLN 100 HA GLN 100 -2.640 9.600 11.596 662 HB3 GLN 100 2HB GLN 100 -3.339 11.391 10.173 663 HG3 GLN 100 2HG GLN 100 -1.083 12.575 11.762 664 HE21 GLN 100 1HE2 GLN 100 -0.969 14.571 10.990 665 HE22 GLN 100 2HE2 GLN 100 -2.312 15.626 10.731 666 H TRP 101 H TRP 101 -2.822 7.624 10.695 667 HA TRP 101 HA TRP 101 -1.675 7.146 8.048 668 HB3 TRP 101 2HB TRP 101 -1.984 4.830 8.451 669 HD1 TRP 101 HD TRP 101 0.277 6.888 9.548 670 HE1 TRP 101 1HE TRP 101 1.676 6.178 11.588 671 HE3 TRP 101 3HE TRP 101 -2.852 3.338 11.480 672 HZ2 TRP 101 2HZ TRP 101 1.479 4.353 13.733 673 HZ3 TRP 101 3HZ TRP 101 -2.173 2.155 13.528 674 HH2 TRP 101 HH TRP 101 -0.051 2.653 14.630 675 H THR 102 H THR 102 -2.950 7.945 6.483 676 HA THR 102 HA THR 102 -5.833 7.845 6.687 677 HB THR 102 HB THR 102 -4.056 8.791 4.430 678 HG1 THR 102 1HG THR 102 -3.844 10.293 5.974 679 HG21 THR 102 3HG2 THR 102 -6.181 8.163 3.512 680 HG22 THR 102 1HG2 THR 102 -6.144 9.921 3.637 681 HG23 THR 102 2HG2 THR 102 -7.043 8.971 4.821 682 H VAL 103 H VAL 103 -6.813 5.958 6.336 683 HA VAL 103 HA VAL 103 -5.718 4.073 4.395 684 HB VAL 103 HB VAL 103 -7.501 2.541 5.244 685 HG11 VAL 103 1HG1 VAL 103 -5.528 3.742 7.171 686 HG12 VAL 103 2HG1 VAL 103 -6.475 2.300 7.544 687 HG13 VAL 103 3HG1 VAL 103 -5.348 2.291 6.188 688 HG21 VAL 103 3HG2 VAL 103 -7.988 4.206 7.615 689 HG22 VAL 103 1HG2 VAL 103 -8.732 4.791 6.127 690 HG23 VAL 103 2HG2 VAL 103 -9.088 3.166 6.712 691 H TYR 104 H TYR 104 -6.895 3.253 2.648 692 HA TYR 104 HA TYR 104 -8.824 5.125 1.546 693 HB3 TYR 104 2HB TYR 104 -8.577 3.791 -0.526 694 HD1 TYR 104 1HD TYR 104 -7.827 6.297 -0.519 695 HD2 TYR 104 2HD TYR 104 -5.229 3.027 0.293 696 HE1 TYR 104 1HE TYR 104 -5.890 7.703 -1.086 697 HE2 TYR 104 2HE TYR 104 -3.284 4.425 -0.270 698 HH TYR 104 HH TYR 104 -2.987 7.269 -0.223 699 H GLU 105 H GLU 105 -10.715 4.773 2.673 700 HA GLU 105 HA GLU 105 -11.807 2.234 3.236 701 HB3 GLU 105 2HB GLU 105 -13.772 3.380 3.912 702 HG3 GLU 105 2HG GLU 105 -11.383 4.161 4.909 703 H GLU 106 H GLU 106 -13.798 1.329 2.339 704 HA GLU 106 HA GLU 106 -13.943 1.753 -0.572 705 HB3 GLU 106 2HB GLU 106 -15.111 -0.736 0.358 706 HG3 GLU 106 2HG GLU 106 -13.472 -1.721 -1.229 707 H GLN 107 H GLN 107 -16.032 0.386 1.978 708 HA GLN 107 HA GLN 107 -18.322 1.699 0.693 709 HB3 GLN 107 2HB GLN 107 -18.571 -0.696 0.940 710 HG3 GLN 107 2HG GLN 107 -18.093 -0.233 3.873 711 HE21 GLN 107 1HE2 GLN 107 -20.441 -0.940 3.957 712 HE22 GLN 107 2HE2 GLN 107 -20.726 -2.642 4.042 713 H GLY 108 H GLY 108 -16.289 2.880 2.614 714 HA2 GLY 108 2HA GLY 108 -16.603 4.728 4.027 715 HA3 GLY 108 3HA GLY 108 -18.263 4.217 4.291 716 H SER 109 H SER 109 -16.957 1.421 4.757 717 HA SER 109 HA SER 109 -16.622 1.844 7.630 718 HB3 SER 109 2HB SER 109 -16.774 -0.698 7.687 719 HG SER 109 HG SER 109 -19.106 -0.509 6.834 720 H SER 110 H SER 110 -14.546 2.396 5.521 721 HA SER 110 HA SER 110 -12.311 2.113 5.171 722 HB3 SER 110 2HB SER 110 -11.006 2.193 7.089 723 HG SER 110 HG SER 110 -12.751 2.828 8.839 724 H LYS 111 H LYS 111 -13.062 0.254 3.782 725 HA LYS 111 HA LYS 111 -12.294 -2.363 4.847 726 HB3 LYS 111 2HB LYS 111 -13.254 -2.167 2.064 727 HG3 LYS 111 2HG LYS 111 -12.991 -4.304 3.357 728 HD3 LYS 111 2HD LYS 111 -14.641 -2.902 5.202 729 HE3 LYS 111 2HE LYS 111 -15.867 -5.532 4.441 730 HZ1 LYS 111 3HZ LYS 111 -17.800 -4.240 5.550 731 HZ2 LYS 111 1HZ LYS 111 -16.567 -3.280 6.199 732 HZ3 LYS 111 2HZ LYS 111 -16.604 -4.940 6.520 733 H VAL 112 H VAL 112 -10.645 -3.589 3.998 734 HA VAL 112 HA VAL 112 -8.368 -2.340 3.051 735 HB VAL 112 HB VAL 112 -7.485 -4.530 2.529 736 HG11 VAL 112 1HG1 VAL 112 -8.836 -5.589 4.770 737 HG12 VAL 112 2HG1 VAL 112 -7.265 -4.788 4.724 738 HG13 VAL 112 3HG1 VAL 112 -8.728 -3.845 5.006 739 HG21 VAL 112 3HG2 VAL 112 -9.168 -5.597 1.299 740 HG22 VAL 112 1HG2 VAL 112 -9.070 -6.521 2.797 741 HG23 VAL 112 2HG2 VAL 112 -10.371 -5.355 2.564 742 H PHE 113 H PHE 113 -7.239 -2.791 0.954 743 HA PHE 113 HA PHE 113 -9.114 -2.319 -1.251 744 HB3 PHE 113 2HB PHE 113 -6.549 -1.873 -2.221 745 HD1 PHE 113 1HD PHE 113 -9.138 -0.211 -0.130 746 HD2 PHE 113 2HD PHE 113 -6.612 0.016 -3.548 747 HE1 PHE 113 1HE PHE 113 -10.234 1.889 -0.797 748 HE2 PHE 113 2HE PHE 113 -7.704 2.116 -4.220 749 HZ PHE 113 HZ PHE 113 -9.518 3.056 -2.844 750 H GLN 114 H GLN 114 -9.436 -3.811 -2.765 751 HA GLN 114 HA GLN 114 -7.849 -6.248 -2.699 752 HB3 GLN 114 2HB GLN 114 -10.214 -6.590 -2.748 753 HG3 GLN 114 2HG GLN 114 -10.973 -5.700 -5.327 754 HE21 GLN 114 1HE2 GLN 114 -11.015 -4.734 -1.915 755 HE22 GLN 114 2HE2 GLN 114 -12.735 -4.722 -1.762 756 H GLY 115 H GLY 115 -6.641 -7.042 -4.392 757 HA2 GLY 115 2HA GLY 115 -5.971 -5.062 -6.463 758 HA3 GLY 115 3HA GLY 115 -4.929 -6.373 -5.930 759 H ASN 116 H ASN 116 -4.583 -7.551 -7.713 760 HA ASN 116 HA ASN 116 -6.948 -8.629 -9.089 761 HB3 ASN 116 2HB ASN 116 -4.652 -8.408 -10.852 762 HD21 ASN 116 1HD2 ASN 116 -5.406 -8.473 -12.852 763 HD22 ASN 116 2HD2 ASN 116 -7.038 -8.159 -13.322 764 H LEU 117 H LEU 117 -5.737 -10.337 -10.831 765 HA LEU 117 HA LEU 117 -4.195 -12.133 -9.076 766 HB3 LEU 117 2HB LEU 117 -5.283 -14.019 -10.185 767 HG LEU 117 HG LEU 117 -7.216 -12.045 -8.991 768 HD11 LEU 117 1HD1 LEU 117 -8.616 -13.315 -10.369 769 HD12 LEU 117 2HD1 LEU 117 -8.704 -14.110 -8.798 770 HD13 LEU 117 3HD1 LEU 117 -7.707 -14.798 -10.079 771 HD21 LEU 117 3HD2 LEU 117 -7.128 -14.175 -7.344 772 HD22 LEU 117 1HD2 LEU 117 -6.066 -12.774 -7.193 773 HD23 LEU 117 2HD2 LEU 117 -5.495 -14.229 -8.011 774 H ASP 118 H ASP 118 -3.111 -10.202 -10.902 775 HA ASP 118 HA ASP 118 -1.754 -12.033 -12.766 776 HB3 ASP 118 2HB ASP 118 -1.630 -10.256 -14.427 777 H ASN 119 H ASN 119 0.345 -12.171 -12.369 778 HA ASN 119 HA ASN 119 1.628 -10.293 -10.593 779 HB3 ASN 119 2HB ASN 119 1.973 -12.865 -10.710 780 HD21 ASN 119 1HD2 ASN 119 4.842 -11.487 -12.126 781 HD22 ASN 119 2HD2 ASN 119 4.935 -12.567 -13.471 782 H ASN 120 H ASN 120 1.340 -10.754 -13.981 783 HA ASN 120 HA ASN 120 3.742 -9.286 -14.649 784 HB3 ASN 120 2HB ASN 120 3.270 -9.780 -16.887 785 HD21 ASN 120 1HD2 ASN 120 1.135 -11.907 -17.299 786 HD22 ASN 120 2HD2 ASN 120 1.854 -13.339 -16.654 787 H SER 121 H SER 121 0.277 -8.771 -15.341 788 HA SER 121 HA SER 121 0.429 -6.171 -16.237 789 HB3 SER 121 2HB SER 121 -1.604 -7.812 -16.038 790 HG SER 121 HG SER 121 -2.908 -7.437 -14.305 791 H HIS 122 H HIS 122 1.071 -4.338 -15.337 792 HA HIS 122 HA HIS 122 1.165 -4.161 -12.405 793 HB3 HIS 122 2HB HIS 122 3.273 -3.861 -13.835 794 HD1 HIS 122 1HD HIS 122 1.503 -2.852 -16.115 795 HD2 HIS 122 2HD HIS 122 3.907 -0.386 -13.792 796 HE1 HIS 122 1HE HIS 122 1.925 -0.808 -17.518 797 H LYS 123 H LYS 123 -0.040 -2.719 -11.335 798 HA LYS 123 HA LYS 123 -0.833 -0.206 -12.171 799 HB3 LYS 123 2HB LYS 123 -3.396 -1.451 -12.343 800 HG3 LYS 123 2HG LYS 123 -1.782 0.420 -13.879 801 HD3 LYS 123 2HD LYS 123 -2.063 -1.327 -15.597 802 HE3 LYS 123 2HE LYS 123 -4.805 -1.281 -14.561 803 HZ1 LYS 123 3HZ LYS 123 -5.746 -0.598 -16.448 804 HZ2 LYS 123 1HZ LYS 123 -5.272 -2.087 -17.097 805 HZ3 LYS 123 2HZ LYS 123 -4.312 -0.716 -17.338 806 H LYS 124 H LYS 124 -2.903 0.534 -10.910 807 HA LYS 124 HA LYS 124 -3.693 -0.901 -8.609 808 HB3 LYS 124 2HB LYS 124 -2.161 1.406 -7.629 809 HG3 LYS 124 2HG LYS 124 -1.546 -0.025 -5.851 810 HD3 LYS 124 2HD LYS 124 -4.177 0.457 -6.477 811 HE3 LYS 124 2HE LYS 124 -3.713 -2.471 -6.240 812 HZ1 LYS 124 3HZ LYS 124 -5.489 -2.906 -4.955 813 HZ2 LYS 124 1HZ LYS 124 -6.362 -1.556 -5.483 814 HZ3 LYS 124 2HZ LYS 124 -5.166 -1.380 -4.301 815 H ASN 125 H ASN 125 -2.873 2.539 -9.041 816 HA ASN 125 HA ASN 125 -5.640 3.239 -9.479 817 HB3 ASN 125 2HB ASN 125 -4.333 4.513 -7.093 818 HD21 ASN 125 1HD2 ASN 125 -7.393 3.129 -8.252 819 HD22 ASN 125 2HD2 ASN 125 -8.360 4.504 -7.851 820 H ILE 126 H ILE 126 -5.924 5.509 -9.988 821 HA ILE 126 HA ILE 126 -3.492 6.635 -11.170 822 HB ILE 126 HB ILE 126 -5.823 6.267 -12.377 823 HG13 ILE 126 2HG1 ILE 126 -3.565 8.033 -12.743 824 HG21 ILE 126 1HG2 ILE 126 -7.386 7.919 -12.184 825 HG22 ILE 126 2HG2 ILE 126 -6.759 7.915 -10.538 826 HG23 ILE 126 3HG2 ILE 126 -6.207 9.133 -11.688 827 HD11 ILE 126 3HD1 ILE 126 -4.744 7.528 -15.219 828 HD12 ILE 126 1HD1 ILE 126 -3.394 6.673 -14.476 829 HD13 ILE 126 2HD1 ILE 126 -5.042 6.088 -14.246 830 H PHE 127 H PHE 127 -4.076 9.262 -11.390 831 HA PHE 127 HA PHE 127 -3.469 10.248 -8.795 832 HB3 PHE 127 2HB PHE 127 -2.546 11.344 -10.743 833 HD1 PHE 127 2HD PHE 127 -3.373 10.283 -12.835 834 HD2 PHE 127 1HD PHE 127 -5.474 13.442 -10.904 835 HE1 PHE 127 2HE PHE 127 -4.639 10.702 -14.902 836 HE2 PHE 127 1HE PHE 127 -6.743 13.865 -12.969 837 HZ PHE 127 HZ PHE 127 -6.325 12.495 -14.972 838 H GLU 128 H GLU 128 -5.584 9.131 -8.012 839 HA GLU 128 HA GLU 128 -7.949 10.785 -8.364 840 HB3 GLU 128 2HB GLU 128 -7.772 8.469 -6.467 841 HG3 GLU 128 2HG GLU 128 -9.997 9.030 -8.373 842 H LYS 129 H LYS 129 -7.153 12.702 -7.362 843 HA LYS 129 HA LYS 129 -7.129 14.182 -5.629 844 HB3 LYS 129 2HB LYS 129 -8.227 13.679 -3.609 845 HG3 LYS 129 2HG LYS 129 -9.676 11.526 -4.928 846 HD3 LYS 129 2HD LYS 129 -10.586 14.343 -4.431 847 HE3 LYS 129 2HE LYS 129 -11.896 11.636 -4.489 848 HZ1 LYS 129 3HZ LYS 129 -13.643 12.374 -3.332 849 HZ2 LYS 129 1HZ LYS 129 -13.581 13.925 -4.005 850 HZ3 LYS 129 2HZ LYS 129 -12.579 13.529 -2.702 851 HA PRO 130 HA PRO 130 -2.917 12.649 -4.596 852 HB3 PRO 130 2HB PRO 130 -2.060 13.772 -6.408 853 HG3 PRO 130 2HG PRO 130 -3.170 15.601 -7.321 854 HD3 PRO 130 2HD PRO 130 -4.907 14.086 -7.233 855 H PHE 131 H PHE 131 -1.326 13.562 -3.045 856 HA PHE 131 HA PHE 131 -1.917 15.742 -1.370 857 HB3 PHE 131 2HB PHE 131 -2.276 13.404 0.351 858 HD1 PHE 131 2HD PHE 131 -1.845 15.142 2.025 859 HD2 PHE 131 1HD PHE 131 -5.123 15.406 -0.676 860 HE1 PHE 131 2HE PHE 131 -2.876 16.860 3.451 861 HE2 PHE 131 1HE PHE 131 -6.160 17.126 0.745 862 HZ PHE 131 HZ PHE 131 -5.038 17.855 2.812 863 H MET 132 H MET 132 -0.400 15.974 0.377 864 HA MET 132 HA MET 132 2.177 15.020 -0.255 865 HB3 MET 132 2HB MET 132 1.918 17.141 0.856 866 HG3 MET 132 2HG MET 132 1.356 16.214 3.531 867 HE1 MET 132 3HE MET 132 0.096 18.025 0.362 868 HE2 MET 132 1HE MET 132 -1.439 17.899 1.224 869 HE3 MET 132 2HE MET 132 -0.683 19.476 0.993 870 H ALA 133 H ALA 133 3.575 13.663 0.975 871 HA ALA 133 HA ALA 133 2.487 12.003 3.066 872 HB1 ALA 133 1HB ALA 133 2.436 9.951 1.989 873 HB2 ALA 133 2HB ALA 133 1.746 11.038 0.783 874 HB3 ALA 133 3HB ALA 133 3.425 10.518 0.643 875 H ARG 134 H ARG 134 4.065 10.916 4.238 876 HA ARG 134 HA ARG 134 6.846 11.409 3.399 877 HB3 ARG 134 2HB ARG 134 6.285 11.245 6.298 878 HG3 ARG 134 2HG ARG 134 7.706 13.576 5.345 879 HD3 ARG 134 2HD ARG 134 7.768 12.605 7.637 880 HE ARG 134 HE ARG 134 8.644 10.253 6.322 881 HH11 ARG 134 1HH1 ARG 134 9.151 12.155 9.195 882 HH12 ARG 134 2HH1 ARG 134 9.672 10.809 10.152 883 HH21 ARG 134 1HH2 ARG 134 9.329 8.472 7.572 884 HH22 ARG 134 2HH2 ARG 134 9.774 8.714 9.229 885 H TYR 135 H TYR 135 4.542 9.275 4.909 886 HA TYR 135 HA TYR 135 6.208 6.998 4.375 887 HB3 TYR 135 2HB TYR 135 5.792 7.968 7.185 888 HD1 TYR 135 2HD TYR 135 7.720 5.006 6.229 889 HD2 TYR 135 1HD TYR 135 4.157 6.409 8.084 890 HE1 TYR 135 2HE TYR 135 7.342 2.771 7.183 891 HE2 TYR 135 1HE TYR 135 3.771 4.178 9.044 892 HH TYR 135 HH TYR 135 6.128 1.574 8.647 893 H VAL 136 H VAL 136 4.935 5.358 3.815 894 HA VAL 136 HA VAL 136 2.137 5.386 4.745 895 HB VAL 136 HB VAL 136 1.411 4.493 2.686 896 HG11 VAL 136 1HG1 VAL 136 3.551 6.504 2.001 897 HG12 VAL 136 2HG1 VAL 136 2.104 6.141 1.058 898 HG13 VAL 136 3HG1 VAL 136 1.958 6.899 2.645 899 HG21 VAL 136 3HG2 VAL 136 2.723 2.879 1.841 900 HG22 VAL 136 1HG2 VAL 136 3.490 4.193 0.947 901 HG23 VAL 136 2HG2 VAL 136 4.200 3.622 2.458 902 H ARG 137 H ARG 137 1.129 3.377 5.168 903 HA ARG 137 HA ARG 137 2.986 1.120 5.538 904 HB3 ARG 137 2HB ARG 137 0.836 2.097 7.421 905 HG3 ARG 137 2HG ARG 137 2.123 0.175 8.811 906 HD3 ARG 137 2HD ARG 137 0.004 -1.172 7.567 907 HE ARG 137 HE ARG 137 0.553 -0.356 10.108 908 HH11 ARG 137 1HH1 ARG 137 -2.265 -0.291 8.065 909 HH12 ARG 137 2HH1 ARG 137 -3.384 -0.418 9.382 910 HH21 ARG 137 1HH2 ARG 137 -0.910 -0.524 11.851 911 HH22 ARG 137 2HH2 ARG 137 -2.613 -0.549 11.535 912 H VAL 138 H VAL 138 2.233 -0.896 5.034 913 HA VAL 138 HA VAL 138 -0.554 -1.110 4.116 914 HB VAL 138 HB VAL 138 1.778 -2.388 2.687 915 HG11 VAL 138 1HG1 VAL 138 -0.985 -2.893 2.638 916 HG12 VAL 138 2HG1 VAL 138 -0.609 -2.048 1.136 917 HG13 VAL 138 3HG1 VAL 138 0.250 -3.532 1.554 918 HG21 VAL 138 3HG2 VAL 138 0.732 -0.564 0.941 919 HG22 VAL 138 1HG2 VAL 138 0.651 0.304 2.475 920 HG23 VAL 138 2HG2 VAL 138 2.193 -0.328 1.901 921 H LEU 139 H LEU 139 -1.606 -2.927 4.707 922 HA LEU 139 HA LEU 139 -0.038 -5.119 5.883 923 HB3 LEU 139 2HB LEU 139 -2.665 -4.214 7.022 924 HG LEU 139 HG LEU 139 -0.839 -6.318 7.737 925 HD11 LEU 139 1HD1 LEU 139 -0.479 -5.887 10.033 926 HD12 LEU 139 2HD1 LEU 139 -1.472 -4.430 9.990 927 HD13 LEU 139 3HD1 LEU 139 0.087 -4.458 9.166 928 HD21 LEU 139 3HD2 LEU 139 -2.715 -6.842 9.310 929 HD22 LEU 139 1HD2 LEU 139 -3.192 -6.674 7.621 930 HD23 LEU 139 2HD2 LEU 139 -3.507 -5.365 8.761 931 HA PRO 140 HA PRO 140 -2.702 -7.035 2.751 932 HB3 PRO 140 2HB PRO 140 -0.797 -7.714 1.661 933 HG3 PRO 140 2HG PRO 140 1.200 -8.019 2.814 934 HD3 PRO 140 2HD PRO 140 0.623 -5.919 3.569 935 H VAL 141 H VAL 141 -4.272 -8.562 2.971 936 HA VAL 141 HA VAL 141 -4.192 -10.241 5.393 937 HB VAL 141 HB VAL 141 -6.630 -8.946 4.165 938 HG11 VAL 141 1HG1 VAL 141 -7.330 -11.011 5.049 939 HG12 VAL 141 2HG1 VAL 141 -6.286 -10.853 6.463 940 HG13 VAL 141 3HG1 VAL 141 -7.707 -9.820 6.294 941 HG21 VAL 141 3HG2 VAL 141 -5.332 -7.298 5.328 942 HG22 VAL 141 1HG2 VAL 141 -6.718 -7.721 6.335 943 HG23 VAL 141 2HG2 VAL 141 -5.122 -8.370 6.712 944 H SER 142 H SER 142 -5.445 -9.913 2.096 945 HA SER 142 HA SER 142 -5.664 -12.851 1.973 946 HB3 SER 142 2HB SER 142 -7.543 -12.690 0.585 947 HG SER 142 HG SER 142 -8.948 -11.350 1.692 948 H TRP 143 H TRP 143 -4.110 -13.725 0.793 949 HA TRP 143 HA TRP 143 -3.186 -12.287 -1.606 950 HB3 TRP 143 2HB TRP 143 -1.497 -12.191 0.206 951 HD1 TRP 143 HD TRP 143 -0.056 -15.478 -0.807 952 HE1 TRP 143 1HE TRP 143 0.037 -17.063 1.219 953 HE3 TRP 143 3HE TRP 143 -2.951 -12.803 2.447 954 HZ2 TRP 143 2HZ TRP 143 -0.984 -17.165 3.848 955 HZ3 TRP 143 3HZ TRP 143 -3.347 -13.714 4.698 956 HH2 TRP 143 HH TRP 143 -2.382 -15.851 5.383 957 H HIS 144 H HIS 144 -1.668 -14.046 -2.852 958 HA HIS 144 HA HIS 144 -3.152 -16.574 -2.990 959 HB3 HIS 144 2HB HIS 144 -2.408 -15.846 -5.640 960 HD1 HIS 144 1HD HIS 144 -5.430 -15.842 -3.328 961 HD2 HIS 144 2HD HIS 144 -4.295 -17.098 -7.123 962 HE1 HIS 144 1HE HIS 144 -7.404 -17.108 -4.236 963 H ASN 145 H ASN 145 -1.815 -18.247 -2.904 964 HA ASN 145 HA ASN 145 0.003 -19.586 -3.269 965 HB3 ASN 145 2HB ASN 145 1.486 -17.458 -4.752 966 HD21 ASN 145 1HD2 ASN 145 2.838 -19.352 -3.653 967 HD22 ASN 145 2HD2 ASN 145 3.216 -20.640 -4.741 968 H ARG 146 H ARG 146 1.188 -16.228 -3.004 969 HA ARG 146 HA ARG 146 2.119 -16.512 -0.362 970 HB3 ARG 146 2HB ARG 146 4.567 -16.198 -1.881 971 HG3 ARG 146 2HG ARG 146 4.790 -18.510 -0.402 972 HD3 ARG 146 2HD ARG 146 5.775 -16.943 1.337 973 HE ARG 146 HE ARG 146 7.081 -16.131 -1.065 974 HH11 ARG 146 1HH1 ARG 146 6.384 -18.875 0.959 975 HH12 ARG 146 2HH1 ARG 146 7.776 -19.771 0.449 976 HH21 ARG 146 1HH2 ARG 146 8.917 -17.299 -1.745 977 HH22 ARG 146 2HH2 ARG 146 9.217 -18.873 -1.089 978 H ILE 147 H ILE 147 2.871 -14.574 0.486 979 HA ILE 147 HA ILE 147 2.077 -12.222 -0.845 980 HB ILE 147 HB ILE 147 3.847 -12.564 1.577 981 HG13 ILE 147 2HG1 ILE 147 0.902 -12.335 1.128 982 HG21 ILE 147 1HG2 ILE 147 2.650 -10.082 1.735 983 HG22 ILE 147 2HG2 ILE 147 4.333 -10.404 1.323 984 HG23 ILE 147 3HG2 ILE 147 3.134 -10.205 0.044 985 HD11 ILE 147 3HD1 ILE 147 1.483 -13.600 3.546 986 HD12 ILE 147 1HD1 ILE 147 0.958 -14.346 2.037 987 HD13 ILE 147 2HD1 ILE 147 2.679 -14.191 2.393 988 H THR 148 H THR 148 3.162 -12.198 -2.849 989 HA THR 148 HA THR 148 5.908 -11.181 -2.665 990 HB THR 148 HB THR 148 5.338 -12.871 -5.028 991 HG1 THR 148 1HG THR 148 4.527 -14.125 -3.239 992 HG21 THR 148 3HG2 THR 148 7.770 -13.500 -3.723 993 HG22 THR 148 1HG2 THR 148 7.583 -11.748 -3.668 994 HG23 THR 148 2HG2 THR 148 7.539 -12.591 -5.216 995 H LEU 149 H LEU 149 5.479 -9.110 -3.217 996 HA LEU 149 HA LEU 149 4.875 -8.527 -5.946 997 HB3 LEU 149 2HB LEU 149 2.613 -8.926 -4.958 998 HG LEU 149 HG LEU 149 1.562 -7.526 -3.455 999 HD11 LEU 149 1HD1 LEU 149 4.392 -7.560 -2.420 1000 HD12 LEU 149 2HD1 LEU 149 3.284 -8.930 -2.359 1001 HD13 LEU 149 3HD1 LEU 149 2.911 -7.454 -1.467 1002 HD21 LEU 149 3HD2 LEU 149 1.958 -5.316 -3.145 1003 HD22 LEU 149 1HD2 LEU 149 2.761 -5.492 -4.705 1004 HD23 LEU 149 2HD2 LEU 149 3.711 -5.504 -3.219 1005 H ARG 150 H ARG 150 4.493 -5.981 -6.100 1006 HA ARG 150 HA ARG 150 6.251 -4.646 -4.162 1007 HB3 ARG 150 2HB ARG 150 7.665 -5.139 -6.046 1008 HG3 ARG 150 2HG ARG 150 5.447 -5.017 -7.627 1009 HD3 ARG 150 2HD ARG 150 6.425 -2.374 -7.499 1010 HE ARG 150 HE ARG 150 7.717 -3.645 -9.619 1011 HH11 ARG 150 1HH1 ARG 150 5.657 -0.895 -9.062 1012 HH12 ARG 150 2HH1 ARG 150 6.298 0.018 -10.387 1013 HH21 ARG 150 1HH2 ARG 150 8.569 -2.453 -11.367 1014 HH22 ARG 150 2HH2 ARG 150 7.955 -0.868 -11.698 1015 H LEU 151 H LEU 151 5.245 -2.958 -3.312 1016 HA LEU 151 HA LEU 151 3.041 -1.718 -4.797 1017 HB3 LEU 151 2HB LEU 151 3.788 -1.660 -1.879 1018 HG LEU 151 HG LEU 151 2.170 0.254 -3.217 1019 HD11 LEU 151 1HD1 LEU 151 0.028 -0.034 -2.337 1020 HD12 LEU 151 2HD1 LEU 151 0.554 -1.294 -1.222 1021 HD13 LEU 151 3HD1 LEU 151 0.459 -1.631 -2.950 1022 HD21 LEU 151 3HD2 LEU 151 2.796 -0.380 -0.344 1023 HD22 LEU 151 1HD2 LEU 151 1.837 1.020 -0.827 1024 HD23 LEU 151 2HD2 LEU 151 3.507 0.867 -1.372 1025 H GLU 152 H GLU 152 4.085 -0.289 -6.142 1026 HA GLU 152 HA GLU 152 5.906 1.662 -4.937 1027 HB3 GLU 152 2HB GLU 152 5.288 0.941 -7.799 1028 HG3 GLU 152 2HG GLU 152 6.874 3.246 -6.736 1029 H LEU 153 H LEU 153 5.524 3.855 -4.964 1030 HA LEU 153 HA LEU 153 2.781 4.659 -5.680 1031 HB3 LEU 153 2HB LEU 153 3.269 4.717 -3.269 1032 HG LEU 153 HG LEU 153 5.751 5.618 -3.737 1033 HD11 LEU 153 1HD1 LEU 153 5.919 7.805 -4.049 1034 HD12 LEU 153 2HD1 LEU 153 4.943 8.124 -2.615 1035 HD13 LEU 153 3HD1 LEU 153 4.162 7.894 -4.180 1036 HD21 LEU 153 3HD2 LEU 153 4.350 6.562 -1.269 1037 HD22 LEU 153 1HD2 LEU 153 5.950 5.842 -1.445 1038 HD23 LEU 153 2HD2 LEU 153 4.510 4.836 -1.596 1039 H LEU 154 H LEU 154 2.456 6.586 -6.767 1040 HA LEU 154 HA LEU 154 4.882 7.804 -7.912 1041 HB3 LEU 154 2HB LEU 154 3.490 8.409 -9.844 1042 HG LEU 154 HG LEU 154 3.339 6.360 -10.951 1043 HD11 LEU 154 1HD1 LEU 154 5.612 6.867 -10.190 1044 HD12 LEU 154 2HD1 LEU 154 5.329 5.131 -10.303 1045 HD13 LEU 154 3HD1 LEU 154 5.328 5.922 -8.727 1046 HD21 LEU 154 3HD2 LEU 154 2.313 4.571 -10.122 1047 HD22 LEU 154 1HD2 LEU 154 2.028 5.497 -8.648 1048 HD23 LEU 154 2HD2 LEU 154 3.452 4.465 -8.778 1049 H GLY 155 H GLY 155 4.974 10.054 -8.152 1050 HA2 GLY 155 2HA GLY 155 2.878 11.561 -6.720 1051 HA3 GLY 155 3HA GLY 155 4.583 11.844 -6.398 1052 H CYS 156 H CYS 156 3.592 14.068 -6.990 1053 HA CYS 156 HA CYS 156 3.728 14.463 -9.902 1054 HB3 CYS 156 2HB CYS 156 2.848 16.850 -8.780 1055 H LEU 157 H LEU 157 5.332 15.067 -6.944 1056 HA LEU 157 HA LEU 157 7.255 16.153 -6.406 1057 HB3 LEU 157 2HB LEU 157 8.093 16.755 -9.139 1058 HG LEU 157 HG LEU 157 10.061 15.437 -8.625 1059 HD11 LEU 157 1HD1 LEU 157 10.212 17.667 -7.882 1060 HD12 LEU 157 2HD1 LEU 157 10.790 16.677 -6.542 1061 HD13 LEU 157 3HD1 LEU 157 9.165 17.360 -6.496 1062 HD21 LEU 157 3HD2 LEU 157 8.421 13.973 -6.998 1063 HD22 LEU 157 1HD2 LEU 157 9.372 14.900 -5.837 1064 HD23 LEU 157 2HD2 LEU 157 10.183 13.878 -7.025 1065 H GLU 158 H GLU 158 4.783 17.659 -6.914 1066 HA GLU 158 HA GLU 158 6.002 20.288 -7.446 1067 HB3 GLU 158 2HB GLU 158 3.096 19.786 -7.968 1068 HG3 GLU 158 2HG GLU 158 5.030 21.876 -8.562 Start of MODEL 12 1 H1 MET -5 H MET -5 11.873 30.805 -14.290 2 HA MET -5 HA MET -5 11.172 31.467 -16.915 3 HB3 MET -5 2HB MET -5 13.397 31.991 -17.861 4 HG3 MET -5 2HG MET -5 11.820 33.771 -16.304 5 HE1 MET -5 3HE MET -5 15.679 35.704 -16.965 6 HE2 MET -5 1HE MET -5 14.181 35.575 -17.889 7 HE3 MET -5 2HE MET -5 14.335 36.795 -16.625 8 H LYS -4 H LYS -4 10.822 29.180 -15.663 9 HA LYS -4 HA LYS -4 12.579 27.350 -17.102 10 HB3 LYS -4 2HB LYS -4 12.708 25.875 -15.056 11 HG3 LYS -4 2HG LYS -4 14.032 28.572 -14.853 12 HD3 LYS -4 2HD LYS -4 15.770 27.098 -13.621 13 HE3 LYS -4 2HE LYS -4 13.672 28.728 -12.749 14 HZ1 LYS -4 3HZ LYS -4 13.991 26.536 -10.797 15 HZ2 LYS -4 1HZ LYS -4 12.733 26.516 -11.930 16 HZ3 LYS -4 2HZ LYS -4 12.846 27.782 -10.815 17 H SER -3 H SER -3 11.689 25.168 -17.257 18 HA SER -3 HA SER -3 8.834 24.945 -16.652 19 HB3 SER -3 2HB SER -3 9.596 23.961 -19.334 20 HG SER -3 HG SER -3 7.514 24.091 -19.474 21 H GLY -2 H GLY -2 8.019 22.735 -16.841 22 HA2 GLY -2 2HA GLY -2 9.392 20.449 -17.420 23 HA3 GLY -2 3HA GLY -2 9.932 20.858 -15.798 24 H HIS -1 H HIS -1 6.780 20.963 -17.462 25 HA HIS -1 HA HIS -1 5.408 20.064 -15.114 26 HB3 HIS -1 2HB HIS -1 4.402 21.606 -16.800 27 HD1 HIS -1 1HD HIS -1 3.278 18.345 -18.311 28 HD2 HIS -1 2HD HIS -1 5.210 21.850 -19.428 29 HE1 HIS -1 1HE HIS -1 3.425 18.262 -20.820 30 H GLY 0 H GLY 0 3.870 18.175 -15.230 31 HA2 GLY 0 2HA GLY 0 3.548 16.034 -16.571 32 HA3 GLY 0 3HA GLY 0 5.293 15.885 -16.429 33 H CYS 1 H CYS 1 2.345 15.063 -15.073 34 HA CYS 1 HA CYS 1 3.409 14.668 -12.385 35 HB3 CYS 1 2HB CYS 1 1.012 13.736 -12.035 36 H SER 2 H SER 2 2.362 12.441 -11.452 37 HA SER 2 HA SER 2 2.585 10.180 -11.339 38 HB3 SER 2 2HB SER 2 1.923 8.914 -13.171 39 HG SER 2 HG SER 2 0.797 10.753 -14.587 40 H GLU 3 H GLU 3 4.742 10.698 -10.504 41 HA GLU 3 HA GLU 3 6.825 9.590 -12.260 42 HB3 GLU 3 2HB GLU 3 8.420 11.203 -11.566 43 HG3 GLU 3 2HG GLU 3 7.417 13.399 -12.066 44 HA PRO 4 HA PRO 4 7.791 6.881 -8.944 45 HB3 PRO 4 2HB PRO 4 9.227 5.822 -10.392 46 HG3 PRO 4 2HG PRO 4 10.468 7.027 -11.946 47 HD3 PRO 4 2HD PRO 4 8.374 7.900 -12.350 48 H LEU 5 H LEU 5 10.002 6.617 -7.427 49 HA LEU 5 HA LEU 5 10.325 9.236 -6.116 50 HB3 LEU 5 2HB LEU 5 8.947 8.087 -4.648 51 HG LEU 5 HG LEU 5 9.451 5.765 -3.790 52 HD11 LEU 5 1HD1 LEU 5 7.877 6.634 -5.861 53 HD12 LEU 5 2HD1 LEU 5 7.821 5.032 -5.126 54 HD13 LEU 5 3HD1 LEU 5 8.773 5.300 -6.586 55 HD21 LEU 5 3HD2 LEU 5 10.829 4.310 -4.995 56 HD22 LEU 5 1HD2 LEU 5 11.771 5.795 -4.867 57 HD23 LEU 5 2HD2 LEU 5 10.937 5.407 -6.373 58 H GLY 6 H GLY 6 11.871 6.833 -7.755 59 HA2 GLY 6 2HA GLY 6 14.457 7.835 -7.146 60 HA3 GLY 6 3HA GLY 6 14.203 6.290 -6.349 61 H LEU 7 H LEU 7 12.979 7.311 -9.505 62 HA LEU 7 HA LEU 7 14.765 5.349 -10.773 63 HB3 LEU 7 2HB LEU 7 13.058 4.364 -11.992 64 HG LEU 7 HG LEU 7 11.761 5.014 -9.349 65 HD11 LEU 7 1HD1 LEU 7 10.840 2.615 -10.677 66 HD12 LEU 7 2HD1 LEU 7 10.489 4.062 -11.621 67 HD13 LEU 7 3HD1 LEU 7 9.916 3.934 -9.958 68 HD21 LEU 7 3HD2 LEU 7 12.366 2.405 -9.260 69 HD22 LEU 7 1HD2 LEU 7 13.467 3.671 -8.716 70 HD23 LEU 7 2HD2 LEU 7 13.659 2.968 -10.322 71 H LYS 8 H LYS 8 14.163 8.462 -10.542 72 HA LYS 8 HA LYS 8 14.502 8.989 -13.422 73 HB3 LYS 8 2HB LYS 8 13.302 10.750 -11.278 74 HG3 LYS 8 2HG LYS 8 14.357 11.428 -13.906 75 HD3 LYS 8 2HD LYS 8 11.484 11.984 -13.226 76 HE3 LYS 8 2HE LYS 8 12.965 14.064 -13.769 77 HZ1 LYS 8 3HZ LYS 8 12.399 13.750 -16.532 78 HZ2 LYS 8 1HZ LYS 8 13.482 12.558 -16.013 79 HZ3 LYS 8 2HZ LYS 8 13.848 14.192 -15.782 80 H ASN 9 H ASN 9 15.109 10.893 -10.477 81 HA ASN 9 HA ASN 9 17.916 11.158 -11.333 82 HB3 ASN 9 2HB ASN 9 17.545 13.470 -9.993 83 HD21 ASN 9 1HD2 ASN 9 15.518 13.790 -12.662 84 HD22 ASN 9 2HD2 ASN 9 16.712 14.238 -13.830 85 H ASN 10 H ASN 10 15.635 11.163 -8.638 86 HA ASN 10 HA ASN 10 17.438 11.414 -6.529 87 HB3 ASN 10 2HB ASN 10 15.635 9.982 -5.291 88 HD21 ASN 10 1HD2 ASN 10 15.417 12.692 -7.551 89 HD22 ASN 10 2HD2 ASN 10 14.771 13.817 -6.410 90 H THR 11 H THR 11 16.374 8.540 -8.291 91 HA THR 11 HA THR 11 17.100 6.376 -8.283 92 HB THR 11 HB THR 11 19.424 6.043 -8.535 93 HG1 THR 11 1HG THR 11 20.885 7.104 -7.393 94 HG21 THR 11 3HG2 THR 11 19.646 8.821 -9.384 95 HG22 THR 11 1HG2 THR 11 18.133 8.070 -9.891 96 HG23 THR 11 2HG2 THR 11 19.674 7.342 -10.344 97 H ILE 12 H ILE 12 16.016 7.225 -5.815 98 HA ILE 12 HA ILE 12 17.482 6.737 -3.534 99 HB ILE 12 HB ILE 12 14.609 5.929 -3.999 100 HG13 ILE 12 2HG1 ILE 12 14.084 8.139 -3.001 101 HG21 ILE 12 1HG2 ILE 12 14.355 6.078 -1.601 102 HG22 ILE 12 2HG2 ILE 12 15.645 4.941 -1.989 103 HG23 ILE 12 3HG2 ILE 12 16.040 6.563 -1.423 104 HD11 ILE 12 3HD1 ILE 12 15.740 9.875 -2.867 105 HD12 ILE 12 1HD1 ILE 12 16.205 8.535 -1.820 106 HD13 ILE 12 2HD1 ILE 12 17.003 8.755 -3.377 107 HA PRO 13 HA PRO 13 18.630 2.477 -3.855 108 HB3 PRO 13 2HB PRO 13 20.389 3.017 -2.478 109 HG3 PRO 13 2HG PRO 13 20.173 4.659 -0.845 110 HD3 PRO 13 2HD PRO 13 19.345 5.801 -2.668 111 H ASP 14 H ASP 14 18.413 0.559 -2.019 112 HA ASP 14 HA ASP 14 15.548 0.146 -1.852 113 HB3 ASP 14 2HB ASP 14 16.782 -1.721 -2.673 114 H SER 15 H SER 15 16.114 2.158 -0.181 115 HA SER 15 HA SER 15 16.078 0.925 2.496 116 HB3 SER 15 2HB SER 15 17.083 2.901 3.401 117 HG SER 15 HG SER 15 18.855 2.059 2.648 118 H GLN 16 H GLN 16 14.463 2.961 0.230 119 HA GLN 16 HA GLN 16 12.761 4.406 1.907 120 HB3 GLN 16 2HB GLN 16 12.917 4.962 -0.426 121 HG3 GLN 16 2HG GLN 16 11.308 2.687 -1.376 122 HE21 GLN 16 1HE2 GLN 16 13.450 1.974 -3.190 123 HE22 GLN 16 2HE2 GLN 16 13.575 3.265 -4.332 124 H MET 17 H MET 17 12.322 1.212 0.418 125 HA MET 17 HA MET 17 9.833 0.825 1.876 126 HB3 MET 17 2HB MET 17 9.975 -1.464 0.672 127 HG3 MET 17 2HG MET 17 9.099 1.072 -0.240 128 HE1 MET 17 3HE MET 17 9.582 2.619 -2.683 129 HE2 MET 17 1HE MET 17 8.860 1.599 -3.929 130 HE3 MET 17 2HE MET 17 8.104 1.719 -2.339 131 H SER 18 H SER 18 9.504 -0.723 3.456 132 HA SER 18 HA SER 18 11.565 -2.527 4.288 133 HB3 SER 18 2HB SER 18 12.611 -0.730 5.374 134 HG SER 18 HG SER 18 11.552 0.950 6.269 135 H ALA 19 H ALA 19 10.351 -4.258 4.652 136 HA ALA 19 HA ALA 19 7.785 -3.923 6.055 137 HB1 ALA 19 1HB ALA 19 6.891 -5.579 4.804 138 HB2 ALA 19 2HB ALA 19 8.162 -5.101 3.679 139 HB3 ALA 19 3HB ALA 19 8.398 -6.494 4.735 140 H SER 20 H SER 20 7.165 -5.961 7.342 141 HA SER 20 HA SER 20 8.789 -6.206 9.553 142 HB3 SER 20 2HB SER 20 6.464 -7.661 8.480 143 HG SER 20 HG SER 20 6.708 -9.420 9.835 144 H SER 21 H SER 21 8.671 -8.275 6.684 145 HA SER 21 HA SER 21 11.379 -8.982 6.807 146 HB3 SER 21 2HB SER 21 9.487 -11.084 7.889 147 HG SER 21 HG SER 21 12.040 -11.782 8.058 148 H SER 22 H SER 22 11.960 -10.638 5.201 149 HA SER 22 HA SER 22 9.922 -10.795 3.080 150 HB3 SER 22 2HB SER 22 12.737 -10.035 3.061 151 HG SER 22 HG SER 22 12.568 -11.203 0.756 152 H TYR 23 H TYR 23 10.109 -12.685 1.626 153 HA TYR 23 HA TYR 23 9.877 -15.084 2.984 154 HB3 TYR 23 2HB TYR 23 9.107 -14.515 0.618 155 HD1 TYR 23 2HD TYR 23 11.036 -12.766 -0.076 156 HD2 TYR 23 1HD TYR 23 11.159 -16.968 -0.730 157 HE1 TYR 23 2HE TYR 23 12.650 -12.428 -1.900 158 HE2 TYR 23 1HE TYR 23 12.776 -16.642 -2.555 159 HH TYR 23 HH TYR 23 13.254 -14.343 -4.201 160 H LYS 24 H LYS 24 11.249 -17.095 2.325 161 HA LYS 24 HA LYS 24 13.164 -18.192 2.983 162 HB3 LYS 24 2HB LYS 24 14.608 -16.339 1.119 163 HG3 LYS 24 2HG LYS 24 15.681 -18.405 2.136 164 HD3 LYS 24 2HD LYS 24 13.447 -19.710 1.517 165 HE3 LYS 24 2HE LYS 24 14.706 -19.343 -1.010 166 HZ1 LYS 24 3HZ LYS 24 14.808 -21.657 -1.723 167 HZ2 LYS 24 1HZ LYS 24 14.562 -22.176 -0.132 168 HZ3 LYS 24 2HZ LYS 24 15.972 -21.334 -0.538 169 H THR 25 H THR 25 12.555 -15.942 4.676 170 HA THR 25 HA THR 25 14.632 -14.223 5.238 171 HB THR 25 HB THR 25 12.405 -14.204 6.367 172 HG1 THR 25 1HG THR 25 13.695 -12.886 7.456 173 HG21 THR 25 3HG2 THR 25 11.690 -15.950 7.549 174 HG22 THR 25 1HG2 THR 25 13.094 -15.841 8.610 175 HG23 THR 25 2HG2 THR 25 13.174 -16.809 7.138 176 H TRP 26 H TRP 26 16.390 -14.269 6.682 177 HA TRP 26 HA TRP 26 17.504 -16.958 7.076 178 HB3 TRP 26 2HB TRP 26 19.336 -14.754 7.582 179 HD1 TRP 26 HD TRP 26 20.919 -16.862 8.094 180 HE1 TRP 26 1HE TRP 26 22.180 -18.471 6.530 181 HE3 TRP 26 3HE TRP 26 18.467 -15.836 3.726 182 HZ2 TRP 26 2HZ TRP 26 22.141 -19.208 3.805 183 HZ3 TRP 26 3HZ TRP 26 19.141 -17.037 1.687 184 HH2 TRP 26 HH TRP 26 20.940 -18.686 1.727 185 H ASN 27 H ASN 27 17.057 -13.851 8.731 186 HA ASN 27 HA ASN 27 16.972 -13.290 10.934 187 HB3 ASN 27 2HB ASN 27 16.330 -16.196 11.452 188 HD21 ASN 27 1HD2 ASN 27 15.118 -12.933 12.150 189 HD22 ASN 27 2HD2 ASN 27 15.023 -13.153 13.862 190 H LEU 28 H LEU 28 19.381 -13.119 10.588 191 HA LEU 28 HA LEU 28 20.715 -14.653 12.682 192 HB3 LEU 28 2HB LEU 28 22.076 -14.257 10.039 193 HG LEU 28 HG LEU 28 22.894 -15.482 12.497 194 HD11 LEU 28 1HD1 LEU 28 23.520 -17.645 11.824 195 HD12 LEU 28 2HD1 LEU 28 23.098 -17.334 10.140 196 HD13 LEU 28 3HD1 LEU 28 21.828 -17.481 11.354 197 HD21 LEU 28 3HD2 LEU 28 24.423 -14.127 11.378 198 HD22 LEU 28 1HD2 LEU 28 24.110 -14.894 9.821 199 HD23 LEU 28 2HD2 LEU 28 25.012 -15.760 11.065 200 H ARG 29 H ARG 29 21.512 -12.278 10.137 201 HA ARG 29 HA ARG 29 21.888 -10.143 11.960 202 HB3 ARG 29 2HB ARG 29 24.496 -10.995 10.771 203 HG3 ARG 29 2HG ARG 29 24.018 -9.772 13.463 204 HD3 ARG 29 2HD ARG 29 26.325 -9.105 11.742 205 HE ARG 29 HE ARG 29 25.787 -8.858 14.430 206 HH11 ARG 29 1HH1 ARG 29 28.322 -10.228 12.475 207 HH12 ARG 29 2HH1 ARG 29 29.561 -9.946 13.652 208 HH21 ARG 29 1HH2 ARG 29 27.410 -8.481 15.988 209 HH22 ARG 29 2HH2 ARG 29 29.042 -8.953 15.650 210 H ALA 30 H ALA 30 20.388 -10.043 9.837 211 HA ALA 30 HA ALA 30 21.693 -9.325 7.411 212 HB1 ALA 30 1HB ALA 30 19.625 -9.774 6.728 213 HB2 ALA 30 2HB ALA 30 18.974 -9.600 8.359 214 HB3 ALA 30 3HB ALA 30 19.166 -8.180 7.330 215 H PHE 31 H PHE 31 21.159 -7.120 6.380 216 HA PHE 31 HA PHE 31 21.972 -5.047 8.296 217 HB3 PHE 31 2HB PHE 31 22.345 -3.895 5.866 218 HD1 PHE 31 1HD PHE 31 24.290 -6.911 6.796 219 HD2 PHE 31 2HD PHE 31 24.036 -2.663 6.894 220 HE1 PHE 31 1HE PHE 31 26.591 -6.797 7.658 221 HE2 PHE 31 2HE PHE 31 26.337 -2.543 7.757 222 HZ PHE 31 HZ PHE 31 27.618 -4.611 8.139 223 H GLY 32 H GLY 32 19.601 -5.839 5.831 224 HA2 GLY 32 2HA GLY 32 17.392 -4.700 6.688 225 HA3 GLY 32 3HA GLY 32 18.270 -3.259 6.199 226 H TRP 33 H TRP 33 19.553 -4.674 3.944 227 HA TRP 33 HA TRP 33 17.798 -3.975 1.910 228 HB3 TRP 33 2HB TRP 33 20.238 -4.283 1.619 229 HD1 TRP 33 HD TRP 33 21.413 -5.809 3.545 230 HE1 TRP 33 1HE TRP 33 22.208 -8.256 3.482 231 HE3 TRP 33 3HE TRP 33 18.810 -7.401 -0.556 232 HZ2 TRP 33 2HZ TRP 33 21.788 -10.558 1.901 233 HZ3 TRP 33 3HZ TRP 33 19.063 -9.740 -1.278 234 HH2 TRP 33 HH TRP 33 20.521 -11.283 -0.073 235 H TYR 34 H TYR 34 16.191 -4.979 0.838 236 HA TYR 34 HA TYR 34 15.823 -7.729 0.564 237 HB3 TYR 34 2HB TYR 34 13.606 -7.383 2.221 238 HD1 TYR 34 2HD TYR 34 14.665 -9.669 0.908 239 HD2 TYR 34 1HD TYR 34 15.703 -8.117 4.731 240 HE1 TYR 34 2HE TYR 34 15.396 -11.910 1.612 241 HE2 TYR 34 1HE TYR 34 16.439 -10.354 5.446 242 HH TYR 34 HH TYR 34 16.772 -12.463 4.839 243 HA PRO 35 HA PRO 35 11.706 -5.507 -0.617 244 HB3 PRO 35 2HB PRO 35 10.926 -4.255 1.144 245 HG3 PRO 35 2HG PRO 35 12.393 -3.165 2.583 246 HD3 PRO 35 2HD PRO 35 13.320 -5.276 2.594 247 H HIS 36 H HIS 36 11.136 -3.282 -1.909 248 HA HIS 36 HA HIS 36 11.546 -2.112 -3.817 249 HB3 HIS 36 2HB HIS 36 14.401 -1.897 -2.863 250 HD1 HIS 36 1HD HIS 36 15.674 -0.069 -4.024 251 HD2 HIS 36 2HD HIS 36 11.633 -0.069 -4.992 252 HE1 HIS 36 1HE HIS 36 15.430 1.596 -5.893 253 H LEU 37 H LEU 37 11.301 -4.435 -4.680 254 HA LEU 37 HA LEU 37 13.752 -5.207 -6.121 255 HB3 LEU 37 2HB LEU 37 12.311 -7.385 -6.436 256 HG LEU 37 HG LEU 37 14.200 -7.923 -5.280 257 HD11 LEU 37 1HD1 LEU 37 13.495 -5.734 -3.334 258 HD12 LEU 37 2HD1 LEU 37 14.795 -5.736 -4.526 259 HD13 LEU 37 3HD1 LEU 37 14.866 -6.828 -3.143 260 HD21 LEU 37 3HD2 LEU 37 12.016 -7.995 -3.206 261 HD22 LEU 37 1HD2 LEU 37 13.583 -8.782 -3.015 262 HD23 LEU 37 2HD2 LEU 37 12.495 -9.284 -4.310 263 H GLY 38 H GLY 38 10.333 -4.484 -6.403 264 HA2 GLY 38 2HA GLY 38 10.338 -5.007 -9.268 265 HA3 GLY 38 3HA GLY 38 8.960 -4.501 -8.303 266 H ARG 39 H ARG 39 12.094 -2.906 -8.311 267 HA ARG 39 HA ARG 39 10.933 -0.361 -8.772 268 HB3 ARG 39 2HB ARG 39 13.039 -0.734 -7.505 269 HG3 ARG 39 2HG ARG 39 14.219 -1.229 -10.230 270 HD3 ARG 39 2HD ARG 39 15.487 0.322 -8.607 271 HE ARG 39 HE ARG 39 15.251 -1.871 -6.887 272 HH11 ARG 39 1HH1 ARG 39 17.683 0.309 -8.091 273 HH12 ARG 39 2HH1 ARG 39 18.673 0.195 -6.674 274 HH21 ARG 39 1HH2 ARG 39 16.545 -2.030 -5.016 275 HH22 ARG 39 2HH2 ARG 39 18.025 -1.137 -4.926 276 H LEU 40 H LEU 40 12.528 0.949 -10.546 277 HA LEU 40 HA LEU 40 11.327 0.316 -13.025 278 HB3 LEU 40 2HB LEU 40 13.484 2.213 -12.172 279 HG LEU 40 HG LEU 40 12.848 1.497 -14.960 280 HD11 LEU 40 1HD1 LEU 40 13.466 4.123 -15.290 281 HD12 LEU 40 2HD1 LEU 40 12.377 4.189 -13.904 282 HD13 LEU 40 3HD1 LEU 40 11.842 3.447 -15.411 283 HD21 LEU 40 3HD2 LEU 40 15.119 2.517 -13.349 284 HD22 LEU 40 1HD2 LEU 40 15.086 2.924 -15.064 285 HD23 LEU 40 2HD2 LEU 40 15.070 1.234 -14.559 286 H ASP 41 H ASP 41 14.658 -0.040 -11.840 287 HA ASP 41 HA ASP 41 15.279 -1.677 -14.197 288 HB3 ASP 41 2HB ASP 41 17.393 -0.937 -12.237 289 H ASN 42 H ASN 42 13.630 -2.904 -12.389 290 HA ASN 42 HA ASN 42 14.735 -4.325 -10.301 291 HB3 ASN 42 2HB ASN 42 12.386 -4.455 -10.616 292 HD21 ASN 42 1HD2 ASN 42 11.759 -3.216 -12.427 293 HD22 ASN 42 2HD2 ASN 42 11.313 -3.977 -13.912 294 H GLN 43 H GLN 43 16.234 -5.857 -10.132 295 HA GLN 43 HA GLN 43 17.065 -7.264 -12.583 296 HB3 GLN 43 2HB GLN 43 18.913 -5.996 -11.905 297 HG3 GLN 43 2HG GLN 43 19.694 -6.471 -9.380 298 HE21 GLN 43 1HE2 GLN 43 17.643 -4.614 -8.134 299 HE22 GLN 43 2HE2 GLN 43 18.038 -3.064 -8.786 300 H GLY 44 H GLY 44 18.471 -9.328 -11.729 301 HA2 GLY 44 2HA GLY 44 18.442 -11.364 -10.628 302 HA3 GLY 44 3HA GLY 44 17.230 -10.716 -9.533 303 H LYS 45 H LYS 45 15.071 -11.045 -9.946 304 HA LYS 45 HA LYS 45 13.972 -11.915 -12.369 305 HB3 LYS 45 2HB LYS 45 15.301 -13.942 -11.978 306 HG3 LYS 45 2HG LYS 45 14.543 -15.491 -10.145 307 HD3 LYS 45 2HD LYS 45 15.745 -13.113 -8.830 308 HE3 LYS 45 2HE LYS 45 16.325 -16.057 -8.998 309 HZ1 LYS 45 3HZ LYS 45 17.939 -14.314 -7.291 310 HZ2 LYS 45 1HZ LYS 45 18.343 -14.396 -8.931 311 HZ3 LYS 45 2HZ LYS 45 18.331 -15.803 -7.993 312 H ILE 46 H ILE 46 13.842 -11.876 -8.874 313 HA ILE 46 HA ILE 46 11.140 -12.450 -8.479 314 HB ILE 46 HB ILE 46 12.718 -10.464 -6.848 315 HG13 ILE 46 2HG1 ILE 46 13.171 -13.304 -7.282 316 HG21 ILE 46 1HG2 ILE 46 10.632 -12.411 -5.910 317 HG22 ILE 46 2HG2 ILE 46 11.263 -10.991 -5.077 318 HG23 ILE 46 3HG2 ILE 46 10.222 -10.796 -6.488 319 HD11 ILE 46 3HD1 ILE 46 14.626 -11.163 -5.762 320 HD12 ILE 46 1HD1 ILE 46 15.186 -12.831 -5.868 321 HD13 ILE 46 2HD1 ILE 46 15.038 -11.856 -7.331 322 H ASN 47 H ASN 47 12.718 -9.274 -8.843 323 HA ASN 47 HA ASN 47 11.884 -7.212 -9.338 324 HB3 ASN 47 2HB ASN 47 10.735 -7.088 -11.349 325 HD21 ASN 47 1HD2 ASN 47 13.248 -8.012 -10.976 326 HD22 ASN 47 2HD2 ASN 47 13.596 -9.273 -12.104 327 H ALA 48 H ALA 48 10.826 -8.428 -6.977 328 HA ALA 48 HA ALA 48 8.743 -6.652 -6.378 329 HB1 ALA 48 1HB ALA 48 7.525 -9.330 -6.277 330 HB2 ALA 48 2HB ALA 48 6.806 -7.766 -6.666 331 HB3 ALA 48 3HB ALA 48 7.727 -8.642 -7.888 332 H TRP 49 H TRP 49 7.925 -6.910 -4.194 333 HA TRP 49 HA TRP 49 9.884 -8.256 -2.502 334 HB3 TRP 49 2HB TRP 49 7.808 -6.133 -2.003 335 HD1 TRP 49 HD TRP 49 10.634 -6.819 0.440 336 HE1 TRP 49 1HE TRP 49 9.632 -7.431 2.732 337 HE3 TRP 49 3HE TRP 49 5.723 -7.255 -0.911 338 HZ2 TRP 49 2HZ TRP 49 7.096 -8.021 3.820 339 HZ3 TRP 49 3HZ TRP 49 4.072 -7.846 0.815 340 HH2 TRP 49 HH TRP 49 4.748 -8.222 3.131 341 H THR 50 H THR 50 9.443 -9.950 -1.202 342 HA THR 50 HA THR 50 6.699 -11.018 -1.285 343 HB THR 50 HB THR 50 8.956 -12.790 -0.511 344 HG1 THR 50 1HG THR 50 9.959 -12.144 -2.299 345 HG21 THR 50 3HG2 THR 50 6.376 -13.046 -2.032 346 HG22 THR 50 1HG2 THR 50 6.846 -13.824 -0.522 347 HG23 THR 50 2HG2 THR 50 7.590 -14.325 -2.040 348 H ALA 51 H ALA 51 6.093 -12.356 0.633 349 HA ALA 51 HA ALA 51 6.789 -10.900 3.059 350 HB1 ALA 51 1HB ALA 51 4.871 -12.007 4.056 351 HB2 ALA 51 2HB ALA 51 4.423 -11.269 2.517 352 HB3 ALA 51 3HB ALA 51 4.679 -13.011 2.619 353 H GLN 52 H GLN 52 7.110 -12.128 5.089 354 HA GLN 52 HA GLN 52 8.952 -14.347 4.610 355 HB3 GLN 52 2HB GLN 52 8.493 -12.547 6.985 356 HG3 GLN 52 2HG GLN 52 10.814 -13.845 7.536 357 HE21 GLN 52 1HE2 GLN 52 8.975 -16.269 8.475 358 HE22 GLN 52 2HE2 GLN 52 8.274 -15.624 9.916 359 H SER 53 H SER 53 6.258 -13.512 6.783 360 HA SER 53 HA SER 53 6.007 -16.234 7.698 361 HB3 SER 53 2HB SER 53 4.310 -15.437 9.149 362 HG SER 53 HG SER 53 6.112 -14.513 9.917 363 H ASN 54 H ASN 54 5.214 -14.808 4.875 364 HA ASN 54 HA ASN 54 3.624 -15.118 3.253 365 HB3 ASN 54 2HB ASN 54 4.946 -17.235 3.240 366 HD21 ASN 54 1HD2 ASN 54 5.586 -18.215 5.116 367 HD22 ASN 54 2HD2 ASN 54 4.615 -19.368 5.959 368 H SER 55 H SER 55 2.527 -14.257 5.759 369 HA SER 55 HA SER 55 -0.162 -15.432 5.523 370 HB3 SER 55 2HB SER 55 -0.482 -15.250 7.922 371 HG SER 55 HG SER 55 0.523 -17.067 8.194 372 H ALA 56 H ALA 56 -1.546 -13.790 7.191 373 HA ALA 56 HA ALA 56 -1.509 -11.293 5.699 374 HB1 ALA 56 1HB ALA 56 -3.580 -12.773 6.335 375 HB2 ALA 56 2HB ALA 56 -3.506 -11.851 7.837 376 HB3 ALA 56 3HB ALA 56 -3.704 -11.014 6.298 377 H LYS 57 H LYS 57 -0.448 -12.496 8.707 378 HA LYS 57 HA LYS 57 -0.680 -10.169 10.294 379 HB3 LYS 57 2HB LYS 57 1.010 -11.236 11.739 380 HG3 LYS 57 2HG LYS 57 -1.418 -12.564 10.873 381 HD3 LYS 57 2HD LYS 57 0.258 -14.373 12.495 382 HE3 LYS 57 2HE LYS 57 -1.013 -15.717 10.404 383 HZ1 LYS 57 3HZ LYS 57 -0.949 -15.847 13.099 384 HZ2 LYS 57 1HZ LYS 57 -1.898 -16.832 12.104 385 HZ3 LYS 57 2HZ LYS 57 -2.568 -15.449 12.810 386 H GLU 58 H GLU 58 1.284 -10.877 7.634 387 HA GLU 58 HA GLU 58 3.583 -9.346 8.350 388 HB3 GLU 58 2HB GLU 58 2.928 -9.644 5.483 389 HG3 GLU 58 2HG GLU 58 5.189 -9.025 6.466 390 H TRP 59 H TRP 59 4.263 -7.399 7.091 391 HA TRP 59 HA TRP 59 2.275 -5.727 5.909 392 HB3 TRP 59 2HB TRP 59 1.456 -5.167 8.005 393 HD1 TRP 59 HD TRP 59 5.265 -4.871 8.771 394 HE1 TRP 59 1HE TRP 59 5.651 -5.744 11.161 395 HE3 TRP 59 3HE TRP 59 0.451 -6.107 9.971 396 HZ2 TRP 59 2HZ TRP 59 4.117 -6.814 13.276 397 HZ3 TRP 59 3HZ TRP 59 -0.004 -7.050 12.198 398 HH2 TRP 59 HH TRP 59 1.792 -7.396 13.814 399 H LEU 60 H LEU 60 3.155 -3.909 4.909 400 HA LEU 60 HA LEU 60 6.096 -3.748 5.003 401 HB3 LEU 60 2HB LEU 60 4.158 -3.512 2.733 402 HG LEU 60 HG LEU 60 5.671 -1.557 2.510 403 HD11 LEU 60 1HD1 LEU 60 7.944 -3.412 2.002 404 HD12 LEU 60 2HD1 LEU 60 7.577 -2.944 3.662 405 HD13 LEU 60 3HD1 LEU 60 7.956 -1.709 2.460 406 HD21 LEU 60 3HD2 LEU 60 4.737 -2.755 0.555 407 HD22 LEU 60 1HD2 LEU 60 6.203 -3.735 0.494 408 HD23 LEU 60 2HD2 LEU 60 6.294 -1.994 0.226 409 H GLN 61 H GLN 61 7.007 -1.832 5.440 410 HA GLN 61 HA GLN 61 5.260 0.540 5.488 411 HB3 GLN 61 2HB GLN 61 6.223 1.283 7.489 412 HG3 GLN 61 2HG GLN 61 5.065 -1.194 7.514 413 HE21 GLN 61 1HE2 GLN 61 5.954 -3.135 7.357 414 HE22 GLN 61 2HE2 GLN 61 7.262 -3.725 8.320 415 H VAL 62 H VAL 62 5.946 2.288 4.413 416 HA VAL 62 HA VAL 62 8.730 2.297 3.437 417 HB VAL 62 HB VAL 62 6.289 3.359 2.008 418 HG11 VAL 62 1HG1 VAL 62 7.798 3.811 0.153 419 HG12 VAL 62 2HG1 VAL 62 8.305 4.694 1.594 420 HG13 VAL 62 3HG1 VAL 62 9.165 3.232 1.106 421 HG21 VAL 62 3HG2 VAL 62 7.207 1.534 0.332 422 HG22 VAL 62 1HG2 VAL 62 7.828 0.823 1.821 423 HG23 VAL 62 2HG2 VAL 62 6.098 1.111 1.636 424 H ASP 63 H ASP 63 9.912 3.980 4.047 425 HA ASP 63 HA ASP 63 8.519 6.407 4.975 426 HB3 ASP 63 2HB ASP 63 11.293 5.672 5.857 427 H LEU 64 H LEU 64 8.946 8.257 3.957 428 HA LEU 64 HA LEU 64 11.051 8.256 1.919 429 HB3 LEU 64 2HB LEU 64 9.780 10.541 1.434 430 HG LEU 64 HG LEU 64 9.845 8.700 -0.199 431 HD11 LEU 64 1HD1 LEU 64 7.516 7.635 1.390 432 HD12 LEU 64 2HD1 LEU 64 9.093 6.874 1.184 433 HD13 LEU 64 3HD1 LEU 64 8.012 7.048 -0.198 434 HD21 LEU 64 3HD2 LEU 64 8.232 10.765 -0.237 435 HD22 LEU 64 1HD2 LEU 64 6.986 9.530 -0.049 436 HD23 LEU 64 2HD2 LEU 64 8.076 9.480 -1.435 437 H GLY 65 H GLY 65 9.714 10.490 4.366 438 HA2 GLY 65 2HA GLY 65 10.861 11.842 5.863 439 HA3 GLY 65 3HA GLY 65 12.373 11.224 5.217 440 H THR 66 H THR 66 10.721 12.107 2.568 441 HA THR 66 HA THR 66 11.944 14.784 2.560 442 HB THR 66 HB THR 66 12.813 13.208 0.861 443 HG1 THR 66 1HG THR 66 13.028 14.912 -0.372 444 HG21 THR 66 3HG2 THR 66 10.022 12.682 0.480 445 HG22 THR 66 1HG2 THR 66 11.413 11.841 -0.203 446 HG23 THR 66 2HG2 THR 66 10.729 13.237 -1.037 447 H GLN 67 H GLN 67 9.009 13.333 2.910 448 HA GLN 67 HA GLN 67 6.837 13.976 2.666 449 HB3 GLN 67 2HB GLN 67 7.900 16.794 2.560 450 HG3 GLN 67 2HG GLN 67 5.422 15.588 3.765 451 HE21 GLN 67 1HE2 GLN 67 3.954 17.885 3.728 452 HE22 GLN 67 2HE2 GLN 67 4.574 18.999 4.894 453 H ARG 68 H ARG 68 6.461 13.125 0.612 454 HA ARG 68 HA ARG 68 6.513 15.099 -1.576 455 HB3 ARG 68 2HB ARG 68 6.473 12.886 -3.002 456 HG3 ARG 68 2HG ARG 68 8.961 12.754 -2.955 457 HD3 ARG 68 2HD ARG 68 7.413 15.251 -3.354 458 HE ARG 68 HE ARG 68 10.237 15.346 -2.863 459 HH11 ARG 68 1HH1 ARG 68 7.620 16.718 -4.703 460 HH12 ARG 68 2HH1 ARG 68 8.421 18.233 -4.957 461 HH21 ARG 68 1HH2 ARG 68 11.302 17.336 -3.191 462 HH22 ARG 68 2HH2 ARG 68 10.516 18.583 -4.099 463 H GLN 69 H GLN 69 4.760 15.087 -3.044 464 HA GLN 69 HA GLN 69 2.278 14.110 -1.845 465 HB3 GLN 69 2HB GLN 69 2.951 16.250 -3.827 466 HG3 GLN 69 2HG GLN 69 0.250 14.983 -3.485 467 HE21 GLN 69 1HE2 GLN 69 -1.459 16.064 -4.682 468 HE22 GLN 69 2HE2 GLN 69 -1.500 17.791 -4.715 469 H VAL 70 H VAL 70 1.438 12.269 -2.536 470 HA VAL 70 HA VAL 70 2.285 11.134 -5.075 471 HB VAL 70 HB VAL 70 1.148 9.111 -4.378 472 HG11 VAL 70 1HG1 VAL 70 2.649 10.268 -2.033 473 HG12 VAL 70 2HG1 VAL 70 2.457 8.561 -2.435 474 HG13 VAL 70 3HG1 VAL 70 3.408 9.614 -3.484 475 HG21 VAL 70 3HG2 VAL 70 -0.065 8.966 -2.269 476 HG22 VAL 70 1HG2 VAL 70 0.200 10.687 -1.985 477 HG23 VAL 70 2HG2 VAL 70 -0.808 10.161 -3.333 478 H THR 71 H THR 71 0.916 10.592 -6.768 479 HA THR 71 HA THR 71 -1.836 11.614 -6.637 480 HB THR 71 HB THR 71 -0.666 11.977 -9.274 481 HG1 THR 71 1HG THR 71 0.387 13.560 -7.149 482 HG21 THR 71 3HG2 THR 71 -1.586 14.326 -7.795 483 HG22 THR 71 1HG2 THR 71 -2.750 13.002 -7.812 484 HG23 THR 71 2HG2 THR 71 -2.146 13.666 -9.331 485 H GLY 72 H GLY 72 -0.339 8.922 -6.725 486 HA2 GLY 72 2HA GLY 72 -2.249 7.367 -7.922 487 HA3 GLY 72 3HA GLY 72 -1.116 7.730 -9.215 488 H ILE 73 H ILE 73 -1.584 5.132 -8.383 489 HA ILE 73 HA ILE 73 1.092 4.380 -7.543 490 HB ILE 73 HB ILE 73 0.461 2.982 -5.734 491 HG13 ILE 73 2HG1 ILE 73 -1.822 2.599 -5.029 492 HG21 ILE 73 1HG2 ILE 73 -0.543 4.578 -4.138 493 HG22 ILE 73 2HG2 ILE 73 0.738 5.298 -5.113 494 HG23 ILE 73 3HG2 ILE 73 -0.951 5.634 -5.490 495 HD11 ILE 73 3HD1 ILE 73 -2.825 4.139 -7.395 496 HD12 ILE 73 1HD1 ILE 73 -3.740 3.471 -6.043 497 HD13 ILE 73 2HD1 ILE 73 -2.681 4.860 -5.792 498 H ILE 74 H ILE 74 1.175 1.841 -7.464 499 HA ILE 74 HA ILE 74 -0.649 0.492 -9.230 500 HB ILE 74 HB ILE 74 0.811 1.716 -10.832 501 HG13 ILE 74 2HG1 ILE 74 0.798 -0.023 -12.322 502 HG21 ILE 74 1HG2 ILE 74 2.962 0.053 -9.541 503 HG22 ILE 74 2HG2 ILE 74 3.147 0.854 -11.099 504 HG23 ILE 74 3HG2 ILE 74 2.874 1.811 -9.644 505 HD11 ILE 74 3HD1 ILE 74 1.296 -2.433 -11.530 506 HD12 ILE 74 1HD1 ILE 74 2.633 -1.322 -11.830 507 HD13 ILE 74 2HD1 ILE 74 2.099 -1.636 -10.178 508 H THR 75 H THR 75 -0.467 -1.733 -9.130 509 HA THR 75 HA THR 75 1.649 -2.788 -7.370 510 HB THR 75 HB THR 75 -1.244 -3.673 -7.398 511 HG1 THR 75 1HG THR 75 0.232 -1.921 -5.781 512 HG21 THR 75 3HG2 THR 75 0.279 -4.557 -5.137 513 HG22 THR 75 1HG2 THR 75 1.086 -5.056 -6.623 514 HG23 THR 75 2HG2 THR 75 -0.591 -5.517 -6.333 515 H GLN 76 H GLN 76 2.738 -4.489 -8.136 516 HA GLN 76 HA GLN 76 1.591 -5.963 -10.414 517 HB3 GLN 76 2HB GLN 76 4.494 -5.973 -10.367 518 HG3 GLN 76 2HG GLN 76 3.115 -4.608 -12.560 519 HE21 GLN 76 1HE2 GLN 76 4.370 -7.878 -12.063 520 HE22 GLN 76 2HE2 GLN 76 5.723 -7.710 -13.124 521 H GLY 77 H GLY 77 1.668 -8.144 -10.326 522 HA2 GLY 77 2HA GLY 77 2.441 -9.354 -7.824 523 HA3 GLY 77 3HA GLY 77 1.696 -10.167 -9.192 524 H ALA 78 H ALA 78 3.696 -11.404 -7.795 525 HA ALA 78 HA ALA 78 5.852 -11.442 -9.791 526 HB1 ALA 78 1HB ALA 78 7.207 -10.534 -8.261 527 HB2 ALA 78 2HB ALA 78 6.083 -10.853 -6.939 528 HB3 ALA 78 3HB ALA 78 7.173 -12.123 -7.496 529 H ARG 79 H ARG 79 7.094 -13.472 -9.780 530 HA ARG 79 HA ARG 79 5.447 -15.741 -8.871 531 HB3 ARG 79 2HB ARG 79 5.326 -15.615 -11.267 532 HG3 ARG 79 2HG ARG 79 8.333 -15.712 -11.351 533 HD3 ARG 79 2HD ARG 79 6.164 -15.934 -13.361 534 HE ARG 79 HE ARG 79 7.081 -14.216 -14.561 535 HH11 ARG 79 1HH1 ARG 79 9.636 -16.064 -13.082 536 HH12 ARG 79 2HH1 ARG 79 10.901 -15.229 -13.921 537 HH21 ARG 79 1HH2 ARG 79 8.740 -13.109 -15.670 538 HH22 ARG 79 2HH2 ARG 79 10.391 -13.547 -15.391 539 H ASP 80 H ASP 80 6.593 -17.698 -8.342 540 HA ASP 80 HA ASP 80 9.327 -17.163 -7.389 541 HB3 ASP 80 2HB ASP 80 7.260 -19.095 -6.317 542 H PHE 81 H PHE 81 9.768 -17.754 -9.750 543 HA PHE 81 HA PHE 81 10.551 -19.213 -11.315 544 HB3 PHE 81 2HB PHE 81 12.058 -20.865 -10.530 545 HD1 PHE 81 2HD PHE 81 11.377 -19.369 -7.248 546 HD2 PHE 81 1HD PHE 81 13.660 -19.120 -10.832 547 HE1 PHE 81 2HE PHE 81 12.879 -17.744 -6.175 548 HE2 PHE 81 1HE PHE 81 15.166 -17.494 -9.764 549 HZ PHE 81 HZ PHE 81 14.776 -16.803 -7.432 550 H GLY 82 H GLY 82 8.330 -19.569 -12.040 551 HA2 GLY 82 2HA GLY 82 7.203 -21.420 -13.093 552 HA3 GLY 82 3HA GLY 82 7.570 -22.393 -11.677 553 H HIS 83 H HIS 83 6.615 -21.373 -9.576 554 HA HIS 83 HA HIS 83 3.778 -21.300 -9.955 555 HB3 HIS 83 2HB HIS 83 4.654 -20.519 -7.298 556 HD1 HIS 83 1HD HIS 83 4.360 -23.897 -6.833 557 HD2 HIS 83 2HD HIS 83 1.648 -21.052 -8.181 558 HE1 HIS 83 1HE HIS 83 2.085 -24.890 -6.426 559 H ILE 84 H ILE 84 2.631 -19.561 -10.444 560 HA ILE 84 HA ILE 84 3.769 -16.913 -10.110 561 HB ILE 84 HB ILE 84 1.137 -17.766 -11.321 562 HG13 ILE 84 2HG1 ILE 84 3.851 -17.756 -12.312 563 HG21 ILE 84 1HG2 ILE 84 2.336 -15.130 -10.770 564 HG22 ILE 84 2HG2 ILE 84 1.624 -15.340 -12.369 565 HG23 ILE 84 3HG2 ILE 84 0.643 -15.598 -10.926 566 HD11 ILE 84 3HD1 ILE 84 1.225 -18.532 -13.553 567 HD12 ILE 84 1HD1 ILE 84 2.799 -18.788 -14.307 568 HD13 ILE 84 2HD1 ILE 84 2.407 -19.595 -12.789 569 H GLN 85 H GLN 85 3.333 -15.584 -8.479 570 HA GLN 85 HA GLN 85 0.958 -16.131 -6.823 571 HB3 GLN 85 2HB GLN 85 2.175 -15.484 -4.863 572 HG3 GLN 85 2HG GLN 85 3.171 -17.620 -6.516 573 HE21 GLN 85 1HE2 GLN 85 5.053 -15.735 -6.965 574 HE22 GLN 85 2HE2 GLN 85 6.532 -16.159 -6.178 575 H TYR 86 H TYR 86 0.215 -14.201 -5.569 576 HA TYR 86 HA TYR 86 0.933 -11.579 -6.266 577 HB3 TYR 86 2HB TYR 86 0.044 -12.149 -8.470 578 HD1 TYR 86 2HD TYR 86 -0.710 -14.601 -8.336 579 HD2 TYR 86 1HD TYR 86 -3.271 -11.320 -7.453 580 HE1 TYR 86 2HE TYR 86 -2.670 -16.044 -8.689 581 HE2 TYR 86 1HE TYR 86 -5.238 -12.755 -7.802 582 HH TYR 86 HH TYR 86 -5.809 -14.835 -9.015 583 H VAL 87 H VAL 87 -0.320 -10.005 -5.191 584 HA VAL 87 HA VAL 87 -1.928 -11.108 -3.017 585 HB VAL 87 HB VAL 87 -1.036 -8.246 -3.347 586 HG11 VAL 87 1HG1 VAL 87 -2.211 -9.865 -1.124 587 HG12 VAL 87 2HG1 VAL 87 -1.197 -8.466 -0.767 588 HG13 VAL 87 3HG1 VAL 87 -2.673 -8.267 -1.711 589 HG21 VAL 87 3HG2 VAL 87 0.398 -10.583 -2.108 590 HG22 VAL 87 1HG2 VAL 87 0.976 -9.492 -3.367 591 HG23 VAL 87 2HG2 VAL 87 0.780 -8.906 -1.715 592 H ALA 88 H ALA 88 -3.968 -10.214 -2.437 593 HA ALA 88 HA ALA 88 -5.401 -9.020 -4.718 594 HB1 ALA 88 1HB ALA 88 -6.173 -11.265 -4.196 595 HB2 ALA 88 2HB ALA 88 -6.481 -10.788 -2.526 596 HB3 ALA 88 3HB ALA 88 -7.427 -10.079 -3.835 597 H SER 89 H SER 89 -6.111 -9.324 -1.243 598 HA SER 89 HA SER 89 -7.050 -6.573 -1.213 599 HB3 SER 89 2HB SER 89 -8.082 -7.078 0.851 600 HG SER 89 HG SER 89 -9.299 -8.305 -0.377 601 H TYR 90 H TYR 90 -5.873 -4.911 -0.544 602 HA TYR 90 HA TYR 90 -3.735 -5.335 1.404 603 HB3 TYR 90 2HB TYR 90 -2.939 -3.477 -0.711 604 HD1 TYR 90 1HD TYR 90 -1.664 -3.476 1.726 605 HD2 TYR 90 2HD TYR 90 -1.223 -6.371 -1.360 606 HE1 TYR 90 1HE TYR 90 0.555 -4.066 2.605 607 HE2 TYR 90 2HE TYR 90 0.997 -6.971 -0.488 608 HH TYR 90 HH TYR 90 2.130 -6.779 1.952 609 H LYS 91 H LYS 91 -3.342 -3.602 2.731 610 HA LYS 91 HA LYS 91 -5.292 -1.424 2.561 611 HB3 LYS 91 2HB LYS 91 -3.591 -1.461 4.930 612 HG3 LYS 91 2HG LYS 91 -5.763 -1.610 6.102 613 HD3 LYS 91 2HD LYS 91 -4.723 0.519 4.689 614 HE3 LYS 91 2HE LYS 91 -6.418 0.201 2.934 615 HZ1 LYS 91 3HZ LYS 91 -8.534 -0.205 3.395 616 HZ2 LYS 91 1HZ LYS 91 -8.648 1.130 4.427 617 HZ3 LYS 91 2HZ LYS 91 -8.114 -0.357 5.027 618 H VAL 92 H VAL 92 -4.720 0.559 1.964 619 HA VAL 92 HA VAL 92 -1.849 1.217 1.884 620 HB VAL 92 HB VAL 92 -4.056 2.418 0.208 621 HG11 VAL 92 1HG1 VAL 92 -1.804 2.998 -1.109 622 HG12 VAL 92 2HG1 VAL 92 -2.493 4.058 0.122 623 HG13 VAL 92 3HG1 VAL 92 -1.168 2.970 0.536 624 HG21 VAL 92 3HG2 VAL 92 -1.928 0.454 -0.631 625 HG22 VAL 92 1HG2 VAL 92 -3.607 0.028 -0.300 626 HG23 VAL 92 2HG2 VAL 92 -3.219 1.115 -1.633 627 H ALA 93 H ALA 93 -1.338 2.432 3.590 628 HA ALA 93 HA ALA 93 -3.112 4.687 4.262 629 HB1 ALA 93 1HB ALA 93 -2.774 2.618 5.913 630 HB2 ALA 93 2HB ALA 93 -1.376 3.583 6.389 631 HB3 ALA 93 3HB ALA 93 -2.997 4.271 6.488 632 H HIS 94 H HIS 94 -2.163 6.652 4.673 633 HA HIS 94 HA HIS 94 0.750 6.801 4.246 634 HB3 HIS 94 2HB HIS 94 0.178 9.161 3.352 635 HD1 HIS 94 1HD HIS 94 0.763 9.324 0.913 636 HD2 HIS 94 2HD HIS 94 -0.702 5.581 1.964 637 HE1 HIS 94 1HE HIS 94 1.125 7.869 -1.107 638 H SER 95 H SER 95 1.937 8.111 5.569 639 HA SER 95 HA SER 95 0.476 9.548 7.685 640 HB3 SER 95 2HB SER 95 1.646 8.541 9.358 641 HG SER 95 HG SER 95 0.833 6.801 7.987 642 H ASP 96 H ASP 96 1.278 11.513 8.297 643 HA ASP 96 HA ASP 96 3.392 12.610 6.589 644 HB3 ASP 96 2HB ASP 96 1.405 14.049 8.361 645 H ASP 97 H ASP 97 2.466 12.250 9.976 646 HA ASP 97 HA ASP 97 5.012 13.403 10.832 647 HB3 ASP 97 2HB ASP 97 3.958 12.963 13.157 648 H GLY 98 H GLY 98 3.551 10.373 10.262 649 HA2 GLY 98 2HA GLY 98 4.987 8.428 10.154 650 HA3 GLY 98 3HA GLY 98 5.846 9.049 11.556 651 H VAL 99 H VAL 99 3.359 9.772 12.946 652 HA VAL 99 HA VAL 99 2.681 7.078 13.889 653 HB VAL 99 HB VAL 99 1.894 8.123 15.928 654 HG11 VAL 99 1HG1 VAL 99 4.565 9.271 15.122 655 HG12 VAL 99 2HG1 VAL 99 3.992 9.005 16.770 656 HG13 VAL 99 3HG1 VAL 99 4.294 7.629 15.708 657 HG21 VAL 99 3HG2 VAL 99 1.005 10.166 15.727 658 HG22 VAL 99 1HG2 VAL 99 2.661 10.760 15.855 659 HG23 VAL 99 2HG2 VAL 99 1.931 10.520 14.268 660 H GLN 100 H GLN 100 1.342 9.859 12.334 661 HA GLN 100 HA GLN 100 -1.403 9.026 12.804 662 HB3 GLN 100 2HB GLN 100 -2.022 11.036 11.569 663 HG3 GLN 100 2HG GLN 100 0.280 11.836 13.317 664 HE21 GLN 100 1HE2 GLN 100 0.336 13.847 12.342 665 HE22 GLN 100 2HE2 GLN 100 -0.946 14.993 12.504 666 H TRP 101 H TRP 101 -1.782 7.156 11.712 667 HA TRP 101 HA TRP 101 -0.994 6.929 8.917 668 HB3 TRP 101 2HB TRP 101 -1.544 4.634 9.075 669 HD1 TRP 101 HD TRP 101 1.024 6.263 10.213 670 HE1 TRP 101 1HE TRP 101 2.462 5.144 12.030 671 HE3 TRP 101 3HE TRP 101 -2.379 2.876 11.972 672 HZ2 TRP 101 2HZ TRP 101 2.192 3.097 13.954 673 HZ3 TRP 101 3HZ TRP 101 -1.709 1.373 13.802 674 HH2 TRP 101 HH TRP 101 0.530 1.483 14.771 675 H THR 102 H THR 102 -2.275 7.793 7.430 676 HA THR 102 HA THR 102 -5.162 7.935 7.926 677 HB THR 102 HB THR 102 -3.415 9.393 5.939 678 HG1 THR 102 1HG THR 102 -3.442 10.142 8.149 679 HG21 THR 102 3HG2 THR 102 -5.531 8.928 4.866 680 HG22 THR 102 1HG2 THR 102 -5.478 10.628 5.328 681 HG23 THR 102 2HG2 THR 102 -6.413 9.482 6.289 682 H VAL 103 H VAL 103 -6.573 6.742 6.805 683 HA VAL 103 HA VAL 103 -5.524 5.009 4.685 684 HB VAL 103 HB VAL 103 -7.689 3.762 4.993 685 HG11 VAL 103 1HG1 VAL 103 -5.661 2.934 5.991 686 HG12 VAL 103 2HG1 VAL 103 -5.840 4.033 7.359 687 HG13 VAL 103 3HG1 VAL 103 -6.990 2.715 7.128 688 HG21 VAL 103 3HG2 VAL 103 -8.958 5.617 5.995 689 HG22 VAL 103 1HG2 VAL 103 -8.988 4.170 7.001 690 HG23 VAL 103 2HG2 VAL 103 -7.940 5.521 7.432 691 H TYR 104 H TYR 104 -6.140 5.206 2.621 692 HA TYR 104 HA TYR 104 -7.763 7.448 1.851 693 HB3 TYR 104 2HB TYR 104 -7.309 6.595 -0.478 694 HD1 TYR 104 1HD TYR 104 -6.511 8.901 1.120 695 HD2 TYR 104 2HD TYR 104 -4.172 5.635 -0.284 696 HE1 TYR 104 1HE TYR 104 -4.502 10.320 1.183 697 HE2 TYR 104 2HE TYR 104 -2.158 7.045 -0.225 698 HH TYR 104 HH TYR 104 -2.332 10.476 0.378 699 H GLU 105 H GLU 105 -9.721 6.684 2.961 700 HA GLU 105 HA GLU 105 -11.098 4.387 1.913 701 HB3 GLU 105 2HB GLU 105 -11.780 6.540 3.890 702 HG3 GLU 105 2HG GLU 105 -13.863 6.162 2.709 703 H GLU 106 H GLU 106 -12.998 4.382 0.678 704 HA GLU 106 HA GLU 106 -13.170 6.577 -1.209 705 HB3 GLU 106 2HB GLU 106 -15.026 4.249 -1.327 706 HG3 GLU 106 2HG GLU 106 -13.314 5.085 -3.589 707 H GLN 107 H GLN 107 -15.260 4.959 1.150 708 HA GLN 107 HA GLN 107 -17.162 7.193 0.892 709 HB3 GLN 107 2HB GLN 107 -17.570 4.308 1.651 710 HG3 GLN 107 2HG GLN 107 -18.879 6.286 2.980 711 HE21 GLN 107 1HE2 GLN 107 -21.369 4.478 1.672 712 HE22 GLN 107 2HE2 GLN 107 -22.155 5.725 0.772 713 H GLY 108 H GLY 108 -16.538 4.772 3.429 714 HA2 GLY 108 2HA GLY 108 -15.376 6.554 5.276 715 HA3 GLY 108 3HA GLY 108 -17.109 6.497 5.561 716 H SER 109 H SER 109 -15.567 3.670 4.320 717 HA SER 109 HA SER 109 -15.652 2.453 7.002 718 HB3 SER 109 2HB SER 109 -16.343 1.043 4.416 719 HG SER 109 HG SER 109 -16.772 -0.634 5.675 720 H SER 110 H SER 110 -13.535 3.560 4.991 721 HA SER 110 HA SER 110 -11.473 2.968 4.169 722 HB3 SER 110 2HB SER 110 -11.626 2.023 7.002 723 HG SER 110 HG SER 110 -10.153 0.577 6.432 724 H LYS 111 H LYS 111 -12.095 1.617 2.446 725 HA LYS 111 HA LYS 111 -12.110 -1.267 2.970 726 HB3 LYS 111 2HB LYS 111 -12.746 0.171 0.390 727 HG3 LYS 111 2HG LYS 111 -12.225 -2.309 0.311 728 HD3 LYS 111 2HD LYS 111 -13.489 -2.745 2.485 729 HE3 LYS 111 2HE LYS 111 -15.559 -1.509 1.295 730 HZ1 LYS 111 3HZ LYS 111 -16.997 -3.825 1.136 731 HZ2 LYS 111 1HZ LYS 111 -15.587 -4.172 0.267 732 HZ3 LYS 111 2HZ LYS 111 -16.539 -2.843 -0.164 733 H VAL 112 H VAL 112 -10.437 -2.527 2.461 734 HA VAL 112 HA VAL 112 -7.974 -1.448 1.611 735 HB VAL 112 HB VAL 112 -7.131 -3.701 1.591 736 HG11 VAL 112 1HG1 VAL 112 -8.381 -2.511 3.770 737 HG12 VAL 112 2HG1 VAL 112 -8.909 -4.195 3.816 738 HG13 VAL 112 3HG1 VAL 112 -7.187 -3.808 3.813 739 HG21 VAL 112 3HG2 VAL 112 -8.942 -5.537 2.117 740 HG22 VAL 112 1HG2 VAL 112 -10.007 -4.406 1.283 741 HG23 VAL 112 2HG2 VAL 112 -8.592 -5.057 0.457 742 H PHE 113 H PHE 113 -6.852 -1.633 -0.323 743 HA PHE 113 HA PHE 113 -8.428 -1.540 -2.686 744 HB3 PHE 113 2HB PHE 113 -5.989 -1.674 -3.722 745 HD1 PHE 113 2HD PHE 113 -7.522 0.488 -1.105 746 HD2 PHE 113 1HD PHE 113 -5.630 0.265 -4.911 747 HE1 PHE 113 2HE PHE 113 -7.917 2.893 -1.438 748 HE2 PHE 113 1HE PHE 113 -6.022 2.671 -5.250 749 HZ PHE 113 HZ PHE 113 -7.168 3.987 -3.514 750 H GLN 114 H GLN 114 -8.188 -2.905 -4.569 751 HA GLN 114 HA GLN 114 -7.670 -5.708 -3.832 752 HB3 GLN 114 2HB GLN 114 -9.205 -6.238 -5.765 753 HG3 GLN 114 2HG GLN 114 -11.231 -5.913 -4.611 754 HE21 GLN 114 1HE2 GLN 114 -9.405 -4.826 -1.911 755 HE22 GLN 114 2HE2 GLN 114 -9.166 -6.369 -1.172 756 H GLY 115 H GLY 115 -6.576 -7.062 -5.287 757 HA2 GLY 115 2HA GLY 115 -5.029 -5.606 -7.341 758 HA3 GLY 115 3HA GLY 115 -4.370 -6.919 -6.377 759 H ASN 116 H ASN 116 -4.884 -9.049 -6.884 760 HA ASN 116 HA ASN 116 -5.414 -10.809 -8.224 761 HB3 ASN 116 2HB ASN 116 -7.522 -10.836 -9.312 762 HD21 ASN 116 1HD2 ASN 116 -8.550 -7.910 -8.029 763 HD22 ASN 116 2HD2 ASN 116 -9.126 -8.488 -6.506 764 H LEU 117 H LEU 117 -6.407 -10.770 -10.910 765 HA LEU 117 HA LEU 117 -5.717 -10.560 -13.070 766 HB3 LEU 117 2HB LEU 117 -4.755 -8.578 -13.804 767 HG LEU 117 HG LEU 117 -6.099 -7.891 -11.199 768 HD11 LEU 117 1HD1 LEU 117 -4.390 -6.181 -11.927 769 HD12 LEU 117 2HD1 LEU 117 -6.048 -5.602 -11.773 770 HD13 LEU 117 3HD1 LEU 117 -5.377 -5.939 -13.369 771 HD21 LEU 117 3HD2 LEU 117 -7.024 -7.478 -14.034 772 HD22 LEU 117 1HD2 LEU 117 -7.966 -7.326 -12.552 773 HD23 LEU 117 2HD2 LEU 117 -7.412 -8.913 -13.086 774 H ASP 118 H ASP 118 -4.040 -11.768 -10.709 775 HA ASP 118 HA ASP 118 -2.094 -12.925 -10.449 776 HB3 ASP 118 2HB ASP 118 -1.417 -14.272 -12.302 777 H ASN 119 H ASN 119 0.228 -13.180 -11.792 778 HA ASN 119 HA ASN 119 1.471 -10.647 -11.345 779 HB3 ASN 119 2HB ASN 119 2.411 -13.368 -12.159 780 HD21 ASN 119 1HD2 ASN 119 4.265 -13.746 -13.171 781 HD22 ASN 119 2HD2 ASN 119 5.380 -12.536 -13.700 782 H ASN 120 H ASN 120 0.438 -12.454 -14.158 783 HA ASN 120 HA ASN 120 1.851 -11.179 -16.171 784 HB3 ASN 120 2HB ASN 120 -0.124 -11.736 -17.628 785 HD21 ASN 120 1HD2 ASN 120 -1.160 -14.375 -16.642 786 HD22 ASN 120 2HD2 ASN 120 0.184 -15.449 -16.797 787 H SER 121 H SER 121 -1.362 -10.299 -14.899 788 HA SER 121 HA SER 121 -1.075 -7.662 -16.156 789 HB3 SER 121 2HB SER 121 -3.563 -7.491 -15.494 790 HG SER 121 HG SER 121 -2.709 -9.444 -17.370 791 H HIS 122 H HIS 122 -1.018 -5.809 -14.991 792 HA HIS 122 HA HIS 122 -0.857 -6.104 -12.072 793 HB3 HIS 122 2HB HIS 122 1.126 -5.186 -13.321 794 HD1 HIS 122 1HD HIS 122 -0.931 -2.046 -12.863 795 HD2 HIS 122 2HD HIS 122 1.192 -4.056 -15.815 796 HE1 HIS 122 1HE HIS 122 -0.863 -0.478 -14.828 797 H LYS 123 H LYS 123 -1.264 -3.626 -11.157 798 HA LYS 123 HA LYS 123 -3.817 -2.677 -12.229 799 HB3 LYS 123 2HB LYS 123 -3.384 -3.379 -9.319 800 HG3 LYS 123 2HG LYS 123 -4.919 -1.471 -9.664 801 HD3 LYS 123 2HD LYS 123 -6.137 -3.400 -11.559 802 HE3 LYS 123 2HE LYS 123 -7.686 -2.704 -9.450 803 HZ1 LYS 123 3HZ LYS 123 -8.894 -0.902 -11.306 804 HZ2 LYS 123 1HZ LYS 123 -7.401 -0.324 -10.760 805 HZ3 LYS 123 2HZ LYS 123 -8.614 -0.711 -9.649 806 H LYS 124 H LYS 124 -3.254 -0.656 -12.764 807 HA LYS 124 HA LYS 124 -1.724 0.936 -10.820 808 HB3 LYS 124 2HB LYS 124 -2.235 1.613 -13.717 809 HG3 LYS 124 2HG LYS 124 0.280 2.478 -12.623 810 HD3 LYS 124 2HD LYS 124 -1.475 3.279 -14.559 811 HE3 LYS 124 2HE LYS 124 -1.818 5.003 -12.140 812 HZ1 LYS 124 3HZ LYS 124 -1.892 6.903 -13.280 813 HZ2 LYS 124 1HZ LYS 124 -2.665 6.202 -14.612 814 HZ3 LYS 124 2HZ LYS 124 -0.982 6.107 -14.464 815 H ASN 125 H ASN 125 -2.822 2.338 -9.632 816 HA ASN 125 HA ASN 125 -5.474 3.199 -10.530 817 HB3 ASN 125 2HB ASN 125 -5.021 4.178 -7.940 818 HD21 ASN 125 1HD2 ASN 125 -5.576 0.888 -7.677 819 HD22 ASN 125 2HD2 ASN 125 -7.301 0.909 -7.762 820 H ILE 126 H ILE 126 -6.091 5.390 -10.507 821 HA ILE 126 HA ILE 126 -3.919 7.206 -11.138 822 HB ILE 126 HB ILE 126 -6.649 8.295 -11.080 823 HG13 ILE 126 2HG1 ILE 126 -7.321 6.117 -11.765 824 HG21 ILE 126 1HG2 ILE 126 -4.324 9.060 -12.173 825 HG22 ILE 126 2HG2 ILE 126 -5.022 8.198 -13.542 826 HG23 ILE 126 3HG2 ILE 126 -5.895 9.543 -12.810 827 HD11 ILE 126 3HD1 ILE 126 -8.130 7.926 -13.263 828 HD12 ILE 126 1HD1 ILE 126 -6.795 7.552 -14.353 829 HD13 ILE 126 2HD1 ILE 126 -8.033 6.339 -14.027 830 H PHE 127 H PHE 127 -5.109 9.636 -10.402 831 HA PHE 127 HA PHE 127 -4.282 9.787 -7.665 832 HB3 PHE 127 2HB PHE 127 -3.714 11.682 -8.916 833 HD1 PHE 127 2HD PHE 127 -7.275 12.561 -9.010 834 HD2 PHE 127 1HD PHE 127 -3.850 11.481 -11.295 835 HE1 PHE 127 2HE PHE 127 -8.440 13.236 -11.068 836 HE2 PHE 127 1HE PHE 127 -5.009 12.156 -13.357 837 HZ PHE 127 HZ PHE 127 -7.308 13.034 -13.246 838 H GLU 128 H GLU 128 -6.160 8.070 -7.337 839 HA GLU 128 HA GLU 128 -8.819 8.954 -7.136 840 HB3 GLU 128 2HB GLU 128 -7.455 6.808 -5.502 841 HG3 GLU 128 2HG GLU 128 -10.255 7.616 -5.803 842 H LYS 129 H LYS 129 -6.072 9.491 -5.133 843 HA LYS 129 HA LYS 129 -7.428 11.397 -3.535 844 HB3 LYS 129 2HB LYS 129 -6.650 9.870 -1.405 845 HG3 LYS 129 2HG LYS 129 -9.297 9.082 -1.859 846 HD3 LYS 129 2HD LYS 129 -7.880 11.159 -0.268 847 HE3 LYS 129 2HE LYS 129 -10.852 11.033 -0.711 848 HZ1 LYS 129 3HZ LYS 129 -10.086 11.000 1.731 849 HZ2 LYS 129 1HZ LYS 129 -11.239 12.144 1.256 850 HZ3 LYS 129 2HZ LYS 129 -9.624 12.604 1.458 851 HA PRO 130 HA PRO 130 -2.817 11.764 -3.907 852 HB3 PRO 130 2HB PRO 130 -3.001 12.962 -5.859 853 HG3 PRO 130 2HG PRO 130 -4.958 14.102 -6.386 854 HD3 PRO 130 2HD PRO 130 -5.833 12.036 -5.856 855 H PHE 131 H PHE 131 -1.394 13.000 -2.612 856 HA PHE 131 HA PHE 131 -2.025 15.163 -1.009 857 HB3 PHE 131 2HB PHE 131 -1.979 13.335 1.123 858 HD1 PHE 131 2HD PHE 131 -2.262 16.147 1.071 859 HD2 PHE 131 1HD PHE 131 -5.285 13.183 0.633 860 HE1 PHE 131 2HE PHE 131 -3.943 17.746 1.888 861 HE2 PHE 131 1HE PHE 131 -6.972 14.778 1.449 862 HZ PHE 131 HZ PHE 131 -6.302 17.063 2.079 863 H MET 132 H MET 132 -0.414 15.548 0.715 864 HA MET 132 HA MET 132 2.154 14.432 -0.082 865 HB3 MET 132 2HB MET 132 2.109 16.817 0.071 866 HG3 MET 132 2HG MET 132 1.834 17.597 2.653 867 HE1 MET 132 3HE MET 132 2.043 19.576 1.000 868 HE2 MET 132 1HE MET 132 1.750 18.697 -0.502 869 HE3 MET 132 2HE MET 132 0.781 20.116 -0.108 870 H ALA 133 H ALA 133 3.387 13.121 1.145 871 HA ALA 133 HA ALA 133 2.720 12.720 3.960 872 HB1 ALA 133 1HB ALA 133 2.724 10.504 1.917 873 HB2 ALA 133 2HB ALA 133 2.744 10.248 3.663 874 HB3 ALA 133 3HB ALA 133 1.368 11.047 2.904 875 H ARG 134 H ARG 134 4.384 11.599 5.153 876 HA ARG 134 HA ARG 134 7.024 11.891 3.885 877 HB3 ARG 134 2HB ARG 134 6.311 11.915 6.823 878 HG3 ARG 134 2HG ARG 134 8.848 13.061 5.848 879 HD3 ARG 134 2HD ARG 134 7.649 12.354 8.304 880 HE ARG 134 HE ARG 134 9.412 10.308 7.592 881 HH11 ARG 134 1HH1 ARG 134 8.898 12.566 10.193 882 HH12 ARG 134 2HH1 ARG 134 9.585 11.530 11.401 883 HH21 ARG 134 1HH2 ARG 134 10.319 8.937 9.173 884 HH22 ARG 134 2HH2 ARG 134 10.394 9.467 10.819 885 H TYR 135 H TYR 135 4.910 9.712 5.592 886 HA TYR 135 HA TYR 135 6.644 7.489 4.894 887 HB3 TYR 135 2HB TYR 135 6.097 8.357 7.699 888 HD1 TYR 135 2HD TYR 135 7.755 5.244 6.614 889 HD2 TYR 135 1HD TYR 135 4.443 6.943 8.676 890 HE1 TYR 135 2HE TYR 135 7.187 3.027 7.514 891 HE2 TYR 135 1HE TYR 135 3.866 4.730 9.582 892 HH TYR 135 HH TYR 135 4.469 2.596 9.756 893 H VAL 136 H VAL 136 5.340 6.139 3.865 894 HA VAL 136 HA VAL 136 2.531 5.941 4.708 895 HB VAL 136 HB VAL 136 1.973 5.189 2.546 896 HG11 VAL 136 1HG1 VAL 136 2.402 7.573 2.630 897 HG12 VAL 136 2HG1 VAL 136 4.106 7.302 2.261 898 HG13 VAL 136 3HG1 VAL 136 2.872 6.929 1.058 899 HG21 VAL 136 3HG2 VAL 136 3.680 3.551 2.177 900 HG22 VAL 136 1HG2 VAL 136 3.715 4.686 0.827 901 HG23 VAL 136 2HG2 VAL 136 4.929 4.793 2.103 902 H ARG 137 H ARG 137 1.592 3.982 5.187 903 HA ARG 137 HA ARG 137 3.391 1.654 5.309 904 HB3 ARG 137 2HB ARG 137 1.282 2.287 7.371 905 HG3 ARG 137 2HG ARG 137 3.669 0.654 7.978 906 HD3 ARG 137 2HD ARG 137 1.299 -0.557 8.826 907 HE ARG 137 HE ARG 137 3.516 0.704 10.100 908 HH11 ARG 137 1HH1 ARG 137 0.311 -0.541 10.643 909 HH12 ARG 137 2HH1 ARG 137 0.583 -0.873 12.322 910 HH21 ARG 137 1HH2 ARG 137 3.886 0.272 12.308 911 HH22 ARG 137 2HH2 ARG 137 2.617 -0.409 13.268 912 H VAL 138 H VAL 138 2.514 -0.327 4.813 913 HA VAL 138 HA VAL 138 -0.326 -0.375 4.037 914 HB VAL 138 HB VAL 138 0.545 -2.060 2.219 915 HG11 VAL 138 1HG1 VAL 138 0.236 0.869 2.217 916 HG12 VAL 138 2HG1 VAL 138 1.062 0.185 0.814 917 HG13 VAL 138 3HG1 VAL 138 -0.562 -0.360 1.235 918 HG21 VAL 138 3HG2 VAL 138 2.942 -0.266 2.600 919 HG22 VAL 138 1HG2 VAL 138 2.881 -1.996 2.940 920 HG23 VAL 138 2HG2 VAL 138 2.707 -1.416 1.283 921 H LEU 139 H LEU 139 -1.356 -2.411 4.168 922 HA LEU 139 HA LEU 139 0.133 -4.587 5.428 923 HB3 LEU 139 2HB LEU 139 -2.252 -3.188 6.597 924 HG LEU 139 HG LEU 139 -1.489 -6.025 7.007 925 HD11 LEU 139 1HD1 LEU 139 -1.851 -6.081 9.290 926 HD12 LEU 139 2HD1 LEU 139 -2.623 -4.496 9.313 927 HD13 LEU 139 3HD1 LEU 139 -0.877 -4.624 9.099 928 HD21 LEU 139 3HD2 LEU 139 -3.599 -6.078 6.261 929 HD22 LEU 139 1HD2 LEU 139 -3.885 -4.384 6.660 930 HD23 LEU 139 2HD2 LEU 139 -4.038 -5.621 7.907 931 HA PRO 140 HA PRO 140 -2.346 -6.651 2.339 932 HB3 PRO 140 2HB PRO 140 -0.443 -7.826 1.811 933 HG3 PRO 140 2HG PRO 140 1.181 -8.262 3.418 934 HD3 PRO 140 2HD PRO 140 0.909 -5.996 3.735 935 H VAL 141 H VAL 141 -4.203 -7.832 2.397 936 HA VAL 141 HA VAL 141 -4.969 -8.999 4.994 937 HB VAL 141 HB VAL 141 -6.780 -7.659 2.981 938 HG11 VAL 141 1HG1 VAL 141 -8.543 -7.990 4.642 939 HG12 VAL 141 2HG1 VAL 141 -7.870 -9.531 4.110 940 HG13 VAL 141 3HG1 VAL 141 -7.411 -8.860 5.675 941 HG21 VAL 141 3HG2 VAL 141 -7.144 -6.070 4.928 942 HG22 VAL 141 1HG2 VAL 141 -5.702 -6.787 5.648 943 HG23 VAL 141 2HG2 VAL 141 -5.592 -5.955 4.097 944 H SER 142 H SER 142 -5.131 -9.260 1.491 945 HA SER 142 HA SER 142 -5.610 -12.129 1.767 946 HB3 SER 142 2HB SER 142 -7.151 -10.861 -0.415 947 HG SER 142 HG SER 142 -7.393 -13.042 -0.052 948 H TRP 143 H TRP 143 -4.549 -13.341 0.286 949 HA TRP 143 HA TRP 143 -3.434 -12.040 -2.085 950 HB3 TRP 143 2HB TRP 143 -1.694 -11.872 -0.358 951 HD1 TRP 143 HD TRP 143 -0.535 -15.372 -1.001 952 HE1 TRP 143 1HE TRP 143 -0.480 -16.694 1.207 953 HE3 TRP 143 3HE TRP 143 -3.060 -12.076 1.981 954 HZ2 TRP 143 2HZ TRP 143 -1.387 -16.381 3.861 955 HZ3 TRP 143 3HZ TRP 143 -3.425 -12.663 4.342 956 HH2 TRP 143 HH TRP 143 -2.605 -14.772 5.261 957 H HIS 144 H HIS 144 -1.982 -13.974 -3.187 958 HA HIS 144 HA HIS 144 -3.528 -16.455 -3.110 959 HB3 HIS 144 2HB HIS 144 -2.963 -15.865 -5.850 960 HD1 HIS 144 1HD HIS 144 -4.278 -18.274 -4.904 961 HD2 HIS 144 2HD HIS 144 -6.455 -14.800 -5.575 962 HE1 HIS 144 1HE HIS 144 -6.657 -19.022 -5.221 963 H ASN 145 H ASN 145 -2.228 -18.167 -3.116 964 HA ASN 145 HA ASN 145 -0.445 -19.532 -3.540 965 HB3 ASN 145 2HB ASN 145 0.984 -19.134 -5.355 966 HD21 ASN 145 1HD2 ASN 145 -1.057 -20.251 -5.960 967 HD22 ASN 145 2HD2 ASN 145 -2.085 -19.466 -7.107 968 H ARG 146 H ARG 146 0.803 -16.188 -3.438 969 HA ARG 146 HA ARG 146 1.911 -16.482 -0.842 970 HB3 ARG 146 2HB ARG 146 3.883 -16.515 -3.133 971 HG3 ARG 146 2HG ARG 146 4.413 -15.398 -0.791 972 HD3 ARG 146 2HD ARG 146 3.788 -17.384 0.510 973 HE ARG 146 HE ARG 146 4.892 -18.963 -1.313 974 HH11 ARG 146 1HH1 ARG 146 5.863 -18.299 1.963 975 HH12 ARG 146 2HH1 ARG 146 6.575 -19.860 2.206 976 HH21 ARG 146 1HH2 ARG 146 5.826 -21.020 -1.005 977 HH22 ARG 146 2HH2 ARG 146 6.556 -21.406 0.517 978 H ILE 147 H ILE 147 2.546 -14.532 0.008 979 HA ILE 147 HA ILE 147 1.644 -12.189 -1.288 980 HB ILE 147 HB ILE 147 3.405 -12.493 1.146 981 HG13 ILE 147 2HG1 ILE 147 0.460 -12.434 0.672 982 HG21 ILE 147 1HG2 ILE 147 3.818 -10.311 0.759 983 HG22 ILE 147 2HG2 ILE 147 2.417 -10.124 -0.296 984 HG23 ILE 147 3HG2 ILE 147 2.212 -10.096 1.456 985 HD11 ILE 147 3HD1 ILE 147 0.585 -13.808 2.833 986 HD12 ILE 147 1HD1 ILE 147 1.160 -14.541 1.336 987 HD13 ILE 147 2HD1 ILE 147 2.315 -13.897 2.503 988 H THR 148 H THR 148 2.772 -12.155 -3.288 989 HA THR 148 HA THR 148 5.455 -10.988 -3.053 990 HB THR 148 HB THR 148 5.045 -12.689 -5.432 991 HG1 THR 148 1HG THR 148 4.223 -14.100 -3.880 992 HG21 THR 148 3HG2 THR 148 7.436 -13.271 -4.062 993 HG22 THR 148 1HG2 THR 148 7.189 -11.532 -3.916 994 HG23 THR 148 2HG2 THR 148 7.235 -12.286 -5.511 995 H LEU 149 H LEU 149 5.044 -8.953 -3.683 996 HA LEU 149 HA LEU 149 4.304 -8.468 -6.413 997 HB3 LEU 149 2HB LEU 149 2.112 -8.742 -5.230 998 HG LEU 149 HG LEU 149 1.224 -7.208 -3.744 999 HD11 LEU 149 1HD1 LEU 149 2.689 -7.141 -1.854 1000 HD12 LEU 149 2HD1 LEU 149 4.108 -7.322 -2.883 1001 HD13 LEU 149 3HD1 LEU 149 2.966 -8.655 -2.714 1002 HD21 LEU 149 3HD2 LEU 149 3.463 -5.291 -3.706 1003 HD22 LEU 149 1HD2 LEU 149 1.724 -5.012 -3.613 1004 HD23 LEU 149 2HD2 LEU 149 2.488 -5.312 -5.176 1005 H ARG 150 H ARG 150 4.071 -5.953 -6.715 1006 HA ARG 150 HA ARG 150 5.993 -4.594 -4.952 1007 HB3 ARG 150 2HB ARG 150 6.047 -4.855 -7.935 1008 HG3 ARG 150 2HG ARG 150 6.064 -2.463 -7.649 1009 HD3 ARG 150 2HD ARG 150 6.637 -2.006 -5.452 1010 HE ARG 150 HE ARG 150 8.632 -4.078 -5.689 1011 HH11 ARG 150 1HH1 ARG 150 7.439 -1.406 -3.803 1012 HH12 ARG 150 2HH1 ARG 150 8.163 -1.954 -2.328 1013 HH21 ARG 150 1HH2 ARG 150 9.592 -4.811 -3.753 1014 HH22 ARG 150 2HH2 ARG 150 9.389 -3.890 -2.300 1015 H LEU 151 H LEU 151 4.960 -2.960 -4.023 1016 HA LEU 151 HA LEU 151 2.734 -1.670 -5.397 1017 HB3 LEU 151 2HB LEU 151 2.903 -0.411 -3.004 1018 HG LEU 151 HG LEU 151 1.349 -2.731 -3.912 1019 HD11 LEU 151 1HD1 LEU 151 0.626 -3.506 -1.831 1020 HD12 LEU 151 2HD1 LEU 151 1.369 -2.161 -0.968 1021 HD13 LEU 151 3HD1 LEU 151 2.381 -3.420 -1.674 1022 HD21 LEU 151 3HD2 LEU 151 0.905 -0.075 -3.590 1023 HD22 LEU 151 1HD2 LEU 151 0.203 -0.720 -2.106 1024 HD23 LEU 151 2HD2 LEU 151 -0.364 -1.298 -3.673 1025 H GLU 152 H GLU 152 3.805 -0.437 -6.952 1026 HA GLU 152 HA GLU 152 5.879 1.415 -6.193 1027 HB3 GLU 152 2HB GLU 152 4.802 2.079 -8.739 1028 HG3 GLU 152 2HG GLU 152 7.062 0.282 -8.858 1029 H LEU 153 H LEU 153 5.735 3.634 -6.038 1030 HA LEU 153 HA LEU 153 3.001 4.711 -5.839 1031 HB3 LEU 153 2HB LEU 153 3.864 6.300 -4.212 1032 HG LEU 153 HG LEU 153 4.103 4.978 -2.334 1033 HD11 LEU 153 1HD1 LEU 153 3.059 2.771 -4.022 1034 HD12 LEU 153 2HD1 LEU 153 2.189 4.305 -4.032 1035 HD13 LEU 153 3HD1 LEU 153 2.434 3.441 -2.514 1036 HD21 LEU 153 3HD2 LEU 153 5.997 3.551 -3.977 1037 HD22 LEU 153 1HD2 LEU 153 4.951 2.436 -3.096 1038 HD23 LEU 153 2HD2 LEU 153 5.882 3.652 -2.219 1039 H LEU 154 H LEU 154 2.503 6.624 -6.828 1040 HA LEU 154 HA LEU 154 4.626 7.862 -8.453 1041 HB3 LEU 154 2HB LEU 154 3.234 8.052 -10.285 1042 HG LEU 154 HG LEU 154 2.332 5.482 -8.995 1043 HD11 LEU 154 1HD1 LEU 154 0.665 6.239 -10.614 1044 HD12 LEU 154 2HD1 LEU 154 1.534 4.820 -11.197 1045 HD13 LEU 154 3HD1 LEU 154 1.927 6.417 -11.833 1046 HD21 LEU 154 3HD2 LEU 154 4.715 5.606 -9.489 1047 HD22 LEU 154 1HD2 LEU 154 4.359 6.078 -11.150 1048 HD23 LEU 154 2HD2 LEU 154 3.908 4.473 -10.575 1049 H GLY 155 H GLY 155 4.570 10.104 -8.703 1050 HA2 GLY 155 2HA GLY 155 2.559 11.547 -7.107 1051 HA3 GLY 155 3HA GLY 155 4.268 11.851 -6.837 1052 H CYS 156 H CYS 156 2.782 13.978 -7.447 1053 HA CYS 156 HA CYS 156 2.801 14.446 -10.307 1054 HB3 CYS 156 2HB CYS 156 2.294 16.879 -9.077 1055 H LEU 157 H LEU 157 4.796 15.099 -7.550 1056 HA LEU 157 HA LEU 157 6.799 16.147 -7.287 1057 HB3 LEU 157 2HB LEU 157 7.627 16.243 -10.045 1058 HG LEU 157 HG LEU 157 9.379 14.757 -9.435 1059 HD11 LEU 157 1HD1 LEU 157 10.358 15.883 -7.537 1060 HD12 LEU 157 2HD1 LEU 157 8.780 16.503 -7.052 1061 HD13 LEU 157 3HD1 LEU 157 9.520 17.054 -8.555 1062 HD21 LEU 157 3HD2 LEU 157 8.013 13.088 -8.271 1063 HD22 LEU 157 1HD2 LEU 157 7.842 14.187 -6.902 1064 HD23 LEU 157 2HD2 LEU 157 9.430 13.546 -7.325 1065 H GLU 158 H GLU 158 4.403 17.739 -8.013 1066 HA GLU 158 HA GLU 158 5.602 20.003 -9.430 1067 HB3 GLU 158 2HB GLU 158 2.885 20.451 -8.569 1068 HG3 GLU 158 2HG GLU 158 3.172 19.880 -11.376 Start of MODEL 13 1 H1 MET -5 H MET -5 10.682 23.531 -3.400 2 HA MET -5 HA MET -5 10.209 20.864 -4.124 3 HB3 MET -5 2HB MET -5 8.240 21.913 -5.782 4 HG3 MET -5 2HG MET -5 8.456 19.705 -4.317 5 HE1 MET -5 3HE MET -5 6.506 18.557 -1.482 6 HE2 MET -5 1HE MET -5 5.260 18.956 -2.663 7 HE3 MET -5 2HE MET -5 6.794 18.271 -3.199 8 H LYS -4 H LYS -4 9.867 20.819 -6.713 9 HA LYS -4 HA LYS -4 11.625 22.887 -7.855 10 HB3 LYS -4 2HB LYS -4 12.791 21.210 -9.155 11 HG3 LYS -4 2HG LYS -4 12.996 21.360 -6.368 12 HD3 LYS -4 2HD LYS -4 12.938 18.537 -7.394 13 HE3 LYS -4 2HE LYS -4 15.133 19.313 -6.165 14 HZ1 LYS -4 3HZ LYS -4 14.850 19.966 -4.083 15 HZ2 LYS -4 1HZ LYS -4 14.199 18.454 -3.693 16 HZ3 LYS -4 2HZ LYS -4 13.180 19.714 -4.176 17 H SER -3 H SER -3 10.852 23.822 -9.633 18 HA SER -3 HA SER -3 8.305 23.091 -10.674 19 HB3 SER -3 2HB SER -3 9.076 25.430 -10.610 20 HG SER -3 HG SER -3 10.847 26.047 -11.591 21 H GLY -2 H GLY -2 8.365 23.351 -13.350 22 HA2 GLY -2 2HA GLY -2 9.622 22.483 -15.284 23 HA3 GLY -2 3HA GLY -2 10.125 21.155 -14.250 24 H HIS -1 H HIS -1 8.678 21.180 -16.838 25 HA HIS -1 HA HIS -1 6.021 20.229 -16.169 26 HB3 HIS -1 2HB HIS -1 6.273 21.561 -18.185 27 HD1 HIS -1 1HD HIS -1 8.600 22.330 -18.942 28 HD2 HIS -1 2HD HIS -1 7.706 18.412 -19.998 29 HE1 HIS -1 1HE HIS -1 10.379 21.654 -20.586 30 H GLY 0 H GLY 0 5.327 18.138 -16.206 31 HA2 GLY 0 2HA GLY 0 5.734 15.861 -17.143 32 HA3 GLY 0 3HA GLY 0 7.410 16.090 -16.663 33 H CYS 1 H CYS 1 4.170 15.421 -15.571 34 HA CYS 1 HA CYS 1 5.056 15.112 -12.808 35 HB3 CYS 1 2HB CYS 1 2.499 14.366 -12.677 36 H SER 2 H SER 2 3.710 13.079 -11.796 37 HA SER 2 HA SER 2 3.652 10.819 -11.534 38 HB3 SER 2 2HB SER 2 2.974 9.525 -13.322 39 HG SER 2 HG SER 2 2.548 11.735 -14.884 40 H GLU 3 H GLU 3 5.851 11.406 -10.623 41 HA GLU 3 HA GLU 3 8.046 10.260 -12.194 42 HB3 GLU 3 2HB GLU 3 9.496 11.263 -10.407 43 HG3 GLU 3 2HG GLU 3 9.135 13.629 -11.001 44 HA PRO 4 HA PRO 4 8.124 6.560 -9.821 45 HB3 PRO 4 2HB PRO 4 9.586 5.750 -11.397 46 HG3 PRO 4 2HG PRO 4 11.160 7.137 -12.399 47 HD3 PRO 4 2HD PRO 4 9.265 8.414 -12.691 48 H LEU 5 H LEU 5 11.428 7.412 -9.152 49 HA LEU 5 HA LEU 5 11.100 8.700 -6.679 50 HB3 LEU 5 2HB LEU 5 10.152 6.759 -5.777 51 HG LEU 5 HG LEU 5 11.393 5.255 -7.707 52 HD11 LEU 5 1HD1 LEU 5 12.925 5.071 -5.185 53 HD12 LEU 5 2HD1 LEU 5 13.436 4.799 -6.851 54 HD13 LEU 5 3HD1 LEU 5 12.530 3.553 -5.992 55 HD21 LEU 5 3HD2 LEU 5 10.456 3.314 -6.266 56 HD22 LEU 5 1HD2 LEU 5 9.348 4.529 -6.902 57 HD23 LEU 5 2HD2 LEU 5 9.866 4.604 -5.218 58 H GLY 6 H GLY 6 13.087 6.256 -8.335 59 HA2 GLY 6 2HA GLY 6 15.399 8.034 -8.004 60 HA3 GLY 6 3HA GLY 6 15.530 6.377 -7.434 61 H LEU 7 H LEU 7 13.690 7.185 -10.282 62 HA LEU 7 HA LEU 7 15.725 5.810 -11.907 63 HB3 LEU 7 2HB LEU 7 14.032 4.970 -13.282 64 HG LEU 7 HG LEU 7 12.825 4.958 -10.518 65 HD11 LEU 7 1HD1 LEU 7 12.123 3.373 -12.982 66 HD12 LEU 7 2HD1 LEU 7 11.089 4.501 -12.107 67 HD13 LEU 7 3HD1 LEU 7 11.572 2.982 -11.353 68 HD21 LEU 7 3HD2 LEU 7 13.775 2.438 -11.194 69 HD22 LEU 7 1HD2 LEU 7 14.511 3.579 -10.069 70 HD23 LEU 7 2HD2 LEU 7 15.026 3.548 -11.756 71 H LYS 8 H LYS 8 15.021 8.797 -11.179 72 HA LYS 8 HA LYS 8 15.159 9.795 -13.949 73 HB3 LYS 8 2HB LYS 8 14.427 11.606 -11.697 74 HG3 LYS 8 2HG LYS 8 12.633 12.055 -13.659 75 HD3 LYS 8 2HD LYS 8 15.367 13.230 -13.951 76 HE3 LYS 8 2HE LYS 8 13.397 15.179 -13.595 77 HZ1 LYS 8 3HZ LYS 8 13.772 15.611 -15.937 78 HZ2 LYS 8 1HZ LYS 8 14.511 14.101 -16.129 79 HZ3 LYS 8 2HZ LYS 8 15.239 15.281 -15.159 80 H ASN 9 H ASN 9 16.436 10.147 -10.675 81 HA ASN 9 HA ASN 9 19.051 10.689 -11.536 82 HB3 ASN 9 2HB ASN 9 18.646 13.163 -10.297 83 HD21 ASN 9 1HD2 ASN 9 17.665 13.872 -13.300 84 HD22 ASN 9 2HD2 ASN 9 19.188 13.948 -14.114 85 H ASN 10 H ASN 10 16.604 10.950 -9.051 86 HA ASN 10 HA ASN 10 18.142 11.376 -6.794 87 HB3 ASN 10 2HB ASN 10 16.334 9.873 -5.668 88 HD21 ASN 10 1HD2 ASN 10 16.227 12.448 -8.074 89 HD22 ASN 10 2HD2 ASN 10 15.336 13.564 -7.102 90 H THR 11 H THR 11 17.547 8.374 -8.548 91 HA THR 11 HA THR 11 18.422 6.273 -8.347 92 HB THR 11 HB THR 11 20.798 6.128 -8.250 93 HG1 THR 11 1HG THR 11 21.502 7.245 -6.540 94 HG21 THR 11 3HG2 THR 11 20.959 8.772 -9.384 95 HG22 THR 11 1HG2 THR 11 19.481 7.965 -9.904 96 HG23 THR 11 2HG2 THR 11 21.046 7.204 -10.187 97 H ILE 12 H ILE 12 16.898 6.761 -6.189 98 HA ILE 12 HA ILE 12 17.960 6.720 -3.658 99 HB ILE 12 HB ILE 12 15.599 5.057 -4.541 100 HG13 ILE 12 2HG1 ILE 12 14.258 7.068 -3.911 101 HG21 ILE 12 1HG2 ILE 12 14.914 5.011 -2.326 102 HG22 ILE 12 2HG2 ILE 12 16.660 4.804 -2.198 103 HG23 ILE 12 3HG2 ILE 12 15.932 6.378 -1.876 104 HD11 ILE 12 3HD1 ILE 12 15.859 8.254 -2.524 105 HD12 ILE 12 1HD1 ILE 12 16.917 8.477 -3.917 106 HD13 ILE 12 2HD1 ILE 12 15.332 9.252 -3.880 107 HA PRO 13 HA PRO 13 20.308 2.976 -3.474 108 HB3 PRO 13 2HB PRO 13 21.538 4.020 -1.840 109 HG3 PRO 13 2HG PRO 13 20.554 5.547 -0.389 110 HD3 PRO 13 2HD PRO 13 19.807 6.377 -2.404 111 H ASP 14 H ASP 14 17.185 3.142 -3.042 112 HA ASP 14 HA ASP 14 15.569 1.547 -2.787 113 HB3 ASP 14 2HB ASP 14 17.921 0.025 -3.113 114 H SER 15 H SER 15 17.418 2.874 -0.466 115 HA SER 15 HA SER 15 16.425 1.420 1.824 116 HB3 SER 15 2HB SER 15 17.678 4.131 2.047 117 HG SER 15 HG SER 15 18.243 3.378 3.955 118 H GLN 16 H GLN 16 14.209 2.013 0.574 119 HA GLN 16 HA GLN 16 13.094 4.311 2.042 120 HB3 GLN 16 2HB GLN 16 13.168 4.890 -0.299 121 HG3 GLN 16 2HG GLN 16 11.423 2.545 -0.958 122 HE21 GLN 16 1HE2 GLN 16 10.374 4.381 -2.104 123 HE22 GLN 16 2HE2 GLN 16 11.004 4.822 -3.651 124 H MET 17 H MET 17 12.416 1.150 0.592 125 HA MET 17 HA MET 17 9.947 0.915 2.113 126 HB3 MET 17 2HB MET 17 10.179 -1.489 0.936 127 HG3 MET 17 2HG MET 17 9.110 1.086 -0.040 128 HE1 MET 17 3HE MET 17 7.551 -1.507 -3.173 129 HE2 MET 17 1HE MET 17 7.841 -2.259 -1.604 130 HE3 MET 17 2HE MET 17 6.892 -0.776 -1.710 131 H SER 18 H SER 18 9.554 -0.684 3.665 132 HA SER 18 HA SER 18 11.667 -2.439 4.537 133 HB3 SER 18 2HB SER 18 12.509 -0.604 5.737 134 HG SER 18 HG SER 18 10.556 0.404 7.133 135 H ALA 19 H ALA 19 10.588 -4.265 4.833 136 HA ALA 19 HA ALA 19 7.948 -4.147 6.140 137 HB1 ALA 19 1HB ALA 19 8.987 -6.113 4.105 138 HB2 ALA 19 2HB ALA 19 7.456 -6.280 4.966 139 HB3 ALA 19 3HB ALA 19 7.711 -4.915 3.879 140 H SER 20 H SER 20 7.403 -6.386 7.151 141 HA SER 20 HA SER 20 8.982 -6.781 9.373 142 HB3 SER 20 2HB SER 20 6.786 -8.248 8.067 143 HG SER 20 HG SER 20 7.347 -10.175 8.661 144 H SER 21 H SER 21 8.944 -8.725 6.392 145 HA SER 21 HA SER 21 11.718 -9.181 6.392 146 HB3 SER 21 2HB SER 21 10.073 -11.531 7.366 147 HG SER 21 HG SER 21 12.827 -11.595 7.458 148 H SER 22 H SER 22 12.329 -10.924 4.787 149 HA SER 22 HA SER 22 10.245 -11.152 2.713 150 HB3 SER 22 2HB SER 22 11.974 -10.895 1.015 151 HG SER 22 HG SER 22 12.205 -8.769 1.272 152 H TYR 23 H TYR 23 10.692 -12.934 1.130 153 HA TYR 23 HA TYR 23 10.725 -15.399 2.351 154 HB3 TYR 23 2HB TYR 23 9.971 -14.888 0.006 155 HD1 TYR 23 1HD TYR 23 11.271 -12.769 -0.725 156 HD2 TYR 23 2HD TYR 23 12.753 -16.728 -1.205 157 HE1 TYR 23 1HE TYR 23 12.821 -11.972 -2.460 158 HE2 TYR 23 2HE TYR 23 14.307 -15.942 -2.940 159 HH TYR 23 HH TYR 23 14.691 -12.530 -3.655 160 H LYS 24 H LYS 24 13.417 -13.469 1.246 161 HA LYS 24 HA LYS 24 15.336 -15.607 1.606 162 HB3 LYS 24 2HB LYS 24 16.866 -13.394 1.338 163 HG3 LYS 24 2HG LYS 24 16.285 -13.732 -1.264 164 HD3 LYS 24 2HD LYS 24 18.364 -14.322 0.222 165 HE3 LYS 24 2HE LYS 24 16.750 -16.730 0.352 166 HZ1 LYS 24 3HZ LYS 24 19.587 -17.175 -0.344 167 HZ2 LYS 24 1HZ LYS 24 18.372 -17.234 -1.519 168 HZ3 LYS 24 2HZ LYS 24 18.342 -18.313 -0.217 169 H THR 25 H THR 25 16.687 -15.896 3.306 170 HA THR 25 HA THR 25 16.521 -13.965 5.523 171 HB THR 25 HB THR 25 15.179 -15.788 6.249 172 HG1 THR 25 1HG THR 25 16.322 -16.383 8.062 173 HG21 THR 25 3HG2 THR 25 17.298 -17.445 4.969 174 HG22 THR 25 1HG2 THR 25 15.543 -17.614 4.910 175 HG23 THR 25 2HG2 THR 25 16.429 -18.116 6.350 176 H TRP 26 H TRP 26 18.531 -13.247 4.362 177 HA TRP 26 HA TRP 26 20.847 -14.924 5.057 178 HB3 TRP 26 2HB TRP 26 21.472 -12.621 3.410 179 HD1 TRP 26 HD TRP 26 20.894 -16.373 2.572 180 HE1 TRP 26 1HE TRP 26 23.149 -17.368 1.830 181 HE3 TRP 26 3HE TRP 26 23.855 -12.258 3.236 182 HZ2 TRP 26 2HZ TRP 26 25.828 -16.522 1.562 183 HZ3 TRP 26 3HZ TRP 26 26.253 -12.435 2.714 184 HH2 TRP 26 HH TRP 26 27.218 -14.524 1.896 185 H ASN 27 H ASN 27 19.307 -13.113 6.856 186 HA ASN 27 HA ASN 27 21.488 -11.996 8.251 187 HB3 ASN 27 2HB ASN 27 19.880 -9.668 7.650 188 HD21 ASN 27 1HD2 ASN 27 22.564 -9.841 5.667 189 HD22 ASN 27 2HD2 ASN 27 23.718 -9.111 6.726 190 H LEU 28 H LEU 28 20.331 -10.066 9.770 191 HA LEU 28 HA LEU 28 17.702 -10.886 10.632 192 HB3 LEU 28 2HB LEU 28 19.775 -11.016 12.762 193 HG LEU 28 HG LEU 28 17.374 -11.283 13.356 194 HD11 LEU 28 1HD1 LEU 28 17.639 -13.662 11.542 195 HD12 LEU 28 2HD1 LEU 28 16.435 -12.374 11.500 196 HD13 LEU 28 3HD1 LEU 28 16.407 -13.565 12.800 197 HD21 LEU 28 3HD2 LEU 28 19.387 -12.364 14.549 198 HD22 LEU 28 1HD2 LEU 28 18.803 -13.871 13.842 199 HD23 LEU 28 2HD2 LEU 28 17.766 -12.949 14.931 200 H ARG 29 H ARG 29 18.558 -8.470 9.630 201 HA ARG 29 HA ARG 29 17.626 -6.653 11.536 202 HB3 ARG 29 2HB ARG 29 20.349 -5.744 11.186 203 HG3 ARG 29 2HG ARG 29 19.122 -6.507 13.802 204 HD3 ARG 29 2HD ARG 29 20.352 -4.640 14.633 205 HE ARG 29 HE ARG 29 21.740 -6.703 13.389 206 HH11 ARG 29 1HH1 ARG 29 22.306 -3.422 14.406 207 HH12 ARG 29 2HH1 ARG 29 23.999 -3.663 14.687 208 HH21 ARG 29 1HH2 ARG 29 23.968 -7.033 13.754 209 HH22 ARG 29 2HH2 ARG 29 24.943 -5.717 14.315 210 H ALA 30 H ALA 30 18.728 -4.288 10.794 211 HA ALA 30 HA ALA 30 18.807 -2.706 9.154 212 HB1 ALA 30 1HB ALA 30 18.976 -4.131 6.741 213 HB2 ALA 30 2HB ALA 30 20.284 -3.345 7.626 214 HB3 ALA 30 3HB ALA 30 19.916 -5.045 7.922 215 H PHE 31 H PHE 31 17.335 -5.316 7.250 216 HA PHE 31 HA PHE 31 15.302 -5.519 6.255 217 HB3 PHE 31 2HB PHE 31 13.355 -4.829 7.463 218 HD1 PHE 31 2HD PHE 31 14.377 -7.292 7.750 219 HD2 PHE 31 1HD PHE 31 14.793 -4.089 10.522 220 HE1 PHE 31 2HE PHE 31 14.785 -8.913 9.557 221 HE2 PHE 31 1HE PHE 31 15.204 -5.704 12.332 222 HZ PHE 31 HZ PHE 31 15.199 -8.119 11.851 223 H GLY 32 H GLY 32 16.975 -3.756 5.040 224 HA2 GLY 32 2HA GLY 32 15.107 -1.658 4.131 225 HA3 GLY 32 3HA GLY 32 16.811 -1.314 4.391 226 H TRP 33 H TRP 33 17.937 -3.623 3.296 227 HA TRP 33 HA TRP 33 17.742 -2.978 0.500 228 HB3 TRP 33 2HB TRP 33 19.891 -3.537 1.693 229 HD1 TRP 33 HD TRP 33 19.404 -4.955 4.019 230 HE1 TRP 33 1HE TRP 33 19.755 -7.459 4.501 231 HE3 TRP 33 3HE TRP 33 19.587 -6.686 -0.786 232 HZ2 TRP 33 2HZ TRP 33 20.069 -9.851 3.036 233 HZ3 TRP 33 3HZ TRP 33 19.917 -9.097 -1.160 234 HH2 TRP 33 HH TRP 33 20.153 -10.644 0.714 235 H TYR 34 H TYR 34 16.478 -5.404 2.618 236 HA TYR 34 HA TYR 34 16.003 -7.530 0.924 237 HB3 TYR 34 2HB TYR 34 13.726 -7.517 2.429 238 HD1 TYR 34 2HD TYR 34 15.318 -9.606 1.389 239 HD2 TYR 34 1HD TYR 34 15.693 -7.667 5.158 240 HE1 TYR 34 2HE TYR 34 16.410 -11.610 2.305 241 HE2 TYR 34 1HE TYR 34 16.787 -9.665 6.084 242 HH TYR 34 HH TYR 34 17.467 -11.740 5.696 243 HA PRO 35 HA PRO 35 11.805 -5.562 -0.424 244 HB3 PRO 35 2HB PRO 35 10.873 -4.373 1.307 245 HG3 PRO 35 2HG PRO 35 12.204 -3.208 2.815 246 HD3 PRO 35 2HD PRO 35 13.258 -5.258 2.857 247 H HIS 36 H HIS 36 11.166 -3.315 -1.690 248 HA HIS 36 HA HIS 36 11.608 -2.001 -3.495 249 HB3 HIS 36 2HB HIS 36 14.508 -1.993 -2.675 250 HD1 HIS 36 1HD HIS 36 14.841 -1.363 -5.259 251 HD2 HIS 36 2HD HIS 36 12.671 1.352 -2.980 252 HE1 HIS 36 1HE HIS 36 14.811 0.766 -6.598 253 H LEU 37 H LEU 37 11.232 -4.346 -4.372 254 HA LEU 37 HA LEU 37 13.583 -5.233 -5.892 255 HB3 LEU 37 2HB LEU 37 12.124 -7.250 -6.366 256 HG LEU 37 HG LEU 37 12.491 -8.398 -4.319 257 HD11 LEU 37 1HD1 LEU 37 14.797 -8.000 -3.942 258 HD12 LEU 37 2HD1 LEU 37 14.662 -6.319 -4.459 259 HD13 LEU 37 3HD1 LEU 37 14.487 -7.620 -5.637 260 HD21 LEU 37 3HD2 LEU 37 13.292 -6.090 -2.703 261 HD22 LEU 37 1HD2 LEU 37 12.338 -7.509 -2.268 262 HD23 LEU 37 2HD2 LEU 37 11.570 -6.148 -3.086 263 H GLY 38 H GLY 38 10.308 -4.034 -6.210 264 HA2 GLY 38 2HA GLY 38 9.900 -4.557 -8.938 265 HA3 GLY 38 3HA GLY 38 9.128 -3.270 -8.024 266 H ARG 39 H ARG 39 11.217 -1.655 -7.353 267 HA ARG 39 HA ARG 39 12.085 0.261 -8.324 268 HB3 ARG 39 2HB ARG 39 14.138 -0.688 -8.014 269 HG3 ARG 39 2HG ARG 39 13.291 -2.917 -9.841 270 HD3 ARG 39 2HD ARG 39 15.987 -2.176 -8.772 271 HE ARG 39 HE ARG 39 15.709 -4.899 -9.678 272 HH11 ARG 39 1HH1 ARG 39 15.770 -2.760 -6.932 273 HH12 ARG 39 2HH1 ARG 39 16.217 -4.003 -5.810 274 HH21 ARG 39 1HH2 ARG 39 16.298 -6.543 -8.211 275 HH22 ARG 39 2HH2 ARG 39 16.519 -6.154 -6.539 276 H LEU 40 H LEU 40 13.197 -1.482 -11.090 277 HA LEU 40 HA LEU 40 11.090 -1.084 -12.875 278 HB3 LEU 40 2HB LEU 40 13.023 1.198 -12.634 279 HG LEU 40 HG LEU 40 11.999 0.212 -15.131 280 HD11 LEU 40 1HD1 LEU 40 10.653 1.881 -15.912 281 HD12 LEU 40 2HD1 LEU 40 11.280 3.074 -14.776 282 HD13 LEU 40 3HD1 LEU 40 10.141 1.847 -14.225 283 HD21 LEU 40 3HD2 LEU 40 13.641 2.614 -14.341 284 HD22 LEU 40 1HD2 LEU 40 13.399 2.060 -15.998 285 HD23 LEU 40 2HD2 LEU 40 14.244 1.032 -14.840 286 H ASP 41 H ASP 41 11.560 -2.665 -14.241 287 HA ASP 41 HA ASP 41 12.665 -3.988 -15.726 288 HB3 ASP 41 2HB ASP 41 14.799 -1.862 -15.863 289 H ASN 42 H ASN 42 12.995 -5.163 -13.577 290 HA ASN 42 HA ASN 42 15.347 -5.164 -12.138 291 HB3 ASN 42 2HB ASN 42 13.231 -6.503 -11.686 292 HD21 ASN 42 1HD2 ASN 42 12.308 -6.902 -13.876 293 HD22 ASN 42 2HD2 ASN 42 12.432 -8.506 -14.509 294 H GLN 43 H GLN 43 16.971 -7.043 -12.139 295 HA GLN 43 HA GLN 43 17.891 -7.491 -14.901 296 HB3 GLN 43 2HB GLN 43 19.508 -6.070 -14.035 297 HG3 GLN 43 2HG GLN 43 20.539 -6.726 -11.690 298 HE21 GLN 43 1HE2 GLN 43 19.848 -5.329 -9.872 299 HE22 GLN 43 2HE2 GLN 43 19.037 -3.852 -10.253 300 H GLY 44 H GLY 44 16.972 -8.915 -11.949 301 HA2 GLY 44 2HA GLY 44 18.290 -11.456 -12.618 302 HA3 GLY 44 3HA GLY 44 17.568 -11.055 -11.068 303 H LYS 45 H LYS 45 15.197 -10.865 -11.005 304 HA LYS 45 HA LYS 45 13.463 -11.658 -13.011 305 HB3 LYS 45 2HB LYS 45 14.401 -13.796 -13.192 306 HG3 LYS 45 2HG LYS 45 15.770 -13.621 -11.074 307 HD3 LYS 45 2HD LYS 45 13.132 -13.992 -9.939 308 HE3 LYS 45 2HE LYS 45 14.996 -16.214 -9.728 309 HZ1 LYS 45 3HZ LYS 45 14.843 -14.587 -7.475 310 HZ2 LYS 45 1HZ LYS 45 15.526 -16.131 -7.596 311 HZ3 LYS 45 2HZ LYS 45 13.902 -15.956 -7.153 312 H ILE 46 H ILE 46 14.282 -11.400 -9.677 313 HA ILE 46 HA ILE 46 11.902 -11.987 -8.394 314 HB ILE 46 HB ILE 46 13.774 -9.721 -7.703 315 HG13 ILE 46 2HG1 ILE 46 14.020 -12.643 -7.514 316 HG21 ILE 46 1HG2 ILE 46 12.208 -9.294 -6.164 317 HG22 ILE 46 2HG2 ILE 46 11.396 -10.836 -6.431 318 HG23 ILE 46 3HG2 ILE 46 12.795 -10.750 -5.362 319 HD11 ILE 46 3HD1 ILE 46 15.910 -11.927 -8.469 320 HD12 ILE 46 1HD1 ILE 46 15.772 -10.311 -7.777 321 HD13 ILE 46 2HD1 ILE 46 16.424 -11.633 -6.807 322 H ASN 47 H ASN 47 12.926 -8.653 -9.138 323 HA ASN 47 HA ASN 47 11.668 -6.751 -9.387 324 HB3 ASN 47 2HB ASN 47 11.683 -7.741 -11.656 325 HD21 ASN 47 1HD2 ASN 47 11.283 -9.497 -12.766 326 HD22 ASN 47 2HD2 ASN 47 9.885 -10.502 -12.625 327 H ALA 48 H ALA 48 10.813 -8.405 -7.191 328 HA ALA 48 HA ALA 48 8.416 -7.133 -6.510 329 HB1 ALA 48 1HB ALA 48 6.867 -8.363 -7.522 330 HB2 ALA 48 2HB ALA 48 8.070 -9.530 -8.074 331 HB3 ALA 48 3HB ALA 48 7.340 -9.703 -6.477 332 H TRP 49 H TRP 49 8.365 -7.077 -4.359 333 HA TRP 49 HA TRP 49 10.189 -8.664 -2.827 334 HB3 TRP 49 2HB TRP 49 8.146 -6.564 -2.139 335 HD1 TRP 49 HD TRP 49 11.045 -7.310 0.179 336 HE1 TRP 49 1HE TRP 49 10.130 -8.053 2.467 337 HE3 TRP 49 3HE TRP 49 6.109 -7.823 -1.048 338 HZ2 TRP 49 2HZ TRP 49 7.645 -8.764 3.601 339 HZ3 TRP 49 3HZ TRP 49 4.528 -8.538 0.696 340 HH2 TRP 49 HH TRP 49 5.282 -8.999 2.971 341 H THR 50 H THR 50 9.815 -10.429 -1.611 342 HA THR 50 HA THR 50 7.068 -11.491 -1.596 343 HB THR 50 HB THR 50 9.350 -13.305 -1.031 344 HG1 THR 50 1HG THR 50 9.869 -11.900 -2.936 345 HG21 THR 50 3HG2 THR 50 7.178 -14.268 -1.006 346 HG22 THR 50 1HG2 THR 50 7.935 -14.788 -2.511 347 HG23 THR 50 2HG2 THR 50 6.740 -13.491 -2.526 348 H ALA 51 H ALA 51 6.587 -12.956 0.280 349 HA ALA 51 HA ALA 51 7.290 -11.580 2.731 350 HB1 ALA 51 1HB ALA 51 5.313 -13.738 2.060 351 HB2 ALA 51 2HB ALA 51 5.636 -13.244 3.722 352 HB3 ALA 51 3HB ALA 51 5.002 -12.076 2.562 353 H GLN 52 H GLN 52 7.946 -12.759 4.667 354 HA GLN 52 HA GLN 52 10.062 -14.636 4.050 355 HB3 GLN 52 2HB GLN 52 9.203 -13.427 6.684 356 HG3 GLN 52 2HG GLN 52 11.971 -14.333 6.332 357 HE21 GLN 52 1HE2 GLN 52 12.931 -14.330 8.252 358 HE22 GLN 52 2HE2 GLN 52 12.125 -14.194 9.775 359 H SER 53 H SER 53 7.348 -14.602 6.368 360 HA SER 53 HA SER 53 7.468 -17.520 6.498 361 HB3 SER 53 2HB SER 53 5.828 -17.235 8.376 362 HG SER 53 HG SER 53 7.372 -16.220 9.772 363 H ASN 54 H ASN 54 6.185 -15.535 4.398 364 HA ASN 54 HA ASN 54 4.261 -15.392 3.149 365 HB3 ASN 54 2HB ASN 54 5.325 -17.365 2.213 366 HD21 ASN 54 1HD2 ASN 54 6.616 -18.566 3.593 367 HD22 ASN 54 2HD2 ASN 54 6.033 -19.975 4.407 368 H SER 55 H SER 55 3.475 -14.729 5.576 369 HA SER 55 HA SER 55 0.943 -16.187 5.932 370 HB3 SER 55 2HB SER 55 2.207 -14.884 8.301 371 HG SER 55 HG SER 55 0.825 -17.344 8.023 372 H ALA 56 H ALA 56 -0.254 -14.601 7.794 373 HA ALA 56 HA ALA 56 -0.710 -12.155 6.259 374 HB1 ALA 56 1HB ALA 56 -2.433 -13.952 7.465 375 HB2 ALA 56 2HB ALA 56 -2.464 -12.550 8.535 376 HB3 ALA 56 3HB ALA 56 -2.855 -12.363 6.826 377 H LYS 57 H LYS 57 1.213 -13.059 8.743 378 HA LYS 57 HA LYS 57 0.802 -10.749 10.449 379 HB3 LYS 57 2HB LYS 57 2.629 -11.667 11.787 380 HG3 LYS 57 2HG LYS 57 0.384 -13.415 10.989 381 HD3 LYS 57 2HD LYS 57 2.907 -14.395 12.223 382 HE3 LYS 57 2HE LYS 57 0.941 -16.238 12.945 383 HZ1 LYS 57 3HZ LYS 57 2.174 -16.214 14.770 384 HZ2 LYS 57 1HZ LYS 57 1.745 -14.618 15.131 385 HZ3 LYS 57 2HZ LYS 57 3.062 -14.931 14.117 386 H GLU 58 H GLU 58 2.047 -11.007 7.510 387 HA GLU 58 HA GLU 58 4.525 -9.554 7.922 388 HB3 GLU 58 2HB GLU 58 4.736 -9.652 5.475 389 HG3 GLU 58 2HG GLU 58 4.305 -12.254 5.250 390 H TRP 59 H TRP 59 4.945 -7.501 6.875 391 HA TRP 59 HA TRP 59 2.761 -5.891 5.947 392 HB3 TRP 59 2HB TRP 59 2.199 -5.599 8.222 393 HD1 TRP 59 HD TRP 59 5.889 -4.393 8.458 394 HE1 TRP 59 1HE TRP 59 6.859 -5.262 10.678 395 HE3 TRP 59 3HE TRP 59 1.841 -7.028 10.134 396 HZ2 TRP 59 2HZ TRP 59 6.018 -6.853 12.852 397 HZ3 TRP 59 3HZ TRP 59 2.007 -8.195 12.293 398 HH2 TRP 59 HH TRP 59 4.053 -8.110 13.623 399 H LEU 60 H LEU 60 3.457 -4.115 4.820 400 HA LEU 60 HA LEU 60 6.372 -3.700 4.733 401 HB3 LEU 60 2HB LEU 60 4.364 -3.279 2.524 402 HG LEU 60 HG LEU 60 6.995 -2.298 2.675 403 HD11 LEU 60 1HD1 LEU 60 7.074 -4.099 0.366 404 HD12 LEU 60 2HD1 LEU 60 7.243 -4.901 1.927 405 HD13 LEU 60 3HD1 LEU 60 8.356 -3.610 1.474 406 HD21 LEU 60 3HD2 LEU 60 5.008 -2.630 0.440 407 HD22 LEU 60 1HD2 LEU 60 6.525 -1.749 0.255 408 HD23 LEU 60 2HD2 LEU 60 5.321 -1.196 1.420 409 H GLN 61 H GLN 61 7.088 -1.760 5.310 410 HA GLN 61 HA GLN 61 5.201 0.502 5.252 411 HB3 GLN 61 2HB GLN 61 6.191 1.371 7.261 412 HG3 GLN 61 2HG GLN 61 4.941 -1.179 7.240 413 HE21 GLN 61 1HE2 GLN 61 7.233 -2.300 7.219 414 HE22 GLN 61 2HE2 GLN 61 7.738 -2.884 8.764 415 H VAL 62 H VAL 62 5.834 2.283 4.201 416 HA VAL 62 HA VAL 62 8.619 2.384 3.243 417 HB VAL 62 HB VAL 62 6.262 3.773 1.975 418 HG11 VAL 62 1HG1 VAL 62 7.796 3.816 0.008 419 HG12 VAL 62 2HG1 VAL 62 8.358 4.767 1.384 420 HG13 VAL 62 3HG1 VAL 62 9.070 3.189 1.051 421 HG21 VAL 62 3HG2 VAL 62 7.251 0.987 1.684 422 HG22 VAL 62 1HG2 VAL 62 5.611 1.626 1.568 423 HG23 VAL 62 2HG2 VAL 62 6.737 1.838 0.228 424 H ASP 63 H ASP 63 9.854 3.964 3.998 425 HA ASP 63 HA ASP 63 8.550 6.303 5.220 426 HB3 ASP 63 2HB ASP 63 11.246 5.057 5.787 427 H LEU 64 H LEU 64 8.794 8.203 4.253 428 HA LEU 64 HA LEU 64 10.886 8.472 2.206 429 HB3 LEU 64 2HB LEU 64 9.384 10.537 1.624 430 HG LEU 64 HG LEU 64 9.569 8.660 0.070 431 HD11 LEU 64 1HD1 LEU 64 9.045 6.854 1.631 432 HD12 LEU 64 2HD1 LEU 64 8.025 6.782 0.195 433 HD13 LEU 64 3HD1 LEU 64 7.371 7.405 1.709 434 HD21 LEU 64 3HD2 LEU 64 7.717 10.522 0.016 435 HD22 LEU 64 1HD2 LEU 64 6.640 9.150 0.274 436 HD23 LEU 64 2HD2 LEU 64 7.696 9.188 -1.138 437 H GLY 65 H GLY 65 9.163 10.532 4.563 438 HA2 GLY 65 2HA GLY 65 9.965 12.132 6.010 439 HA3 GLY 65 3HA GLY 65 11.578 11.497 5.722 440 H THR 66 H THR 66 10.142 12.235 2.803 441 HA THR 66 HA THR 66 11.579 14.801 2.700 442 HB THR 66 HB THR 66 12.448 13.172 1.122 443 HG1 THR 66 1HG THR 66 10.870 15.059 -0.313 444 HG21 THR 66 3HG2 THR 66 10.451 12.887 -0.804 445 HG22 THR 66 1HG2 THR 66 9.642 12.587 0.734 446 HG23 THR 66 2HG2 THR 66 11.060 11.638 0.283 447 H GLN 67 H GLN 67 8.508 13.559 2.914 448 HA GLN 67 HA GLN 67 6.410 14.347 2.495 449 HB3 GLN 67 2HB GLN 67 7.462 17.136 2.378 450 HG3 GLN 67 2HG GLN 67 5.072 15.760 3.405 451 HE21 GLN 67 1HE2 GLN 67 4.044 18.408 4.221 452 HE22 GLN 67 2HE2 GLN 67 4.582 18.625 5.849 453 H ARG 68 H ARG 68 6.398 13.437 0.357 454 HA ARG 68 HA ARG 68 6.593 15.466 -1.772 455 HB3 ARG 68 2HB ARG 68 6.783 13.380 -3.280 456 HG3 ARG 68 2HG ARG 68 9.233 13.032 -2.663 457 HD3 ARG 68 2HD ARG 68 8.203 15.820 -3.180 458 HE ARG 68 HE ARG 68 10.425 16.323 -3.169 459 HH11 ARG 68 1HH1 ARG 68 10.024 13.114 -4.457 460 HH12 ARG 68 2HH1 ARG 68 11.699 12.925 -4.858 461 HH21 ARG 68 1HH2 ARG 68 12.632 16.087 -3.693 462 HH22 ARG 68 2HH2 ARG 68 13.182 14.616 -4.423 463 H GLN 69 H GLN 69 4.959 15.562 -3.326 464 HA GLN 69 HA GLN 69 2.382 14.601 -2.395 465 HB3 GLN 69 2HB GLN 69 3.310 16.632 -4.370 466 HG3 GLN 69 2HG GLN 69 0.632 15.288 -4.448 467 HE21 GLN 69 1HE2 GLN 69 1.171 17.212 -7.044 468 HE22 GLN 69 2HE2 GLN 69 0.225 18.586 -6.595 469 H VAL 70 H VAL 70 1.594 12.720 -3.041 470 HA VAL 70 HA VAL 70 2.689 11.358 -5.344 471 HB VAL 70 HB VAL 70 1.246 9.494 -4.706 472 HG11 VAL 70 1HG1 VAL 70 2.224 9.008 -2.535 473 HG12 VAL 70 2HG1 VAL 70 3.413 9.779 -3.587 474 HG13 VAL 70 3HG1 VAL 70 2.623 10.711 -2.314 475 HG21 VAL 70 3HG2 VAL 70 -0.242 11.558 -3.397 476 HG22 VAL 70 1HG2 VAL 70 -0.682 9.873 -3.672 477 HG23 VAL 70 2HG2 VAL 70 0.211 10.325 -2.220 478 H THR 71 H THR 71 1.662 10.902 -7.247 479 HA THR 71 HA THR 71 -0.984 12.133 -7.658 480 HB THR 71 HB THR 71 0.678 11.960 -10.063 481 HG1 THR 71 1HG THR 71 1.434 13.725 -7.952 482 HG21 THR 71 3HG2 THR 71 -0.192 14.597 -9.387 483 HG22 THR 71 1HG2 THR 71 -1.497 13.459 -9.053 484 HG23 THR 71 2HG2 THR 71 -0.781 13.532 -10.664 485 H GLY 72 H GLY 72 0.238 9.292 -7.227 486 HA2 GLY 72 2HA GLY 72 -1.625 7.676 -8.220 487 HA3 GLY 72 3HA GLY 72 -0.660 7.962 -9.661 488 H ILE 73 H ILE 73 -1.180 5.525 -7.972 489 HA ILE 73 HA ILE 73 1.643 4.815 -7.514 490 HB ILE 73 HB ILE 73 0.768 3.144 -5.828 491 HG13 ILE 73 2HG1 ILE 73 -1.683 3.786 -6.790 492 HG21 ILE 73 1HG2 ILE 73 0.045 5.578 -4.497 493 HG22 ILE 73 2HG2 ILE 73 1.513 4.613 -4.341 494 HG23 ILE 73 3HG2 ILE 73 1.409 5.865 -5.579 495 HD11 ILE 73 3HD1 ILE 73 -0.985 1.929 -5.169 496 HD12 ILE 73 1HD1 ILE 73 -1.451 3.060 -3.900 497 HD13 ILE 73 2HD1 ILE 73 -2.640 2.533 -5.092 498 H ILE 74 H ILE 74 2.259 2.673 -8.015 499 HA ILE 74 HA ILE 74 0.328 1.126 -9.601 500 HB ILE 74 HB ILE 74 1.920 2.475 -11.051 501 HG13 ILE 74 2HG1 ILE 74 1.220 -0.360 -11.187 502 HG21 ILE 74 1HG2 ILE 74 3.881 2.009 -9.513 503 HG22 ILE 74 2HG2 ILE 74 3.942 0.405 -10.241 504 HG23 ILE 74 3HG2 ILE 74 4.182 1.837 -11.242 505 HD11 ILE 74 3HD1 ILE 74 1.425 1.535 -13.492 506 HD12 ILE 74 1HD1 ILE 74 0.354 0.151 -13.283 507 HD13 ILE 74 2HD1 ILE 74 0.091 1.619 -12.342 508 H THR 75 H THR 75 0.401 -1.042 -9.321 509 HA THR 75 HA THR 75 2.610 -2.144 -7.715 510 HB THR 75 HB THR 75 0.286 -1.768 -6.535 511 HG1 THR 75 1HG THR 75 1.430 -4.341 -6.247 512 HG21 THR 75 3HG2 THR 75 -1.370 -3.308 -6.887 513 HG22 THR 75 1HG2 THR 75 -0.250 -4.547 -7.451 514 HG23 THR 75 2HG2 THR 75 -0.710 -3.220 -8.520 515 H GLN 76 H GLN 76 3.131 -4.328 -8.091 516 HA GLN 76 HA GLN 76 1.805 -5.639 -10.348 517 HB3 GLN 76 2HB GLN 76 4.481 -6.241 -10.749 518 HG3 GLN 76 2HG GLN 76 4.097 -4.196 -12.505 519 HE21 GLN 76 1HE2 GLN 76 5.485 -6.456 -12.523 520 HE22 GLN 76 2HE2 GLN 76 4.885 -7.559 -13.709 521 H GLY 77 H GLY 77 2.278 -7.934 -10.509 522 HA2 GLY 77 2HA GLY 77 2.911 -9.065 -7.859 523 HA3 GLY 77 3HA GLY 77 1.859 -9.816 -9.049 524 H ALA 78 H ALA 78 3.793 -11.331 -7.929 525 HA ALA 78 HA ALA 78 5.719 -11.643 -10.136 526 HB1 ALA 78 1HB ALA 78 7.396 -11.314 -8.722 527 HB2 ALA 78 2HB ALA 78 6.277 -11.169 -7.365 528 HB3 ALA 78 3HB ALA 78 6.890 -12.754 -7.838 529 H ARG 79 H ARG 79 6.781 -13.946 -9.906 530 HA ARG 79 HA ARG 79 4.739 -15.919 -9.170 531 HB3 ARG 79 2HB ARG 79 4.408 -15.635 -11.521 532 HG3 ARG 79 2HG ARG 79 7.298 -16.251 -12.043 533 HD3 ARG 79 2HD ARG 79 5.040 -15.187 -13.734 534 HE ARG 79 HE ARG 79 7.736 -14.739 -14.172 535 HH11 ARG 79 1HH1 ARG 79 5.075 -16.247 -15.836 536 HH12 ARG 79 2HH1 ARG 79 5.699 -15.905 -17.416 537 HH21 ARG 79 1HH2 ARG 79 8.568 -14.285 -16.246 538 HH22 ARG 79 2HH2 ARG 79 7.687 -14.790 -17.648 539 H ASP 80 H ASP 80 5.537 -18.006 -8.702 540 HA ASP 80 HA ASP 80 8.264 -17.989 -7.720 541 HB3 ASP 80 2HB ASP 80 6.088 -20.080 -7.514 542 H PHE 81 H PHE 81 8.980 -17.837 -10.069 543 HA PHE 81 HA PHE 81 10.081 -18.776 -11.822 544 HB3 PHE 81 2HB PHE 81 11.102 -20.922 -11.527 545 HD1 PHE 81 2HD PHE 81 12.923 -19.433 -10.963 546 HD2 PHE 81 1HD PHE 81 10.039 -20.580 -8.051 547 HE1 PHE 81 2HE PHE 81 14.401 -18.605 -9.180 548 HE2 PHE 81 1HE PHE 81 11.512 -19.754 -6.262 549 HZ PHE 81 HZ PHE 81 13.697 -18.766 -6.825 550 H GLY 82 H GLY 82 7.104 -18.819 -11.620 551 HA2 GLY 82 2HA GLY 82 6.247 -19.636 -13.979 552 HA3 GLY 82 3HA GLY 82 6.404 -21.191 -13.176 553 H HIS 83 H HIS 83 5.482 -20.741 -10.681 554 HA HIS 83 HA HIS 83 2.668 -20.645 -11.086 555 HB3 HIS 83 2HB HIS 83 2.537 -20.915 -8.623 556 HD1 HIS 83 1HD HIS 83 5.634 -22.747 -8.586 557 HD2 HIS 83 2HD HIS 83 1.875 -23.304 -10.267 558 HE1 HIS 83 1HE HIS 83 5.499 -25.198 -9.136 559 H ILE 84 H ILE 84 1.449 -18.894 -11.249 560 HA ILE 84 HA ILE 84 2.419 -16.282 -10.707 561 HB ILE 84 HB ILE 84 -0.383 -17.254 -11.271 562 HG13 ILE 84 2HG1 ILE 84 1.508 -17.458 -13.020 563 HG21 ILE 84 1HG2 ILE 84 -1.063 -15.251 -10.573 564 HG22 ILE 84 2HG2 ILE 84 0.591 -14.660 -10.421 565 HG23 ILE 84 3HG2 ILE 84 -0.233 -14.583 -11.978 566 HD11 ILE 84 3HD1 ILE 84 -0.801 -17.634 -13.708 567 HD12 ILE 84 1HD1 ILE 84 -0.956 -15.877 -13.715 568 HD13 ILE 84 2HD1 ILE 84 0.111 -16.674 -14.871 569 H GLN 85 H GLN 85 2.621 -15.362 -8.786 570 HA GLN 85 HA GLN 85 0.694 -16.074 -6.674 571 HB3 GLN 85 2HB GLN 85 2.375 -15.987 -5.043 572 HG3 GLN 85 2HG GLN 85 3.929 -17.046 -7.384 573 HE21 GLN 85 1HE2 GLN 85 5.264 -15.908 -5.361 574 HE22 GLN 85 2HE2 GLN 85 5.932 -17.107 -4.310 575 H TYR 86 H TYR 86 0.006 -14.421 -5.277 576 HA TYR 86 HA TYR 86 0.898 -11.765 -5.340 577 HB3 TYR 86 2HB TYR 86 -1.629 -12.189 -6.947 578 HD1 TYR 86 2HD TYR 86 1.172 -9.725 -6.891 579 HD2 TYR 86 1HD TYR 86 -3.010 -10.384 -6.474 580 HE1 TYR 86 2HE TYR 86 0.812 -7.297 -6.720 581 HE2 TYR 86 1HE TYR 86 -3.382 -7.959 -6.303 582 HH TYR 86 HH TYR 86 -1.590 -5.876 -5.482 583 H VAL 87 H VAL 87 -0.495 -10.309 -4.113 584 HA VAL 87 HA VAL 87 -2.046 -11.795 -2.132 585 HB VAL 87 HB VAL 87 -1.494 -10.222 -0.607 586 HG11 VAL 87 1HG1 VAL 87 0.603 -10.893 -1.953 587 HG12 VAL 87 2HG1 VAL 87 0.552 -9.237 -2.561 588 HG13 VAL 87 3HG1 VAL 87 0.717 -9.537 -0.831 589 HG21 VAL 87 3HG2 VAL 87 -2.824 -8.443 -1.424 590 HG22 VAL 87 1HG2 VAL 87 -1.204 -7.780 -1.201 591 HG23 VAL 87 2HG2 VAL 87 -1.771 -8.199 -2.818 592 H ALA 88 H ALA 88 -4.182 -11.454 -1.723 593 HA ALA 88 HA ALA 88 -5.657 -9.937 -3.736 594 HB1 ALA 88 1HB ALA 88 -7.646 -11.108 -2.735 595 HB2 ALA 88 2HB ALA 88 -6.440 -12.161 -3.477 596 HB3 ALA 88 3HB ALA 88 -6.513 -12.002 -1.722 597 H SER 89 H SER 89 -6.046 -10.464 -0.226 598 HA SER 89 HA SER 89 -7.231 -7.810 0.010 599 HB3 SER 89 2HB SER 89 -6.898 -9.476 2.433 600 HG SER 89 HG SER 89 -9.402 -8.745 1.633 601 H TYR 90 H TYR 90 -6.244 -6.101 0.899 602 HA TYR 90 HA TYR 90 -4.092 -6.330 2.766 603 HB3 TYR 90 2HB TYR 90 -2.844 -6.826 0.722 604 HD1 TYR 90 2HD TYR 90 -4.287 -6.919 -1.301 605 HD2 TYR 90 1HD TYR 90 -2.675 -3.255 0.140 606 HE1 TYR 90 2HE TYR 90 -4.750 -5.866 -3.476 607 HE2 TYR 90 1HE TYR 90 -3.134 -2.192 -2.030 608 HH TYR 90 HH TYR 90 -5.002 -3.782 -4.495 609 H LYS 91 H LYS 91 -3.689 -4.417 3.831 610 HA LYS 91 HA LYS 91 -5.420 -2.161 3.068 611 HB3 LYS 91 2HB LYS 91 -4.361 -2.075 5.779 612 HG3 LYS 91 2HG LYS 91 -7.018 -2.286 6.093 613 HD3 LYS 91 2HD LYS 91 -6.083 0.306 4.987 614 HE3 LYS 91 2HE LYS 91 -8.049 -0.623 6.796 615 HZ1 LYS 91 3HZ LYS 91 -7.328 1.287 8.485 616 HZ2 LYS 91 1HZ LYS 91 -5.798 0.681 8.092 617 HZ3 LYS 91 2HZ LYS 91 -6.973 -0.348 8.740 618 H VAL 92 H VAL 92 -4.295 -0.638 2.048 619 HA VAL 92 HA VAL 92 -1.610 0.031 3.065 620 HB VAL 92 HB VAL 92 -1.411 -0.835 0.830 621 HG11 VAL 92 1HG1 VAL 92 -3.921 0.412 0.444 622 HG12 VAL 92 2HG1 VAL 92 -2.793 1.111 -0.720 623 HG13 VAL 92 3HG1 VAL 92 -3.036 -0.636 -0.666 624 HG21 VAL 92 3HG2 VAL 92 -0.310 1.449 1.627 625 HG22 VAL 92 1HG2 VAL 92 -0.047 0.794 0.010 626 HG23 VAL 92 2HG2 VAL 92 -1.236 2.073 0.262 627 H ALA 93 H ALA 93 -1.549 1.903 4.102 628 HA ALA 93 HA ALA 93 -3.332 4.072 3.203 629 HB1 ALA 93 1HB ALA 93 -3.413 2.810 5.663 630 HB2 ALA 93 2HB ALA 93 -2.526 4.301 5.977 631 HB3 ALA 93 3HB ALA 93 -4.134 4.367 5.257 632 H HIS 94 H HIS 94 -2.527 6.211 3.394 633 HA HIS 94 HA HIS 94 0.413 6.354 3.546 634 HB3 HIS 94 2HB HIS 94 0.198 8.335 2.022 635 HD1 HIS 94 1HD HIS 94 1.046 7.778 -0.257 636 HD2 HIS 94 2HD HIS 94 -1.326 4.756 1.325 637 HE1 HIS 94 1HE HIS 94 1.228 5.863 -1.877 638 H SER 95 H SER 95 1.361 7.955 4.741 639 HA SER 95 HA SER 95 -0.442 9.753 6.223 640 HB3 SER 95 2HB SER 95 2.066 8.624 7.446 641 HG SER 95 HG SER 95 -0.164 10.057 8.286 642 H ASP 96 H ASP 96 0.210 11.837 6.464 643 HA ASP 96 HA ASP 96 2.597 12.626 4.965 644 HB3 ASP 96 2HB ASP 96 0.102 14.066 5.814 645 H ASP 97 H ASP 97 1.053 13.087 8.119 646 HA ASP 97 HA ASP 97 3.455 14.413 9.125 647 HB3 ASP 97 2HB ASP 97 1.947 14.530 11.254 648 H GLY 98 H GLY 98 1.994 11.337 9.047 649 HA2 GLY 98 2HA GLY 98 3.297 9.421 9.705 650 HA3 GLY 98 3HA GLY 98 3.958 10.377 11.023 651 H VAL 99 H VAL 99 1.163 11.430 11.539 652 HA VAL 99 HA VAL 99 0.314 9.159 13.189 653 HB VAL 99 HB VAL 99 0.749 11.273 14.364 654 HG11 VAL 99 1HG1 VAL 99 -1.668 12.593 13.337 655 HG12 VAL 99 2HG1 VAL 99 -0.100 13.273 13.775 656 HG13 VAL 99 3HG1 VAL 99 -0.321 12.505 12.202 657 HG21 VAL 99 3HG2 VAL 99 -1.096 9.583 14.997 658 HG22 VAL 99 1HG2 VAL 99 -1.100 11.167 15.773 659 HG23 VAL 99 2HG2 VAL 99 -2.215 10.831 14.448 660 H GLN 100 H GLN 100 -0.801 11.362 10.701 661 HA GLN 100 HA GLN 100 -3.497 10.286 10.767 662 HB3 GLN 100 2HB GLN 100 -3.995 11.908 9.035 663 HG3 GLN 100 2HG GLN 100 -2.150 13.261 10.985 664 HE21 GLN 100 1HE2 GLN 100 -1.844 14.937 9.487 665 HE22 GLN 100 2HE2 GLN 100 -3.108 16.052 9.109 666 H TRP 101 H TRP 101 -3.528 8.218 10.053 667 HA TRP 101 HA TRP 101 -2.117 7.539 7.585 668 HB3 TRP 101 2HB TRP 101 -2.416 5.264 8.167 669 HD1 TRP 101 HD TRP 101 -0.327 7.473 9.308 670 HE1 TRP 101 1HE TRP 101 0.853 6.987 11.542 671 HE3 TRP 101 3HE TRP 101 -3.583 4.021 11.211 672 HZ2 TRP 101 2HZ TRP 101 0.458 5.355 13.811 673 HZ3 TRP 101 3HZ TRP 101 -3.108 3.045 13.419 674 HH2 TRP 101 HH TRP 101 -1.130 3.700 14.691 675 H THR 102 H THR 102 -3.208 8.045 5.795 676 HA THR 102 HA THR 102 -6.108 7.916 5.730 677 HB THR 102 HB THR 102 -4.134 8.730 3.589 678 HG1 THR 102 1HG THR 102 -4.338 10.131 5.464 679 HG21 THR 102 3HG2 THR 102 -6.124 9.689 2.463 680 HG22 THR 102 1HG2 THR 102 -7.148 8.908 3.667 681 HG23 THR 102 2HG2 THR 102 -6.176 7.930 2.567 682 H VAL 103 H VAL 103 -6.938 5.929 5.516 683 HA VAL 103 HA VAL 103 -5.617 3.959 3.821 684 HB VAL 103 HB VAL 103 -7.253 2.365 4.689 685 HG11 VAL 103 1HG1 VAL 103 -5.640 4.040 6.547 686 HG12 VAL 103 2HG1 VAL 103 -6.697 2.800 7.225 687 HG13 VAL 103 3HG1 VAL 103 -5.433 2.353 6.080 688 HG21 VAL 103 3HG2 VAL 103 -9.249 3.088 5.352 689 HG22 VAL 103 1HG2 VAL 103 -8.480 3.771 6.785 690 HG23 VAL 103 2HG2 VAL 103 -8.694 4.762 5.341 691 H TYR 104 H TYR 104 -7.504 2.464 2.749 692 HA TYR 104 HA TYR 104 -9.053 4.303 1.044 693 HB3 TYR 104 2HB TYR 104 -8.798 2.649 -0.766 694 HD1 TYR 104 2HD TYR 104 -7.899 5.135 -1.017 695 HD2 TYR 104 1HD TYR 104 -5.530 1.806 0.166 696 HE1 TYR 104 2HE TYR 104 -5.872 6.330 -1.735 697 HE2 TYR 104 1HE TYR 104 -3.496 2.992 -0.547 698 HH TYR 104 HH TYR 104 -2.806 5.442 -0.852 699 H GLU 105 H GLU 105 -10.895 4.161 2.375 700 HA GLU 105 HA GLU 105 -12.077 1.750 3.216 701 HB3 GLU 105 2HB GLU 105 -13.978 3.045 3.812 702 HG3 GLU 105 2HG GLU 105 -11.550 3.795 4.697 703 H GLU 106 H GLU 106 -14.494 1.329 2.491 704 HA GLU 106 HA GLU 106 -15.032 1.653 -0.302 705 HB3 GLU 106 2HB GLU 106 -14.763 -1.218 0.426 706 HG3 GLU 106 2HG GLU 106 -13.711 -1.059 -1.994 707 H GLN 107 H GLN 107 -15.729 -0.788 2.209 708 HA GLN 107 HA GLN 107 -18.393 -1.192 1.610 709 HB3 GLN 107 2HB GLN 107 -16.962 -2.480 3.253 710 HG3 GLN 107 2HG GLN 107 -17.855 -0.305 5.134 711 HE21 GLN 107 1HE2 GLN 107 -15.985 -0.791 7.042 712 HE22 GLN 107 2HE2 GLN 107 -16.285 -2.317 7.794 713 H GLY 108 H GLY 108 -16.900 1.445 3.337 714 HA2 GLY 108 2HA GLY 108 -18.413 3.500 3.067 715 HA3 GLY 108 3HA GLY 108 -19.559 2.535 3.985 716 H SER 109 H SER 109 -17.052 1.448 5.440 717 HA SER 109 HA SER 109 -16.863 3.700 7.331 718 HB3 SER 109 2HB SER 109 -16.181 1.738 8.935 719 HG SER 109 HG SER 109 -18.106 2.116 9.666 720 H SER 110 H SER 110 -14.978 0.760 6.597 721 HA SER 110 HA SER 110 -12.687 2.056 5.664 722 HB3 SER 110 2HB SER 110 -12.249 3.045 7.744 723 HG SER 110 HG SER 110 -12.948 0.575 8.960 724 H LYS 111 H LYS 111 -13.267 0.132 4.367 725 HA LYS 111 HA LYS 111 -12.383 -2.407 5.534 726 HB3 LYS 111 2HB LYS 111 -13.440 -2.221 2.751 727 HG3 LYS 111 2HG LYS 111 -12.830 -4.403 3.725 728 HD3 LYS 111 2HD LYS 111 -14.427 -3.400 5.920 729 HE3 LYS 111 2HE LYS 111 -16.182 -4.782 4.882 730 HZ1 LYS 111 3HZ LYS 111 -15.398 -7.336 5.326 731 HZ2 LYS 111 1HZ LYS 111 -14.014 -6.651 4.634 732 HZ3 LYS 111 2HZ LYS 111 -15.490 -6.591 3.808 733 H VAL 112 H VAL 112 -10.934 -3.788 4.311 734 HA VAL 112 HA VAL 112 -8.698 -2.305 3.272 735 HB VAL 112 HB VAL 112 -7.526 -4.398 3.185 736 HG11 VAL 112 1HG1 VAL 112 -8.946 -5.064 5.627 737 HG12 VAL 112 2HG1 VAL 112 -7.295 -4.484 5.401 738 HG13 VAL 112 3HG1 VAL 112 -8.630 -3.334 5.486 739 HG21 VAL 112 3HG2 VAL 112 -8.693 -6.147 2.410 740 HG22 VAL 112 1HG2 VAL 112 -9.181 -6.385 4.088 741 HG23 VAL 112 2HG2 VAL 112 -10.228 -5.494 2.984 742 H PHE 113 H PHE 113 -7.564 -3.470 1.287 743 HA PHE 113 HA PHE 113 -9.523 -3.349 -0.893 744 HB3 PHE 113 2HB PHE 113 -7.021 -3.376 -2.067 745 HD1 PHE 113 1HD PHE 113 -9.268 -1.057 -0.222 746 HD2 PHE 113 2HD PHE 113 -6.992 -1.785 -3.745 747 HE1 PHE 113 1HE PHE 113 -10.209 0.973 -1.246 748 HE2 PHE 113 2HE PHE 113 -7.929 0.244 -4.774 749 HZ PHE 113 HZ PHE 113 -9.539 1.627 -3.524 750 H GLN 114 H GLN 114 -10.247 -5.248 -1.577 751 HA GLN 114 HA GLN 114 -8.420 -7.554 -1.542 752 HB3 GLN 114 2HB GLN 114 -10.270 -8.106 -0.208 753 HG3 GLN 114 2HG GLN 114 -12.595 -7.901 -1.657 754 HE21 GLN 114 1HE2 GLN 114 -10.444 -5.940 0.351 755 HE22 GLN 114 2HE2 GLN 114 -11.595 -5.645 1.606 756 H GLY 115 H GLY 115 -7.905 -8.576 -3.394 757 HA2 GLY 115 2HA GLY 115 -9.080 -9.178 -5.643 758 HA3 GLY 115 3HA GLY 115 -8.986 -7.439 -5.876 759 H ASN 116 H ASN 116 -7.632 -10.080 -6.955 760 HA ASN 116 HA ASN 116 -4.841 -9.243 -6.706 761 HB3 ASN 116 2HB ASN 116 -5.143 -11.584 -6.360 762 HD21 ASN 116 1HD2 ASN 116 -7.353 -12.125 -6.231 763 HD22 ASN 116 2HD2 ASN 116 -8.160 -12.891 -7.553 764 H LEU 117 H LEU 117 -3.495 -9.043 -8.599 765 HA LEU 117 HA LEU 117 -4.967 -8.375 -11.057 766 HB3 LEU 117 2HB LEU 117 -3.322 -6.511 -11.386 767 HG LEU 117 HG LEU 117 -5.189 -6.311 -9.034 768 HD11 LEU 117 1HD1 LEU 117 -4.742 -3.746 -9.711 769 HD12 LEU 117 2HD1 LEU 117 -3.135 -4.422 -9.978 770 HD13 LEU 117 3HD1 LEU 117 -3.903 -4.574 -8.399 771 HD21 LEU 117 3HD2 LEU 117 -5.397 -4.905 -11.671 772 HD22 LEU 117 1HD2 LEU 117 -6.664 -5.286 -10.507 773 HD23 LEU 117 2HD2 LEU 117 -5.953 -6.569 -11.487 774 H ASP 118 H ASP 118 -3.412 -10.744 -10.213 775 HA ASP 118 HA ASP 118 -1.804 -12.160 -10.996 776 HB3 ASP 118 2HB ASP 118 -1.710 -12.399 -13.349 777 H ASN 119 H ASN 119 0.221 -11.968 -12.816 778 HA ASN 119 HA ASN 119 1.957 -9.964 -11.553 779 HB3 ASN 119 2HB ASN 119 3.765 -11.394 -11.883 780 HD21 ASN 119 1HD2 ASN 119 1.748 -11.503 -9.996 781 HD22 ASN 119 2HD2 ASN 119 1.508 -13.148 -9.525 782 H ASN 120 H ASN 120 0.450 -10.795 -14.503 783 HA ASN 120 HA ASN 120 2.288 -9.145 -16.075 784 HB3 ASN 120 2HB ASN 120 1.323 -10.100 -18.019 785 HD21 ASN 120 1HD2 ASN 120 3.419 -10.954 -16.687 786 HD22 ASN 120 2HD2 ASN 120 3.424 -12.674 -16.521 787 H SER 121 H SER 121 0.404 -8.061 -14.073 788 HA SER 121 HA SER 121 -0.864 -6.093 -15.820 789 HB3 SER 121 2HB SER 121 -2.660 -6.611 -13.644 790 HG SER 121 HG SER 121 -3.050 -7.202 -16.383 791 H HIS 122 H HIS 122 0.005 -4.235 -15.196 792 HA HIS 122 HA HIS 122 0.572 -3.813 -12.343 793 HB3 HIS 122 2HB HIS 122 2.434 -3.600 -14.060 794 HD1 HIS 122 1HD HIS 122 2.726 -0.195 -14.284 795 HD2 HIS 122 2HD HIS 122 0.485 -2.922 -16.476 796 HE1 HIS 122 1HE HIS 122 2.241 0.939 -16.476 797 H LYS 123 H LYS 123 -0.480 -2.300 -11.210 798 HA LYS 123 HA LYS 123 -1.499 0.107 -12.137 799 HB3 LYS 123 2HB LYS 123 -3.997 -1.191 -11.684 800 HG3 LYS 123 2HG LYS 123 -2.728 0.347 -13.873 801 HD3 LYS 123 2HD LYS 123 -4.975 -1.584 -14.227 802 HE3 LYS 123 2HE LYS 123 -4.900 1.220 -15.187 803 HZ1 LYS 123 3HZ LYS 123 -6.474 -0.066 -17.012 804 HZ2 LYS 123 1HZ LYS 123 -5.065 -1.001 -16.972 805 HZ3 LYS 123 2HZ LYS 123 -4.974 0.652 -17.319 806 H LYS 124 H LYS 124 -3.363 0.909 -10.591 807 HA LYS 124 HA LYS 124 -3.749 -0.229 -8.078 808 HB3 LYS 124 2HB LYS 124 -2.055 1.897 -7.252 809 HG3 LYS 124 2HG LYS 124 -0.789 0.171 -6.107 810 HD3 LYS 124 2HD LYS 124 -3.462 -0.997 -5.809 811 HE3 LYS 124 2HE LYS 124 -1.300 0.140 -4.149 812 HZ1 LYS 124 3HZ LYS 124 -3.616 -0.172 -2.555 813 HZ2 LYS 124 1HZ LYS 124 -3.877 1.034 -3.712 814 HZ3 LYS 124 2HZ LYS 124 -2.562 1.147 -2.654 815 H ASN 125 H ASN 125 -2.705 3.103 -8.726 816 HA ASN 125 HA ASN 125 -5.455 4.025 -8.814 817 HB3 ASN 125 2HB ASN 125 -3.806 5.492 -6.837 818 HD21 ASN 125 1HD2 ASN 125 -5.339 7.099 -7.305 819 HD22 ASN 125 2HD2 ASN 125 -6.959 6.995 -6.712 820 H ILE 126 H ILE 126 -5.689 6.080 -9.711 821 HA ILE 126 HA ILE 126 -3.290 7.071 -11.073 822 HB ILE 126 HB ILE 126 -5.586 6.474 -12.226 823 HG13 ILE 126 2HG1 ILE 126 -3.368 8.124 -12.852 824 HG21 ILE 126 1HG2 ILE 126 -6.096 9.385 -11.839 825 HG22 ILE 126 2HG2 ILE 126 -7.213 8.094 -12.278 826 HG23 ILE 126 3HG2 ILE 126 -6.649 8.244 -10.614 827 HD11 ILE 126 3HD1 ILE 126 -3.984 7.612 -15.208 828 HD12 ILE 126 1HD1 ILE 126 -3.848 6.200 -14.161 829 HD13 ILE 126 2HD1 ILE 126 -5.439 6.823 -14.597 830 H PHE 127 H PHE 127 -3.840 9.614 -11.644 831 HA PHE 127 HA PHE 127 -3.441 10.932 -9.125 832 HB3 PHE 127 2HB PHE 127 -2.268 11.524 -11.290 833 HD1 PHE 127 1HD PHE 127 -3.630 10.586 -13.226 834 HD2 PHE 127 2HD PHE 127 -4.431 14.353 -11.413 835 HE1 PHE 127 1HE PHE 127 -4.880 11.279 -15.229 836 HE2 PHE 127 2HE PHE 127 -5.682 15.053 -13.412 837 HZ PHE 127 HZ PHE 127 -5.908 13.516 -15.323 838 H GLU 128 H GLU 128 -6.044 9.703 -9.517 839 HA GLU 128 HA GLU 128 -8.052 11.537 -10.155 840 HB3 GLU 128 2HB GLU 128 -8.114 9.249 -8.181 841 HG3 GLU 128 2HG GLU 128 -10.213 11.089 -9.083 842 H LYS 129 H LYS 129 -5.993 11.340 -7.415 843 HA LYS 129 HA LYS 129 -6.864 13.825 -6.384 844 HB3 LYS 129 2HB LYS 129 -7.402 12.440 -4.075 845 HG3 LYS 129 2HG LYS 129 -9.890 12.722 -5.368 846 HD3 LYS 129 2HD LYS 129 -8.751 14.982 -3.829 847 HE3 LYS 129 2HE LYS 129 -11.232 13.285 -3.575 848 HZ1 LYS 129 3HZ LYS 129 -10.719 15.873 -2.237 849 HZ2 LYS 129 1HZ LYS 129 -10.387 14.395 -1.485 850 HZ3 LYS 129 2HZ LYS 129 -11.970 14.773 -1.945 851 HA PRO 130 HA PRO 130 -2.582 12.591 -5.272 852 HB3 PRO 130 2HB PRO 130 -1.774 13.836 -7.025 853 HG3 PRO 130 2HG PRO 130 -3.001 15.603 -7.907 854 HD3 PRO 130 2HD PRO 130 -4.616 13.958 -7.911 855 H PHE 131 H PHE 131 -1.087 13.610 -3.670 856 HA PHE 131 HA PHE 131 -1.835 15.678 -1.949 857 HB3 PHE 131 2HB PHE 131 -2.184 13.587 -0.090 858 HD1 PHE 131 2HD PHE 131 -2.274 16.317 0.375 859 HD2 PHE 131 1HD PHE 131 -5.391 13.857 -1.159 860 HE1 PHE 131 2HE PHE 131 -3.943 17.928 1.192 861 HE2 PHE 131 1HE PHE 131 -7.065 15.465 -0.345 862 HZ PHE 131 HZ PHE 131 -6.342 17.503 0.834 863 H MET 132 H MET 132 -0.418 15.885 -0.103 864 HA MET 132 HA MET 132 2.208 14.934 -0.655 865 HB3 MET 132 2HB MET 132 1.923 17.121 0.318 866 HG3 MET 132 2HG MET 132 1.221 16.246 3.011 867 HE1 MET 132 3HE MET 132 -0.547 19.701 0.518 868 HE2 MET 132 1HE MET 132 0.266 18.301 -0.183 869 HE3 MET 132 2HE MET 132 -1.290 18.104 0.624 870 H ALA 133 H ALA 133 3.555 13.660 0.725 871 HA ALA 133 HA ALA 133 2.322 12.095 2.825 872 HB1 ALA 133 1HB ALA 133 1.902 11.023 0.470 873 HB2 ALA 133 2HB ALA 133 3.570 10.479 0.654 874 HB3 ALA 133 3HB ALA 133 2.356 10.019 1.848 875 H ARG 134 H ARG 134 3.810 11.114 4.196 876 HA ARG 134 HA ARG 134 6.641 11.703 3.624 877 HB3 ARG 134 2HB ARG 134 5.272 11.795 6.317 878 HG3 ARG 134 2HG ARG 134 7.858 13.119 5.963 879 HD3 ARG 134 2HD ARG 134 6.213 12.163 8.045 880 HE ARG 134 HE ARG 134 8.417 10.398 7.694 881 HH11 ARG 134 1HH1 ARG 134 6.573 12.105 10.104 882 HH12 ARG 134 2HH1 ARG 134 6.927 10.972 11.366 883 HH21 ARG 134 1HH2 ARG 134 8.891 8.899 9.347 884 HH22 ARG 134 2HH2 ARG 134 8.247 9.150 10.934 885 H TYR 135 H TYR 135 4.291 9.471 4.887 886 HA TYR 135 HA TYR 135 6.097 7.272 4.572 887 HB3 TYR 135 2HB TYR 135 5.392 8.265 7.314 888 HD1 TYR 135 1HD TYR 135 3.718 6.660 8.064 889 HD2 TYR 135 2HD TYR 135 7.508 5.364 6.630 890 HE1 TYR 135 1HE TYR 135 3.316 4.434 9.032 891 HE2 TYR 135 2HE TYR 135 7.116 3.135 7.592 892 HH TYR 135 HH TYR 135 4.963 2.468 9.868 893 H VAL 136 H VAL 136 4.990 5.473 4.081 894 HA VAL 136 HA VAL 136 2.093 5.458 4.637 895 HB VAL 136 HB VAL 136 1.682 4.336 2.588 896 HG11 VAL 136 1HG1 VAL 136 2.614 5.896 0.906 897 HG12 VAL 136 2HG1 VAL 136 1.948 6.715 2.320 898 HG13 VAL 136 3HG1 VAL 136 3.694 6.537 2.143 899 HG21 VAL 136 3HG2 VAL 136 3.171 2.810 1.930 900 HG22 VAL 136 1HG2 VAL 136 4.064 4.140 1.193 901 HG23 VAL 136 2HG2 VAL 136 4.478 3.593 2.817 902 H ARG 137 H ARG 137 1.109 3.437 5.082 903 HA ARG 137 HA ARG 137 2.981 1.309 5.884 904 HB3 ARG 137 2HB ARG 137 0.475 2.122 7.366 905 HG3 ARG 137 2HG ARG 137 2.568 0.046 7.897 906 HD3 ARG 137 2HD ARG 137 1.883 1.819 9.823 907 HE ARG 137 HE ARG 137 -0.259 1.340 10.456 908 HH11 ARG 137 1HH1 ARG 137 1.392 -1.637 9.721 909 HH12 ARG 137 2HH1 ARG 137 0.094 -2.644 10.273 910 HH21 ARG 137 1HH2 ARG 137 -1.973 0.024 11.186 911 HH22 ARG 137 2HH2 ARG 137 -1.819 -1.699 11.105 912 H VAL 138 H VAL 138 2.459 -0.726 5.296 913 HA VAL 138 HA VAL 138 -0.220 -1.206 4.178 914 HB VAL 138 HB VAL 138 2.318 -2.275 2.942 915 HG11 VAL 138 1HG1 VAL 138 -0.566 -2.303 2.059 916 HG12 VAL 138 2HG1 VAL 138 0.794 -2.815 1.058 917 HG13 VAL 138 3HG1 VAL 138 0.411 -3.688 2.543 918 HG21 VAL 138 3HG2 VAL 138 1.074 0.320 2.675 919 HG22 VAL 138 1HG2 VAL 138 2.603 -0.268 2.023 920 HG23 VAL 138 2HG2 VAL 138 1.104 -0.540 1.136 921 H LEU 139 H LEU 139 -1.092 -3.202 4.566 922 HA LEU 139 HA LEU 139 0.542 -5.293 5.754 923 HB3 LEU 139 2HB LEU 139 -0.093 -4.041 7.698 924 HG LEU 139 HG LEU 139 -2.493 -3.416 6.425 925 HD11 LEU 139 1HD1 LEU 139 -2.845 -5.574 8.412 926 HD12 LEU 139 2HD1 LEU 139 -3.844 -5.123 7.030 927 HD13 LEU 139 3HD1 LEU 139 -3.947 -4.202 8.530 928 HD21 LEU 139 3HD2 LEU 139 -2.784 -1.943 8.210 929 HD22 LEU 139 1HD2 LEU 139 -1.039 -2.186 8.148 930 HD23 LEU 139 2HD2 LEU 139 -2.002 -3.030 9.360 931 HA PRO 140 HA PRO 140 -2.391 -7.249 2.941 932 HB3 PRO 140 2HB PRO 140 -0.578 -8.105 1.820 933 HG3 PRO 140 2HG PRO 140 1.442 -8.473 2.911 934 HD3 PRO 140 2HD PRO 140 1.026 -6.303 3.568 935 H VAL 141 H VAL 141 -4.035 -8.670 3.300 936 HA VAL 141 HA VAL 141 -4.029 -10.074 5.891 937 HB VAL 141 HB VAL 141 -6.395 -9.043 4.320 938 HG11 VAL 141 1HG1 VAL 141 -6.161 -10.982 6.475 939 HG12 VAL 141 2HG1 VAL 141 -7.246 -9.647 6.869 940 HG13 VAL 141 3HG1 VAL 141 -7.528 -10.619 5.423 941 HG21 VAL 141 3HG2 VAL 141 -5.263 -8.111 6.957 942 HG22 VAL 141 1HG2 VAL 141 -5.062 -7.283 5.413 943 HG23 VAL 141 2HG2 VAL 141 -6.667 -7.445 6.123 944 H SER 142 H SER 142 -5.132 -10.282 2.524 945 HA SER 142 HA SER 142 -5.090 -13.216 2.788 946 HB3 SER 142 2HB SER 142 -7.057 -13.454 1.562 947 HG SER 142 HG SER 142 -8.527 -11.837 2.413 948 H TRP 143 H TRP 143 -3.900 -14.287 1.333 949 HA TRP 143 HA TRP 143 -3.075 -12.895 -1.119 950 HB3 TRP 143 2HB TRP 143 -1.254 -12.688 0.527 951 HD1 TRP 143 HD TRP 143 0.143 -16.037 -0.304 952 HE1 TRP 143 1HE TRP 143 0.363 -17.459 1.830 953 HE3 TRP 143 3HE TRP 143 -2.590 -13.132 2.893 954 HZ2 TRP 143 2HZ TRP 143 -0.507 -17.363 4.513 955 HZ3 TRP 143 3HZ TRP 143 -2.849 -13.868 5.227 956 HH2 TRP 143 HH TRP 143 -1.828 -15.940 6.018 957 H HIS 144 H HIS 144 -2.073 -14.430 -2.717 958 HA HIS 144 HA HIS 144 -3.248 -17.121 -2.488 959 HB3 HIS 144 2HB HIS 144 -3.443 -16.836 -5.106 960 HD1 HIS 144 1HD HIS 144 -5.336 -18.307 -3.753 961 HD2 HIS 144 2HD HIS 144 -5.957 -14.211 -4.082 962 HE1 HIS 144 1HE HIS 144 -7.785 -17.959 -3.298 963 H ASN 145 H ASN 145 -1.867 -18.735 -2.842 964 HA ASN 145 HA ASN 145 -0.075 -19.920 -3.629 965 HB3 ASN 145 2HB ASN 145 1.242 -17.797 -5.148 966 HD21 ASN 145 1HD2 ASN 145 -0.310 -19.087 -7.482 967 HD22 ASN 145 2HD2 ASN 145 0.533 -20.574 -7.730 968 H ARG 146 H ARG 146 0.951 -16.519 -3.272 969 HA ARG 146 HA ARG 146 2.283 -16.840 -0.847 970 HB3 ARG 146 2HB ARG 146 4.520 -16.547 -2.663 971 HG3 ARG 146 2HG ARG 146 5.131 -18.749 -1.324 972 HD3 ARG 146 2HD ARG 146 5.057 -16.414 0.461 973 HE ARG 146 HE ARG 146 6.872 -17.685 1.032 974 HH11 ARG 146 1HH1 ARG 146 6.831 -17.243 -2.421 975 HH12 ARG 146 2HH1 ARG 146 8.392 -17.955 -2.661 976 HH21 ARG 146 1HH2 ARG 146 8.928 -18.624 0.729 977 HH22 ARG 146 2HH2 ARG 146 9.583 -18.742 -0.870 978 H ILE 147 H ILE 147 2.693 -14.870 -0.042 979 HA ILE 147 HA ILE 147 1.940 -12.542 -1.345 980 HB ILE 147 HB ILE 147 3.933 -12.728 0.916 981 HG13 ILE 147 2HG1 ILE 147 1.018 -13.168 0.782 982 HG21 ILE 147 1HG2 ILE 147 2.496 -10.512 -0.395 983 HG22 ILE 147 2HG2 ILE 147 2.538 -10.476 1.367 984 HG23 ILE 147 3HG2 ILE 147 4.044 -10.521 0.450 985 HD11 ILE 147 3HD1 ILE 147 1.391 -14.756 2.311 986 HD12 ILE 147 1HD1 ILE 147 3.073 -14.583 1.810 987 HD13 ILE 147 2HD1 ILE 147 2.490 -13.743 3.247 988 H THR 148 H THR 148 2.848 -12.202 -3.332 989 HA THR 148 HA THR 148 5.635 -11.323 -3.317 990 HB THR 148 HB THR 148 4.778 -12.924 -5.681 991 HG1 THR 148 1HG THR 148 4.312 -14.409 -4.111 992 HG21 THR 148 3HG2 THR 148 7.428 -12.745 -4.249 993 HG22 THR 148 1HG2 THR 148 6.938 -11.656 -5.546 994 HG23 THR 148 2HG2 THR 148 7.122 -13.381 -5.865 995 H LEU 149 H LEU 149 5.264 -9.220 -3.746 996 HA LEU 149 HA LEU 149 4.288 -8.522 -6.370 997 HB3 LEU 149 2HB LEU 149 2.244 -8.668 -4.931 998 HG LEU 149 HG LEU 149 3.507 -6.344 -3.497 999 HD11 LEU 149 1HD1 LEU 149 1.372 -5.747 -2.622 1000 HD12 LEU 149 2HD1 LEU 149 0.592 -7.095 -3.447 1001 HD13 LEU 149 3HD1 LEU 149 1.248 -5.752 -4.381 1002 HD21 LEU 149 3HD2 LEU 149 2.862 -9.088 -2.857 1003 HD22 LEU 149 1HD2 LEU 149 2.059 -7.963 -1.762 1004 HD23 LEU 149 2HD2 LEU 149 3.812 -7.911 -1.948 1005 H ARG 150 H ARG 150 4.159 -5.921 -6.388 1006 HA ARG 150 HA ARG 150 6.317 -4.783 -4.791 1007 HB3 ARG 150 2HB ARG 150 7.708 -5.314 -6.538 1008 HG3 ARG 150 2HG ARG 150 5.258 -5.328 -8.177 1009 HD3 ARG 150 2HD ARG 150 6.502 -5.153 -10.265 1010 HE ARG 150 HE ARG 150 6.130 -2.886 -8.594 1011 HH11 ARG 150 1HH1 ARG 150 7.576 -3.912 -11.590 1012 HH12 ARG 150 2HH1 ARG 150 7.471 -2.348 -12.327 1013 HH21 ARG 150 1HH2 ARG 150 5.984 -0.823 -9.553 1014 HH22 ARG 150 2HH2 ARG 150 6.565 -0.591 -11.168 1015 H LEU 151 H LEU 151 5.286 -3.127 -3.872 1016 HA LEU 151 HA LEU 151 3.328 -1.597 -5.403 1017 HB3 LEU 151 2HB LEU 151 4.112 -1.405 -2.497 1018 HG LEU 151 HG LEU 151 1.732 -0.463 -2.284 1019 HD11 LEU 151 1HD1 LEU 151 2.574 1.682 -2.213 1020 HD12 LEU 151 2HD1 LEU 151 3.594 1.445 -3.631 1021 HD13 LEU 151 3HD1 LEU 151 4.041 0.712 -2.090 1022 HD21 LEU 151 3HD2 LEU 151 0.676 0.449 -4.104 1023 HD22 LEU 151 1HD2 LEU 151 1.411 -0.976 -4.837 1024 HD23 LEU 151 2HD2 LEU 151 2.167 0.605 -5.032 1025 H GLU 152 H GLU 152 3.826 0.254 -6.363 1026 HA GLU 152 HA GLU 152 6.154 1.767 -5.377 1027 HB3 GLU 152 2HB GLU 152 5.898 2.452 -8.051 1028 HG3 GLU 152 2HG GLU 152 7.717 0.441 -6.755 1029 H LEU 153 H LEU 153 5.982 3.985 -5.305 1030 HA LEU 153 HA LEU 153 3.295 5.070 -5.833 1031 HB3 LEU 153 2HB LEU 153 3.811 5.045 -3.474 1032 HG LEU 153 HG LEU 153 6.429 5.485 -4.005 1033 HD11 LEU 153 1HD1 LEU 153 7.092 7.661 -3.405 1034 HD12 LEU 153 2HD1 LEU 153 5.468 8.099 -2.876 1035 HD13 LEU 153 3HD1 LEU 153 5.805 7.873 -4.592 1036 HD21 LEU 153 3HD2 LEU 153 5.142 6.320 -1.418 1037 HD22 LEU 153 1HD2 LEU 153 6.729 5.593 -1.665 1038 HD23 LEU 153 2HD2 LEU 153 5.272 4.635 -1.925 1039 H LEU 154 H LEU 154 3.085 6.913 -7.009 1040 HA LEU 154 HA LEU 154 5.568 8.134 -8.024 1041 HB3 LEU 154 2HB LEU 154 4.603 8.405 -10.151 1042 HG LEU 154 HG LEU 154 4.604 5.754 -9.102 1043 HD11 LEU 154 1HD1 LEU 154 2.965 5.067 -11.129 1044 HD12 LEU 154 2HD1 LEU 154 2.159 6.523 -10.548 1045 HD13 LEU 154 3HD1 LEU 154 2.455 5.180 -9.445 1046 HD21 LEU 154 3HD2 LEU 154 5.634 5.267 -11.090 1047 HD22 LEU 154 1HD2 LEU 154 5.912 7.006 -11.001 1048 HD23 LEU 154 2HD2 LEU 154 4.616 6.371 -12.016 1049 H GLY 155 H GLY 155 5.579 10.376 -8.362 1050 HA2 GLY 155 2HA GLY 155 3.287 11.828 -7.193 1051 HA3 GLY 155 3HA GLY 155 4.943 12.225 -6.762 1052 H CYS 156 H CYS 156 4.031 14.376 -7.516 1053 HA CYS 156 HA CYS 156 4.119 14.639 -10.436 1054 HB3 CYS 156 2HB CYS 156 3.526 17.133 -9.245 1055 H LEU 157 H LEU 157 5.962 15.201 -7.622 1056 HA LEU 157 HA LEU 157 7.927 16.276 -7.202 1057 HB3 LEU 157 2HB LEU 157 8.776 16.302 -10.010 1058 HG LEU 157 HG LEU 157 10.674 15.028 -9.270 1059 HD11 LEU 157 1HD1 LEU 157 10.727 17.428 -8.859 1060 HD12 LEU 157 2HD1 LEU 157 11.599 16.552 -7.600 1061 HD13 LEU 157 3HD1 LEU 157 9.984 17.183 -7.278 1062 HD21 LEU 157 3HD2 LEU 157 10.912 14.136 -7.075 1063 HD22 LEU 157 1HD2 LEU 157 9.366 13.570 -7.707 1064 HD23 LEU 157 2HD2 LEU 157 9.411 14.891 -6.538 1065 H GLU 158 H GLU 158 5.634 17.929 -7.947 1066 HA GLU 158 HA GLU 158 6.623 20.087 -9.565 1067 HB3 GLU 158 2HB GLU 158 4.310 20.484 -7.737 1068 HG3 GLU 158 2HG GLU 158 5.209 21.483 -10.300 Start of MODEL 14 1 H1 MET -5 H MET -5 19.348 25.873 -14.611 2 HA MET -5 HA MET -5 18.649 23.843 -15.415 3 HB3 MET -5 2HB MET -5 16.869 24.549 -13.809 4 HG3 MET -5 2HG MET -5 15.207 25.152 -16.235 5 HE1 MET -5 3HE MET -5 12.319 24.322 -15.196 6 HE2 MET -5 1HE MET -5 12.073 26.057 -14.992 7 HE3 MET -5 2HE MET -5 13.152 25.461 -16.254 8 H LYS -4 H LYS -4 17.106 22.728 -17.054 9 HA LYS -4 HA LYS -4 16.279 24.182 -19.346 10 HB3 LYS -4 2HB LYS -4 18.648 24.393 -19.782 11 HG3 LYS -4 2HG LYS -4 19.685 21.971 -20.401 12 HD3 LYS -4 2HD LYS -4 20.706 22.187 -17.978 13 HE3 LYS -4 2HE LYS -4 21.062 23.878 -20.396 14 HZ1 LYS -4 3HZ LYS -4 21.417 25.389 -18.486 15 HZ2 LYS -4 1HZ LYS -4 22.817 25.120 -19.398 16 HZ3 LYS -4 2HZ LYS -4 22.615 24.341 -17.911 17 H SER -3 H SER -3 14.802 22.507 -17.964 18 HA SER -3 HA SER -3 14.414 20.279 -19.796 19 HB3 SER -3 2HB SER -3 14.137 18.674 -17.892 20 HG SER -3 HG SER -3 16.205 19.100 -19.110 21 H GLY -2 H GLY -2 12.340 19.025 -19.046 22 HA2 GLY -2 2HA GLY -2 10.334 21.087 -18.391 23 HA3 GLY -2 3HA GLY -2 10.032 19.686 -19.408 24 H HIS -1 H HIS -1 8.707 20.686 -16.927 25 HA HIS -1 HA HIS -1 9.315 18.713 -14.911 26 HB3 HIS -1 2HB HIS -1 6.960 19.785 -14.098 27 HD1 HIS -1 1HD HIS -1 9.214 22.635 -14.154 28 HD2 HIS -1 2HD HIS -1 8.858 19.122 -11.964 29 HE1 HIS -1 1HE HIS -1 10.606 22.986 -12.089 30 H GLY 0 H GLY 0 7.914 17.057 -14.196 31 HA2 GLY 0 2HA GLY 0 5.583 16.414 -15.817 32 HA3 GLY 0 3HA GLY 0 6.921 15.279 -15.919 33 H CYS 1 H CYS 1 4.194 14.900 -14.892 34 HA CYS 1 HA CYS 1 4.601 14.522 -12.030 35 HB3 CYS 1 2HB CYS 1 2.175 13.652 -12.213 36 H SER 2 H SER 2 3.321 12.329 -11.337 37 HA SER 2 HA SER 2 3.471 10.067 -11.141 38 HB3 SER 2 2HB SER 2 4.336 9.651 -13.950 39 HG SER 2 HG SER 2 2.111 8.454 -13.514 40 H GLU 3 H GLU 3 5.645 11.382 -10.262 41 HA GLU 3 HA GLU 3 8.008 10.097 -11.402 42 HB3 GLU 3 2HB GLU 3 8.087 12.512 -10.874 43 HG3 GLU 3 2HG GLU 3 6.706 12.049 -8.648 44 HA PRO 4 HA PRO 4 7.802 6.886 -8.347 45 HB3 PRO 4 2HB PRO 4 8.783 5.541 -9.930 46 HG3 PRO 4 2HG PRO 4 10.263 6.416 -11.495 47 HD3 PRO 4 2HD PRO 4 8.519 7.903 -11.727 48 H LEU 5 H LEU 5 11.253 7.341 -8.524 49 HA LEU 5 HA LEU 5 11.285 8.762 -5.966 50 HB3 LEU 5 2HB LEU 5 11.631 6.785 -4.954 51 HG LEU 5 HG LEU 5 12.315 5.708 -7.625 52 HD11 LEU 5 1HD1 LEU 5 13.817 5.028 -5.217 53 HD12 LEU 5 2HD1 LEU 5 14.158 4.669 -6.909 54 HD13 LEU 5 3HD1 LEU 5 13.057 3.638 -5.995 55 HD21 LEU 5 3HD2 LEU 5 10.134 5.273 -6.901 56 HD22 LEU 5 1HD2 LEU 5 10.657 4.893 -5.260 57 HD23 LEU 5 2HD2 LEU 5 11.006 3.774 -6.578 58 H GLY 6 H GLY 6 13.816 7.073 -7.802 59 HA2 GLY 6 2HA GLY 6 15.060 9.705 -8.309 60 HA3 GLY 6 3HA GLY 6 15.998 8.311 -7.795 61 H LEU 7 H LEU 7 13.811 6.931 -9.691 62 HA LEU 7 HA LEU 7 15.607 6.552 -11.852 63 HB3 LEU 7 2HB LEU 7 13.842 5.234 -12.856 64 HG LEU 7 HG LEU 7 14.251 4.827 -9.931 65 HD11 LEU 7 1HD1 LEU 7 12.908 2.631 -10.378 66 HD12 LEU 7 2HD1 LEU 7 12.092 3.616 -11.592 67 HD13 LEU 7 3HD1 LEU 7 12.071 4.107 -9.899 68 HD21 LEU 7 3HD2 LEU 7 15.629 3.160 -10.585 69 HD22 LEU 7 1HD2 LEU 7 15.684 4.100 -12.077 70 HD23 LEU 7 2HD2 LEU 7 14.611 2.705 -11.953 71 H LYS 8 H LYS 8 13.486 9.049 -11.137 72 HA LYS 8 HA LYS 8 12.630 9.726 -13.775 73 HB3 LYS 8 2HB LYS 8 12.748 12.005 -12.014 74 HG3 LYS 8 2HG LYS 8 10.245 11.742 -12.073 75 HD3 LYS 8 2HD LYS 8 10.749 11.636 -14.887 76 HE3 LYS 8 2HE LYS 8 10.208 13.798 -12.873 77 HZ1 LYS 8 3HZ LYS 8 9.802 15.245 -14.821 78 HZ2 LYS 8 1HZ LYS 8 10.551 14.093 -15.807 79 HZ3 LYS 8 2HZ LYS 8 11.436 14.873 -14.595 80 H ASN 9 H ASN 9 15.200 10.928 -11.635 81 HA ASN 9 HA ASN 9 17.042 11.385 -13.682 82 HB3 ASN 9 2HB ASN 9 16.535 14.102 -12.925 83 HD21 ASN 9 1HD2 ASN 9 18.520 13.445 -14.297 84 HD22 ASN 9 2HD2 ASN 9 18.326 13.642 -16.002 85 H ASN 10 H ASN 10 16.849 10.411 -10.963 86 HA ASN 10 HA ASN 10 18.985 12.040 -9.779 87 HB3 ASN 10 2HB ASN 10 18.013 11.665 -7.531 88 HD21 ASN 10 1HD2 ASN 10 15.578 12.284 -10.034 89 HD22 ASN 10 2HD2 ASN 10 15.334 13.945 -9.625 90 H THR 11 H THR 11 17.982 9.714 -7.645 91 HA THR 11 HA THR 11 18.853 7.280 -8.546 92 HB THR 11 HB THR 11 21.011 7.913 -9.111 93 HG1 THR 11 1HG THR 11 21.553 6.277 -7.840 94 HG21 THR 11 3HG2 THR 11 21.227 10.130 -8.471 95 HG22 THR 11 1HG2 THR 11 22.388 9.330 -7.411 96 HG23 THR 11 2HG2 THR 11 20.802 9.795 -6.793 97 H ILE 12 H ILE 12 17.107 7.042 -6.981 98 HA ILE 12 HA ILE 12 17.799 7.382 -4.177 99 HB ILE 12 HB ILE 12 15.275 6.365 -5.487 100 HG13 ILE 12 2HG1 ILE 12 14.328 8.507 -4.697 101 HG21 ILE 12 1HG2 ILE 12 15.843 6.911 -2.576 102 HG22 ILE 12 2HG2 ILE 12 14.267 6.507 -3.257 103 HG23 ILE 12 3HG2 ILE 12 15.578 5.328 -3.307 104 HD11 ILE 12 3HD1 ILE 12 17.148 9.331 -4.065 105 HD12 ILE 12 1HD1 ILE 12 15.681 10.296 -3.904 106 HD13 ILE 12 2HD1 ILE 12 15.944 8.908 -2.847 107 HA PRO 13 HA PRO 13 19.303 3.235 -3.787 108 HB3 PRO 13 2HB PRO 13 20.582 4.036 -2.054 109 HG3 PRO 13 2HG PRO 13 19.822 5.773 -0.707 110 HD3 PRO 13 2HD PRO 13 19.447 6.692 -2.786 111 H ASP 14 H ASP 14 18.727 1.438 -1.922 112 HA ASP 14 HA ASP 14 15.887 0.908 -2.362 113 HB3 ASP 14 2HB ASP 14 17.306 -0.896 -3.028 114 H SER 15 H SER 15 17.086 2.759 -0.276 115 HA SER 15 HA SER 15 16.252 1.450 2.195 116 HB3 SER 15 2HB SER 15 17.415 4.215 1.776 117 HG SER 15 HG SER 15 17.870 3.115 4.174 118 H GLN 16 H GLN 16 14.176 1.836 0.399 119 HA GLN 16 HA GLN 16 12.659 4.042 1.630 120 HB3 GLN 16 2HB GLN 16 12.900 4.460 -0.718 121 HG3 GLN 16 2HG GLN 16 11.667 1.782 -1.298 122 HE21 GLN 16 1HE2 GLN 16 10.626 1.929 -3.140 123 HE22 GLN 16 2HE2 GLN 16 11.075 2.902 -4.495 124 H MET 17 H MET 17 12.400 0.737 0.361 125 HA MET 17 HA MET 17 9.828 0.364 1.651 126 HB3 MET 17 2HB MET 17 10.023 -1.958 0.694 127 HG3 MET 17 2HG MET 17 10.526 -0.591 -1.748 128 HE1 MET 17 3HE MET 17 9.556 -3.393 -2.132 129 HE2 MET 17 1HE MET 17 8.166 -2.997 -3.144 130 HE3 MET 17 2HE MET 17 9.637 -2.029 -3.249 131 H SER 18 H SER 18 9.425 -0.892 3.424 132 HA SER 18 HA SER 18 11.465 -2.527 4.624 133 HB3 SER 18 2HB SER 18 12.342 -0.607 5.611 134 HG SER 18 HG SER 18 11.179 1.165 6.110 135 H ALA 19 H ALA 19 10.263 -4.264 5.021 136 HA ALA 19 HA ALA 19 7.614 -3.891 6.255 137 HB1 ALA 19 1HB ALA 19 8.089 -5.154 3.941 138 HB2 ALA 19 2HB ALA 19 8.292 -6.505 5.058 139 HB3 ALA 19 3HB ALA 19 6.778 -5.601 5.033 140 H SER 20 H SER 20 6.961 -5.927 7.563 141 HA SER 20 HA SER 20 8.472 -6.062 9.861 142 HB3 SER 20 2HB SER 20 6.255 -7.634 8.712 143 HG SER 20 HG SER 20 6.912 -9.465 9.485 144 H SER 21 H SER 21 8.415 -8.407 7.187 145 HA SER 21 HA SER 21 11.186 -9.019 7.523 146 HB3 SER 21 2HB SER 21 10.751 -11.493 7.967 147 HG SER 21 HG SER 21 10.603 -11.135 10.210 148 H SER 22 H SER 22 11.889 -10.754 5.993 149 HA SER 22 HA SER 22 10.120 -10.811 3.635 150 HB3 SER 22 2HB SER 22 11.779 -9.787 2.529 151 HG SER 22 HG SER 22 12.575 -9.181 4.694 152 H TYR 23 H TYR 23 10.405 -12.665 2.199 153 HA TYR 23 HA TYR 23 10.109 -15.097 3.447 154 HB3 TYR 23 2HB TYR 23 9.586 -14.488 1.030 155 HD1 TYR 23 2HD TYR 23 11.463 -12.666 0.524 156 HD2 TYR 23 1HD TYR 23 11.902 -16.853 -0.088 157 HE1 TYR 23 2HE TYR 23 13.252 -12.234 -1.107 158 HE2 TYR 23 1HE TYR 23 13.693 -16.433 -1.721 159 HH TYR 23 HH TYR 23 14.779 -14.878 -2.903 160 H LYS 24 H LYS 24 11.436 -16.933 3.696 161 HA LYS 24 HA LYS 24 14.151 -16.305 4.424 162 HB3 LYS 24 2HB LYS 24 12.839 -17.801 5.830 163 HG3 LYS 24 2HG LYS 24 11.968 -18.962 3.450 164 HD3 LYS 24 2HD LYS 24 13.585 -20.916 5.090 165 HE3 LYS 24 2HE LYS 24 11.553 -21.234 2.915 166 HZ1 LYS 24 3HZ LYS 24 12.754 -22.767 1.893 167 HZ2 LYS 24 1HZ LYS 24 12.846 -23.662 3.326 168 HZ3 LYS 24 2HZ LYS 24 14.049 -22.531 2.956 169 H THR 25 H THR 25 15.840 -18.094 3.819 170 HA THR 25 HA THR 25 15.736 -18.418 0.891 171 HB THR 25 HB THR 25 18.383 -18.660 1.451 172 HG1 THR 25 1HG THR 25 18.946 -17.307 3.076 173 HG21 THR 25 3HG2 THR 25 18.637 -16.438 0.554 174 HG22 THR 25 1HG2 THR 25 16.983 -16.023 1.002 175 HG23 THR 25 2HG2 THR 25 17.280 -17.221 -0.258 176 H TRP 26 H TRP 26 16.911 -19.898 3.896 177 HA TRP 26 HA TRP 26 16.211 -22.515 3.013 178 HB3 TRP 26 2HB TRP 26 18.328 -22.145 1.742 179 HD1 TRP 26 HD TRP 26 19.513 -19.788 2.710 180 HE1 TRP 26 1HE TRP 26 21.676 -19.550 4.084 181 HE3 TRP 26 3HE TRP 26 19.864 -24.562 4.506 182 HZ2 TRP 26 2HZ TRP 26 23.316 -21.171 5.712 183 HZ3 TRP 26 3HZ TRP 26 21.761 -25.137 5.965 184 HH2 TRP 26 HH TRP 26 23.450 -23.476 6.554 185 H ASN 27 H ASN 27 15.676 -20.842 5.262 186 HA ASN 27 HA ASN 27 16.237 -22.714 7.359 187 HB3 ASN 27 2HB ASN 27 17.085 -20.140 8.374 188 HD21 ASN 27 1HD2 ASN 27 19.903 -21.393 7.847 189 HD22 ASN 27 2HD2 ASN 27 20.023 -22.564 9.111 190 H LEU 28 H LEU 28 14.827 -22.522 9.078 191 HA LEU 28 HA LEU 28 12.350 -21.379 8.658 192 HB3 LEU 28 2HB LEU 28 12.625 -23.102 10.282 193 HG LEU 28 HG LEU 28 14.882 -21.787 11.224 194 HD11 LEU 28 1HD1 LEU 28 14.437 -21.413 13.588 195 HD12 LEU 28 2HD1 LEU 28 12.725 -21.746 13.331 196 HD13 LEU 28 3HD1 LEU 28 13.468 -20.331 12.586 197 HD21 LEU 28 3HD2 LEU 28 14.632 -23.676 13.036 198 HD22 LEU 28 1HD2 LEU 28 14.932 -24.073 11.344 199 HD23 LEU 28 2HD2 LEU 28 13.299 -24.188 12.000 200 H ARG 29 H ARG 29 15.162 -20.024 10.299 201 HA ARG 29 HA ARG 29 13.759 -17.436 10.405 202 HB3 ARG 29 2HB ARG 29 15.943 -17.522 12.260 203 HG3 ARG 29 2HG ARG 29 13.051 -17.574 13.027 204 HD3 ARG 29 2HD ARG 29 14.339 -15.579 14.394 205 HE ARG 29 HE ARG 29 14.454 -18.112 15.728 206 HH11 ARG 29 1HH1 ARG 29 12.325 -15.633 14.524 207 HH12 ARG 29 2HH1 ARG 29 11.045 -16.014 15.626 208 HH21 ARG 29 1HH2 ARG 29 12.775 -18.623 17.185 209 HH22 ARG 29 2HH2 ARG 29 11.302 -17.715 17.141 210 H ALA 30 H ALA 30 14.540 -16.609 8.501 211 HA ALA 30 HA ALA 30 17.468 -16.336 8.292 212 HB1 ALA 30 1HB ALA 30 15.535 -16.121 5.998 213 HB2 ALA 30 2HB ALA 30 17.288 -16.307 5.936 214 HB3 ALA 30 3HB ALA 30 16.279 -17.644 6.486 215 H PHE 31 H PHE 31 17.724 -14.361 6.488 216 HA PHE 31 HA PHE 31 16.419 -12.060 7.786 217 HB3 PHE 31 2HB PHE 31 18.845 -11.352 6.388 218 HD1 PHE 31 1HD PHE 31 16.949 -9.636 7.592 219 HD2 PHE 31 2HD PHE 31 20.103 -11.804 9.452 220 HE1 PHE 31 1HE PHE 31 17.002 -7.987 9.417 221 HE2 PHE 31 2HE PHE 31 20.160 -10.160 11.281 222 HZ PHE 31 HZ PHE 31 18.608 -8.248 11.265 223 H GLY 32 H GLY 32 17.218 -13.633 4.802 224 HA2 GLY 32 2HA GLY 32 16.282 -13.324 2.710 225 HA3 GLY 32 3HA GLY 32 15.342 -11.994 3.370 226 H TRP 33 H TRP 33 15.968 -11.214 1.115 227 HA TRP 33 HA TRP 33 18.631 -9.970 1.142 228 HB3 TRP 33 2HB TRP 33 17.316 -9.582 -1.358 229 HD1 TRP 33 HD TRP 33 18.940 -12.654 -2.041 230 HE1 TRP 33 1HE TRP 33 21.452 -12.374 -2.528 231 HE3 TRP 33 3HE TRP 33 19.615 -7.954 -0.147 232 HZ2 TRP 33 2HZ TRP 33 23.455 -10.419 -2.158 233 HZ3 TRP 33 3HZ TRP 33 21.860 -6.951 -0.253 234 HH2 TRP 33 HH TRP 33 23.738 -8.160 -1.237 235 H TYR 34 H TYR 34 16.145 -9.054 2.556 236 HA TYR 34 HA TYR 34 15.143 -7.080 3.076 237 HB3 TYR 34 2HB TYR 34 16.406 -5.068 1.698 238 HD1 TYR 34 2HD TYR 34 17.158 -7.531 4.394 239 HD2 TYR 34 1HD TYR 34 17.061 -3.440 3.227 240 HE1 TYR 34 2HE TYR 34 17.685 -6.866 6.702 241 HE2 TYR 34 1HE TYR 34 17.590 -2.765 5.532 242 HH TYR 34 HH TYR 34 18.032 -3.443 7.594 243 HA PRO 35 HA PRO 35 12.198 -6.153 -0.040 244 HB3 PRO 35 2HB PRO 35 11.012 -5.001 1.556 245 HG3 PRO 35 2HG PRO 35 12.097 -3.714 3.160 246 HD3 PRO 35 2HD PRO 35 13.280 -5.682 3.362 247 H HIS 36 H HIS 36 11.538 -3.994 -1.434 248 HA HIS 36 HA HIS 36 12.073 -2.672 -3.207 249 HB3 HIS 36 2HB HIS 36 14.893 -2.461 -2.185 250 HD1 HIS 36 1HD HIS 36 15.801 -1.398 -4.282 251 HD2 HIS 36 2HD HIS 36 12.302 0.401 -2.948 252 HE1 HIS 36 1HE HIS 36 15.534 0.674 -5.682 253 H LEU 37 H LEU 37 11.926 -5.059 -4.054 254 HA LEU 37 HA LEU 37 14.444 -5.713 -5.433 255 HB3 LEU 37 2HB LEU 37 13.619 -7.980 -5.645 256 HG LEU 37 HG LEU 37 13.886 -8.785 -3.517 257 HD11 LEU 37 1HD1 LEU 37 14.787 -6.045 -2.791 258 HD12 LEU 37 2HD1 LEU 37 15.527 -6.839 -4.181 259 HD13 LEU 37 3HD1 LEU 37 15.603 -7.595 -2.589 260 HD21 LEU 37 3HD2 LEU 37 13.137 -6.869 -1.652 261 HD22 LEU 37 1HD2 LEU 37 12.254 -8.337 -2.072 262 HD23 LEU 37 2HD2 LEU 37 11.866 -6.815 -2.875 263 H GLY 38 H GLY 38 11.082 -4.927 -5.816 264 HA2 GLY 38 2HA GLY 38 10.700 -5.758 -8.476 265 HA3 GLY 38 3HA GLY 38 9.805 -4.479 -7.669 266 H ARG 39 H ARG 39 12.743 -3.363 -7.265 267 HA ARG 39 HA ARG 39 12.658 -1.237 -8.939 268 HB3 ARG 39 2HB ARG 39 14.344 -1.543 -7.166 269 HG3 ARG 39 2HG ARG 39 15.395 -3.603 -9.034 270 HD3 ARG 39 2HD ARG 39 17.072 -1.623 -8.604 271 HE ARG 39 HE ARG 39 16.752 -2.501 -5.970 272 HH11 ARG 39 1HH1 ARG 39 19.303 -1.854 -8.250 273 HH12 ARG 39 2HH1 ARG 39 20.462 -1.433 -7.032 274 HH21 ARG 39 1HH2 ARG 39 18.268 -1.949 -4.358 275 HH22 ARG 39 2HH2 ARG 39 19.871 -1.488 -4.818 276 H LEU 40 H LEU 40 13.618 -0.674 -10.948 277 HA LEU 40 HA LEU 40 13.108 -2.375 -13.058 278 HB3 LEU 40 2HB LEU 40 15.319 -0.545 -13.583 279 HG LEU 40 HG LEU 40 13.456 -1.420 -15.212 280 HD11 LEU 40 1HD1 LEU 40 11.926 0.837 -15.304 281 HD12 LEU 40 2HD1 LEU 40 12.065 0.557 -13.568 282 HD13 LEU 40 3HD1 LEU 40 11.422 -0.707 -14.616 283 HD21 LEU 40 3HD2 LEU 40 13.708 0.786 -16.484 284 HD22 LEU 40 1HD2 LEU 40 15.179 -0.096 -16.075 285 HD23 LEU 40 2HD2 LEU 40 14.700 1.310 -15.123 286 H ASP 41 H ASP 41 14.578 -3.378 -14.603 287 HA ASP 41 HA ASP 41 16.374 -4.653 -15.227 288 HB3 ASP 41 2HB ASP 41 18.027 -4.282 -12.841 289 H ASN 42 H ASN 42 16.014 -4.772 -11.678 290 HA ASN 42 HA ASN 42 16.116 -6.600 -10.268 291 HB3 ASN 42 2HB ASN 42 13.728 -6.314 -10.877 292 HD21 ASN 42 1HD2 ASN 42 13.423 -5.721 -13.067 293 HD22 ASN 42 2HD2 ASN 42 12.985 -6.902 -14.249 294 H GLN 43 H GLN 43 18.163 -6.867 -12.097 295 HA GLN 43 HA GLN 43 18.292 -9.121 -13.663 296 HB3 GLN 43 2HB GLN 43 20.158 -7.721 -13.758 297 HG3 GLN 43 2HG GLN 43 21.619 -7.684 -11.502 298 HE21 GLN 43 1HE2 GLN 43 21.737 -6.109 -13.472 299 HE22 GLN 43 2HE2 GLN 43 21.096 -4.533 -13.168 300 H GLY 44 H GLY 44 18.193 -8.905 -10.205 301 HA2 GLY 44 2HA GLY 44 19.343 -11.286 -9.401 302 HA3 GLY 44 3HA GLY 44 17.975 -10.531 -8.597 303 H LYS 45 H LYS 45 15.932 -11.336 -8.897 304 HA LYS 45 HA LYS 45 15.109 -13.061 -10.932 305 HB3 LYS 45 2HB LYS 45 16.751 -14.614 -9.948 306 HG3 LYS 45 2HG LYS 45 16.153 -15.692 -7.763 307 HD3 LYS 45 2HD LYS 45 16.798 -12.845 -7.184 308 HE3 LYS 45 2HE LYS 45 18.143 -15.461 -6.509 309 HZ1 LYS 45 3HZ LYS 45 18.565 -12.770 -5.329 310 HZ2 LYS 45 1HZ LYS 45 19.603 -13.489 -6.455 311 HZ3 LYS 45 2HZ LYS 45 19.389 -14.193 -4.932 312 H ILE 46 H ILE 46 14.820 -12.045 -7.597 313 HA ILE 46 HA ILE 46 12.134 -12.890 -7.214 314 HB ILE 46 HB ILE 46 13.403 -10.577 -5.772 315 HG13 ILE 46 2HG1 ILE 46 14.234 -13.386 -5.824 316 HG21 ILE 46 1HG2 ILE 46 10.966 -11.260 -5.463 317 HG22 ILE 46 2HG2 ILE 46 11.594 -12.708 -4.677 318 HG23 ILE 46 3HG2 ILE 46 11.951 -11.116 -4.008 319 HD11 ILE 46 3HD1 ILE 46 16.281 -12.598 -5.227 320 HD12 ILE 46 1HD1 ILE 46 15.610 -11.154 -5.984 321 HD13 ILE 46 2HD1 ILE 46 15.618 -11.306 -4.227 322 H ASN 47 H ASN 47 13.556 -9.704 -7.938 323 HA ASN 47 HA ASN 47 12.641 -7.781 -8.752 324 HB3 ASN 47 2HB ASN 47 11.897 -8.076 -10.862 325 HD21 ASN 47 1HD2 ASN 47 10.654 -10.975 -11.336 326 HD22 ASN 47 2HD2 ASN 47 12.080 -11.904 -11.639 327 H ALA 48 H ALA 48 11.517 -8.742 -6.297 328 HA ALA 48 HA ALA 48 9.366 -7.005 -5.983 329 HB1 ALA 48 1HB ALA 48 7.505 -8.109 -6.502 330 HB2 ALA 48 2HB ALA 48 8.536 -9.281 -7.325 331 HB3 ALA 48 3HB ALA 48 8.043 -9.560 -5.655 332 H TRP 49 H TRP 49 8.406 -7.106 -3.845 333 HA TRP 49 HA TRP 49 10.262 -8.274 -1.925 334 HB3 TRP 49 2HB TRP 49 8.157 -6.145 -1.805 335 HD1 TRP 49 HD TRP 49 10.530 -6.985 1.083 336 HE1 TRP 49 1HE TRP 49 9.131 -7.356 3.211 337 HE3 TRP 49 3HE TRP 49 5.855 -6.836 -0.982 338 HZ2 TRP 49 2HZ TRP 49 6.407 -7.559 3.921 339 HZ3 TRP 49 3HZ TRP 49 3.906 -7.127 0.490 340 HH2 TRP 49 HH TRP 49 4.178 -7.482 2.891 341 H THR 50 H THR 50 9.842 -10.043 -0.780 342 HA THR 50 HA THR 50 7.095 -11.105 -0.821 343 HB THR 50 HB THR 50 9.404 -12.843 -0.086 344 HG1 THR 50 1HG THR 50 10.158 -11.865 -1.975 345 HG21 THR 50 3HG2 THR 50 8.038 -14.507 -1.323 346 HG22 THR 50 1HG2 THR 50 6.839 -13.251 -1.628 347 HG23 THR 50 2HG2 THR 50 7.174 -13.768 0.025 348 H ALA 51 H ALA 51 6.401 -12.316 1.090 349 HA ALA 51 HA ALA 51 7.197 -10.921 3.518 350 HB1 ALA 51 1HB ALA 51 5.218 -11.900 4.517 351 HB2 ALA 51 2HB ALA 51 4.810 -11.158 2.969 352 HB3 ALA 51 3HB ALA 51 4.970 -12.910 3.093 353 H GLN 52 H GLN 52 7.372 -12.214 5.559 354 HA GLN 52 HA GLN 52 9.068 -14.554 5.060 355 HB3 GLN 52 2HB GLN 52 8.812 -13.013 7.640 356 HG3 GLN 52 2HG GLN 52 11.288 -13.799 7.727 357 HE21 GLN 52 1HE2 GLN 52 9.378 -13.530 9.504 358 HE22 GLN 52 2HE2 GLN 52 9.018 -15.017 10.305 359 H SER 53 H SER 53 6.513 -13.442 7.274 360 HA SER 53 HA SER 53 6.083 -16.069 8.341 361 HB3 SER 53 2HB SER 53 4.116 -13.807 8.582 362 HG SER 53 HG SER 53 3.542 -15.670 9.652 363 H ASN 54 H ASN 54 5.302 -14.692 5.439 364 HA ASN 54 HA ASN 54 3.671 -15.026 3.856 365 HB3 ASN 54 2HB ASN 54 5.037 -17.085 3.749 366 HD21 ASN 54 1HD2 ASN 54 5.838 -17.918 5.666 367 HD22 ASN 54 2HD2 ASN 54 5.009 -19.142 6.558 368 H SER 55 H SER 55 2.525 -14.070 6.203 369 HA SER 55 HA SER 55 -0.067 -15.467 6.172 370 HB3 SER 55 2HB SER 55 1.011 -14.062 8.615 371 HG SER 55 HG SER 55 -0.551 -15.987 9.291 372 H ALA 56 H ALA 56 -1.550 -13.740 7.662 373 HA ALA 56 HA ALA 56 -1.695 -11.428 5.888 374 HB1 ALA 56 1HB ALA 56 -3.603 -12.942 7.525 375 HB2 ALA 56 2HB ALA 56 -3.859 -11.196 7.509 376 HB3 ALA 56 3HB ALA 56 -3.835 -12.098 5.994 377 H LYS 57 H LYS 57 -0.712 -12.242 9.066 378 HA LYS 57 HA LYS 57 -1.147 -9.736 10.327 379 HB3 LYS 57 2HB LYS 57 0.277 -10.561 12.086 380 HG3 LYS 57 2HG LYS 57 -1.864 -12.115 11.078 381 HD3 LYS 57 2HD LYS 57 0.130 -13.757 10.764 382 HE3 LYS 57 2HE LYS 57 -0.310 -14.618 13.527 383 HZ1 LYS 57 3HZ LYS 57 1.265 -15.753 12.193 384 HZ2 LYS 57 1HZ LYS 57 2.146 -14.897 13.356 385 HZ3 LYS 57 2HZ LYS 57 2.060 -14.321 11.769 386 H GLU 58 H GLU 58 1.066 -10.758 7.970 387 HA GLU 58 HA GLU 58 3.299 -9.151 8.638 388 HB3 GLU 58 2HB GLU 58 3.818 -9.408 6.147 389 HG3 GLU 58 2HG GLU 58 3.814 -12.052 6.403 390 H TRP 59 H TRP 59 3.995 -7.181 7.697 391 HA TRP 59 HA TRP 59 2.072 -5.608 6.193 392 HB3 TRP 59 2HB TRP 59 1.512 -5.261 8.615 393 HD1 TRP 59 HD TRP 59 4.296 -6.389 9.438 394 HE1 TRP 59 1HE TRP 59 5.773 -5.140 11.136 395 HE3 TRP 59 3HE TRP 59 2.287 -1.710 8.976 396 HZ2 TRP 59 2HZ TRP 59 6.050 -2.519 12.147 397 HZ3 TRP 59 3HZ TRP 59 3.216 0.112 10.344 398 HH2 TRP 59 HH TRP 59 5.057 -0.286 11.896 399 H LEU 60 H LEU 60 3.012 -4.042 4.948 400 HA LEU 60 HA LEU 60 5.940 -3.795 5.161 401 HB3 LEU 60 2HB LEU 60 4.121 -3.975 2.793 402 HG LEU 60 HG LEU 60 5.540 -2.027 2.297 403 HD11 LEU 60 1HD1 LEU 60 7.919 -3.847 2.445 404 HD12 LEU 60 2HD1 LEU 60 7.411 -2.874 3.825 405 HD13 LEU 60 3HD1 LEU 60 7.872 -2.089 2.315 406 HD21 LEU 60 3HD2 LEU 60 5.073 -4.226 0.729 407 HD22 LEU 60 1HD2 LEU 60 6.818 -4.015 0.582 408 HD23 LEU 60 2HD2 LEU 60 5.732 -2.688 0.168 409 H GLN 61 H GLN 61 6.759 -1.820 5.440 410 HA GLN 61 HA GLN 61 4.997 0.492 4.958 411 HB3 GLN 61 2HB GLN 61 5.808 1.566 6.897 412 HG3 GLN 61 2HG GLN 61 4.453 -0.735 7.201 413 HE21 GLN 61 1HE2 GLN 61 5.312 -2.734 7.073 414 HE22 GLN 61 2HE2 GLN 61 6.432 -3.388 8.212 415 H VAL 62 H VAL 62 5.793 2.134 3.776 416 HA VAL 62 HA VAL 62 8.615 1.951 2.942 417 HB VAL 62 HB VAL 62 6.471 3.334 1.350 418 HG11 VAL 62 1HG1 VAL 62 8.008 3.041 -0.488 419 HG12 VAL 62 2HG1 VAL 62 8.847 3.814 0.858 420 HG13 VAL 62 3HG1 VAL 62 9.097 2.098 0.530 421 HG21 VAL 62 3HG2 VAL 62 6.419 1.225 -0.033 422 HG22 VAL 62 1HG2 VAL 62 7.234 0.423 1.308 423 HG23 VAL 62 2HG2 VAL 62 5.632 1.122 1.542 424 H ASP 63 H ASP 63 9.836 3.475 3.821 425 HA ASP 63 HA ASP 63 8.620 6.067 4.488 426 HB3 ASP 63 2HB ASP 63 9.545 5.221 6.458 427 H LEU 64 H LEU 64 9.097 7.760 3.265 428 HA LEU 64 HA LEU 64 11.452 7.607 1.512 429 HB3 LEU 64 2HB LEU 64 10.312 8.735 -0.083 430 HG LEU 64 HG LEU 64 8.017 7.685 1.561 431 HD11 LEU 64 1HD1 LEU 64 7.897 8.737 -1.260 432 HD12 LEU 64 2HD1 LEU 64 7.331 9.622 0.157 433 HD13 LEU 64 3HD1 LEU 64 6.564 8.099 -0.295 434 HD21 LEU 64 3HD2 LEU 64 8.912 6.663 -1.098 435 HD22 LEU 64 1HD2 LEU 64 8.084 5.820 0.211 436 HD23 LEU 64 2HD2 LEU 64 9.799 6.208 0.358 437 H GLY 65 H GLY 65 9.808 9.600 3.894 438 HA2 GLY 65 2HA GLY 65 10.543 11.369 5.159 439 HA3 GLY 65 3HA GLY 65 12.173 10.831 4.781 440 H THR 66 H THR 66 10.174 11.556 2.098 441 HA THR 66 HA THR 66 11.766 13.961 1.587 442 HB THR 66 HB THR 66 11.434 11.963 -0.090 443 HG1 THR 66 1HG THR 66 12.353 13.380 -1.358 444 HG21 THR 66 3HG2 THR 66 8.931 12.149 0.035 445 HG22 THR 66 1HG2 THR 66 9.595 12.202 -1.598 446 HG23 THR 66 2HG2 THR 66 9.068 13.690 -0.812 447 H GLN 67 H GLN 67 8.520 12.902 2.205 448 HA GLN 67 HA GLN 67 6.550 14.007 2.479 449 HB3 GLN 67 2HB GLN 67 8.329 16.420 2.866 450 HG3 GLN 67 2HG GLN 67 5.466 15.885 3.458 451 HE21 GLN 67 1HE2 GLN 67 4.567 16.282 5.345 452 HE22 GLN 67 2HE2 GLN 67 5.287 17.146 6.655 453 H ARG 68 H ARG 68 6.435 13.539 0.070 454 HA ARG 68 HA ARG 68 6.184 16.075 -1.410 455 HB3 ARG 68 2HB ARG 68 6.342 14.377 -3.434 456 HG3 ARG 68 2HG ARG 68 8.844 14.573 -3.414 457 HD3 ARG 68 2HD ARG 68 7.318 17.105 -2.815 458 HE ARG 68 HE ARG 68 10.000 16.732 -3.693 459 HH11 ARG 68 1HH1 ARG 68 7.177 18.722 -4.128 460 HH12 ARG 68 2HH1 ARG 68 8.075 20.113 -4.636 461 HH21 ARG 68 1HH2 ARG 68 11.194 18.557 -4.361 462 HH22 ARG 68 2HH2 ARG 68 10.360 20.018 -4.770 463 H GLN 69 H GLN 69 4.527 15.994 -3.171 464 HA GLN 69 HA GLN 69 2.072 14.892 -2.088 465 HB3 GLN 69 2HB GLN 69 2.714 16.837 -4.285 466 HG3 GLN 69 2HG GLN 69 0.167 15.362 -3.867 467 HE21 GLN 69 1HE2 GLN 69 0.057 17.589 -6.320 468 HE22 GLN 69 2HE2 GLN 69 -0.958 18.772 -5.574 469 H VAL 70 H VAL 70 1.357 12.956 -2.650 470 HA VAL 70 HA VAL 70 2.410 11.607 -4.985 471 HB VAL 70 HB VAL 70 1.217 9.653 -4.207 472 HG11 VAL 70 1HG1 VAL 70 3.355 10.192 -3.141 473 HG12 VAL 70 2HG1 VAL 70 2.501 11.103 -1.894 474 HG13 VAL 70 3HG1 VAL 70 2.267 9.359 -2.030 475 HG21 VAL 70 3HG2 VAL 70 -0.382 11.638 -2.810 476 HG22 VAL 70 1HG2 VAL 70 -0.776 9.978 -3.257 477 HG23 VAL 70 2HG2 VAL 70 0.105 10.304 -1.764 478 H THR 71 H THR 71 1.218 10.875 -6.742 479 HA THR 71 HA THR 71 -1.480 12.025 -7.035 480 HB THR 71 HB THR 71 0.036 11.679 -9.531 481 HG1 THR 71 1HG THR 71 0.836 13.554 -7.546 482 HG21 THR 71 3HG2 THR 71 -1.638 13.008 -10.157 483 HG22 THR 71 1HG2 THR 71 -0.932 14.305 -9.194 484 HG23 THR 71 2HG2 THR 71 -2.134 13.231 -8.480 485 H GLY 72 H GLY 72 0.040 9.241 -6.624 486 HA2 GLY 72 2HA GLY 72 -1.876 7.476 -7.210 487 HA3 GLY 72 3HA GLY 72 -1.163 7.724 -8.796 488 H ILE 73 H ILE 73 -1.189 5.229 -7.632 489 HA ILE 73 HA ILE 73 1.677 4.747 -7.361 490 HB ILE 73 HB ILE 73 1.555 3.457 -5.403 491 HG13 ILE 73 2HG1 ILE 73 -0.570 2.882 -4.279 492 HG21 ILE 73 1HG2 ILE 73 -0.210 5.875 -5.042 493 HG22 ILE 73 2HG2 ILE 73 0.542 4.975 -3.726 494 HG23 ILE 73 3HG2 ILE 73 1.547 5.813 -4.908 495 HD11 ILE 73 3HD1 ILE 73 -1.781 4.854 -5.591 496 HD12 ILE 73 1HD1 ILE 73 -2.163 3.522 -6.680 497 HD13 ILE 73 2HD1 ILE 73 -2.639 3.438 -4.985 498 H ILE 74 H ILE 74 2.321 2.622 -7.904 499 HA ILE 74 HA ILE 74 0.234 0.938 -9.114 500 HB ILE 74 HB ILE 74 1.590 2.310 -10.802 501 HG13 ILE 74 2HG1 ILE 74 0.900 -0.548 -10.801 502 HG21 ILE 74 1HG2 ILE 74 3.781 1.511 -11.380 503 HG22 ILE 74 2HG2 ILE 74 3.766 1.933 -9.668 504 HG23 ILE 74 3HG2 ILE 74 3.686 0.242 -10.161 505 HD11 ILE 74 3HD1 ILE 74 -0.564 1.288 -11.655 506 HD12 ILE 74 1HD1 ILE 74 0.577 1.487 -12.985 507 HD13 ILE 74 2HD1 ILE 74 -0.288 -0.037 -12.785 508 H THR 75 H THR 75 0.471 -1.235 -8.856 509 HA THR 75 HA THR 75 2.902 -2.176 -7.485 510 HB THR 75 HB THR 75 0.763 -1.925 -6.029 511 HG1 THR 75 1HG THR 75 2.679 -3.908 -6.156 512 HG21 THR 75 3HG2 THR 75 -0.388 -3.414 -7.981 513 HG22 THR 75 1HG2 THR 75 -0.978 -3.334 -6.322 514 HG23 THR 75 2HG2 THR 75 0.057 -4.670 -6.826 515 H GLN 76 H GLN 76 3.479 -4.365 -7.853 516 HA GLN 76 HA GLN 76 2.026 -5.783 -9.956 517 HB3 GLN 76 2HB GLN 76 4.115 -6.224 -11.192 518 HG3 GLN 76 2HG GLN 76 2.658 -4.186 -11.694 519 HE21 GLN 76 1HE2 GLN 76 5.818 -3.474 -10.254 520 HE22 GLN 76 2HE2 GLN 76 5.422 -1.869 -9.755 521 H GLY 77 H GLY 77 2.106 -7.981 -9.792 522 HA2 GLY 77 2HA GLY 77 3.144 -9.045 -7.312 523 HA3 GLY 77 3HA GLY 77 2.199 -9.917 -8.509 524 H ALA 78 H ALA 78 4.254 -11.221 -7.365 525 HA ALA 78 HA ALA 78 6.308 -11.248 -9.480 526 HB1 ALA 78 1HB ALA 78 7.277 -12.464 -7.080 527 HB2 ALA 78 2HB ALA 78 7.907 -11.066 -7.953 528 HB3 ALA 78 3HB ALA 78 6.668 -10.849 -6.717 529 H ARG 79 H ARG 79 6.869 -13.197 -10.353 530 HA ARG 79 HA ARG 79 5.420 -15.561 -9.353 531 HB3 ARG 79 2HB ARG 79 4.525 -14.627 -11.509 532 HG3 ARG 79 2HG ARG 79 7.190 -15.537 -12.571 533 HD3 ARG 79 2HD ARG 79 4.781 -14.572 -14.104 534 HE ARG 79 HE ARG 79 7.477 -14.961 -14.901 535 HH11 ARG 79 1HH1 ARG 79 4.188 -15.408 -15.949 536 HH12 ARG 79 2HH1 ARG 79 4.574 -15.315 -17.635 537 HH21 ARG 79 1HH2 ARG 79 7.999 -14.836 -17.118 538 HH22 ARG 79 2HH2 ARG 79 6.743 -14.990 -18.299 539 H ASP 80 H ASP 80 6.474 -17.559 -9.492 540 HA ASP 80 HA ASP 80 9.383 -17.370 -9.924 541 HB3 ASP 80 2HB ASP 80 9.411 -19.421 -8.357 542 H PHE 81 H PHE 81 7.592 -17.878 -12.045 543 HA PHE 81 HA PHE 81 7.369 -19.261 -13.836 544 HB3 PHE 81 2HB PHE 81 9.067 -20.882 -14.280 545 HD1 PHE 81 2HD PHE 81 9.584 -18.722 -15.469 546 HD2 PHE 81 1HD PHE 81 11.079 -19.636 -11.590 547 HE1 PHE 81 2HE PHE 81 11.326 -17.005 -15.740 548 HE2 PHE 81 1HE PHE 81 12.824 -17.920 -11.854 549 HZ PHE 81 HZ PHE 81 12.949 -16.604 -13.933 550 H GLY 82 H GLY 82 5.292 -19.952 -13.430 551 HA2 GLY 82 2HA GLY 82 3.830 -21.794 -13.378 552 HA3 GLY 82 3HA GLY 82 5.072 -22.728 -12.556 553 H HIS 83 H HIS 83 5.650 -21.012 -10.436 554 HA HIS 83 HA HIS 83 3.236 -21.378 -8.833 555 HB3 HIS 83 2HB HIS 83 5.810 -20.459 -7.636 556 HD1 HIS 83 1HD HIS 83 4.075 -23.735 -7.040 557 HD2 HIS 83 2HD HIS 83 4.439 -19.994 -5.268 558 HE1 HIS 83 1HE HIS 83 3.054 -23.971 -4.753 559 H ILE 84 H ILE 84 3.213 -19.236 -10.679 560 HA ILE 84 HA ILE 84 3.957 -16.747 -9.945 561 HB ILE 84 HB ILE 84 1.185 -17.485 -10.895 562 HG13 ILE 84 2HG1 ILE 84 3.696 -17.765 -12.157 563 HG21 ILE 84 1HG2 ILE 84 1.089 -15.259 -10.115 564 HG22 ILE 84 2HG2 ILE 84 2.662 -14.868 -10.806 565 HG23 ILE 84 3HG2 ILE 84 1.279 -15.147 -11.864 566 HD11 ILE 84 3HD1 ILE 84 1.487 -17.627 -14.021 567 HD12 ILE 84 1HD1 ILE 84 2.525 -18.986 -13.589 568 HD13 ILE 84 2HD1 ILE 84 1.110 -18.608 -12.605 569 H GLN 85 H GLN 85 3.633 -15.369 -8.314 570 HA GLN 85 HA GLN 85 1.472 -15.963 -6.403 571 HB3 GLN 85 2HB GLN 85 2.943 -15.168 -4.600 572 HG3 GLN 85 2HG GLN 85 3.242 -17.602 -5.951 573 HE21 GLN 85 1HE2 GLN 85 5.074 -16.090 -7.332 574 HE22 GLN 85 2HE2 GLN 85 6.663 -16.702 -7.038 575 H TYR 86 H TYR 86 0.603 -14.144 -5.255 576 HA TYR 86 HA TYR 86 1.300 -11.477 -5.689 577 HB3 TYR 86 2HB TYR 86 0.713 -11.680 -7.983 578 HD1 TYR 86 2HD TYR 86 -2.688 -12.207 -6.583 579 HD2 TYR 86 1HD TYR 86 0.348 -13.659 -9.186 580 HE1 TYR 86 2HE TYR 86 -4.254 -13.888 -7.462 581 HE2 TYR 86 1HE TYR 86 -1.209 -15.344 -10.072 582 HH TYR 86 HH TYR 86 -3.387 -15.969 -10.167 583 H VAL 87 H VAL 87 0.076 -10.100 -4.449 584 HA VAL 87 HA VAL 87 -1.825 -11.379 -2.662 585 HB VAL 87 HB VAL 87 -0.983 -8.494 -2.540 586 HG11 VAL 87 1HG1 VAL 87 -2.413 -10.386 -0.813 587 HG12 VAL 87 2HG1 VAL 87 -1.188 -9.417 0.009 588 HG13 VAL 87 3HG1 VAL 87 -2.491 -8.626 -0.880 589 HG21 VAL 87 3HG2 VAL 87 0.643 -10.886 -2.094 590 HG22 VAL 87 1HG2 VAL 87 1.132 -9.208 -2.334 591 HG23 VAL 87 2HG2 VAL 87 0.631 -9.763 -0.735 592 H ALA 88 H ALA 88 -3.868 -10.332 -2.117 593 HA ALA 88 HA ALA 88 -5.029 -8.865 -4.396 594 HB1 ALA 88 1HB ALA 88 -7.206 -10.062 -3.593 595 HB2 ALA 88 2HB ALA 88 -6.059 -10.909 -4.632 596 HB3 ALA 88 3HB ALA 88 -6.076 -11.224 -2.897 597 H SER 89 H SER 89 -6.379 -9.793 -1.251 598 HA SER 89 HA SER 89 -7.358 -7.120 -0.832 599 HB3 SER 89 2HB SER 89 -7.429 -9.140 1.359 600 HG SER 89 HG SER 89 -9.576 -7.706 0.229 601 H TYR 90 H TYR 90 -6.131 -5.545 -0.065 602 HA TYR 90 HA TYR 90 -4.492 -5.984 2.282 603 HB3 TYR 90 2HB TYR 90 -2.894 -6.542 0.555 604 HD1 TYR 90 2HD TYR 90 -3.136 -2.887 -0.053 605 HD2 TYR 90 1HD TYR 90 -3.275 -6.786 -1.750 606 HE1 TYR 90 2HE TYR 90 -3.149 -1.899 -2.305 607 HE2 TYR 90 1HE TYR 90 -3.286 -5.810 -4.007 608 HH TYR 90 HH TYR 90 -3.615 -3.868 -5.172 609 H LYS 91 H LYS 91 -4.085 -4.115 3.446 610 HA LYS 91 HA LYS 91 -5.591 -1.759 2.545 611 HB3 LYS 91 2HB LYS 91 -4.714 -1.623 5.293 612 HG3 LYS 91 2HG LYS 91 -7.390 -1.961 5.440 613 HD3 LYS 91 2HD LYS 91 -7.409 0.610 4.889 614 HE3 LYS 91 2HE LYS 91 -7.289 -0.676 7.155 615 HZ1 LYS 91 3HZ LYS 91 -4.507 0.097 6.684 616 HZ2 LYS 91 1HZ LYS 91 -5.131 -1.238 7.516 617 HZ3 LYS 91 2HZ LYS 91 -5.123 0.287 8.248 618 H VAL 92 H VAL 92 -4.159 -0.581 1.365 619 HA VAL 92 HA VAL 92 -1.599 0.119 2.644 620 HB VAL 92 HB VAL 92 -1.128 -0.877 0.552 621 HG11 VAL 92 1HG1 VAL 92 -3.198 0.945 -0.672 622 HG12 VAL 92 2HG1 VAL 92 -2.187 -0.208 -1.545 623 HG13 VAL 92 3HG1 VAL 92 -3.384 -0.785 -0.385 624 HG21 VAL 92 3HG2 VAL 92 0.182 0.743 -0.401 625 HG22 VAL 92 1HG2 VAL 92 -1.082 1.970 -0.316 626 HG23 VAL 92 2HG2 VAL 92 -0.192 1.519 1.139 627 H ALA 93 H ALA 93 -1.625 2.035 3.605 628 HA ALA 93 HA ALA 93 -3.115 4.230 2.322 629 HB1 ALA 93 1HB ALA 93 -4.236 4.659 4.193 630 HB2 ALA 93 2HB ALA 93 -3.629 3.127 4.822 631 HB3 ALA 93 3HB ALA 93 -2.761 4.625 5.160 632 H HIS 94 H HIS 94 -2.228 6.340 2.554 633 HA HIS 94 HA HIS 94 0.671 6.318 3.066 634 HB3 HIS 94 2HB HIS 94 0.731 8.328 1.571 635 HD1 HIS 94 1HD HIS 94 1.661 7.802 -0.701 636 HD2 HIS 94 2HD HIS 94 -0.864 4.826 0.721 637 HE1 HIS 94 1HE HIS 94 1.892 5.893 -2.323 638 H SER 95 H SER 95 1.573 7.781 4.436 639 HA SER 95 HA SER 95 -0.230 9.727 5.714 640 HB3 SER 95 2HB SER 95 0.565 9.193 7.873 641 HG SER 95 HG SER 95 0.498 6.688 6.542 642 H ASP 96 H ASP 96 0.605 11.720 6.136 643 HA ASP 96 HA ASP 96 3.273 12.252 5.040 644 HB3 ASP 96 2HB ASP 96 1.224 14.334 5.777 645 H ASP 97 H ASP 97 1.236 13.114 7.828 646 HA ASP 97 HA ASP 97 3.620 13.997 9.276 647 HB3 ASP 97 2HB ASP 97 2.102 14.994 10.870 648 H GLY 98 H GLY 98 1.701 11.258 8.911 649 HA2 GLY 98 2HA GLY 98 2.315 9.192 9.935 650 HA3 GLY 98 3HA GLY 98 2.891 10.091 11.330 651 H VAL 99 H VAL 99 0.243 11.695 10.962 652 HA VAL 99 HA VAL 99 -1.329 9.878 12.645 653 HB VAL 99 HB VAL 99 -2.594 11.861 13.330 654 HG11 VAL 99 1HG1 VAL 99 -0.962 11.667 14.877 655 HG12 VAL 99 2HG1 VAL 99 0.324 11.623 13.671 656 HG13 VAL 99 3HG1 VAL 99 -0.385 13.167 14.150 657 HG21 VAL 99 3HG2 VAL 99 -2.692 13.494 11.789 658 HG22 VAL 99 1HG2 VAL 99 -1.198 14.056 12.538 659 HG23 VAL 99 2HG2 VAL 99 -1.134 13.060 11.084 660 H GLN 100 H GLN 100 -1.464 11.750 9.681 661 HA GLN 100 HA GLN 100 -4.236 11.001 9.208 662 HB3 GLN 100 2HB GLN 100 -4.082 12.413 7.227 663 HG3 GLN 100 2HG GLN 100 -2.658 13.854 9.446 664 HE21 GLN 100 1HE2 GLN 100 -1.908 14.922 7.351 665 HE22 GLN 100 2HE2 GLN 100 -2.895 16.213 6.766 666 H TRP 101 H TRP 101 -4.384 8.880 8.708 667 HA TRP 101 HA TRP 101 -2.530 7.739 6.757 668 HB3 TRP 101 2HB TRP 101 -3.236 5.609 7.482 669 HD1 TRP 101 HD TRP 101 -1.255 7.723 8.923 670 HE1 TRP 101 1HE TRP 101 -0.779 7.435 11.435 671 HE3 TRP 101 3HE TRP 101 -5.329 4.914 10.202 672 HZ2 TRP 101 2HZ TRP 101 -1.973 6.181 13.665 673 HZ3 TRP 101 3HZ TRP 101 -5.588 4.211 12.546 674 HH2 TRP 101 HH TRP 101 -3.943 4.832 14.240 675 H THR 102 H THR 102 -3.132 8.330 4.746 676 HA THR 102 HA THR 102 -5.886 8.498 3.946 677 HB THR 102 HB THR 102 -3.409 8.557 2.212 678 HG1 THR 102 1HG THR 102 -3.138 10.417 3.191 679 HG21 THR 102 3HG2 THR 102 -5.306 10.103 0.999 680 HG22 THR 102 1HG2 THR 102 -6.283 8.801 1.676 681 HG23 THR 102 2HG2 THR 102 -4.953 8.426 0.580 682 H VAL 103 H VAL 103 -6.869 6.520 4.079 683 HA VAL 103 HA VAL 103 -5.641 4.230 2.745 684 HB VAL 103 HB VAL 103 -7.397 2.889 3.737 685 HG11 VAL 103 1HG1 VAL 103 -5.949 4.801 5.529 686 HG12 VAL 103 2HG1 VAL 103 -7.005 3.557 6.201 687 HG13 VAL 103 3HG1 VAL 103 -5.616 3.098 5.214 688 HG21 VAL 103 3HG2 VAL 103 -8.762 5.405 3.886 689 HG22 VAL 103 1HG2 VAL 103 -9.396 3.776 4.124 690 HG23 VAL 103 2HG2 VAL 103 -8.705 4.662 5.484 691 H TYR 104 H TYR 104 -7.678 2.779 1.821 692 HA TYR 104 HA TYR 104 -9.087 4.503 -0.105 693 HB3 TYR 104 2HB TYR 104 -8.746 2.630 -1.781 694 HD1 TYR 104 2HD TYR 104 -8.266 5.403 -1.918 695 HD2 TYR 104 1HD TYR 104 -5.416 2.290 -1.371 696 HE1 TYR 104 2HE TYR 104 -6.516 6.845 -2.871 697 HE2 TYR 104 1HE TYR 104 -3.658 3.724 -2.321 698 HH TYR 104 HH TYR 104 -3.980 7.012 -2.711 699 H GLU 105 H GLU 105 -10.658 4.092 1.784 700 HA GLU 105 HA GLU 105 -11.849 1.689 2.358 701 HB3 GLU 105 2HB GLU 105 -12.357 3.945 3.379 702 HG3 GLU 105 2HG GLU 105 -14.649 4.265 1.558 703 H GLU 106 H GLU 106 -13.503 0.454 1.507 704 HA GLU 106 HA GLU 106 -14.337 1.125 -1.238 705 HB3 GLU 106 2HB GLU 106 -13.994 -1.707 -0.295 706 HG3 GLU 106 2HG GLU 106 -15.161 -1.032 -2.492 707 H GLN 107 H GLN 107 -15.155 -0.440 1.805 708 HA GLN 107 HA GLN 107 -17.950 -0.664 0.944 709 HB3 GLN 107 2HB GLN 107 -16.860 -2.687 1.878 710 HG3 GLN 107 2HG GLN 107 -16.846 -1.177 4.481 711 HE21 GLN 107 1HE2 GLN 107 -16.655 -2.384 6.253 712 HE22 GLN 107 2HE2 GLN 107 -16.478 -4.103 6.275 713 H GLY 108 H GLY 108 -15.838 1.058 3.070 714 HA2 GLY 108 2HA GLY 108 -16.793 3.281 3.715 715 HA3 GLY 108 3HA GLY 108 -18.183 2.375 4.296 716 H SER 109 H SER 109 -15.354 0.670 4.862 717 HA SER 109 HA SER 109 -15.207 1.712 7.617 718 HB3 SER 109 2HB SER 109 -14.811 -1.141 6.678 719 HG SER 109 HG SER 109 -13.610 -0.986 8.469 720 H SER 110 H SER 110 -13.624 1.995 4.919 721 HA SER 110 HA SER 110 -11.448 2.166 4.234 722 HB3 SER 110 2HB SER 110 -11.276 4.066 5.566 723 HG SER 110 HG SER 110 -10.917 3.473 8.014 724 H LYS 111 H LYS 111 -12.062 -0.455 4.719 725 HA LYS 111 HA LYS 111 -9.814 -1.546 6.250 726 HB3 LYS 111 2HB LYS 111 -11.349 -3.670 5.277 727 HG3 LYS 111 2HG LYS 111 -11.976 -2.458 7.928 728 HD3 LYS 111 2HD LYS 111 -11.193 -5.288 7.372 729 HE3 LYS 111 2HE LYS 111 -13.001 -3.876 9.317 730 HZ1 LYS 111 3HZ LYS 111 -12.963 -6.678 8.509 731 HZ2 LYS 111 1HZ LYS 111 -14.236 -5.745 9.118 732 HZ3 LYS 111 2HZ LYS 111 -13.062 -6.363 10.168 733 H VAL 112 H VAL 112 -9.130 -3.804 5.158 734 HA VAL 112 HA VAL 112 -7.489 -3.211 3.023 735 HB VAL 112 HB VAL 112 -7.146 -5.573 2.720 736 HG11 VAL 112 1HG1 VAL 112 -5.983 -5.463 4.608 737 HG12 VAL 112 2HG1 VAL 112 -7.121 -4.302 5.294 738 HG13 VAL 112 3HG1 VAL 112 -7.410 -6.033 5.473 739 HG21 VAL 112 3HG2 VAL 112 -8.584 -7.233 3.873 740 HG22 VAL 112 1HG2 VAL 112 -9.688 -5.926 4.306 741 HG23 VAL 112 2HG2 VAL 112 -9.430 -6.339 2.610 742 H PHE 113 H PHE 113 -7.559 -3.620 0.799 743 HA PHE 113 HA PHE 113 -10.219 -4.162 -0.330 744 HB3 PHE 113 2HB PHE 113 -9.741 -1.724 -0.376 745 HD1 PHE 113 2HD PHE 113 -7.483 -1.153 0.477 746 HD2 PHE 113 1HD PHE 113 -8.145 -2.379 -3.546 747 HE1 PHE 113 2HE PHE 113 -5.293 -0.231 -0.161 748 HE2 PHE 113 1HE PHE 113 -5.955 -1.461 -4.189 749 HZ PHE 113 HZ PHE 113 -4.527 -0.384 -2.497 750 H GLN 114 H GLN 114 -10.270 -5.411 -2.146 751 HA GLN 114 HA GLN 114 -8.031 -7.051 -2.695 752 HB3 GLN 114 2HB GLN 114 -9.411 -8.066 -4.411 753 HG3 GLN 114 2HG GLN 114 -10.356 -7.678 -1.741 754 HE21 GLN 114 1HE2 GLN 114 -12.071 -8.061 -4.809 755 HE22 GLN 114 2HE2 GLN 114 -13.632 -7.657 -4.190 756 H GLY 115 H GLY 115 -6.662 -7.139 -4.463 757 HA2 GLY 115 2HA GLY 115 -6.413 -4.605 -5.924 758 HA3 GLY 115 3HA GLY 115 -5.147 -5.807 -5.727 759 H ASN 116 H ASN 116 -4.829 -7.277 -7.297 760 HA ASN 116 HA ASN 116 -6.869 -7.479 -9.411 761 HB3 ASN 116 2HB ASN 116 -5.228 -7.386 -11.113 762 HD21 ASN 116 1HD2 ASN 116 -2.894 -5.865 -9.255 763 HD22 ASN 116 2HD2 ASN 116 -3.440 -4.237 -9.435 764 H LEU 117 H LEU 117 -5.739 -9.383 -10.989 765 HA LEU 117 HA LEU 117 -5.280 -11.674 -9.202 766 HB3 LEU 117 2HB LEU 117 -6.723 -13.053 -10.553 767 HG LEU 117 HG LEU 117 -7.901 -10.639 -9.345 768 HD11 LEU 117 1HD1 LEU 117 -9.272 -12.185 -11.511 769 HD12 LEU 117 2HD1 LEU 117 -9.217 -10.443 -11.247 770 HD13 LEU 117 3HD1 LEU 117 -10.190 -11.464 -10.189 771 HD21 LEU 117 3HD2 LEU 117 -7.614 -12.600 -8.014 772 HD22 LEU 117 1HD2 LEU 117 -8.420 -13.604 -9.219 773 HD23 LEU 117 2HD2 LEU 117 -9.342 -12.404 -8.313 774 H ASP 118 H ASP 118 -3.391 -10.073 -10.708 775 HA ASP 118 HA ASP 118 -2.129 -12.240 -12.181 776 HB3 ASP 118 2HB ASP 118 -1.632 -10.036 -13.821 777 H ASN 119 H ASN 119 0.064 -12.211 -12.049 778 HA ASN 119 HA ASN 119 1.234 -10.340 -10.192 779 HB3 ASN 119 2HB ASN 119 1.709 -12.894 -10.434 780 HD21 ASN 119 1HD2 ASN 119 1.396 -13.352 -12.773 781 HD22 ASN 119 2HD2 ASN 119 2.811 -13.542 -13.745 782 H ASN 120 H ASN 120 1.345 -10.981 -13.638 783 HA ASN 120 HA ASN 120 3.508 -9.142 -14.122 784 HB3 ASN 120 2HB ASN 120 3.132 -9.621 -16.478 785 HD21 ASN 120 1HD2 ASN 120 1.863 -12.469 -16.547 786 HD22 ASN 120 2HD2 ASN 120 3.158 -13.465 -15.983 787 H SER 121 H SER 121 0.098 -8.953 -13.817 788 HA SER 121 HA SER 121 -0.261 -6.578 -15.386 789 HB3 SER 121 2HB SER 121 -2.517 -6.525 -14.319 790 HG SER 121 HG SER 121 -1.800 -8.049 -16.116 791 H HIS 122 H HIS 122 0.028 -4.526 -14.801 792 HA HIS 122 HA HIS 122 0.704 -3.975 -11.995 793 HB3 HIS 122 2HB HIS 122 2.322 -3.443 -13.928 794 HD1 HIS 122 1HD HIS 122 -0.062 -3.034 -15.772 795 HD2 HIS 122 2HD HIS 122 2.170 0.090 -14.186 796 HE1 HIS 122 1HE HIS 122 -0.424 -1.092 -17.328 797 H LYS 123 H LYS 123 -0.431 -2.541 -10.800 798 HA LYS 123 HA LYS 123 -2.004 -0.444 -11.713 799 HB3 LYS 123 2HB LYS 123 -4.063 -2.278 -10.835 800 HG3 LYS 123 2HG LYS 123 -3.866 -1.092 -13.574 801 HD3 LYS 123 2HD LYS 123 -5.798 -2.575 -12.373 802 HE3 LYS 123 2HE LYS 123 -6.801 0.248 -12.169 803 HZ1 LYS 123 3HZ LYS 123 -7.877 -1.933 -10.579 804 HZ2 LYS 123 1HZ LYS 123 -8.153 -2.032 -12.244 805 HZ3 LYS 123 2HZ LYS 123 -8.679 -0.677 -11.380 806 H LYS 124 H LYS 124 -3.674 0.238 -9.986 807 HA LYS 124 HA LYS 124 -3.680 -0.747 -7.397 808 HB3 LYS 124 2HB LYS 124 -2.011 1.556 -6.974 809 HG3 LYS 124 2HG LYS 124 -0.504 -0.414 -6.038 810 HD3 LYS 124 2HD LYS 124 -2.881 -0.262 -4.386 811 HE3 LYS 124 2HE LYS 124 -1.295 0.955 -2.896 812 HZ1 LYS 124 3HZ LYS 124 0.364 -1.246 -3.659 813 HZ2 LYS 124 1HZ LYS 124 -1.268 -1.683 -3.578 814 HZ3 LYS 124 2HZ LYS 124 -0.508 -1.000 -2.232 815 H ASN 125 H ASN 125 -2.945 2.593 -8.363 816 HA ASN 125 HA ASN 125 -5.677 3.411 -8.398 817 HB3 ASN 125 2HB ASN 125 -4.603 5.003 -6.283 818 HD21 ASN 125 1HD2 ASN 125 -6.081 2.350 -4.938 819 HD22 ASN 125 2HD2 ASN 125 -7.719 2.898 -4.988 820 H ILE 126 H ILE 126 -5.939 5.593 -9.030 821 HA ILE 126 HA ILE 126 -3.506 6.751 -10.188 822 HB ILE 126 HB ILE 126 -6.110 7.949 -10.874 823 HG13 ILE 126 2HG1 ILE 126 -6.744 6.137 -12.395 824 HG21 ILE 126 1HG2 ILE 126 -3.493 7.790 -11.922 825 HG22 ILE 126 2HG2 ILE 126 -4.573 7.034 -13.093 826 HG23 ILE 126 3HG2 ILE 126 -4.870 8.689 -12.558 827 HD11 ILE 126 3HD1 ILE 126 -5.385 3.927 -11.310 828 HD12 ILE 126 1HD1 ILE 126 -5.352 4.524 -12.968 829 HD13 ILE 126 2HD1 ILE 126 -4.163 5.100 -11.800 830 H PHE 127 H PHE 127 -4.716 9.350 -10.564 831 HA PHE 127 HA PHE 127 -4.055 10.480 -7.988 832 HB3 PHE 127 2HB PHE 127 -3.158 11.626 -9.880 833 HD1 PHE 127 2HD PHE 127 -6.542 12.963 -10.353 834 HD2 PHE 127 1HD PHE 127 -3.395 10.654 -12.051 835 HE1 PHE 127 2HE PHE 127 -7.649 13.073 -12.548 836 HE2 PHE 127 1HE PHE 127 -4.498 10.761 -14.248 837 HZ PHE 127 HZ PHE 127 -6.628 11.970 -14.499 838 H GLU 128 H GLU 128 -6.394 8.934 -7.906 839 HA GLU 128 HA GLU 128 -8.787 10.336 -8.203 840 HB3 GLU 128 2HB GLU 128 -8.140 8.255 -6.109 841 HG3 GLU 128 2HG GLU 128 -10.624 9.553 -6.909 842 H LYS 129 H LYS 129 -6.271 10.714 -5.908 843 HA LYS 129 HA LYS 129 -7.383 13.054 -4.804 844 HB3 LYS 129 2HB LYS 129 -8.882 11.667 -3.574 845 HG3 LYS 129 2HG LYS 129 -7.405 10.081 -1.867 846 HD3 LYS 129 2HD LYS 129 -8.282 8.387 -3.891 847 HE3 LYS 129 2HE LYS 129 -9.816 9.543 -1.563 848 HZ1 LYS 129 3HZ LYS 129 -10.801 7.170 -1.735 849 HZ2 LYS 129 1HZ LYS 129 -10.328 7.271 -3.356 850 HZ3 LYS 129 2HZ LYS 129 -11.415 8.400 -2.721 851 HA PRO 130 HA PRO 130 -2.818 12.506 -4.400 852 HB3 PRO 130 2HB PRO 130 -2.483 13.575 -6.405 853 HG3 PRO 130 2HG PRO 130 -4.075 15.032 -7.269 854 HD3 PRO 130 2HD PRO 130 -5.415 13.219 -6.791 855 H PHE 131 H PHE 131 -1.333 13.619 -3.018 856 HA PHE 131 HA PHE 131 -1.837 15.943 -1.584 857 HB3 PHE 131 2HB PHE 131 -2.219 14.221 0.604 858 HD1 PHE 131 2HD PHE 131 -2.136 17.042 0.433 859 HD2 PHE 131 1HD PHE 131 -5.456 14.454 -0.199 860 HE1 PHE 131 2HE PHE 131 -3.670 18.871 1.029 861 HE2 PHE 131 1HE PHE 131 -6.996 16.281 0.395 862 HZ PHE 131 HZ PHE 131 -6.102 18.491 1.012 863 H MET 132 H MET 132 -0.391 16.179 0.331 864 HA MET 132 HA MET 132 2.199 15.261 -0.270 865 HB3 MET 132 2HB MET 132 2.554 16.090 2.231 866 HG3 MET 132 2HG MET 132 2.281 17.519 -0.294 867 HE1 MET 132 3HE MET 132 -0.365 20.007 0.721 868 HE2 MET 132 1HE MET 132 0.649 19.737 -0.697 869 HE3 MET 132 2HE MET 132 -0.093 18.367 0.130 870 H ALA 133 H ALA 133 3.611 13.949 1.055 871 HA ALA 133 HA ALA 133 2.659 12.274 3.122 872 HB1 ALA 133 1HB ALA 133 2.954 10.897 0.457 873 HB2 ALA 133 2HB ALA 133 2.537 10.148 1.999 874 HB3 ALA 133 3HB ALA 133 1.413 11.270 1.231 875 H ARG 134 H ARG 134 4.296 11.032 4.049 876 HA ARG 134 HA ARG 134 6.969 11.426 2.870 877 HB3 ARG 134 2HB ARG 134 5.963 11.716 5.652 878 HG3 ARG 134 2HG ARG 134 8.753 10.780 5.021 879 HD3 ARG 134 2HD ARG 134 7.560 11.923 7.541 880 HE ARG 134 HE ARG 134 9.536 9.963 7.429 881 HH11 ARG 134 1HH1 ARG 134 9.085 13.156 8.742 882 HH12 ARG 134 2HH1 ARG 134 10.172 12.905 10.068 883 HH21 ARG 134 1HH2 ARG 134 10.968 9.622 9.170 884 HH22 ARG 134 2HH2 ARG 134 11.242 10.895 10.310 885 H TYR 135 H TYR 135 4.810 9.233 4.556 886 HA TYR 135 HA TYR 135 6.424 6.987 3.623 887 HB3 TYR 135 2HB TYR 135 7.323 6.891 5.723 888 HD1 TYR 135 2HD TYR 135 3.815 8.048 6.254 889 HD2 TYR 135 1HD TYR 135 7.824 8.038 7.675 890 HE1 TYR 135 2HE TYR 135 3.188 9.646 8.015 891 HE2 TYR 135 1HE TYR 135 7.209 9.635 9.441 892 HH TYR 135 HH TYR 135 5.392 10.512 10.578 893 H VAL 136 H VAL 136 5.269 4.947 3.656 894 HA VAL 136 HA VAL 136 2.343 5.250 3.804 895 HB VAL 136 HB VAL 136 1.990 4.083 1.796 896 HG11 VAL 136 1HG1 VAL 136 3.251 5.358 0.106 897 HG12 VAL 136 2HG1 VAL 136 2.646 6.382 1.411 898 HG13 VAL 136 3HG1 VAL 136 4.346 5.915 1.371 899 HG21 VAL 136 3HG2 VAL 136 4.716 3.085 2.270 900 HG22 VAL 136 1HG2 VAL 136 3.318 2.279 1.559 901 HG23 VAL 136 2HG2 VAL 136 4.300 3.368 0.580 902 H ARG 137 H ARG 137 1.175 3.425 4.431 903 HA ARG 137 HA ARG 137 2.791 1.186 5.461 904 HB3 ARG 137 2HB ARG 137 0.324 2.397 6.721 905 HG3 ARG 137 2HG ARG 137 2.149 0.370 7.968 906 HD3 ARG 137 2HD ARG 137 0.368 0.090 9.540 907 HE ARG 137 HE ARG 137 1.659 2.498 9.392 908 HH11 ARG 137 1HH1 ARG 137 -1.458 1.415 10.499 909 HH12 ARG 137 2HH1 ARG 137 -1.603 2.648 11.707 910 HH21 ARG 137 1HH2 ARG 137 1.481 4.127 10.978 911 HH22 ARG 137 2HH2 ARG 137 0.069 4.191 11.978 912 H VAL 138 H VAL 138 2.118 -0.832 4.983 913 HA VAL 138 HA VAL 138 -0.524 -1.149 3.723 914 HB VAL 138 HB VAL 138 1.963 -2.575 2.781 915 HG11 VAL 138 1HG1 VAL 138 0.459 -3.006 0.786 916 HG12 VAL 138 2HG1 VAL 138 0.052 -3.865 2.274 917 HG13 VAL 138 3HG1 VAL 138 -0.874 -2.442 1.794 918 HG21 VAL 138 3HG2 VAL 138 2.531 -0.728 1.681 919 HG22 VAL 138 1HG2 VAL 138 1.027 -0.864 0.769 920 HG23 VAL 138 2HG2 VAL 138 1.082 0.107 2.240 921 H LEU 139 H LEU 139 -1.644 -2.969 4.253 922 HA LEU 139 HA LEU 139 -0.298 -5.026 5.848 923 HB3 LEU 139 2HB LEU 139 -3.003 -4.074 6.681 924 HG LEU 139 HG LEU 139 -0.756 -5.472 8.087 925 HD11 LEU 139 1HD1 LEU 139 -2.989 -3.909 9.372 926 HD12 LEU 139 2HD1 LEU 139 -1.258 -3.607 9.523 927 HD13 LEU 139 3HD1 LEU 139 -1.959 -5.072 10.210 928 HD21 LEU 139 3HD2 LEU 139 -2.453 -7.033 8.689 929 HD22 LEU 139 1HD2 LEU 139 -2.615 -6.716 6.962 930 HD23 LEU 139 2HD2 LEU 139 -3.729 -5.964 8.104 931 HA PRO 140 HA PRO 140 -2.825 -7.034 2.617 932 HB3 PRO 140 2HB PRO 140 -0.888 -7.682 1.564 933 HG3 PRO 140 2HG PRO 140 1.103 -7.906 2.746 934 HD3 PRO 140 2HD PRO 140 0.458 -5.808 3.449 935 H VAL 141 H VAL 141 -4.343 -8.615 2.843 936 HA VAL 141 HA VAL 141 -4.239 -10.252 5.292 937 HB VAL 141 HB VAL 141 -6.711 -9.026 4.062 938 HG11 VAL 141 1HG1 VAL 141 -6.305 -10.851 6.418 939 HG12 VAL 141 2HG1 VAL 141 -7.763 -9.881 6.198 940 HG13 VAL 141 3HG1 VAL 141 -7.328 -11.104 5.003 941 HG21 VAL 141 3HG2 VAL 141 -5.468 -7.313 5.167 942 HG22 VAL 141 1HG2 VAL 141 -6.800 -7.772 6.228 943 HG23 VAL 141 2HG2 VAL 141 -5.168 -8.351 6.562 944 H SER 142 H SER 142 -5.621 -9.970 2.033 945 HA SER 142 HA SER 142 -5.718 -12.914 1.913 946 HB3 SER 142 2HB SER 142 -7.679 -12.842 0.682 947 HG SER 142 HG SER 142 -8.555 -12.023 2.436 948 H TRP 143 H TRP 143 -4.079 -13.668 0.756 949 HA TRP 143 HA TRP 143 -3.340 -12.241 -1.714 950 HB3 TRP 143 2HB TRP 143 -1.608 -12.000 0.041 951 HD1 TRP 143 HD TRP 143 -0.054 -15.252 -0.973 952 HE1 TRP 143 1HE TRP 143 0.222 -16.769 1.089 953 HE3 TRP 143 3HE TRP 143 -2.870 -12.598 2.369 954 HZ2 TRP 143 2HZ TRP 143 -0.641 -16.832 3.775 955 HZ3 TRP 143 3HZ TRP 143 -3.095 -13.456 4.664 956 HH2 TRP 143 HH TRP 143 -2.003 -15.529 5.351 957 H HIS 144 H HIS 144 -1.858 -13.858 -3.072 958 HA HIS 144 HA HIS 144 -3.233 -16.462 -3.139 959 HB3 HIS 144 2HB HIS 144 -2.315 -15.709 -5.754 960 HD1 HIS 144 1HD HIS 144 -3.531 -17.599 -6.804 961 HD2 HIS 144 2HD HIS 144 -5.956 -15.433 -4.218 962 HE1 HIS 144 1HE HIS 144 -5.833 -18.580 -7.060 963 H ASN 145 H ASN 145 -1.914 -18.148 -2.999 964 HA ASN 145 HA ASN 145 -0.074 -19.484 -3.225 965 HB3 ASN 145 2HB ASN 145 1.543 -19.052 -4.869 966 HD21 ASN 145 1HD2 ASN 145 -0.239 -20.222 -5.835 967 HD22 ASN 145 2HD2 ASN 145 -1.211 -19.442 -7.031 968 H ARG 146 H ARG 146 1.308 -16.199 -3.099 969 HA ARG 146 HA ARG 146 2.034 -16.406 -0.353 970 HB3 ARG 146 2HB ARG 146 4.213 -16.746 -2.417 971 HG3 ARG 146 2HG ARG 146 4.856 -15.220 -0.534 972 HD3 ARG 146 2HD ARG 146 3.461 -16.802 1.083 973 HE ARG 146 HE ARG 146 4.646 -18.718 1.460 974 HH11 ARG 146 1HH1 ARG 146 6.856 -16.031 1.337 975 HH12 ARG 146 2HH1 ARG 146 8.228 -16.969 1.825 976 HH21 ARG 146 1HH2 ARG 146 6.445 -19.964 2.103 977 HH22 ARG 146 2HH2 ARG 146 7.994 -19.206 2.260 978 H ILE 147 H ILE 147 2.764 -14.458 0.488 979 HA ILE 147 HA ILE 147 2.041 -12.125 -0.903 980 HB ILE 147 HB ILE 147 3.735 -12.459 1.572 981 HG13 ILE 147 2HG1 ILE 147 0.819 -12.164 1.019 982 HG21 ILE 147 1HG2 ILE 147 2.673 -9.944 1.703 983 HG22 ILE 147 2HG2 ILE 147 4.324 -10.329 1.219 984 HG23 ILE 147 3HG2 ILE 147 3.081 -10.089 -0.007 985 HD11 ILE 147 3HD1 ILE 147 2.492 -13.708 2.959 986 HD12 ILE 147 1HD1 ILE 147 0.763 -13.473 3.217 987 HD13 ILE 147 2HD1 ILE 147 1.335 -14.301 1.768 988 H THR 148 H THR 148 3.139 -12.005 -2.859 989 HA THR 148 HA THR 148 5.900 -11.061 -2.636 990 HB THR 148 HB THR 148 5.371 -12.766 -4.996 991 HG1 THR 148 1HG THR 148 4.509 -13.957 -3.145 992 HG21 THR 148 3HG2 THR 148 7.579 -11.600 -3.693 993 HG22 THR 148 1HG2 THR 148 7.591 -12.625 -5.128 994 HG23 THR 148 2HG2 THR 148 7.765 -13.346 -3.528 995 H LEU 149 H LEU 149 5.676 -9.022 -3.318 996 HA LEU 149 HA LEU 149 5.044 -8.471 -6.031 997 HB3 LEU 149 2HB LEU 149 2.769 -8.768 -5.013 998 HG LEU 149 HG LEU 149 1.765 -7.225 -3.598 999 HD11 LEU 149 1HD1 LEU 149 3.034 -7.250 -1.586 1000 HD12 LEU 149 2HD1 LEU 149 4.552 -7.386 -2.472 1001 HD13 LEU 149 3HD1 LEU 149 3.412 -8.731 -2.465 1002 HD21 LEU 149 3HD2 LEU 149 2.290 -5.042 -3.403 1003 HD22 LEU 149 1HD2 LEU 149 3.210 -5.339 -4.878 1004 HD23 LEU 149 2HD2 LEU 149 4.024 -5.357 -3.313 1005 H ARG 150 H ARG 150 4.907 -5.988 -6.360 1006 HA ARG 150 HA ARG 150 6.625 -4.628 -4.397 1007 HB3 ARG 150 2HB ARG 150 6.968 -4.755 -7.388 1008 HG3 ARG 150 2HG ARG 150 9.045 -3.222 -6.361 1009 HD3 ARG 150 2HD ARG 150 8.186 -1.489 -7.808 1010 HE ARG 150 HE ARG 150 8.240 -4.189 -8.789 1011 HH11 ARG 150 1HH1 ARG 150 7.757 -0.847 -9.632 1012 HH12 ARG 150 2HH1 ARG 150 8.171 -1.071 -11.299 1013 HH21 ARG 150 1HH2 ARG 150 8.788 -4.498 -10.982 1014 HH22 ARG 150 2HH2 ARG 150 8.757 -3.149 -12.067 1015 H LEU 151 H LEU 151 5.593 -2.915 -3.631 1016 HA LEU 151 HA LEU 151 3.616 -1.565 -5.335 1017 HB3 LEU 151 2HB LEU 151 2.675 -2.363 -3.291 1018 HG LEU 151 HG LEU 151 5.085 -1.925 -2.033 1019 HD11 LEU 151 1HD1 LEU 151 3.261 0.339 -1.521 1020 HD12 LEU 151 2HD1 LEU 151 5.019 0.248 -1.423 1021 HD13 LEU 151 3HD1 LEU 151 4.030 -0.392 -0.111 1022 HD21 LEU 151 3HD2 LEU 151 2.324 -2.598 -1.107 1023 HD22 LEU 151 1HD2 LEU 151 3.639 -2.445 0.058 1024 HD23 LEU 151 2HD2 LEU 151 3.745 -3.634 -1.240 1025 H GLU 152 H GLU 152 4.265 0.243 -6.279 1026 HA GLU 152 HA GLU 152 6.262 1.913 -4.898 1027 HB3 GLU 152 2HB GLU 152 5.956 2.360 -7.778 1028 HG3 GLU 152 2HG GLU 152 8.022 2.478 -5.788 1029 H LEU 153 H LEU 153 5.932 4.110 -4.778 1030 HA LEU 153 HA LEU 153 3.239 5.023 -5.539 1031 HB3 LEU 153 2HB LEU 153 3.757 4.996 -3.121 1032 HG LEU 153 HG LEU 153 6.192 6.243 -3.812 1033 HD11 LEU 153 1HD1 LEU 153 6.144 8.254 -2.447 1034 HD12 LEU 153 2HD1 LEU 153 4.422 8.028 -2.148 1035 HD13 LEU 153 3HD1 LEU 153 4.995 8.377 -3.779 1036 HD21 LEU 153 3HD2 LEU 153 6.373 6.242 -1.234 1037 HD22 LEU 153 1HD2 LEU 153 6.201 4.704 -2.078 1038 HD23 LEU 153 2HD2 LEU 153 4.805 5.434 -1.285 1039 H LEU 154 H LEU 154 2.971 6.865 -6.714 1040 HA LEU 154 HA LEU 154 5.423 8.237 -7.605 1041 HB3 LEU 154 2HB LEU 154 4.480 8.507 -9.780 1042 HG LEU 154 HG LEU 154 5.314 6.098 -9.099 1043 HD11 LEU 154 1HD1 LEU 154 2.490 5.880 -8.800 1044 HD12 LEU 154 2HD1 LEU 154 3.729 4.646 -8.567 1045 HD13 LEU 154 3HD1 LEU 154 2.999 4.874 -10.157 1046 HD21 LEU 154 3HD2 LEU 154 5.519 5.748 -11.315 1047 HD22 LEU 154 1HD2 LEU 154 4.898 7.394 -11.428 1048 HD23 LEU 154 2HD2 LEU 154 3.804 6.025 -11.627 1049 H GLY 155 H GLY 155 5.318 10.472 -7.929 1050 HA2 GLY 155 2HA GLY 155 2.870 11.776 -6.912 1051 HA3 GLY 155 3HA GLY 155 4.468 12.275 -6.378 1052 H CYS 156 H CYS 156 3.137 14.283 -7.287 1053 HA CYS 156 HA CYS 156 3.554 14.580 -10.161 1054 HB3 CYS 156 2HB CYS 156 2.592 16.997 -9.106 1055 H LEU 157 H LEU 157 5.203 15.165 -7.295 1056 HA LEU 157 HA LEU 157 7.113 16.284 -6.775 1057 HB3 LEU 157 2HB LEU 157 7.774 17.065 -9.520 1058 HG LEU 157 HG LEU 157 9.826 15.769 -9.153 1059 HD11 LEU 157 1HD1 LEU 157 9.576 18.145 -8.407 1060 HD12 LEU 157 2HD1 LEU 157 10.806 17.222 -7.544 1061 HD13 LEU 157 3HD1 LEU 157 9.245 17.535 -6.786 1062 HD21 LEU 157 3HD2 LEU 157 8.264 14.494 -7.172 1063 HD22 LEU 157 1HD2 LEU 157 9.599 15.303 -6.351 1064 HD23 LEU 157 2HD2 LEU 157 9.929 14.149 -7.642 1065 H GLU 158 H GLU 158 4.528 17.722 -7.221 1066 HA GLU 158 HA GLU 158 5.671 20.426 -7.424 1067 HB3 GLU 158 2HB GLU 158 2.932 19.667 -8.444 1068 HG3 GLU 158 2HG GLU 158 4.348 22.185 -8.143 Start of MODEL 15 1 H1 MET -5 H MET -5 4.259 28.219 -6.818 2 HA MET -5 HA MET -5 5.329 30.914 -6.747 3 HB3 MET -5 2HB MET -5 7.457 29.015 -7.368 4 HG3 MET -5 2HG MET -5 7.128 31.569 -5.991 5 HE1 MET -5 3HE MET -5 9.849 32.257 -5.732 6 HE2 MET -5 1HE MET -5 9.981 32.351 -3.975 7 HE3 MET -5 2HE MET -5 10.987 31.216 -4.875 8 H LYS -4 H LYS -4 5.987 27.849 -8.454 9 HA LYS -4 HA LYS -4 5.256 29.203 -10.966 10 HB3 LYS -4 2HB LYS -4 7.224 27.019 -11.167 11 HG3 LYS -4 2HG LYS -4 6.384 28.994 -12.841 12 HD3 LYS -4 2HD LYS -4 9.169 29.779 -12.021 13 HE3 LYS -4 2HE LYS -4 7.551 31.815 -13.230 14 HZ1 LYS -4 3HZ LYS -4 9.687 32.201 -13.709 15 HZ2 LYS -4 1HZ LYS -4 9.442 31.162 -15.021 16 HZ3 LYS -4 2HZ LYS -4 10.131 30.572 -13.594 17 H SER -3 H SER -3 5.286 27.210 -12.733 18 HA SER -3 HA SER -3 3.785 24.957 -11.639 19 HB3 SER -3 2HB SER -3 1.965 25.235 -13.266 20 HG SER -3 HG SER -3 1.918 27.758 -12.206 21 H GLY -2 H GLY -2 3.333 23.299 -13.375 22 HA2 GLY -2 2HA GLY -2 4.727 23.320 -15.828 23 HA3 GLY -2 3HA GLY -2 5.723 22.534 -14.612 24 H HIS -1 H HIS -1 4.304 21.534 -17.066 25 HA HIS -1 HA HIS -1 2.370 19.667 -15.949 26 HB3 HIS -1 2HB HIS -1 3.133 19.317 -18.762 27 HD1 HIS -1 1HD HIS -1 1.238 18.131 -19.823 28 HD2 HIS -1 2HD HIS -1 0.038 20.299 -16.488 29 HE1 HIS -1 1HE HIS -1 -1.196 17.587 -19.507 30 H GLY 0 H GLY 0 2.610 17.436 -15.924 31 HA2 GLY 0 2HA GLY 0 4.084 15.578 -16.864 32 HA3 GLY 0 3HA GLY 0 5.401 16.515 -16.175 33 H CYS 1 H CYS 1 2.480 14.698 -15.390 34 HA CYS 1 HA CYS 1 3.381 14.482 -12.606 35 HB3 CYS 1 2HB CYS 1 1.053 13.404 -12.337 36 H SER 2 H SER 2 2.428 12.180 -11.729 37 HA SER 2 HA SER 2 2.798 9.939 -11.602 38 HB3 SER 2 2HB SER 2 2.343 8.641 -13.471 39 HG SER 2 HG SER 2 0.729 9.671 -14.500 40 H GLU 3 H GLU 3 4.886 10.852 -10.701 41 HA GLU 3 HA GLU 3 7.146 9.810 -12.277 42 HB3 GLU 3 2HB GLU 3 8.549 11.562 -11.547 43 HG3 GLU 3 2HG GLU 3 7.432 13.652 -12.116 44 HA PRO 4 HA PRO 4 8.146 7.231 -8.871 45 HB3 PRO 4 2HB PRO 4 9.788 6.320 -10.196 46 HG3 PRO 4 2HG PRO 4 11.016 7.642 -11.662 47 HD3 PRO 4 2HD PRO 4 8.881 8.297 -12.232 48 H LEU 5 H LEU 5 10.314 7.217 -7.225 49 HA LEU 5 HA LEU 5 10.160 9.823 -5.857 50 HB3 LEU 5 2HB LEU 5 8.974 8.377 -4.477 51 HG LEU 5 HG LEU 5 9.927 6.180 -3.644 52 HD11 LEU 5 1HD1 LEU 5 8.365 6.816 -5.912 53 HD12 LEU 5 2HD1 LEU 5 8.334 5.346 -4.937 54 HD13 LEU 5 3HD1 LEU 5 9.394 5.450 -6.342 55 HD21 LEU 5 3HD2 LEU 5 11.556 5.047 -4.910 56 HD22 LEU 5 1HD2 LEU 5 12.206 6.666 -4.652 57 HD23 LEU 5 2HD2 LEU 5 11.495 6.240 -6.209 58 H GLY 6 H GLY 6 12.162 7.876 -7.560 59 HA2 GLY 6 2HA GLY 6 14.494 9.292 -6.973 60 HA3 GLY 6 3HA GLY 6 14.525 7.823 -6.010 61 H LEU 7 H LEU 7 13.229 8.279 -9.274 62 HA LEU 7 HA LEU 7 15.464 6.822 -10.428 63 HB3 LEU 7 2HB LEU 7 14.101 5.105 -11.422 64 HG LEU 7 HG LEU 7 13.600 5.292 -8.459 65 HD11 LEU 7 1HD1 LEU 7 12.978 3.009 -10.325 66 HD12 LEU 7 2HD1 LEU 7 11.803 3.992 -9.453 67 HD13 LEU 7 3HD1 LEU 7 12.910 2.947 -8.564 68 HD21 LEU 7 3HD2 LEU 7 15.936 4.966 -9.408 69 HD22 LEU 7 1HD2 LEU 7 15.372 3.392 -9.968 70 HD23 LEU 7 2HD2 LEU 7 15.375 3.765 -8.244 71 H LYS 8 H LYS 8 14.120 9.498 -10.603 72 HA LYS 8 HA LYS 8 14.343 9.816 -13.422 73 HB3 LYS 8 2HB LYS 8 11.606 10.512 -12.426 74 HG3 LYS 8 2HG LYS 8 11.574 9.446 -15.025 75 HD3 LYS 8 2HD LYS 8 11.632 12.385 -14.591 76 HE3 LYS 8 2HE LYS 8 9.477 10.674 -15.796 77 HZ1 LYS 8 3HZ LYS 8 10.064 13.157 -17.046 78 HZ2 LYS 8 1HZ LYS 8 9.728 13.382 -15.404 79 HZ3 LYS 8 2HZ LYS 8 8.602 12.605 -16.399 80 H ASN 9 H ASN 9 13.264 11.119 -10.337 81 HA ASN 9 HA ASN 9 14.052 13.810 -11.229 82 HB3 ASN 9 2HB ASN 9 12.813 14.119 -8.774 83 HD21 ASN 9 1HD2 ASN 9 11.255 13.220 -11.823 84 HD22 ASN 9 2HD2 ASN 9 10.683 14.807 -12.199 85 H ASN 10 H ASN 10 14.794 11.238 -9.059 86 HA ASN 10 HA ASN 10 17.019 12.821 -7.983 87 HB3 ASN 10 2HB ASN 10 16.678 11.778 -5.759 88 HD21 ASN 10 1HD2 ASN 10 13.631 12.633 -7.354 89 HD22 ASN 10 2HD2 ASN 10 13.390 14.105 -6.483 90 H THR 11 H THR 11 16.782 9.940 -6.372 91 HA THR 11 HA THR 11 17.588 7.945 -8.075 92 HB THR 11 HB THR 11 19.475 9.094 -8.869 93 HG1 THR 11 1HG THR 11 20.495 7.281 -8.452 94 HG21 THR 11 3HG2 THR 11 19.450 10.916 -7.218 95 HG22 THR 11 1HG2 THR 11 21.075 10.271 -7.452 96 HG23 THR 11 2HG2 THR 11 20.149 9.830 -6.018 97 H ILE 12 H ILE 12 16.282 8.385 -5.550 98 HA ILE 12 HA ILE 12 17.787 7.559 -3.341 99 HB ILE 12 HB ILE 12 14.858 7.034 -3.863 100 HG13 ILE 12 2HG1 ILE 12 15.420 9.415 -4.047 101 HG21 ILE 12 1HG2 ILE 12 15.838 5.683 -2.046 102 HG22 ILE 12 2HG2 ILE 12 16.358 7.169 -1.252 103 HG23 ILE 12 3HG2 ILE 12 14.638 6.838 -1.465 104 HD11 ILE 12 3HD1 ILE 12 13.341 8.639 -2.754 105 HD12 ILE 12 1HD1 ILE 12 14.235 9.137 -1.318 106 HD13 ILE 12 2HD1 ILE 12 13.870 10.312 -2.582 107 HA PRO 13 HA PRO 13 18.620 3.326 -4.319 108 HB3 PRO 13 2HB PRO 13 20.432 3.530 -2.920 109 HG3 PRO 13 2HG PRO 13 20.357 4.919 -1.057 110 HD3 PRO 13 2HD PRO 13 19.591 6.377 -2.670 111 H ASP 14 H ASP 14 18.288 1.173 -2.791 112 HA ASP 14 HA ASP 14 15.392 0.988 -2.548 113 HB3 ASP 14 2HB ASP 14 15.853 -1.471 -2.320 114 H SER 15 H SER 15 16.400 2.543 -0.552 115 HA SER 15 HA SER 15 16.243 0.788 1.811 116 HB3 SER 15 2HB SER 15 17.525 2.566 3.020 117 HG SER 15 HG SER 15 18.699 0.838 2.199 118 H GLN 16 H GLN 16 14.236 2.403 0.111 119 HA GLN 16 HA GLN 16 13.181 4.260 2.081 120 HB3 GLN 16 2HB GLN 16 13.136 4.891 -0.283 121 HG3 GLN 16 2HG GLN 16 11.096 2.728 -0.710 122 HE21 GLN 16 1HE2 GLN 16 9.883 3.143 -2.401 123 HE22 GLN 16 2HE2 GLN 16 10.276 4.205 -3.706 124 H MET 17 H MET 17 12.331 1.167 0.604 125 HA MET 17 HA MET 17 9.961 0.961 2.299 126 HB3 MET 17 2HB MET 17 9.724 -1.261 1.008 127 HG3 MET 17 2HG MET 17 9.264 1.459 0.067 128 HE1 MET 17 3HE MET 17 8.087 2.018 -2.768 129 HE2 MET 17 1HE MET 17 7.604 0.483 -3.491 130 HE3 MET 17 2HE MET 17 7.118 0.871 -1.841 131 H SER 18 H SER 18 9.582 -1.000 3.551 132 HA SER 18 HA SER 18 11.648 -2.832 4.162 133 HB3 SER 18 2HB SER 18 12.809 -1.148 5.326 134 HG SER 18 HG SER 18 10.789 0.242 5.324 135 H ALA 19 H ALA 19 10.441 -4.569 4.502 136 HA ALA 19 HA ALA 19 7.946 -4.290 6.034 137 HB1 ALA 19 1HB ALA 19 6.979 -5.582 4.512 138 HB2 ALA 19 2HB ALA 19 8.480 -5.552 3.584 139 HB3 ALA 19 3HB ALA 19 8.191 -6.842 4.751 140 H SER 20 H SER 20 7.358 -6.464 7.164 141 HA SER 20 HA SER 20 9.027 -6.833 9.324 142 HB3 SER 20 2HB SER 20 7.028 -8.771 8.134 143 HG SER 20 HG SER 20 8.301 -8.736 10.670 144 H SER 21 H SER 21 8.847 -8.762 6.353 145 HA SER 21 HA SER 21 11.572 -9.379 6.292 146 HB3 SER 21 2HB SER 21 11.311 -10.765 8.210 147 HG SER 21 HG SER 21 9.017 -10.949 8.128 148 H SER 22 H SER 22 12.152 -10.498 4.434 149 HA SER 22 HA SER 22 9.945 -10.931 2.547 150 HB3 SER 22 2HB SER 22 11.288 -10.143 0.894 151 HG SER 22 HG SER 22 11.605 -8.720 2.832 152 H TYR 23 H TYR 23 10.387 -12.666 0.869 153 HA TYR 23 HA TYR 23 10.391 -15.166 2.015 154 HB3 TYR 23 2HB TYR 23 9.673 -14.551 -0.330 155 HD1 TYR 23 2HD TYR 23 11.062 -12.474 -1.005 156 HD2 TYR 23 1HD TYR 23 12.405 -16.478 -1.527 157 HE1 TYR 23 2HE TYR 23 12.670 -11.707 -2.702 158 HE2 TYR 23 1HE TYR 23 14.017 -15.722 -3.225 159 HH TYR 23 HH TYR 23 14.157 -12.328 -4.242 160 H LYS 24 H LYS 24 11.879 -16.704 2.502 161 HA LYS 24 HA LYS 24 14.530 -15.904 3.057 162 HB3 LYS 24 2HB LYS 24 13.470 -17.628 4.377 163 HG3 LYS 24 2HG LYS 24 13.716 -19.856 2.566 164 HD3 LYS 24 2HD LYS 24 11.270 -20.090 3.301 165 HE3 LYS 24 2HE LYS 24 12.394 -20.092 5.860 166 HZ1 LYS 24 3HZ LYS 24 12.018 -22.276 5.674 167 HZ2 LYS 24 1HZ LYS 24 12.914 -22.428 4.246 168 HZ3 LYS 24 2HZ LYS 24 11.311 -21.891 4.185 169 H THR 25 H THR 25 16.503 -16.810 2.199 170 HA THR 25 HA THR 25 16.476 -18.168 -0.332 171 HB THR 25 HB THR 25 17.976 -15.675 -0.666 172 HG1 THR 25 1HG THR 25 16.035 -14.458 -1.098 173 HG21 THR 25 3HG2 THR 25 15.867 -16.371 -2.575 174 HG22 THR 25 1HG2 THR 25 17.014 -17.675 -2.273 175 HG23 THR 25 2HG2 THR 25 17.591 -16.107 -2.838 176 H TRP 26 H TRP 26 18.921 -17.847 -1.275 177 HA TRP 26 HA TRP 26 20.572 -19.273 0.447 178 HB3 TRP 26 2HB TRP 26 21.987 -17.568 -1.494 179 HD1 TRP 26 HD TRP 26 23.571 -19.287 0.332 180 HE1 TRP 26 1HE TRP 26 24.665 -21.510 -0.367 181 HE3 TRP 26 3HE TRP 26 20.688 -20.361 -3.750 182 HZ2 TRP 26 2HZ TRP 26 24.348 -23.460 -2.384 183 HZ3 TRP 26 3HZ TRP 26 21.149 -22.424 -5.010 184 HH2 TRP 26 HH TRP 26 22.941 -23.940 -4.340 185 H ASN 27 H ASN 27 21.313 -18.615 2.352 186 HA ASN 27 HA ASN 27 23.084 -16.439 2.615 187 HB3 ASN 27 2HB ASN 27 21.035 -15.639 4.441 188 HD21 ASN 27 1HD2 ASN 27 20.345 -13.873 1.835 189 HD22 ASN 27 2HD2 ASN 27 21.580 -12.669 1.930 190 H LEU 28 H LEU 28 23.389 -15.939 5.100 191 HA LEU 28 HA LEU 28 23.071 -18.443 6.611 192 HB3 LEU 28 2HB LEU 28 25.302 -18.576 5.996 193 HG LEU 28 HG LEU 28 25.279 -15.727 5.752 194 HD11 LEU 28 1HD1 LEU 28 27.426 -16.863 7.530 195 HD12 LEU 28 2HD1 LEU 28 26.308 -15.548 7.893 196 HD13 LEU 28 3HD1 LEU 28 27.566 -15.326 6.677 197 HD21 LEU 28 3HD2 LEU 28 26.019 -17.127 3.982 198 HD22 LEU 28 1HD2 LEU 28 27.210 -17.917 5.016 199 HD23 LEU 28 2HD2 LEU 28 27.430 -16.231 4.548 200 H ARG 29 H ARG 29 23.798 -14.974 6.788 201 HA ARG 29 HA ARG 29 21.936 -14.490 8.844 202 HB3 ARG 29 2HB ARG 29 24.744 -14.224 9.867 203 HG3 ARG 29 2HG ARG 29 22.173 -13.668 10.919 204 HD3 ARG 29 2HD ARG 29 23.674 -15.649 12.611 205 HE ARG 29 HE ARG 29 21.346 -14.050 13.063 206 HH11 ARG 29 1HH1 ARG 29 22.873 -17.089 13.811 207 HH12 ARG 29 2HH1 ARG 29 22.041 -17.284 15.318 208 HH21 ARG 29 1HH2 ARG 29 20.246 -14.296 15.046 209 HH22 ARG 29 2HH2 ARG 29 20.547 -15.695 16.019 210 H ALA 30 H ALA 30 21.737 -13.016 6.920 211 HA ALA 30 HA ALA 30 22.861 -10.452 7.610 212 HB1 ALA 30 1HB ALA 30 24.667 -10.949 6.267 213 HB2 ALA 30 2HB ALA 30 23.703 -11.911 5.145 214 HB3 ALA 30 3HB ALA 30 23.582 -10.152 5.127 215 H PHE 31 H PHE 31 21.390 -8.913 7.263 216 HA PHE 31 HA PHE 31 18.905 -9.599 5.976 217 HB3 PHE 31 2HB PHE 31 18.790 -6.891 6.551 218 HD1 PHE 31 2HD PHE 31 16.515 -7.962 6.282 219 HD2 PHE 31 1HD PHE 31 19.035 -8.682 9.635 220 HE1 PHE 31 2HE PHE 31 14.574 -8.762 7.564 221 HE2 PHE 31 1HE PHE 31 17.098 -9.484 10.923 222 HZ PHE 31 HZ PHE 31 14.863 -9.524 9.888 223 H GLY 32 H GLY 32 21.047 -6.771 5.568 224 HA2 GLY 32 2HA GLY 32 21.507 -5.489 3.718 225 HA3 GLY 32 3HA GLY 32 21.523 -7.017 2.850 226 H TRP 33 H TRP 33 20.732 -5.535 1.113 227 HA TRP 33 HA TRP 33 18.176 -4.359 1.218 228 HB3 TRP 33 2HB TRP 33 18.335 -4.201 -1.205 229 HD1 TRP 33 HD TRP 33 19.057 -1.943 0.498 230 HE1 TRP 33 1HE TRP 33 21.256 -0.614 0.347 231 HE3 TRP 33 3HE TRP 33 21.943 -5.417 -1.899 232 HZ2 TRP 33 2HZ TRP 33 23.868 -0.988 -0.655 233 HZ3 TRP 33 3HZ TRP 33 24.281 -4.852 -2.417 234 HH2 TRP 33 HH TRP 33 25.222 -2.683 -1.808 235 H TYR 34 H TYR 34 16.388 -5.067 -0.356 236 HA TYR 34 HA TYR 34 15.997 -7.733 -1.074 237 HB3 TYR 34 2HB TYR 34 14.101 -7.752 0.988 238 HD1 TYR 34 1HD TYR 34 14.735 -9.757 -0.858 239 HD2 TYR 34 2HD TYR 34 16.712 -8.906 2.812 240 HE1 TYR 34 1HE TYR 34 15.529 -12.082 -0.754 241 HE2 TYR 34 2HE TYR 34 17.513 -11.229 2.926 242 HH TYR 34 HH TYR 34 17.087 -13.366 2.072 243 HA PRO 35 HA PRO 35 11.720 -5.496 -1.100 244 HB3 PRO 35 2HB PRO 35 11.252 -4.618 0.971 245 HG3 PRO 35 2HG PRO 35 12.939 -3.755 2.318 246 HD3 PRO 35 2HD PRO 35 13.869 -5.793 1.776 247 H HIS 36 H HIS 36 10.899 -3.142 -1.879 248 HA HIS 36 HA HIS 36 10.980 -1.582 -3.533 249 HB3 HIS 36 2HB HIS 36 13.973 -1.522 -3.153 250 HD1 HIS 36 1HD HIS 36 14.299 -0.408 -5.449 251 HD2 HIS 36 2HD HIS 36 11.614 1.580 -2.981 252 HE1 HIS 36 1HE HIS 36 13.912 1.824 -6.539 253 H LEU 37 H LEU 37 10.539 -3.768 -4.707 254 HA LEU 37 HA LEU 37 12.583 -4.108 -6.803 255 HB3 LEU 37 2HB LEU 37 11.248 -6.357 -7.099 256 HG LEU 37 HG LEU 37 13.414 -6.847 -6.574 257 HD11 LEU 37 1HD1 LEU 37 14.551 -6.023 -4.514 258 HD12 LEU 37 2HD1 LEU 37 13.108 -5.073 -4.159 259 HD13 LEU 37 3HD1 LEU 37 14.041 -4.748 -5.620 260 HD21 LEU 37 3HD2 LEU 37 13.488 -8.158 -4.488 261 HD22 LEU 37 1HD2 LEU 37 12.040 -8.484 -5.441 262 HD23 LEU 37 2HD2 LEU 37 11.942 -7.454 -4.011 263 H GLY 38 H GLY 38 9.365 -3.223 -6.079 264 HA2 GLY 38 2HA GLY 38 8.109 -3.832 -8.539 265 HA3 GLY 38 3HA GLY 38 7.573 -2.621 -7.385 266 H ARG 39 H ARG 39 10.510 -1.560 -7.802 267 HA ARG 39 HA ARG 39 9.893 0.650 -9.330 268 HB3 ARG 39 2HB ARG 39 11.891 0.455 -7.892 269 HG3 ARG 39 2HG ARG 39 12.791 -1.437 -10.020 270 HD3 ARG 39 2HD ARG 39 15.093 -1.165 -9.201 271 HE ARG 39 HE ARG 39 13.805 0.926 -10.702 272 HH11 ARG 39 1HH1 ARG 39 16.815 -0.249 -9.407 273 HH12 ARG 39 2HH1 ARG 39 17.793 0.609 -10.553 274 HH21 ARG 39 1HH2 ARG 39 15.080 2.060 -12.215 275 HH22 ARG 39 2HH2 ARG 39 16.805 1.922 -12.148 276 H LEU 40 H LEU 40 11.027 1.257 -11.439 277 HA LEU 40 HA LEU 40 10.239 -0.684 -13.433 278 HB3 LEU 40 2HB LEU 40 11.489 1.563 -14.622 279 HG LEU 40 HG LEU 40 9.441 0.378 -15.481 280 HD11 LEU 40 1HD1 LEU 40 7.282 1.055 -14.670 281 HD12 LEU 40 2HD1 LEU 40 8.019 2.142 -13.493 282 HD13 LEU 40 3HD1 LEU 40 8.218 0.398 -13.327 283 HD21 LEU 40 3HD2 LEU 40 10.351 2.848 -15.975 284 HD22 LEU 40 1HD2 LEU 40 8.738 3.247 -15.385 285 HD23 LEU 40 2HD2 LEU 40 8.929 2.168 -16.767 286 H ASP 41 H ASP 41 11.565 -1.632 -14.965 287 HA ASP 41 HA ASP 41 13.452 -2.569 -15.824 288 HB3 ASP 41 2HB ASP 41 14.969 -0.243 -14.639 289 H ASN 42 H ASN 42 13.034 -4.193 -14.121 290 HA ASN 42 HA ASN 42 14.670 -4.108 -11.748 291 HB3 ASN 42 2HB ASN 42 12.391 -5.180 -11.854 292 HD21 ASN 42 1HD2 ASN 42 11.632 -5.626 -13.951 293 HD22 ASN 42 2HD2 ASN 42 11.834 -7.188 -14.661 294 H GLN 43 H GLN 43 16.677 -4.852 -11.543 295 HA GLN 43 HA GLN 43 18.101 -5.882 -13.777 296 HB3 GLN 43 2HB GLN 43 19.256 -4.523 -12.159 297 HG3 GLN 43 2HG GLN 43 19.331 -6.576 -10.054 298 HE21 GLN 43 1HE2 GLN 43 20.292 -5.743 -8.330 299 HE22 GLN 43 2HE2 GLN 43 20.602 -4.065 -8.065 300 H GLY 44 H GLY 44 16.919 -7.327 -10.759 301 HA2 GLY 44 2HA GLY 44 17.969 -9.922 -11.326 302 HA3 GLY 44 3HA GLY 44 16.791 -9.527 -10.084 303 H LYS 45 H LYS 45 14.999 -10.667 -10.325 304 HA LYS 45 HA LYS 45 13.593 -10.670 -12.841 305 HB3 LYS 45 2HB LYS 45 15.142 -12.561 -13.140 306 HG3 LYS 45 2HG LYS 45 14.858 -14.606 -11.829 307 HD3 LYS 45 2HD LYS 45 15.468 -12.488 -9.815 308 HE3 LYS 45 2HE LYS 45 16.202 -15.251 -10.367 309 HZ1 LYS 45 3HZ LYS 45 18.500 -14.788 -9.355 310 HZ2 LYS 45 1HZ LYS 45 18.318 -13.233 -9.998 311 HZ3 LYS 45 2HZ LYS 45 18.298 -14.579 -11.022 312 H ILE 46 H ILE 46 13.421 -10.071 -9.819 313 HA ILE 46 HA ILE 46 11.050 -11.638 -9.132 314 HB ILE 46 HB ILE 46 12.291 -9.530 -7.387 315 HG13 ILE 46 2HG1 ILE 46 13.519 -11.534 -6.338 316 HG21 ILE 46 1HG2 ILE 46 10.021 -10.737 -6.984 317 HG22 ILE 46 2HG2 ILE 46 11.039 -12.084 -6.477 318 HG23 ILE 46 3HG2 ILE 46 11.152 -10.531 -5.648 319 HD11 ILE 46 3HD1 ILE 46 13.902 -13.450 -7.492 320 HD12 ILE 46 1HD1 ILE 46 12.252 -13.119 -8.020 321 HD13 ILE 46 2HD1 ILE 46 13.613 -12.698 -9.060 322 H ASN 47 H ASN 47 12.057 -8.250 -9.494 323 HA ASN 47 HA ASN 47 10.830 -6.316 -9.613 324 HB3 ASN 47 2HB ASN 47 10.653 -7.285 -11.893 325 HD21 ASN 47 1HD2 ASN 47 10.401 -9.477 -12.158 326 HD22 ASN 47 2HD2 ASN 47 8.852 -10.236 -12.247 327 H ALA 48 H ALA 48 10.127 -7.887 -7.357 328 HA ALA 48 HA ALA 48 7.773 -6.617 -6.536 329 HB1 ALA 48 1HB ALA 48 6.082 -7.970 -7.052 330 HB2 ALA 48 2HB ALA 48 7.188 -8.778 -8.164 331 HB3 ALA 48 3HB ALA 48 6.969 -9.402 -6.529 332 H TRP 49 H TRP 49 7.580 -6.708 -4.352 333 HA TRP 49 HA TRP 49 9.635 -8.151 -2.914 334 HB3 TRP 49 2HB TRP 49 7.631 -6.037 -2.197 335 HD1 TRP 49 HD TRP 49 10.508 -6.907 0.125 336 HE1 TRP 49 1HE TRP 49 9.561 -7.575 2.423 337 HE3 TRP 49 3HE TRP 49 5.545 -7.133 -1.078 338 HZ2 TRP 49 2HZ TRP 49 7.043 -8.124 3.574 339 HZ3 TRP 49 3HZ TRP 49 3.932 -7.738 0.679 340 HH2 TRP 49 HH TRP 49 4.667 -8.223 2.956 341 H THR 50 H THR 50 9.374 -9.950 -1.737 342 HA THR 50 HA THR 50 6.663 -11.075 -1.564 343 HB THR 50 HB THR 50 9.037 -12.771 -0.986 344 HG1 THR 50 1HG THR 50 9.829 -11.907 -2.835 345 HG21 THR 50 3HG2 THR 50 6.389 -13.129 -2.377 346 HG22 THR 50 1HG2 THR 50 6.917 -13.832 -0.849 347 HG23 THR 50 2HG2 THR 50 7.641 -14.372 -2.364 348 H ALA 51 H ALA 51 6.255 -12.469 0.370 349 HA ALA 51 HA ALA 51 7.280 -11.119 2.770 350 HB1 ALA 51 1HB ALA 51 4.821 -11.081 2.326 351 HB2 ALA 51 2HB ALA 51 4.811 -12.830 2.552 352 HB3 ALA 51 3HB ALA 51 5.272 -11.771 3.885 353 H GLN 52 H GLN 52 8.454 -12.188 4.239 354 HA GLN 52 HA GLN 52 9.723 -14.563 3.770 355 HB3 GLN 52 2HB GLN 52 8.951 -13.479 6.485 356 HG3 GLN 52 2HG GLN 52 9.860 -15.702 6.706 357 HE21 GLN 52 1HE2 GLN 52 12.949 -14.274 6.217 358 HE22 GLN 52 2HE2 GLN 52 13.475 -15.321 4.947 359 H SER 53 H SER 53 6.509 -14.076 4.993 360 HA SER 53 HA SER 53 6.117 -16.985 5.000 361 HB3 SER 53 2HB SER 53 5.147 -17.055 7.092 362 HG SER 53 HG SER 53 6.372 -15.671 8.493 363 H ASN 54 H ASN 54 3.399 -16.854 5.812 364 HA ASN 54 HA ASN 54 2.009 -15.074 4.019 365 HB3 ASN 54 2HB ASN 54 2.588 -16.722 2.388 366 HD21 ASN 54 1HD2 ASN 54 4.153 -18.169 3.209 367 HD22 ASN 54 2HD2 ASN 54 3.714 -19.768 3.694 368 H SER 55 H SER 55 1.328 -14.613 6.287 369 HA SER 55 HA SER 55 -1.003 -16.273 6.962 370 HB3 SER 55 2HB SER 55 -0.515 -15.948 9.368 371 HG SER 55 HG SER 55 0.335 -17.833 8.883 372 H ALA 56 H ALA 56 -0.166 -13.464 5.784 373 HA ALA 56 HA ALA 56 -1.222 -11.454 5.579 374 HB1 ALA 56 1HB ALA 56 -3.379 -11.853 7.480 375 HB2 ALA 56 2HB ALA 56 -3.443 -11.536 5.746 376 HB3 ALA 56 3HB ALA 56 -3.237 -13.186 6.334 377 H LYS 57 H LYS 57 0.380 -12.465 8.130 378 HA LYS 57 HA LYS 57 -0.304 -10.346 9.998 379 HB3 LYS 57 2HB LYS 57 1.768 -11.391 11.208 380 HG3 LYS 57 2HG LYS 57 -0.991 -12.308 11.030 381 HD3 LYS 57 2HD LYS 57 0.692 -14.382 10.759 382 HE3 LYS 57 2HE LYS 57 0.662 -13.661 13.662 383 HZ1 LYS 57 3HZ LYS 57 0.207 -16.274 12.582 384 HZ2 LYS 57 1HZ LYS 57 0.099 -15.736 14.182 385 HZ3 LYS 57 2HZ LYS 57 1.593 -16.213 13.551 386 H GLU 58 H GLU 58 2.183 -11.150 7.668 387 HA GLU 58 HA GLU 58 4.190 -9.385 8.393 388 HB3 GLU 58 2HB GLU 58 4.101 -9.318 5.589 389 HG3 GLU 58 2HG GLU 58 6.160 -9.739 6.617 390 H TRP 59 H TRP 59 4.796 -7.437 6.893 391 HA TRP 59 HA TRP 59 2.723 -5.804 5.877 392 HB3 TRP 59 2HB TRP 59 1.921 -5.193 7.933 393 HD1 TRP 59 HD TRP 59 5.725 -5.409 8.730 394 HE1 TRP 59 1HE TRP 59 5.972 -6.340 11.116 395 HE3 TRP 59 3HE TRP 59 0.779 -5.853 9.945 396 HZ2 TRP 59 2HZ TRP 59 4.294 -7.155 13.234 397 HZ3 TRP 59 3HZ TRP 59 0.184 -6.717 12.171 398 HH2 TRP 59 HH TRP 59 1.907 -7.354 13.780 399 H LEU 60 H LEU 60 3.521 -4.038 4.781 400 HA LEU 60 HA LEU 60 6.446 -3.695 4.870 401 HB3 LEU 60 2HB LEU 60 4.536 -3.460 2.553 402 HG LEU 60 HG LEU 60 6.554 -1.812 2.536 403 HD11 LEU 60 1HD1 LEU 60 8.549 -2.922 1.473 404 HD12 LEU 60 2HD1 LEU 60 7.864 -4.464 1.989 405 HD13 LEU 60 3HD1 LEU 60 8.314 -3.253 3.189 406 HD21 LEU 60 3HD2 LEU 60 5.204 -3.349 0.520 407 HD22 LEU 60 1HD2 LEU 60 6.861 -3.004 0.020 408 HD23 LEU 60 2HD2 LEU 60 5.779 -1.681 0.460 409 H GLN 61 H GLN 61 7.172 -1.756 5.438 410 HA GLN 61 HA GLN 61 5.318 0.530 5.273 411 HB3 GLN 61 2HB GLN 61 5.984 -0.329 7.591 412 HG3 GLN 61 2HG GLN 61 8.358 1.327 7.637 413 HE21 GLN 61 1HE2 GLN 61 7.707 -2.159 7.667 414 HE22 GLN 61 2HE2 GLN 61 8.119 -2.397 9.327 415 H VAL 62 H VAL 62 6.133 2.529 4.627 416 HA VAL 62 HA VAL 62 8.856 2.497 3.501 417 HB VAL 62 HB VAL 62 6.504 3.884 2.216 418 HG11 VAL 62 1HG1 VAL 62 8.412 4.982 1.493 419 HG12 VAL 62 2HG1 VAL 62 9.388 3.512 1.507 420 HG13 VAL 62 3HG1 VAL 62 8.181 3.758 0.245 421 HG21 VAL 62 3HG2 VAL 62 5.930 1.678 1.861 422 HG22 VAL 62 1HG2 VAL 62 6.942 2.007 0.455 423 HG23 VAL 62 2HG2 VAL 62 7.607 1.134 1.836 424 H ASP 63 H ASP 63 10.106 4.106 4.181 425 HA ASP 63 HA ASP 63 8.813 6.508 5.298 426 HB3 ASP 63 2HB ASP 63 9.912 5.026 6.999 427 H LEU 64 H LEU 64 9.288 8.345 4.300 428 HA LEU 64 HA LEU 64 11.687 8.429 2.594 429 HB3 LEU 64 2HB LEU 64 10.566 9.951 1.163 430 HG LEU 64 HG LEU 64 8.864 8.746 0.199 431 HD11 LEU 64 1HD1 LEU 64 9.640 6.618 0.125 432 HD12 LEU 64 2HD1 LEU 64 9.705 6.458 1.879 433 HD13 LEU 64 3HD1 LEU 64 10.970 7.342 1.028 434 HD21 LEU 64 3HD2 LEU 64 7.392 9.078 2.257 435 HD22 LEU 64 1HD2 LEU 64 8.024 7.529 2.813 436 HD23 LEU 64 2HD2 LEU 64 7.125 7.622 1.298 437 H GLY 65 H GLY 65 9.622 10.440 4.683 438 HA2 GLY 65 2HA GLY 65 10.200 12.107 6.165 439 HA3 GLY 65 3HA GLY 65 11.883 11.661 5.927 440 H THR 66 H THR 66 10.467 12.227 2.964 441 HA THR 66 HA THR 66 11.657 14.910 2.865 442 HB THR 66 HB THR 66 12.367 13.008 1.260 443 HG1 THR 66 1HG THR 66 11.655 15.642 0.477 444 HG21 THR 66 3HG2 THR 66 10.004 12.406 0.680 445 HG22 THR 66 1HG2 THR 66 11.043 12.706 -0.712 446 HG23 THR 66 2HG2 THR 66 9.891 13.935 -0.191 447 H GLN 67 H GLN 67 8.668 13.276 2.803 448 HA GLN 67 HA GLN 67 6.518 13.989 2.588 449 HB3 GLN 67 2HB GLN 67 7.439 16.833 2.373 450 HG3 GLN 67 2HG GLN 67 5.037 15.422 3.294 451 HE21 GLN 67 1HE2 GLN 67 5.880 18.754 3.968 452 HE22 GLN 67 2HE2 GLN 67 5.566 18.690 5.665 453 H ARG 68 H ARG 68 6.721 12.969 0.445 454 HA ARG 68 HA ARG 68 6.801 14.882 -1.778 455 HB3 ARG 68 2HB ARG 68 6.563 12.410 -2.933 456 HG3 ARG 68 2HG ARG 68 8.992 12.444 -3.268 457 HD3 ARG 68 2HD ARG 68 7.203 14.687 -3.790 458 HE ARG 68 HE ARG 68 9.983 15.316 -3.369 459 HH11 ARG 68 1HH1 ARG 68 7.081 16.111 -5.120 460 HH12 ARG 68 2HH1 ARG 68 7.572 17.739 -5.452 461 HH21 ARG 68 1HH2 ARG 68 10.641 17.457 -3.800 462 HH22 ARG 68 2HH2 ARG 68 9.596 18.503 -4.702 463 H GLN 69 H GLN 69 5.102 15.148 -3.184 464 HA GLN 69 HA GLN 69 2.502 14.363 -2.165 465 HB3 GLN 69 2HB GLN 69 3.483 16.301 -4.217 466 HG3 GLN 69 2HG GLN 69 0.751 15.106 -4.130 467 HE21 GLN 69 1HE2 GLN 69 2.425 18.077 -5.104 468 HE22 GLN 69 2HE2 GLN 69 1.028 19.091 -5.041 469 H VAL 70 H VAL 70 1.554 12.545 -2.777 470 HA VAL 70 HA VAL 70 2.408 11.208 -5.223 471 HB VAL 70 HB VAL 70 1.100 9.300 -4.429 472 HG11 VAL 70 1HG1 VAL 70 2.798 10.425 -2.206 473 HG12 VAL 70 2HG1 VAL 70 2.455 8.724 -2.527 474 HG13 VAL 70 3HG1 VAL 70 3.434 9.657 -3.660 475 HG21 VAL 70 3HG2 VAL 70 -0.680 9.715 -3.152 476 HG22 VAL 70 1HG2 VAL 70 0.441 9.913 -1.806 477 HG23 VAL 70 2HG2 VAL 70 -0.090 11.321 -2.726 478 H THR 71 H THR 71 1.141 10.862 -6.982 479 HA THR 71 HA THR 71 -1.634 11.827 -6.904 480 HB THR 71 HB THR 71 -0.167 12.332 -9.422 481 HG1 THR 71 1HG THR 71 0.268 13.879 -7.065 482 HG21 THR 71 3HG2 THR 71 -2.565 13.160 -8.117 483 HG22 THR 71 1HG2 THR 71 -2.028 13.506 -9.760 484 HG23 THR 71 2HG2 THR 71 -1.576 14.584 -8.439 485 H GLY 72 H GLY 72 -0.237 9.147 -6.975 486 HA2 GLY 72 2HA GLY 72 -2.053 7.714 -8.476 487 HA3 GLY 72 3HA GLY 72 -0.703 8.024 -9.556 488 H ILE 73 H ILE 73 -1.568 5.458 -8.695 489 HA ILE 73 HA ILE 73 0.945 4.489 -7.623 490 HB ILE 73 HB ILE 73 -0.275 3.027 -5.947 491 HG13 ILE 73 2HG1 ILE 73 -2.519 4.268 -7.094 492 HG21 ILE 73 1HG2 ILE 73 0.240 4.485 -4.281 493 HG22 ILE 73 2HG2 ILE 73 1.007 5.332 -5.624 494 HG23 ILE 73 3HG2 ILE 73 -0.586 5.836 -5.058 495 HD11 ILE 73 3HD1 ILE 73 -2.472 2.775 -4.486 496 HD12 ILE 73 1HD1 ILE 73 -3.828 2.954 -5.600 497 HD13 ILE 73 2HD1 ILE 73 -2.417 2.005 -6.072 498 H ILE 74 H ILE 74 1.024 2.072 -7.642 499 HA ILE 74 HA ILE 74 -0.932 0.672 -9.217 500 HB ILE 74 HB ILE 74 0.228 1.728 -11.043 501 HG13 ILE 74 2HG1 ILE 74 0.452 -0.154 -12.314 502 HG21 ILE 74 1HG2 ILE 74 2.723 0.705 -9.708 503 HG22 ILE 74 2HG2 ILE 74 2.682 1.283 -11.373 504 HG23 ILE 74 3HG2 ILE 74 2.284 2.379 -10.050 505 HD11 ILE 74 3HD1 ILE 74 1.558 -2.275 -11.394 506 HD12 ILE 74 1HD1 ILE 74 2.590 -0.921 -11.852 507 HD13 ILE 74 2HD1 ILE 74 2.223 -1.215 -10.152 508 H THR 75 H THR 75 -0.870 -1.480 -8.841 509 HA THR 75 HA THR 75 1.426 -2.505 -7.300 510 HB THR 75 HB THR 75 -0.427 -2.483 -5.818 511 HG1 THR 75 1HG THR 75 -0.093 -4.492 -5.248 512 HG21 THR 75 3HG2 THR 75 -2.335 -2.158 -7.097 513 HG22 THR 75 1HG2 THR 75 -2.539 -3.819 -6.545 514 HG23 THR 75 2HG2 THR 75 -1.962 -3.497 -8.180 515 H GLN 76 H GLN 76 2.220 -4.537 -7.781 516 HA GLN 76 HA GLN 76 0.966 -6.092 -9.895 517 HB3 GLN 76 2HB GLN 76 2.386 -4.593 -11.160 518 HG3 GLN 76 2HG GLN 76 4.402 -5.276 -9.103 519 HE21 GLN 76 1HE2 GLN 76 4.884 -7.046 -11.006 520 HE22 GLN 76 2HE2 GLN 76 6.240 -6.592 -11.973 521 H GLY 77 H GLY 77 1.424 -8.259 -9.797 522 HA2 GLY 77 2HA GLY 77 2.882 -9.117 -7.408 523 HA3 GLY 77 3HA GLY 77 1.765 -10.096 -8.346 524 H ALA 78 H ALA 78 3.856 -11.461 -7.781 525 HA ALA 78 HA ALA 78 5.365 -11.578 -10.277 526 HB1 ALA 78 1HB ALA 78 7.414 -12.103 -8.677 527 HB2 ALA 78 2HB ALA 78 7.032 -10.463 -9.204 528 HB3 ALA 78 3HB ALA 78 6.527 -11.016 -7.607 529 H ARG 79 H ARG 79 6.975 -13.606 -9.993 530 HA ARG 79 HA ARG 79 5.309 -15.801 -8.946 531 HB3 ARG 79 2HB ARG 79 5.353 -15.903 -11.347 532 HG3 ARG 79 2HG ARG 79 8.119 -15.102 -11.053 533 HD3 ARG 79 2HD ARG 79 7.462 -17.578 -12.595 534 HE ARG 79 HE ARG 79 8.582 -16.689 -14.371 535 HH11 ARG 79 1HH1 ARG 79 10.065 -15.550 -11.434 536 HH12 ARG 79 2HH1 ARG 79 11.372 -14.755 -12.248 537 HH21 ARG 79 1HH2 ARG 79 10.299 -15.647 -15.454 538 HH22 ARG 79 2HH2 ARG 79 11.503 -14.811 -14.535 539 H ASP 80 H ASP 80 6.648 -17.841 -8.552 540 HA ASP 80 HA ASP 80 9.114 -17.067 -7.140 541 HB3 ASP 80 2HB ASP 80 7.204 -19.344 -6.573 542 H PHE 81 H PHE 81 9.942 -17.356 -9.466 543 HA PHE 81 HA PHE 81 11.121 -18.540 -11.015 544 HB3 PHE 81 2HB PHE 81 12.595 -20.316 -10.080 545 HD1 PHE 81 1HD PHE 81 11.699 -17.936 -7.376 546 HD2 PHE 81 2HD PHE 81 14.416 -18.936 -10.497 547 HE1 PHE 81 1HE PHE 81 13.204 -16.133 -6.639 548 HE2 PHE 81 2HE PHE 81 15.926 -17.136 -9.764 549 HZ PHE 81 HZ PHE 81 15.321 -15.733 -7.833 550 H GLY 82 H GLY 82 8.313 -19.257 -10.662 551 HA2 GLY 82 2HA GLY 82 7.942 -21.236 -12.466 552 HA3 GLY 82 3HA GLY 82 8.161 -22.128 -10.968 553 H HIS 83 H HIS 83 6.783 -21.120 -9.093 554 HA HIS 83 HA HIS 83 4.047 -21.303 -9.967 555 HB3 HIS 83 2HB HIS 83 4.607 -20.541 -7.166 556 HD1 HIS 83 1HD HIS 83 2.495 -20.993 -5.982 557 HD2 HIS 83 2HD HIS 83 3.014 -23.543 -9.221 558 HE1 HIS 83 1HE HIS 83 0.428 -22.423 -6.049 559 H ILE 84 H ILE 84 2.876 -19.637 -10.626 560 HA ILE 84 HA ILE 84 3.757 -16.932 -10.240 561 HB ILE 84 HB ILE 84 1.187 -17.971 -11.442 562 HG13 ILE 84 2HG1 ILE 84 3.921 -17.791 -12.429 563 HG21 ILE 84 1HG2 ILE 84 1.041 -15.733 -12.473 564 HG22 ILE 84 2HG2 ILE 84 0.931 -15.683 -10.714 565 HG23 ILE 84 3HG2 ILE 84 2.434 -15.228 -11.516 566 HD11 ILE 84 3HD1 ILE 84 1.509 -19.296 -12.969 567 HD12 ILE 84 1HD1 ILE 84 2.348 -18.817 -14.444 568 HD13 ILE 84 2HD1 ILE 84 3.199 -19.739 -13.204 569 H GLN 85 H GLN 85 3.237 -15.604 -8.636 570 HA GLN 85 HA GLN 85 0.854 -16.221 -7.019 571 HB3 GLN 85 2HB GLN 85 2.012 -15.491 -5.039 572 HG3 GLN 85 2HG GLN 85 3.026 -17.678 -6.601 573 HE21 GLN 85 1HE2 GLN 85 4.899 -15.747 -7.068 574 HE22 GLN 85 2HE2 GLN 85 6.381 -16.167 -6.287 575 H TYR 86 H TYR 86 0.050 -14.294 -5.777 576 HA TYR 86 HA TYR 86 0.702 -11.662 -6.498 577 HB3 TYR 86 2HB TYR 86 -0.111 -12.020 -8.681 578 HD1 TYR 86 1HD TYR 86 -3.444 -12.469 -7.184 579 HD2 TYR 86 2HD TYR 86 -0.340 -14.275 -9.466 580 HE1 TYR 86 1HE TYR 86 -4.970 -14.297 -7.801 581 HE2 TYR 86 2HE TYR 86 -1.858 -16.107 -10.091 582 HH TYR 86 HH TYR 86 -3.847 -17.134 -9.494 583 H VAL 87 H VAL 87 -0.345 -10.207 -5.215 584 HA VAL 87 HA VAL 87 -2.183 -11.330 -3.241 585 HB VAL 87 HB VAL 87 -0.975 -8.570 -3.200 586 HG11 VAL 87 1HG1 VAL 87 -2.546 -8.520 -1.556 587 HG12 VAL 87 2HG1 VAL 87 -2.504 -10.267 -1.308 588 HG13 VAL 87 3HG1 VAL 87 -1.226 -9.249 -0.641 589 HG21 VAL 87 3HG2 VAL 87 0.752 -9.543 -1.691 590 HG22 VAL 87 1HG2 VAL 87 0.173 -11.148 -2.140 591 HG23 VAL 87 2HG2 VAL 87 0.876 -10.088 -3.364 592 H ALA 88 H ALA 88 -4.119 -10.224 -2.631 593 HA ALA 88 HA ALA 88 -5.270 -8.620 -4.821 594 HB1 ALA 88 1HB ALA 88 -6.378 -10.840 -3.192 595 HB2 ALA 88 2HB ALA 88 -7.476 -9.547 -3.677 596 HB3 ALA 88 3HB ALA 88 -6.600 -10.467 -4.902 597 H SER 89 H SER 89 -6.432 -9.266 -1.534 598 HA SER 89 HA SER 89 -7.092 -6.499 -1.157 599 HB3 SER 89 2HB SER 89 -8.064 -7.177 0.919 600 HG SER 89 HG SER 89 -9.370 -8.007 -0.590 601 H TYR 90 H TYR 90 -5.764 -4.975 -0.459 602 HA TYR 90 HA TYR 90 -3.712 -5.635 1.516 603 HB3 TYR 90 2HB TYR 90 -2.682 -3.773 -0.470 604 HD1 TYR 90 1HD TYR 90 -1.402 -4.018 1.904 605 HD2 TYR 90 2HD TYR 90 -1.364 -6.877 -1.247 606 HE1 TYR 90 1HE TYR 90 0.715 -4.929 2.763 607 HE2 TYR 90 2HE TYR 90 0.752 -7.797 -0.396 608 HH TYR 90 HH TYR 90 1.901 -7.821 2.039 609 H LYS 91 H LYS 91 -3.821 -4.238 3.133 610 HA LYS 91 HA LYS 91 -5.324 -1.782 2.839 611 HB3 LYS 91 2HB LYS 91 -4.035 -2.063 5.404 612 HG3 LYS 91 2HG LYS 91 -6.640 -2.681 5.846 613 HD3 LYS 91 2HD LYS 91 -5.529 0.083 5.352 614 HE3 LYS 91 2HE LYS 91 -8.081 -0.894 6.324 615 HZ1 LYS 91 3HZ LYS 91 -8.080 0.919 8.116 616 HZ2 LYS 91 1HZ LYS 91 -6.400 0.717 8.132 617 HZ3 LYS 91 2HZ LYS 91 -7.411 -0.586 8.502 618 H VAL 92 H VAL 92 -4.146 -0.321 1.683 619 HA VAL 92 HA VAL 92 -1.431 0.305 2.617 620 HB VAL 92 HB VAL 92 -1.520 -0.149 0.253 621 HG11 VAL 92 1HG1 VAL 92 -4.035 1.148 0.407 622 HG12 VAL 92 2HG1 VAL 92 -3.041 2.031 -0.752 623 HG13 VAL 92 3HG1 VAL 92 -3.319 0.302 -0.964 624 HG21 VAL 92 3HG2 VAL 92 -0.001 1.617 0.977 625 HG22 VAL 92 1HG2 VAL 92 -0.626 1.950 -0.638 626 HG23 VAL 92 2HG2 VAL 92 -1.273 2.817 0.756 627 H ALA 93 H ALA 93 -1.213 1.976 3.937 628 HA ALA 93 HA ALA 93 -3.084 4.239 3.671 629 HB1 ALA 93 1HB ALA 93 -1.855 3.787 6.314 630 HB2 ALA 93 2HB ALA 93 -3.483 4.317 5.892 631 HB3 ALA 93 3HB ALA 93 -3.063 2.607 5.806 632 H HIS 94 H HIS 94 -2.243 6.293 3.813 633 HA HIS 94 HA HIS 94 0.698 6.464 3.851 634 HB3 HIS 94 2HB HIS 94 0.377 8.554 2.488 635 HD1 HIS 94 1HD HIS 94 1.071 8.211 0.106 636 HD2 HIS 94 2HD HIS 94 -1.013 4.961 1.642 637 HE1 HIS 94 1HE HIS 94 1.251 6.410 -1.641 638 H SER 95 H SER 95 1.693 8.022 5.079 639 HA SER 95 HA SER 95 -0.055 9.657 6.799 640 HB3 SER 95 2HB SER 95 1.410 7.532 7.704 641 HG SER 95 HG SER 95 3.272 8.250 8.577 642 H ASP 96 H ASP 96 0.374 11.763 6.779 643 HA ASP 96 HA ASP 96 2.752 12.694 5.369 644 HB3 ASP 96 2HB ASP 96 0.609 14.504 6.435 645 H ASP 97 H ASP 97 1.269 12.778 8.544 646 HA ASP 97 HA ASP 97 3.414 14.479 9.572 647 HB3 ASP 97 2HB ASP 97 1.124 13.364 11.179 648 H GLY 98 H GLY 98 2.477 11.184 9.394 649 HA2 GLY 98 2HA GLY 98 4.154 9.502 9.852 650 HA3 GLY 98 3HA GLY 98 4.705 10.491 11.196 651 H VAL 99 H VAL 99 1.948 11.044 12.082 652 HA VAL 99 HA VAL 99 1.506 8.495 13.464 653 HB VAL 99 HB VAL 99 0.190 9.800 15.084 654 HG11 VAL 99 1HG1 VAL 99 2.476 9.495 15.632 655 HG12 VAL 99 2HG1 VAL 99 2.985 10.754 14.504 656 HG13 VAL 99 3HG1 VAL 99 2.100 11.185 15.968 657 HG21 VAL 99 3HG2 VAL 99 0.974 12.148 13.360 658 HG22 VAL 99 1HG2 VAL 99 -0.657 11.544 13.652 659 HG23 VAL 99 2HG2 VAL 99 0.261 12.275 14.969 660 H GLN 100 H GLN 100 -0.091 10.890 11.456 661 HA GLN 100 HA GLN 100 -2.660 9.577 11.641 662 HB3 GLN 100 2HB GLN 100 -3.490 11.321 10.256 663 HG3 GLN 100 2HG GLN 100 -1.284 12.724 11.722 664 HE21 GLN 100 1HE2 GLN 100 -1.877 14.793 12.410 665 HE22 GLN 100 2HE2 GLN 100 -3.198 15.645 11.695 666 H TRP 101 H TRP 101 -2.766 7.628 10.699 667 HA TRP 101 HA TRP 101 -1.497 7.224 8.092 668 HB3 TRP 101 2HB TRP 101 -1.717 4.886 8.469 669 HD1 TRP 101 HD TRP 101 0.415 7.069 9.620 670 HE1 TRP 101 1HE TRP 101 1.830 6.405 11.665 671 HE3 TRP 101 3HE TRP 101 -2.522 3.309 11.453 672 HZ2 TRP 101 2HZ TRP 101 1.717 4.534 13.775 673 HZ3 TRP 101 3HZ TRP 101 -1.798 2.132 13.488 674 HH2 TRP 101 HH TRP 101 0.279 2.733 14.624 675 H THR 102 H THR 102 -2.780 8.017 6.521 676 HA THR 102 HA THR 102 -5.655 7.691 6.625 677 HB THR 102 HB THR 102 -3.889 8.904 4.491 678 HG1 THR 102 1HG THR 102 -3.868 10.309 6.149 679 HG21 THR 102 3HG2 THR 102 -5.858 8.229 3.381 680 HG22 THR 102 1HG2 THR 102 -6.106 9.933 3.762 681 HG23 THR 102 2HG2 THR 102 -6.879 8.688 4.744 682 H VAL 103 H VAL 103 -6.306 5.640 6.276 683 HA VAL 103 HA VAL 103 -5.023 3.858 4.459 684 HB VAL 103 HB VAL 103 -6.891 2.344 4.887 685 HG11 VAL 103 1HG1 VAL 103 -5.304 3.609 6.976 686 HG12 VAL 103 2HG1 VAL 103 -6.765 2.831 7.590 687 HG13 VAL 103 3HG1 VAL 103 -5.595 1.900 6.652 688 HG21 VAL 103 3HG2 VAL 103 -8.850 3.528 4.972 689 HG22 VAL 103 1HG2 VAL 103 -8.560 3.291 6.696 690 HG23 VAL 103 2HG2 VAL 103 -8.151 4.829 5.935 691 H TYR 104 H TYR 104 -5.438 3.420 2.370 692 HA TYR 104 HA TYR 104 -6.861 5.257 0.786 693 HB3 TYR 104 2HB TYR 104 -6.649 3.134 -0.872 694 HD1 TYR 104 2HD TYR 104 -4.357 5.335 1.069 695 HD2 TYR 104 1HD TYR 104 -5.396 3.750 -2.740 696 HE1 TYR 104 2HE TYR 104 -2.727 6.839 0.004 697 HE2 TYR 104 1HE TYR 104 -3.770 5.248 -3.815 698 HH TYR 104 HH TYR 104 -2.341 7.862 -2.216 699 H GLU 105 H GLU 105 -8.988 5.461 1.390 700 HA GLU 105 HA GLU 105 -10.714 3.203 1.733 701 HB3 GLU 105 2HB GLU 105 -11.172 5.243 2.949 702 HG3 GLU 105 2HG GLU 105 -11.001 6.492 0.295 703 H GLU 106 H GLU 106 -12.792 3.042 0.461 704 HA GLU 106 HA GLU 106 -12.137 3.176 -2.396 705 HB3 GLU 106 2HB GLU 106 -14.534 1.716 -1.947 706 HG3 GLU 106 2HG GLU 106 -11.862 0.435 -2.357 707 H GLN 107 H GLN 107 -14.904 3.685 -0.209 708 HA GLN 107 HA GLN 107 -15.667 6.069 -1.616 709 HB3 GLN 107 2HB GLN 107 -16.677 4.489 -3.124 710 HG3 GLN 107 2HG GLN 107 -18.212 3.319 -0.821 711 HE21 GLN 107 1HE2 GLN 107 -19.968 2.339 -1.491 712 HE22 GLN 107 2HE2 GLN 107 -20.264 1.745 -3.087 713 H GLY 108 H GLY 108 -14.953 6.152 0.866 714 HA2 GLY 108 2HA GLY 108 -15.728 7.057 2.854 715 HA3 GLY 108 3HA GLY 108 -17.373 6.821 2.282 716 H SER 109 H SER 109 -15.360 4.067 2.106 717 HA SER 109 HA SER 109 -16.752 2.928 4.433 718 HB3 SER 109 2HB SER 109 -15.772 1.765 1.852 719 HG SER 109 HG SER 109 -16.286 -0.322 2.985 720 H SER 110 H SER 110 -13.657 3.695 3.118 721 HA SER 110 HA SER 110 -11.538 3.538 3.930 722 HB3 SER 110 2HB SER 110 -12.985 3.103 6.555 723 HG SER 110 HG SER 110 -11.091 3.242 7.490 724 H LYS 111 H LYS 111 -12.338 1.294 2.679 725 HA LYS 111 HA LYS 111 -11.624 -0.965 4.404 726 HB3 LYS 111 2HB LYS 111 -12.232 -1.661 1.657 727 HG3 LYS 111 2HG LYS 111 -13.973 -2.222 4.027 728 HD3 LYS 111 2HD LYS 111 -13.162 -4.079 1.813 729 HE3 LYS 111 2HE LYS 111 -15.713 -4.651 2.403 730 HZ1 LYS 111 3HZ LYS 111 -14.719 -6.227 4.140 731 HZ2 LYS 111 1HZ LYS 111 -13.224 -5.575 3.689 732 HZ3 LYS 111 2HZ LYS 111 -14.183 -6.366 2.542 733 H VAL 112 H VAL 112 -10.552 -2.728 2.636 734 HA VAL 112 HA VAL 112 -7.900 -1.618 2.251 735 HB VAL 112 HB VAL 112 -7.172 -3.881 1.832 736 HG11 VAL 112 1HG1 VAL 112 -8.820 -4.746 3.981 737 HG12 VAL 112 2HG1 VAL 112 -7.148 -4.183 4.030 738 HG13 VAL 112 3HG1 VAL 112 -8.473 -3.031 4.202 739 HG21 VAL 112 3HG2 VAL 112 -9.229 -5.603 2.205 740 HG22 VAL 112 1HG2 VAL 112 -10.033 -4.310 1.314 741 HG23 VAL 112 2HG2 VAL 112 -8.621 -5.111 0.623 742 H PHE 113 H PHE 113 -6.686 -2.108 0.246 743 HA PHE 113 HA PHE 113 -8.366 -1.541 -2.082 744 HB3 PHE 113 2HB PHE 113 -5.660 -1.412 -2.829 745 HD1 PHE 113 1HD PHE 113 -8.338 0.596 -1.208 746 HD2 PHE 113 2HD PHE 113 -5.401 0.367 -4.279 747 HE1 PHE 113 1HE PHE 113 -9.169 2.711 -2.155 748 HE2 PHE 113 2HE PHE 113 -6.226 2.482 -5.231 749 HZ PHE 113 HZ PHE 113 -8.112 3.656 -4.167 750 H GLN 114 H GLN 114 -8.853 -3.103 -3.462 751 HA GLN 114 HA GLN 114 -7.496 -5.655 -3.315 752 HB3 GLN 114 2HB GLN 114 -9.935 -5.594 -3.496 753 HG3 GLN 114 2HG GLN 114 -10.710 -5.141 -5.982 754 HE21 GLN 114 1HE2 GLN 114 -9.616 -2.113 -4.890 755 HE22 GLN 114 2HE2 GLN 114 -11.039 -1.644 -4.029 756 H GLY 115 H GLY 115 -6.379 -6.660 -4.991 757 HA2 GLY 115 2HA GLY 115 -5.341 -4.794 -7.021 758 HA3 GLY 115 3HA GLY 115 -4.495 -6.214 -6.423 759 H ASN 116 H ASN 116 -4.205 -7.447 -8.179 760 HA ASN 116 HA ASN 116 -6.561 -8.019 -9.854 761 HB3 ASN 116 2HB ASN 116 -4.057 -8.809 -11.067 762 HD21 ASN 116 1HD2 ASN 116 -5.181 -9.403 -12.818 763 HD22 ASN 116 2HD2 ASN 116 -6.139 -8.335 -13.782 764 H LEU 117 H LEU 117 -5.719 -10.237 -11.180 765 HA LEU 117 HA LEU 117 -5.234 -12.206 -9.043 766 HB3 LEU 117 2HB LEU 117 -6.701 -13.748 -10.378 767 HG LEU 117 HG LEU 117 -7.675 -11.519 -8.777 768 HD11 LEU 117 1HD1 LEU 117 -9.693 -12.834 -10.571 769 HD12 LEU 117 2HD1 LEU 117 -8.975 -11.266 -10.941 770 HD13 LEU 117 3HD1 LEU 117 -9.921 -11.478 -9.467 771 HD21 LEU 117 3HD2 LEU 117 -8.418 -13.194 -7.481 772 HD22 LEU 117 1HD2 LEU 117 -7.394 -14.208 -8.497 773 HD23 LEU 117 2HD2 LEU 117 -9.119 -14.073 -8.841 774 H ASP 118 H ASP 118 -3.290 -10.998 -10.794 775 HA ASP 118 HA ASP 118 -2.019 -13.384 -11.732 776 HB3 ASP 118 2HB ASP 118 -2.053 -11.579 -14.002 777 H ASN 119 H ASN 119 0.178 -13.133 -11.969 778 HA ASN 119 HA ASN 119 1.353 -10.878 -10.717 779 HB3 ASN 119 2HB ASN 119 2.208 -13.336 -10.897 780 HD21 ASN 119 1HD2 ASN 119 1.429 -13.882 -13.184 781 HD22 ASN 119 2HD2 ASN 119 2.666 -14.010 -14.383 782 H ASN 120 H ASN 120 0.878 -11.820 -14.061 783 HA ASN 120 HA ASN 120 2.548 -9.718 -15.107 784 HB3 ASN 120 2HB ASN 120 1.252 -10.466 -17.285 785 HD21 ASN 120 1HD2 ASN 120 2.141 -13.488 -16.176 786 HD22 ASN 120 2HD2 ASN 120 3.796 -13.473 -16.672 787 H SER 121 H SER 121 -0.775 -10.116 -14.228 788 HA SER 121 HA SER 121 -1.578 -7.693 -15.645 789 HB3 SER 121 2HB SER 121 -3.859 -8.263 -14.857 790 HG SER 121 HG SER 121 -2.648 -9.379 -16.721 791 H HIS 122 H HIS 122 -0.697 -5.986 -14.568 792 HA HIS 122 HA HIS 122 -0.802 -5.801 -11.691 793 HB3 HIS 122 2HB HIS 122 1.080 -4.875 -13.068 794 HD1 HIS 122 1HD HIS 122 -1.524 -4.357 -15.060 795 HD2 HIS 122 2HD HIS 122 1.306 -1.653 -13.669 796 HE1 HIS 122 1HE HIS 122 -1.532 -2.463 -16.716 797 H LYS 123 H LYS 123 -1.393 -3.208 -11.165 798 HA LYS 123 HA LYS 123 -3.936 -2.491 -12.332 799 HB3 LYS 123 2HB LYS 123 -3.814 -3.193 -9.395 800 HG3 LYS 123 2HG LYS 123 -5.748 -1.769 -10.986 801 HD3 LYS 123 2HD LYS 123 -6.674 -4.273 -9.578 802 HE3 LYS 123 2HE LYS 123 -8.924 -3.373 -10.538 803 HZ1 LYS 123 3HZ LYS 123 -9.409 -2.329 -8.461 804 HZ2 LYS 123 1HZ LYS 123 -7.770 -2.059 -8.140 805 HZ3 LYS 123 2HZ LYS 123 -8.380 -3.636 -8.154 806 H LYS 124 H LYS 124 -3.599 -0.398 -12.679 807 HA LYS 124 HA LYS 124 -2.127 1.174 -10.691 808 HB3 LYS 124 2HB LYS 124 -1.479 1.200 -13.140 809 HG3 LYS 124 2HG LYS 124 -3.941 2.915 -13.396 810 HD3 LYS 124 2HD LYS 124 -2.837 2.326 -15.895 811 HE3 LYS 124 2HE LYS 124 -2.416 4.887 -14.375 812 HZ1 LYS 124 3HZ LYS 124 -2.940 4.280 -17.234 813 HZ2 LYS 124 1HZ LYS 124 -1.498 4.870 -16.573 814 HZ3 LYS 124 2HZ LYS 124 -2.884 5.840 -16.580 815 H ASN 125 H ASN 125 -3.056 2.744 -9.507 816 HA ASN 125 HA ASN 125 -5.927 3.228 -9.938 817 HB3 ASN 125 2HB ASN 125 -6.092 3.744 -7.582 818 HD21 ASN 125 1HD2 ASN 125 -3.315 1.593 -7.757 819 HD22 ASN 125 2HD2 ASN 125 -4.179 0.147 -7.372 820 H ILE 126 H ILE 126 -6.637 5.222 -10.387 821 HA ILE 126 HA ILE 126 -4.944 7.257 -11.227 822 HB ILE 126 HB ILE 126 -7.453 6.965 -11.682 823 HG13 ILE 126 2HG1 ILE 126 -5.750 9.069 -12.009 824 HG21 ILE 126 1HG2 ILE 126 -8.086 8.931 -9.613 825 HG22 ILE 126 2HG2 ILE 126 -8.985 7.511 -10.145 826 HG23 ILE 126 3HG2 ILE 126 -7.671 7.336 -8.983 827 HD11 ILE 126 3HD1 ILE 126 -7.181 9.909 -13.621 828 HD12 ILE 126 1HD1 ILE 126 -7.636 8.209 -13.521 829 HD13 ILE 126 2HD1 ILE 126 -8.627 9.436 -12.729 830 H PHE 127 H PHE 127 -4.872 9.506 -10.323 831 HA PHE 127 HA PHE 127 -3.460 9.727 -8.043 832 HB3 PHE 127 2HB PHE 127 -3.566 11.726 -9.180 833 HD1 PHE 127 2HD PHE 127 -7.114 11.952 -8.192 834 HD2 PHE 127 1HD PHE 127 -4.337 11.698 -11.407 835 HE1 PHE 127 2HE PHE 127 -8.914 12.480 -9.785 836 HE2 PHE 127 1HE PHE 127 -6.131 12.226 -13.005 837 HZ PHE 127 HZ PHE 127 -8.425 12.616 -12.195 838 H GLU 128 H GLU 128 -6.989 9.713 -8.252 839 HA GLU 128 HA GLU 128 -8.613 9.667 -6.639 840 HB3 GLU 128 2HB GLU 128 -6.787 7.880 -5.068 841 HG3 GLU 128 2HG GLU 128 -9.417 8.400 -4.765 842 H LYS 129 H LYS 129 -7.384 11.969 -6.296 843 HA LYS 129 HA LYS 129 -7.182 13.649 -4.765 844 HB3 LYS 129 2HB LYS 129 -7.948 13.374 -2.556 845 HG3 LYS 129 2HG LYS 129 -9.503 11.058 -3.408 846 HD3 LYS 129 2HD LYS 129 -9.837 13.413 -1.913 847 HE3 LYS 129 2HE LYS 129 -11.857 13.293 -4.141 848 HZ1 LYS 129 3HZ LYS 129 -11.947 15.741 -3.078 849 HZ2 LYS 129 1HZ LYS 129 -11.542 14.831 -1.709 850 HZ3 LYS 129 2HZ LYS 129 -12.941 14.464 -2.585 851 HA PRO 130 HA PRO 130 -2.807 12.418 -4.221 852 HB3 PRO 130 2HB PRO 130 -2.286 13.513 -6.173 853 HG3 PRO 130 2HG PRO 130 -3.622 15.239 -6.974 854 HD3 PRO 130 2HD PRO 130 -5.234 13.637 -6.587 855 H PHE 131 H PHE 131 -1.081 13.447 -2.925 856 HA PHE 131 HA PHE 131 -1.424 15.681 -1.306 857 HB3 PHE 131 2HB PHE 131 -1.729 13.563 0.647 858 HD1 PHE 131 1HD PHE 131 -1.113 15.700 1.853 859 HD2 PHE 131 2HD PHE 131 -4.774 15.199 -0.257 860 HE1 PHE 131 1HE PHE 131 -2.087 17.580 3.105 861 HE2 PHE 131 2HE PHE 131 -5.755 17.079 0.991 862 HZ PHE 131 HZ PHE 131 -4.411 18.273 2.674 863 H MET 132 H MET 132 0.202 15.834 0.413 864 HA MET 132 HA MET 132 2.635 14.515 -0.389 865 HB3 MET 132 2HB MET 132 3.669 15.940 1.386 866 HG3 MET 132 2HG MET 132 1.841 17.540 -0.383 867 HE1 MET 132 3HE MET 132 6.095 18.739 0.132 868 HE2 MET 132 1HE MET 132 5.310 17.542 -0.898 869 HE3 MET 132 2HE MET 132 5.193 19.257 -1.293 870 H ALA 133 H ALA 133 3.946 13.198 0.909 871 HA ALA 133 HA ALA 133 2.922 12.264 3.462 872 HB1 ALA 133 1HB ALA 133 2.471 10.805 1.045 873 HB2 ALA 133 2HB ALA 133 3.554 9.888 2.093 874 HB3 ALA 133 3HB ALA 133 1.980 10.411 2.692 875 H ARG 134 H ARG 134 4.482 11.297 4.761 876 HA ARG 134 HA ARG 134 7.229 11.396 3.697 877 HB3 ARG 134 2HB ARG 134 6.656 13.140 5.412 878 HG3 ARG 134 2HG ARG 134 5.658 10.906 6.856 879 HD3 ARG 134 2HD ARG 134 6.761 11.179 8.979 880 HE ARG 134 HE ARG 134 8.363 10.313 6.744 881 HH11 ARG 134 1HH1 ARG 134 8.188 10.681 10.202 882 HH12 ARG 134 2HH1 ARG 134 9.375 9.460 10.522 883 HH21 ARG 134 1HH2 ARG 134 9.926 8.704 7.153 884 HH22 ARG 134 2HH2 ARG 134 10.364 8.337 8.788 885 H TYR 135 H TYR 135 4.825 9.511 5.244 886 HA TYR 135 HA TYR 135 6.507 7.174 5.140 887 HB3 TYR 135 2HB TYR 135 5.519 8.254 7.782 888 HD1 TYR 135 2HD TYR 135 3.987 6.407 8.318 889 HD2 TYR 135 1HD TYR 135 8.080 5.691 7.401 890 HE1 TYR 135 2HE TYR 135 3.800 4.148 9.274 891 HE2 TYR 135 1HE TYR 135 7.903 3.430 8.353 892 HH TYR 135 HH TYR 135 5.055 2.379 10.078 893 H VAL 136 H VAL 136 5.314 5.488 4.538 894 HA VAL 136 HA VAL 136 2.420 5.549 5.093 895 HB VAL 136 HB VAL 136 1.918 4.653 2.954 896 HG11 VAL 136 1HG1 VAL 136 2.606 6.396 1.476 897 HG12 VAL 136 2HG1 VAL 136 2.429 7.100 3.083 898 HG13 VAL 136 3HG1 VAL 136 4.035 6.737 2.451 899 HG21 VAL 136 3HG2 VAL 136 4.693 3.813 3.021 900 HG22 VAL 136 1HG2 VAL 136 3.340 3.170 2.090 901 HG23 VAL 136 2HG2 VAL 136 4.259 4.545 1.476 902 H ARG 137 H ARG 137 1.386 3.515 5.348 903 HA ARG 137 HA ARG 137 3.221 1.275 5.892 904 HB3 ARG 137 2HB ARG 137 0.700 1.614 7.466 905 HG3 ARG 137 2HG ARG 137 3.375 0.358 7.976 906 HD3 ARG 137 2HD ARG 137 2.676 1.642 9.971 907 HE ARG 137 HE ARG 137 0.429 1.644 10.370 908 HH11 ARG 137 1HH1 ARG 137 1.429 -1.604 9.613 909 HH12 ARG 137 2HH1 ARG 137 -0.116 -2.302 9.968 910 HH21 ARG 137 1HH2 ARG 137 -1.610 0.737 10.841 911 HH22 ARG 137 2HH2 ARG 137 -1.844 -0.969 10.666 912 H VAL 138 H VAL 138 2.563 -0.746 5.273 913 HA VAL 138 HA VAL 138 -0.083 -0.977 4.003 914 HB VAL 138 HB VAL 138 2.237 -2.433 2.814 915 HG11 VAL 138 1HG1 VAL 138 0.784 -2.919 1.189 916 HG12 VAL 138 2HG1 VAL 138 -0.462 -2.322 2.287 917 HG13 VAL 138 3HG1 VAL 138 0.231 -1.249 1.071 918 HG21 VAL 138 3HG2 VAL 138 1.740 0.490 2.652 919 HG22 VAL 138 1HG2 VAL 138 3.257 -0.408 2.584 920 HG23 VAL 138 2HG2 VAL 138 2.201 -0.350 1.171 921 H LEU 139 H LEU 139 -1.127 -2.906 4.273 922 HA LEU 139 HA LEU 139 0.295 -5.117 5.551 923 HB3 LEU 139 2HB LEU 139 -2.058 -3.646 6.685 924 HG LEU 139 HG LEU 139 -2.607 -6.101 6.700 925 HD11 LEU 139 1HD1 LEU 139 -0.897 -7.471 7.117 926 HD12 LEU 139 2HD1 LEU 139 -1.120 -7.037 8.811 927 HD13 LEU 139 3HD1 LEU 139 0.074 -6.184 7.833 928 HD21 LEU 139 3HD2 LEU 139 -3.519 -6.005 8.834 929 HD22 LEU 139 1HD2 LEU 139 -3.301 -4.305 8.417 930 HD23 LEU 139 2HD2 LEU 139 -2.149 -5.106 9.488 931 HA PRO 140 HA PRO 140 -2.139 -7.196 2.457 932 HB3 PRO 140 2HB PRO 140 -0.288 -8.511 2.109 933 HG3 PRO 140 2HG PRO 140 1.197 -8.974 3.838 934 HD3 PRO 140 2HD PRO 140 1.054 -6.682 4.040 935 H VAL 141 H VAL 141 -3.999 -8.434 2.404 936 HA VAL 141 HA VAL 141 -4.991 -9.485 4.966 937 HB VAL 141 HB VAL 141 -6.608 -7.843 3.011 938 HG11 VAL 141 1HG1 VAL 141 -7.345 -9.550 5.332 939 HG12 VAL 141 2HG1 VAL 141 -8.241 -8.052 5.073 940 HG13 VAL 141 3HG1 VAL 141 -8.195 -9.283 3.810 941 HG21 VAL 141 3HG2 VAL 141 -5.279 -7.237 5.599 942 HG22 VAL 141 1HG2 VAL 141 -5.509 -6.218 4.177 943 HG23 VAL 141 2HG2 VAL 141 -6.852 -6.504 5.285 944 H SER 142 H SER 142 -5.252 -9.481 1.443 945 HA SER 142 HA SER 142 -5.941 -12.321 1.540 946 HB3 SER 142 2HB SER 142 -7.870 -12.163 0.247 947 HG SER 142 HG SER 142 -8.897 -11.218 1.806 948 H TRP 143 H TRP 143 -4.438 -13.310 0.382 949 HA TRP 143 HA TRP 143 -3.540 -12.049 -2.124 950 HB3 TRP 143 2HB TRP 143 -1.801 -11.939 -0.349 951 HD1 TRP 143 HD TRP 143 -0.537 -15.323 -1.306 952 HE1 TRP 143 1HE TRP 143 -0.423 -16.837 0.772 953 HE3 TRP 143 3HE TRP 143 -3.159 -12.402 1.969 954 HZ2 TRP 143 2HZ TRP 143 -1.326 -16.797 3.447 955 HZ3 TRP 143 3HZ TRP 143 -3.489 -13.213 4.269 956 HH2 TRP 143 HH TRP 143 -2.591 -15.366 4.990 957 H HIS 144 H HIS 144 -2.123 -13.946 -3.301 958 HA HIS 144 HA HIS 144 -3.690 -16.421 -3.248 959 HB3 HIS 144 2HB HIS 144 -3.167 -15.995 -5.957 960 HD1 HIS 144 1HD HIS 144 -4.872 -17.998 -5.698 961 HD2 HIS 144 2HD HIS 144 -6.408 -14.234 -4.842 962 HE1 HIS 144 1HE HIS 144 -7.372 -18.275 -5.703 963 H ASN 145 H ASN 145 -2.425 -18.158 -3.250 964 HA ASN 145 HA ASN 145 -0.660 -19.553 -3.650 965 HB3 ASN 145 2HB ASN 145 0.807 -19.170 -5.439 966 HD21 ASN 145 1HD2 ASN 145 -1.196 -20.254 -6.138 967 HD22 ASN 145 2HD2 ASN 145 -2.208 -19.438 -7.275 968 H ARG 146 H ARG 146 0.844 -16.319 -3.666 969 HA ARG 146 HA ARG 146 1.869 -16.654 -1.001 970 HB3 ARG 146 2HB ARG 146 3.863 -16.538 -3.265 971 HG3 ARG 146 2HG ARG 146 4.534 -15.607 -1.013 972 HD3 ARG 146 2HD ARG 146 3.424 -17.176 0.442 973 HE ARG 146 HE ARG 146 3.403 -19.334 -0.318 974 HH11 ARG 146 1HH1 ARG 146 6.674 -18.145 -0.354 975 HH12 ARG 146 2HH1 ARG 146 7.369 -19.685 -0.735 976 HH21 ARG 146 1HH2 ARG 146 4.305 -21.368 -0.819 977 HH22 ARG 146 2HH2 ARG 146 6.020 -21.518 -1.000 978 H ILE 147 H ILE 147 2.694 -14.743 -0.128 979 HA ILE 147 HA ILE 147 1.704 -12.348 -1.284 980 HB ILE 147 HB ILE 147 3.573 -12.771 1.049 981 HG13 ILE 147 2HG1 ILE 147 0.602 -12.465 0.743 982 HG21 ILE 147 1HG2 ILE 147 4.046 -10.588 0.535 983 HG22 ILE 147 2HG2 ILE 147 2.461 -10.298 -0.181 984 HG23 ILE 147 3HG2 ILE 147 2.636 -10.373 1.572 985 HD11 ILE 147 3HD1 ILE 147 1.154 -14.705 1.042 986 HD12 ILE 147 1HD1 ILE 147 2.402 -14.335 2.233 987 HD13 ILE 147 2HD1 ILE 147 0.698 -14.151 2.652 988 H THR 148 H THR 148 2.726 -12.259 -3.340 989 HA THR 148 HA THR 148 5.445 -11.156 -3.210 990 HB THR 148 HB THR 148 4.767 -12.731 -5.632 991 HG1 THR 148 1HG THR 148 4.199 -14.298 -4.213 992 HG21 THR 148 3HG2 THR 148 7.323 -13.243 -4.412 993 HG22 THR 148 1HG2 THR 148 7.034 -11.507 -4.522 994 HG23 THR 148 2HG2 THR 148 6.959 -12.508 -5.973 995 H LEU 149 H LEU 149 4.866 -9.059 -3.554 996 HA LEU 149 HA LEU 149 4.229 -8.281 -6.219 997 HB3 LEU 149 2HB LEU 149 1.989 -8.918 -5.316 998 HG LEU 149 HG LEU 149 0.836 -7.777 -3.688 999 HD11 LEU 149 1HD1 LEU 149 2.198 -7.712 -1.695 1000 HD12 LEU 149 2HD1 LEU 149 3.669 -7.645 -2.664 1001 HD13 LEU 149 3HD1 LEU 149 2.662 -9.094 -2.689 1002 HD21 LEU 149 3HD2 LEU 149 1.782 -5.535 -4.752 1003 HD22 LEU 149 1HD2 LEU 149 2.794 -5.581 -3.308 1004 HD23 LEU 149 2HD2 LEU 149 1.037 -5.575 -3.154 1005 H ARG 150 H ARG 150 3.580 -5.745 -6.078 1006 HA ARG 150 HA ARG 150 4.869 -4.337 -3.932 1007 HB3 ARG 150 2HB ARG 150 6.152 -3.655 -6.499 1008 HG3 ARG 150 2HG ARG 150 8.184 -3.980 -4.835 1009 HD3 ARG 150 2HD ARG 150 6.747 -1.592 -4.029 1010 HE ARG 150 HE ARG 150 9.317 -2.107 -4.573 1011 HH11 ARG 150 1HH1 ARG 150 7.020 0.041 -6.064 1012 HH12 ARG 150 2HH1 ARG 150 8.217 1.196 -6.549 1013 HH21 ARG 150 1HH2 ARG 150 10.903 -0.594 -5.204 1014 HH22 ARG 150 2HH2 ARG 150 10.426 0.833 -6.060 1015 H LEU 151 H LEU 151 4.032 -2.344 -3.736 1016 HA LEU 151 HA LEU 151 2.315 -1.383 -5.920 1017 HB3 LEU 151 2HB LEU 151 2.268 -0.833 -2.958 1018 HG LEU 151 HG LEU 151 1.494 1.144 -4.419 1019 HD11 LEU 151 1HD1 LEU 151 0.194 -0.583 -5.892 1020 HD12 LEU 151 2HD1 LEU 151 -0.483 1.015 -5.576 1021 HD13 LEU 151 3HD1 LEU 151 -1.054 -0.381 -4.662 1022 HD21 LEU 151 3HD2 LEU 151 -0.365 -0.089 -2.389 1023 HD22 LEU 151 1HD2 LEU 151 -0.360 1.601 -2.895 1024 HD23 LEU 151 2HD2 LEU 151 1.029 0.933 -2.035 1025 H GLU 152 H GLU 152 3.725 -0.201 -7.151 1026 HA GLU 152 HA GLU 152 5.659 1.579 -6.072 1027 HB3 GLU 152 2HB GLU 152 4.465 1.578 -8.848 1028 HG3 GLU 152 2HG GLU 152 6.988 2.728 -7.716 1029 H LEU 153 H LEU 153 5.631 3.794 -5.850 1030 HA LEU 153 HA LEU 153 2.956 5.014 -5.845 1031 HB3 LEU 153 2HB LEU 153 3.755 6.538 -4.191 1032 HG LEU 153 HG LEU 153 4.091 5.233 -2.330 1033 HD11 LEU 153 1HD1 LEU 153 3.268 3.001 -4.141 1034 HD12 LEU 153 2HD1 LEU 153 2.217 4.397 -3.905 1035 HD13 LEU 153 3HD1 LEU 153 2.688 3.405 -2.525 1036 HD21 LEU 153 3HD2 LEU 153 6.191 4.106 -3.890 1037 HD22 LEU 153 1HD2 LEU 153 5.228 2.797 -3.204 1038 HD23 LEU 153 2HD2 LEU 153 5.935 4.017 -2.146 1039 H LEU 154 H LEU 154 2.553 6.907 -6.906 1040 HA LEU 154 HA LEU 154 4.761 8.034 -8.498 1041 HB3 LEU 154 2HB LEU 154 3.437 8.208 -10.384 1042 HG LEU 154 HG LEU 154 2.425 5.692 -9.065 1043 HD11 LEU 154 1HD1 LEU 154 2.141 6.631 -11.913 1044 HD12 LEU 154 2HD1 LEU 154 0.841 6.352 -10.755 1045 HD13 LEU 154 3HD1 LEU 154 1.799 4.996 -11.348 1046 HD21 LEU 154 3HD2 LEU 154 4.374 4.801 -9.640 1047 HD22 LEU 154 1HD2 LEU 154 4.928 6.401 -10.136 1048 HD23 LEU 154 2HD2 LEU 154 4.162 5.330 -11.309 1049 H GLY 155 H GLY 155 4.758 10.270 -8.835 1050 HA2 GLY 155 2HA GLY 155 2.767 11.795 -7.282 1051 HA3 GLY 155 3HA GLY 155 4.486 12.111 -7.091 1052 H CYS 156 H CYS 156 3.051 14.228 -7.731 1053 HA CYS 156 HA CYS 156 3.059 14.542 -10.636 1054 HB3 CYS 156 2HB CYS 156 2.248 16.955 -9.680 1055 H LEU 157 H LEU 157 4.852 15.450 -7.816 1056 HA LEU 157 HA LEU 157 6.785 16.607 -7.513 1057 HB3 LEU 157 2HB LEU 157 7.582 16.820 -10.294 1058 HG LEU 157 HG LEU 157 9.520 15.581 -9.687 1059 HD11 LEU 157 1HD1 LEU 157 9.338 17.908 -8.847 1060 HD12 LEU 157 2HD1 LEU 157 10.393 16.886 -7.872 1061 HD13 LEU 157 3HD1 LEU 157 8.767 17.267 -7.306 1062 HD21 LEU 157 3HD2 LEU 157 8.213 14.926 -7.053 1063 HD22 LEU 157 1HD2 LEU 157 9.772 14.358 -7.652 1064 HD23 LEU 157 2HD2 LEU 157 8.280 13.817 -8.424 1065 H GLU 158 H GLU 158 4.279 18.017 -8.210 1066 HA GLU 158 HA GLU 158 5.332 20.430 -9.505 1067 HB3 GLU 158 2HB GLU 158 2.541 20.616 -8.847 1068 HG3 GLU 158 2HG GLU 158 2.691 20.225 -11.564 Start of MODEL 16 1 H1 MET -5 H MET -5 17.549 15.854 -22.202 2 HA MET -5 HA MET -5 18.974 17.272 -20.185 3 HB3 MET -5 2HB MET -5 19.273 19.343 -21.698 4 HG3 MET -5 2HG MET -5 21.355 17.922 -22.822 5 HE1 MET -5 3HE MET -5 22.162 19.873 -23.186 6 HE2 MET -5 1HE MET -5 21.718 21.270 -22.204 7 HE3 MET -5 2HE MET -5 23.353 20.615 -22.115 8 H LYS -4 H LYS -4 17.348 17.996 -18.994 9 HA LYS -4 HA LYS -4 15.396 18.974 -18.355 10 HB3 LYS -4 2HB LYS -4 14.423 20.411 -20.495 11 HG3 LYS -4 2HG LYS -4 16.025 22.262 -19.567 12 HD3 LYS -4 2HD LYS -4 13.850 20.931 -17.954 13 HE3 LYS -4 2HE LYS -4 14.297 23.804 -17.623 14 HZ1 LYS -4 3HZ LYS -4 12.844 22.077 -16.326 15 HZ2 LYS -4 1HZ LYS -4 13.547 23.392 -15.525 16 HZ3 LYS -4 2HZ LYS -4 14.261 21.862 -15.429 17 H SER -3 H SER -3 13.958 17.362 -18.089 18 HA SER -3 HA SER -3 11.906 17.002 -20.041 19 HB3 SER -3 2HB SER -3 12.427 14.364 -19.886 20 HG SER -3 HG SER -3 12.167 15.250 -21.865 21 H GLY -2 H GLY -2 10.049 16.178 -19.151 22 HA2 GLY -2 2HA GLY -2 9.220 14.587 -17.350 23 HA3 GLY -2 3HA GLY -2 10.206 15.560 -16.269 24 H HIS -1 H HIS -1 7.877 16.299 -18.867 25 HA HIS -1 HA HIS -1 6.706 18.361 -17.167 26 HB3 HIS -1 2HB HIS -1 5.817 17.769 -19.973 27 HD1 HIS -1 1HD HIS -1 3.647 19.059 -19.595 28 HD2 HIS -1 2HD HIS -1 7.053 21.219 -18.595 29 HE1 HIS -1 1HE HIS -1 2.866 21.425 -19.252 30 H GLY 0 H GLY 0 6.200 15.841 -16.202 31 HA2 GLY 0 2HA GLY 0 3.319 15.550 -16.788 32 HA3 GLY 0 3HA GLY 0 4.359 14.152 -16.559 33 H CYS 1 H CYS 1 2.059 14.574 -15.044 34 HA CYS 1 HA CYS 1 3.046 15.488 -12.439 35 HB3 CYS 1 2HB CYS 1 0.211 14.682 -13.056 36 H SER 2 H SER 2 3.754 12.912 -13.754 37 HA SER 2 HA SER 2 3.085 11.191 -11.488 38 HB3 SER 2 2HB SER 2 1.483 10.300 -12.899 39 HG SER 2 HG SER 2 1.491 10.560 -15.010 40 H GLU 3 H GLU 3 5.205 11.382 -10.777 41 HA GLU 3 HA GLU 3 7.289 10.336 -12.570 42 HB3 GLU 3 2HB GLU 3 7.562 12.633 -11.538 43 HG3 GLU 3 2HG GLU 3 6.784 11.648 -9.214 44 HA PRO 4 HA PRO 4 7.708 6.664 -10.199 45 HB3 PRO 4 2HB PRO 4 9.160 5.936 -11.823 46 HG3 PRO 4 2HG PRO 4 10.626 7.410 -12.868 47 HD3 PRO 4 2HD PRO 4 8.655 8.582 -13.096 48 H LEU 5 H LEU 5 10.978 7.714 -9.634 49 HA LEU 5 HA LEU 5 10.600 8.917 -7.104 50 HB3 LEU 5 2HB LEU 5 9.955 6.825 -6.257 51 HG LEU 5 HG LEU 5 11.302 5.579 -8.288 52 HD11 LEU 5 1HD1 LEU 5 13.429 5.375 -7.560 53 HD12 LEU 5 2HD1 LEU 5 12.754 4.009 -6.673 54 HD13 LEU 5 3HD1 LEU 5 12.984 5.559 -5.863 55 HD21 LEU 5 3HD2 LEU 5 10.735 3.476 -6.877 56 HD22 LEU 5 1HD2 LEU 5 9.431 4.531 -7.423 57 HD23 LEU 5 2HD2 LEU 5 10.011 4.634 -5.761 58 H GLY 6 H GLY 6 12.716 7.030 -9.204 59 HA2 GLY 6 2HA GLY 6 14.789 9.030 -8.919 60 HA3 GLY 6 3HA GLY 6 15.206 7.456 -8.259 61 H LEU 7 H LEU 7 13.161 7.845 -11.069 62 HA LEU 7 HA LEU 7 15.297 6.643 -12.701 63 HB3 LEU 7 2HB LEU 7 13.662 5.553 -13.987 64 HG LEU 7 HG LEU 7 12.656 5.465 -11.145 65 HD11 LEU 7 1HD1 LEU 7 11.861 3.136 -12.206 66 HD12 LEU 7 2HD1 LEU 7 11.694 4.176 -13.620 67 HD13 LEU 7 3HD1 LEU 7 10.834 4.567 -12.132 68 HD21 LEU 7 3HD2 LEU 7 13.795 3.088 -11.585 69 HD22 LEU 7 1HD2 LEU 7 14.683 4.476 -10.958 70 HD23 LEU 7 2HD2 LEU 7 14.773 4.075 -12.673 71 H LYS 8 H LYS 8 14.499 9.553 -12.108 72 HA LYS 8 HA LYS 8 14.494 10.409 -14.923 73 HB3 LYS 8 2HB LYS 8 13.300 12.374 -13.153 74 HG3 LYS 8 2HG LYS 8 13.090 12.364 -15.620 75 HD3 LYS 8 2HD LYS 8 10.848 10.581 -15.771 76 HE3 LYS 8 2HE LYS 8 13.383 9.964 -17.164 77 HZ1 LYS 8 3HZ LYS 8 11.849 10.017 -19.080 78 HZ2 LYS 8 1HZ LYS 8 10.580 10.410 -18.033 79 HZ3 LYS 8 2HZ LYS 8 11.370 8.923 -17.882 80 H ASN 9 H ASN 9 15.199 11.367 -11.576 81 HA ASN 9 HA ASN 9 17.781 12.352 -12.296 82 HB3 ASN 9 2HB ASN 9 16.769 14.666 -11.102 83 HD21 ASN 9 1HD2 ASN 9 15.826 15.497 -13.958 84 HD22 ASN 9 2HD2 ASN 9 17.323 15.780 -14.773 85 H ASN 10 H ASN 10 15.181 12.162 -9.939 86 HA ASN 10 HA ASN 10 16.531 12.845 -7.621 87 HB3 ASN 10 2HB ASN 10 14.916 11.085 -6.560 88 HD21 ASN 10 1HD2 ASN 10 14.496 13.600 -9.004 89 HD22 ASN 10 2HD2 ASN 10 13.429 14.582 -8.063 90 H THR 11 H THR 11 16.600 9.857 -9.452 91 HA THR 11 HA THR 11 17.804 7.931 -9.231 92 HB THR 11 HB THR 11 20.133 8.170 -8.829 93 HG1 THR 11 1HG THR 11 19.711 10.727 -7.669 94 HG21 THR 11 3HG2 THR 11 20.444 9.445 -10.632 95 HG22 THR 11 1HG2 THR 11 19.985 10.899 -9.747 96 HG23 THR 11 2HG2 THR 11 18.747 9.914 -10.525 97 H ILE 12 H ILE 12 16.028 8.663 -7.004 98 HA ILE 12 HA ILE 12 17.085 8.215 -4.489 99 HB ILE 12 HB ILE 12 14.400 7.681 -5.688 100 HG13 ILE 12 2HG1 ILE 12 13.687 9.388 -4.150 101 HG21 ILE 12 1HG2 ILE 12 15.344 6.745 -2.991 102 HG22 ILE 12 2HG2 ILE 12 13.644 7.033 -3.358 103 HG23 ILE 12 3HG2 ILE 12 14.545 5.813 -4.256 104 HD11 ILE 12 3HD1 ILE 12 15.009 8.782 -2.192 105 HD12 ILE 12 1HD1 ILE 12 16.465 9.361 -2.997 106 HD13 ILE 12 2HD1 ILE 12 15.175 10.491 -2.589 107 HA PRO 13 HA PRO 13 18.538 4.042 -4.670 108 HB3 PRO 13 2HB PRO 13 19.968 4.639 -2.974 109 HG3 PRO 13 2HG PRO 13 19.346 6.210 -1.378 110 HD3 PRO 13 2HD PRO 13 18.804 7.362 -3.300 111 H ASP 14 H ASP 14 18.102 2.052 -2.957 112 HA ASP 14 HA ASP 14 15.244 1.548 -3.254 113 HB3 ASP 14 2HB ASP 14 15.737 -0.722 -3.222 114 H SER 15 H SER 15 16.582 3.224 -1.089 115 HA SER 15 HA SER 15 15.877 1.721 1.309 116 HB3 SER 15 2HB SER 15 16.866 4.567 1.241 117 HG SER 15 HG SER 15 16.865 4.217 3.302 118 H GLN 16 H GLN 16 13.699 2.229 -0.322 119 HA GLN 16 HA GLN 16 12.272 4.383 1.088 120 HB3 GLN 16 2HB GLN 16 12.298 4.778 -1.280 121 HG3 GLN 16 2HG GLN 16 11.014 2.093 -1.699 122 HE21 GLN 16 1HE2 GLN 16 12.586 1.984 -4.171 123 HE22 GLN 16 2HE2 GLN 16 11.782 3.031 -5.286 124 H MET 17 H MET 17 11.931 1.064 -0.123 125 HA MET 17 HA MET 17 9.501 0.685 1.427 126 HB3 MET 17 2HB MET 17 10.186 -1.783 0.401 127 HG3 MET 17 2HG MET 17 8.300 0.314 -0.257 128 HE1 MET 17 3HE MET 17 6.609 -1.615 -1.877 129 HE2 MET 17 1HE MET 17 6.755 -1.252 -3.597 130 HE3 MET 17 2HE MET 17 7.573 -2.660 -2.921 131 H SER 18 H SER 18 9.305 -0.570 3.231 132 HA SER 18 HA SER 18 11.512 -2.176 4.179 133 HB3 SER 18 2HB SER 18 12.392 -0.304 5.203 134 HG SER 18 HG SER 18 9.726 0.622 5.477 135 H ALA 19 H ALA 19 10.517 -3.987 4.742 136 HA ALA 19 HA ALA 19 7.941 -3.797 6.164 137 HB1 ALA 19 1HB ALA 19 7.076 -5.444 4.911 138 HB2 ALA 19 2HB ALA 19 8.361 -5.026 3.777 139 HB3 ALA 19 3HB ALA 19 8.580 -6.366 4.903 140 H SER 20 H SER 20 7.501 -5.614 7.663 141 HA SER 20 HA SER 20 9.387 -5.818 9.663 142 HB3 SER 20 2HB SER 20 6.799 -6.598 9.410 143 HG SER 20 HG SER 20 6.642 -8.658 9.061 144 H SER 21 H SER 21 8.811 -8.008 6.950 145 HA SER 21 HA SER 21 11.480 -8.901 6.859 146 HB3 SER 21 2HB SER 21 9.557 -10.965 7.955 147 HG SER 21 HG SER 21 12.295 -10.949 7.285 148 H SER 22 H SER 22 11.841 -10.492 5.183 149 HA SER 22 HA SER 22 9.549 -10.777 3.354 150 HB3 SER 22 2HB SER 22 11.817 -9.252 2.890 151 HG SER 22 HG SER 22 13.007 -11.208 2.569 152 H TYR 23 H TYR 23 10.167 -12.471 1.570 153 HA TYR 23 HA TYR 23 10.218 -14.974 2.713 154 HB3 TYR 23 2HB TYR 23 11.014 -14.086 -0.059 155 HD1 TYR 23 2HD TYR 23 10.304 -17.091 2.025 156 HD2 TYR 23 1HD TYR 23 11.789 -15.584 -1.667 157 HE1 TYR 23 2HE TYR 23 11.051 -19.352 1.409 158 HE2 TYR 23 1HE TYR 23 12.539 -17.841 -2.293 159 HH TYR 23 HH TYR 23 12.211 -20.098 -1.782 160 H LYS 24 H LYS 24 12.906 -12.958 1.723 161 HA LYS 24 HA LYS 24 14.804 -15.073 2.454 162 HB3 LYS 24 2HB LYS 24 15.150 -13.994 0.277 163 HG3 LYS 24 2HG LYS 24 15.064 -11.514 1.893 164 HD3 LYS 24 2HD LYS 24 17.416 -12.029 0.638 165 HE3 LYS 24 2HE LYS 24 15.477 -11.192 -1.400 166 HZ1 LYS 24 3HZ LYS 24 17.296 -9.286 -0.692 167 HZ2 LYS 24 1HZ LYS 24 16.491 -9.390 -2.175 168 HZ3 LYS 24 2HZ LYS 24 18.032 -10.064 -2.001 169 H THR 25 H THR 25 16.664 -14.498 3.781 170 HA THR 25 HA THR 25 16.421 -12.138 5.456 171 HB THR 25 HB THR 25 15.020 -13.623 6.713 172 HG1 THR 25 1HG THR 25 16.241 -12.590 8.177 173 HG21 THR 25 3HG2 THR 25 15.263 -15.824 6.418 174 HG22 THR 25 1HG2 THR 25 16.626 -15.743 7.535 175 HG23 THR 25 2HG2 THR 25 16.901 -15.625 5.796 176 H TRP 26 H TRP 26 18.290 -11.842 6.873 177 HA TRP 26 HA TRP 26 20.621 -13.488 6.278 178 HB3 TRP 26 2HB TRP 26 21.546 -10.818 6.116 179 HD1 TRP 26 HD TRP 26 23.359 -13.047 5.691 180 HE1 TRP 26 1HE TRP 26 24.244 -13.844 3.409 181 HE3 TRP 26 3HE TRP 26 19.756 -11.034 2.675 182 HZ2 TRP 26 2HZ TRP 26 23.512 -13.645 0.690 183 HZ3 TRP 26 3HZ TRP 26 19.922 -11.383 0.245 184 HH2 TRP 26 HH TRP 26 21.762 -12.661 -0.725 185 H ASN 27 H ASN 27 22.597 -12.436 7.521 186 HA ASN 27 HA ASN 27 22.042 -12.628 10.246 187 HB3 ASN 27 2HB ASN 27 24.417 -11.067 9.848 188 HD21 ASN 27 1HD2 ASN 27 25.981 -13.555 9.426 189 HD22 ASN 27 2HD2 ASN 27 25.885 -14.404 10.927 190 H LEU 28 H LEU 28 21.685 -11.167 11.858 191 HA LEU 28 HA LEU 28 20.511 -8.678 11.157 192 HB3 LEU 28 2HB LEU 28 21.429 -9.403 13.920 193 HG LEU 28 HG LEU 28 19.198 -7.732 12.849 194 HD11 LEU 28 1HD1 LEU 28 18.161 -9.537 14.209 195 HD12 LEU 28 2HD1 LEU 28 17.957 -7.922 14.887 196 HD13 LEU 28 3HD1 LEU 28 19.154 -9.020 15.573 197 HD21 LEU 28 3HD2 LEU 28 21.243 -7.505 15.044 198 HD22 LEU 28 1HD2 LEU 28 19.881 -6.395 14.890 199 HD23 LEU 28 2HD2 LEU 28 21.073 -6.511 13.596 200 H ARG 29 H ARG 29 23.634 -9.609 12.513 201 HA ARG 29 HA ARG 29 24.584 -7.056 13.156 202 HB3 ARG 29 2HB ARG 29 26.134 -9.485 12.238 203 HG3 ARG 29 2HG ARG 29 27.618 -8.054 14.116 204 HD3 ARG 29 2HD ARG 29 29.033 -7.567 12.003 205 HE ARG 29 HE ARG 29 28.722 -10.417 12.160 206 HH11 ARG 29 1HH1 ARG 29 29.908 -7.576 13.785 207 HH12 ARG 29 2HH1 ARG 29 31.064 -8.445 14.740 208 HH21 ARG 29 1HH2 ARG 29 30.240 -11.573 13.411 209 HH22 ARG 29 2HH2 ARG 29 31.253 -10.719 14.525 210 H ALA 30 H ALA 30 25.072 -8.967 10.188 211 HA ALA 30 HA ALA 30 26.481 -6.927 8.813 212 HB1 ALA 30 1HB ALA 30 26.826 -8.535 7.316 213 HB2 ALA 30 2HB ALA 30 25.894 -9.605 8.363 214 HB3 ALA 30 3HB ALA 30 25.096 -8.746 7.046 215 H PHE 31 H PHE 31 23.117 -7.578 9.312 216 HA PHE 31 HA PHE 31 21.213 -6.527 8.648 217 HB3 PHE 31 2HB PHE 31 22.776 -4.120 7.808 218 HD1 PHE 31 1HD PHE 31 20.437 -4.998 10.569 219 HD2 PHE 31 2HD PHE 31 21.101 -2.748 7.018 220 HE1 PHE 31 1HE PHE 31 18.279 -3.860 10.891 221 HE2 PHE 31 2HE PHE 31 18.945 -1.606 7.334 222 HZ PHE 31 HZ PHE 31 17.531 -2.160 9.273 223 H GLY 32 H GLY 32 20.934 -7.951 6.861 224 HA2 GLY 32 2HA GLY 32 21.901 -7.066 4.257 225 HA3 GLY 32 3HA GLY 32 21.050 -8.565 4.599 226 H TRP 33 H TRP 33 20.251 -7.331 2.411 227 HA TRP 33 HA TRP 33 17.922 -5.691 3.115 228 HB3 TRP 33 2HB TRP 33 17.819 -5.226 0.656 229 HD1 TRP 33 HD TRP 33 21.258 -4.599 0.110 230 HE1 TRP 33 1HE TRP 33 22.049 -2.372 1.129 231 HE3 TRP 33 3HE TRP 33 17.363 -3.741 3.309 232 HZ2 TRP 33 2HZ TRP 33 21.142 -0.500 3.036 233 HZ3 TRP 33 3HZ TRP 33 17.402 -1.710 4.696 234 HH2 TRP 33 HH TRP 33 19.254 -0.124 4.562 235 H TYR 34 H TYR 34 15.941 -6.090 1.735 236 HA TYR 34 HA TYR 34 15.557 -8.805 0.817 237 HB3 TYR 34 2HB TYR 34 14.187 -9.602 2.460 238 HD1 TYR 34 2HD TYR 34 14.809 -6.536 4.397 239 HD2 TYR 34 1HD TYR 34 16.107 -10.505 3.584 240 HE1 TYR 34 2HE TYR 34 16.273 -6.457 6.372 241 HE2 TYR 34 1HE TYR 34 17.572 -10.438 5.557 242 HH TYR 34 HH TYR 34 17.773 -9.236 7.660 243 HA PRO 35 HA PRO 35 11.580 -6.195 -0.030 244 HB3 PRO 35 2HB PRO 35 10.939 -5.054 1.858 245 HG3 PRO 35 2HG PRO 35 12.517 -4.218 3.348 246 HD3 PRO 35 2HD PRO 35 13.275 -6.384 3.142 247 H HIS 36 H HIS 36 11.255 -3.632 -0.923 248 HA HIS 36 HA HIS 36 11.664 -2.494 -2.876 249 HB3 HIS 36 2HB HIS 36 12.919 -1.137 -1.358 250 HD1 HIS 36 1HD HIS 36 13.840 -2.166 0.799 251 HD2 HIS 36 2HD HIS 36 16.233 -2.848 -2.528 252 HE1 HIS 36 1HE HIS 36 16.008 -3.063 1.703 253 H LEU 37 H LEU 37 11.536 -4.728 -3.933 254 HA LEU 37 HA LEU 37 14.089 -5.319 -5.283 255 HB3 LEU 37 2HB LEU 37 13.407 -7.576 -5.538 256 HG LEU 37 HG LEU 37 13.076 -6.528 -2.786 257 HD11 LEU 37 1HD1 LEU 37 11.680 -8.085 -2.059 258 HD12 LEU 37 2HD1 LEU 37 12.758 -9.343 -2.663 259 HD13 LEU 37 3HD1 LEU 37 11.491 -8.694 -3.703 260 HD21 LEU 37 3HD2 LEU 37 14.658 -8.728 -2.688 261 HD22 LEU 37 1HD2 LEU 37 15.240 -7.095 -3.009 262 HD23 LEU 37 2HD2 LEU 37 14.923 -8.196 -4.349 263 H GLY 38 H GLY 38 10.757 -4.468 -5.655 264 HA2 GLY 38 2HA GLY 38 10.483 -5.160 -8.404 265 HA3 GLY 38 3HA GLY 38 9.452 -4.056 -7.505 266 H ARG 39 H ARG 39 11.090 -2.043 -6.786 267 HA ARG 39 HA ARG 39 11.618 0.004 -7.720 268 HB3 ARG 39 2HB ARG 39 13.810 -0.497 -7.357 269 HG3 ARG 39 2HG ARG 39 13.597 -2.834 -9.244 270 HD3 ARG 39 2HD ARG 39 15.874 -1.470 -7.986 271 HE ARG 39 HE ARG 39 15.393 -4.102 -7.144 272 HH11 ARG 39 1HH1 ARG 39 17.917 -2.167 -8.561 273 HH12 ARG 39 2HH1 ARG 39 19.202 -3.112 -7.882 274 HH21 ARG 39 1HH2 ARG 39 17.075 -5.352 -6.244 275 HH22 ARG 39 2HH2 ARG 39 18.722 -4.925 -6.565 276 H LEU 40 H LEU 40 13.134 -1.474 -10.451 277 HA LEU 40 HA LEU 40 10.983 -1.376 -12.276 278 HB3 LEU 40 2HB LEU 40 12.831 1.006 -12.268 279 HG LEU 40 HG LEU 40 11.418 -0.082 -14.496 280 HD11 LEU 40 1HD1 LEU 40 10.387 2.371 -14.905 281 HD12 LEU 40 2HD1 LEU 40 10.115 2.203 -13.171 282 HD13 LEU 40 3HD1 LEU 40 9.457 1.006 -14.286 283 HD21 LEU 40 3HD2 LEU 40 12.567 2.647 -14.568 284 HD22 LEU 40 1HD2 LEU 40 12.806 1.282 -15.660 285 HD23 LEU 40 2HD2 LEU 40 13.648 1.329 -14.111 286 H ASP 41 H ASP 41 11.562 -2.851 -13.712 287 HA ASP 41 HA ASP 41 12.783 -4.086 -15.181 288 HB3 ASP 41 2HB ASP 41 14.929 -1.977 -15.114 289 H ASN 42 H ASN 42 12.981 -5.249 -12.959 290 HA ASN 42 HA ASN 42 15.283 -5.278 -11.443 291 HB3 ASN 42 2HB ASN 42 13.115 -6.589 -11.087 292 HD21 ASN 42 1HD2 ASN 42 12.252 -7.080 -13.246 293 HD22 ASN 42 2HD2 ASN 42 12.443 -8.685 -13.857 294 H GLN 43 H GLN 43 16.879 -7.177 -11.376 295 HA GLN 43 HA GLN 43 17.884 -7.660 -14.104 296 HB3 GLN 43 2HB GLN 43 19.477 -6.242 -13.170 297 HG3 GLN 43 2HG GLN 43 19.327 -7.774 -10.583 298 HE21 GLN 43 1HE2 GLN 43 21.673 -7.945 -10.838 299 HE22 GLN 43 2HE2 GLN 43 22.654 -6.589 -10.406 300 H GLY 44 H GLY 44 16.911 -9.040 -11.127 301 HA2 GLY 44 2HA GLY 44 18.197 -11.603 -11.740 302 HA3 GLY 44 3HA GLY 44 17.407 -11.183 -10.229 303 H LYS 45 H LYS 45 15.030 -10.949 -10.297 304 HA LYS 45 HA LYS 45 13.410 -11.783 -12.390 305 HB3 LYS 45 2HB LYS 45 14.290 -13.946 -12.425 306 HG3 LYS 45 2HG LYS 45 15.554 -13.666 -10.233 307 HD3 LYS 45 2HD LYS 45 12.884 -13.949 -9.228 308 HE3 LYS 45 2HE LYS 45 14.747 -16.216 -8.739 309 HZ1 LYS 45 3HZ LYS 45 12.835 -15.243 -6.686 310 HZ2 LYS 45 1HZ LYS 45 14.516 -15.097 -6.572 311 HZ3 LYS 45 2HZ LYS 45 13.801 -16.629 -6.592 312 H ILE 46 H ILE 46 14.001 -11.558 -8.974 313 HA ILE 46 HA ILE 46 11.514 -11.981 -7.875 314 HB ILE 46 HB ILE 46 13.428 -9.783 -7.080 315 HG13 ILE 46 2HG1 ILE 46 13.530 -12.710 -6.831 316 HG21 ILE 46 1HG2 ILE 46 12.208 -10.769 -4.814 317 HG22 ILE 46 2HG2 ILE 46 11.814 -9.258 -5.634 318 HG23 ILE 46 3HG2 ILE 46 10.901 -10.723 -5.998 319 HD11 ILE 46 3HD1 ILE 46 15.332 -10.576 -7.307 320 HD12 ILE 46 1HD1 ILE 46 15.871 -11.450 -5.875 321 HD13 ILE 46 2HD1 ILE 46 15.626 -12.312 -7.393 322 H ASN 47 H ASN 47 12.696 -8.671 -8.431 323 HA ASN 47 HA ASN 47 11.572 -6.738 -8.884 324 HB3 ASN 47 2HB ASN 47 9.844 -8.341 -10.752 325 HD21 ASN 47 1HD2 ASN 47 8.669 -7.024 -11.925 326 HD22 ASN 47 2HD2 ASN 47 9.013 -5.362 -12.250 327 H ALA 48 H ALA 48 10.578 -8.145 -6.640 328 HA ALA 48 HA ALA 48 8.204 -6.775 -6.134 329 HB1 ALA 48 1HB ALA 48 7.288 -9.533 -6.153 330 HB2 ALA 48 2HB ALA 48 6.511 -8.077 -6.775 331 HB3 ALA 48 3HB ALA 48 7.688 -8.939 -7.765 332 H TRP 49 H TRP 49 7.942 -6.665 -3.987 333 HA TRP 49 HA TRP 49 9.717 -8.117 -2.278 334 HB3 TRP 49 2HB TRP 49 7.598 -6.038 -1.862 335 HD1 TRP 49 HD TRP 49 10.163 -7.402 0.692 336 HE1 TRP 49 1HE TRP 49 8.932 -7.818 2.914 337 HE3 TRP 49 3HE TRP 49 5.395 -6.334 -0.811 338 HZ2 TRP 49 2HZ TRP 49 6.288 -7.708 3.899 339 HZ3 TRP 49 3HZ TRP 49 3.572 -6.515 0.831 340 HH2 TRP 49 HH TRP 49 4.011 -7.188 3.137 341 H THR 50 H THR 50 9.352 -9.885 -1.078 342 HA THR 50 HA THR 50 6.638 -11.031 -1.142 343 HB THR 50 HB THR 50 8.988 -12.750 -0.513 344 HG1 THR 50 1HG THR 50 9.845 -11.924 -2.328 345 HG21 THR 50 3HG2 THR 50 6.376 -13.089 -1.975 346 HG22 THR 50 1HG2 THR 50 6.860 -13.806 -0.440 347 HG23 THR 50 2HG2 THR 50 7.625 -14.333 -1.940 348 H ALA 51 H ALA 51 6.108 -12.450 0.733 349 HA ALA 51 HA ALA 51 6.729 -11.048 3.190 350 HB1 ALA 51 1HB ALA 51 4.861 -13.346 2.626 351 HB2 ALA 51 2HB ALA 51 5.020 -12.532 4.184 352 HB3 ALA 51 3HB ALA 51 4.428 -11.643 2.780 353 H GLN 52 H GLN 52 7.334 -12.204 5.157 354 HA GLN 52 HA GLN 52 9.486 -14.066 4.622 355 HB3 GLN 52 2HB GLN 52 8.540 -12.716 7.152 356 HG3 GLN 52 2HG GLN 52 9.568 -14.807 7.796 357 HE21 GLN 52 1HE2 GLN 52 12.654 -13.531 7.516 358 HE22 GLN 52 2HE2 GLN 52 13.286 -14.636 6.348 359 H SER 53 H SER 53 6.509 -14.020 6.566 360 HA SER 53 HA SER 53 6.733 -16.926 6.907 361 HB3 SER 53 2HB SER 53 4.509 -15.555 8.259 362 HG SER 53 HG SER 53 5.471 -17.730 8.644 363 H ASN 54 H ASN 54 5.753 -15.279 4.503 364 HA ASN 54 HA ASN 54 4.014 -15.259 3.005 365 HB3 ASN 54 2HB ASN 54 5.083 -17.476 2.675 366 HD21 ASN 54 1HD2 ASN 54 5.808 -18.597 4.465 367 HD22 ASN 54 2HD2 ASN 54 4.830 -19.759 5.289 368 H SER 55 H SER 55 3.168 -14.438 5.569 369 HA SER 55 HA SER 55 0.385 -15.397 5.529 370 HB3 SER 55 2HB SER 55 1.514 -14.444 8.115 371 HG SER 55 HG SER 55 -0.064 -15.675 8.884 372 H ALA 56 H ALA 56 -0.954 -13.764 7.010 373 HA ALA 56 HA ALA 56 -0.670 -11.196 5.703 374 HB1 ALA 56 1HB ALA 56 -2.792 -10.959 7.435 375 HB2 ALA 56 2HB ALA 56 -2.886 -11.455 5.745 376 HB3 ALA 56 3HB ALA 56 -2.805 -12.673 7.017 377 H LYS 57 H LYS 57 0.309 -12.600 8.623 378 HA LYS 57 HA LYS 57 0.108 -10.435 10.406 379 HB3 LYS 57 2HB LYS 57 0.656 -12.835 10.979 380 HG3 LYS 57 2HG LYS 57 3.532 -12.298 10.833 381 HD3 LYS 57 2HD LYS 57 3.276 -14.745 9.895 382 HE3 LYS 57 2HE LYS 57 3.029 -15.572 12.258 383 HZ1 LYS 57 3HZ LYS 57 4.956 -13.472 11.517 384 HZ2 LYS 57 1HZ LYS 57 5.211 -15.132 11.717 385 HZ3 LYS 57 2HZ LYS 57 4.991 -14.141 13.071 386 H GLU 58 H GLU 58 2.088 -10.905 7.675 387 HA GLU 58 HA GLU 58 4.259 -9.220 8.534 388 HB3 GLU 58 2HB GLU 58 4.431 -9.328 5.794 389 HG3 GLU 58 2HG GLU 58 6.305 -9.922 7.092 390 H TRP 59 H TRP 59 4.723 -7.130 7.827 391 HA TRP 59 HA TRP 59 2.630 -5.707 6.354 392 HB3 TRP 59 2HB TRP 59 1.965 -5.195 8.555 393 HD1 TRP 59 HD TRP 59 5.617 -3.919 8.907 394 HE1 TRP 59 1HE TRP 59 6.478 -4.626 11.227 395 HE3 TRP 59 3HE TRP 59 1.545 -6.558 10.514 396 HZ2 TRP 59 2HZ TRP 59 5.553 -6.108 13.445 397 HZ3 TRP 59 3HZ TRP 59 1.614 -7.589 12.747 398 HH2 TRP 59 HH TRP 59 3.577 -7.368 14.180 399 H LEU 60 H LEU 60 3.381 -4.150 5.009 400 HA LEU 60 HA LEU 60 6.278 -3.621 5.077 401 HB3 LEU 60 2HB LEU 60 4.370 -3.979 2.793 402 HG LEU 60 HG LEU 60 5.694 -1.956 2.246 403 HD11 LEU 60 1HD1 LEU 60 7.680 -2.732 3.640 404 HD12 LEU 60 2HD1 LEU 60 8.032 -1.979 2.085 405 HD13 LEU 60 3HD1 LEU 60 8.114 -3.733 2.253 406 HD21 LEU 60 3HD2 LEU 60 4.975 -3.788 0.592 407 HD22 LEU 60 1HD2 LEU 60 6.678 -4.243 0.576 408 HD23 LEU 60 2HD2 LEU 60 6.193 -2.625 0.071 409 H GLN 61 H GLN 61 6.874 -1.588 5.418 410 HA GLN 61 HA GLN 61 4.928 0.555 4.864 411 HB3 GLN 61 2HB GLN 61 5.152 0.263 7.261 412 HG3 GLN 61 2HG GLN 61 7.483 1.004 8.198 413 HE21 GLN 61 1HE2 GLN 61 8.994 -0.859 8.824 414 HE22 GLN 61 2HE2 GLN 61 8.226 -2.378 9.119 415 H VAL 62 H VAL 62 5.667 2.412 3.904 416 HA VAL 62 HA VAL 62 8.423 2.295 2.876 417 HB VAL 62 HB VAL 62 6.171 3.955 1.750 418 HG11 VAL 62 1HG1 VAL 62 8.721 2.994 0.462 419 HG12 VAL 62 2HG1 VAL 62 7.555 4.146 -0.193 420 HG13 VAL 62 3HG1 VAL 62 8.529 4.577 1.213 421 HG21 VAL 62 3HG2 VAL 62 6.266 2.071 -0.055 422 HG22 VAL 62 1HG2 VAL 62 6.898 1.097 1.273 423 HG23 VAL 62 2HG2 VAL 62 5.306 1.844 1.407 424 H ASP 63 H ASP 63 9.836 3.690 3.675 425 HA ASP 63 HA ASP 63 8.838 6.080 5.062 426 HB3 ASP 63 2HB ASP 63 11.692 5.312 5.295 427 H LEU 64 H LEU 64 9.094 8.008 4.159 428 HA LEU 64 HA LEU 64 11.030 8.276 1.958 429 HB3 LEU 64 2HB LEU 64 9.523 10.376 1.514 430 HG LEU 64 HG LEU 64 9.619 8.502 -0.078 431 HD11 LEU 64 1HD1 LEU 64 9.067 6.686 1.443 432 HD12 LEU 64 2HD1 LEU 64 7.964 6.708 0.067 433 HD13 LEU 64 3HD1 LEU 64 7.433 7.324 1.632 434 HD21 LEU 64 3HD2 LEU 64 7.736 9.137 -1.219 435 HD22 LEU 64 1HD2 LEU 64 7.856 10.450 -0.047 436 HD23 LEU 64 2HD2 LEU 64 6.722 9.127 0.224 437 H GLY 65 H GLY 65 9.477 10.294 4.464 438 HA2 GLY 65 2HA GLY 65 10.392 11.837 5.909 439 HA3 GLY 65 3HA GLY 65 11.978 11.212 5.480 440 H THR 66 H THR 66 10.339 12.041 2.700 441 HA THR 66 HA THR 66 11.765 14.611 2.576 442 HB THR 66 HB THR 66 12.494 13.001 0.892 443 HG1 THR 66 1HG THR 66 10.904 15.048 -0.297 444 HG21 THR 66 3HG2 THR 66 9.681 12.472 0.692 445 HG22 THR 66 1HG2 THR 66 11.032 11.573 0.004 446 HG23 THR 66 2HG2 THR 66 10.318 12.914 -0.891 447 H GLN 67 H GLN 67 8.713 13.352 2.962 448 HA GLN 67 HA GLN 67 6.592 14.154 2.729 449 HB3 GLN 67 2HB GLN 67 7.913 16.868 2.751 450 HG3 GLN 67 2HG GLN 67 5.214 15.872 3.586 451 HE21 GLN 67 1HE2 GLN 67 3.985 18.211 3.975 452 HE22 GLN 67 2HE2 GLN 67 4.604 19.014 5.374 453 H ARG 68 H ARG 68 6.389 13.317 0.580 454 HA ARG 68 HA ARG 68 6.401 15.420 -1.486 455 HB3 ARG 68 2HB ARG 68 6.524 13.341 -3.061 456 HG3 ARG 68 2HG ARG 68 9.019 13.216 -2.830 457 HD3 ARG 68 2HD ARG 68 7.702 15.923 -2.956 458 HE ARG 68 HE ARG 68 10.485 15.303 -3.171 459 HH11 ARG 68 1HH1 ARG 68 7.941 17.343 -4.393 460 HH12 ARG 68 2HH1 ARG 68 9.015 18.615 -4.872 461 HH21 ARG 68 1HH2 ARG 68 11.908 16.972 -3.797 462 HH22 ARG 68 2HH2 ARG 68 11.270 18.403 -4.534 463 H GLN 69 H GLN 69 4.699 15.378 -3.032 464 HA GLN 69 HA GLN 69 2.225 14.272 -1.938 465 HB3 GLN 69 2HB GLN 69 2.867 16.478 -3.859 466 HG3 GLN 69 2HG GLN 69 0.208 15.107 -3.594 467 HE21 GLN 69 1HE2 GLN 69 -0.274 16.646 -6.168 468 HE22 GLN 69 2HE2 GLN 69 -0.862 18.179 -5.629 469 H VAL 70 H VAL 70 1.486 12.413 -2.696 470 HA VAL 70 HA VAL 70 2.494 11.304 -5.166 471 HB VAL 70 HB VAL 70 1.254 9.311 -4.605 472 HG11 VAL 70 1HG1 VAL 70 2.579 10.533 -2.186 473 HG12 VAL 70 2HG1 VAL 70 2.209 8.818 -2.380 474 HG13 VAL 70 3HG1 VAL 70 3.363 9.600 -3.460 475 HG21 VAL 70 3HG2 VAL 70 -0.308 11.180 -2.996 476 HG22 VAL 70 1HG2 VAL 70 -0.763 9.623 -3.689 477 HG23 VAL 70 2HG2 VAL 70 0.092 9.686 -2.147 478 H THR 71 H THR 71 1.311 10.823 -7.005 479 HA THR 71 HA THR 71 -1.414 11.913 -7.164 480 HB THR 71 HB THR 71 -0.216 12.325 -9.693 481 HG1 THR 71 1HG THR 71 1.369 13.203 -7.503 482 HG21 THR 71 3HG2 THR 71 -2.038 13.580 -8.277 483 HG22 THR 71 1HG2 THR 71 -1.082 14.450 -9.475 484 HG23 THR 71 2HG2 THR 71 -0.666 14.560 -7.765 485 H GLY 72 H GLY 72 0.022 9.184 -7.119 486 HA2 GLY 72 2HA GLY 72 -1.786 7.684 -8.525 487 HA3 GLY 72 3HA GLY 72 -0.517 8.032 -9.690 488 H ILE 73 H ILE 73 -1.145 5.439 -8.910 489 HA ILE 73 HA ILE 73 1.423 4.609 -7.840 490 HB ILE 73 HB ILE 73 0.615 3.263 -6.074 491 HG13 ILE 73 2HG1 ILE 73 -1.735 2.918 -5.572 492 HG21 ILE 73 1HG2 ILE 73 -0.809 5.919 -5.988 493 HG22 ILE 73 2HG2 ILE 73 -0.514 4.880 -4.595 494 HG23 ILE 73 3HG2 ILE 73 0.844 5.592 -5.466 495 HD11 ILE 73 3HD1 ILE 73 -2.509 5.149 -6.476 496 HD12 ILE 73 1HD1 ILE 73 -2.473 4.402 -8.071 497 HD13 ILE 73 2HD1 ILE 73 -3.536 3.757 -6.819 498 H ILE 74 H ILE 74 1.438 2.077 -7.762 499 HA ILE 74 HA ILE 74 -0.273 0.789 -9.690 500 HB ILE 74 HB ILE 74 1.195 1.729 -11.295 501 HG13 ILE 74 2HG1 ILE 74 0.749 -0.841 -11.272 502 HG21 ILE 74 1HG2 ILE 74 3.142 1.473 -9.189 503 HG22 ILE 74 2HG2 ILE 74 3.769 0.826 -10.703 504 HG23 ILE 74 3HG2 ILE 74 3.177 2.486 -10.632 505 HD11 ILE 74 3HD1 ILE 74 1.315 -0.769 -13.405 506 HD12 ILE 74 1HD1 ILE 74 2.053 0.807 -13.111 507 HD13 ILE 74 2HD1 ILE 74 3.027 -0.659 -12.998 508 H THR 75 H THR 75 -0.285 -1.414 -9.480 509 HA THR 75 HA THR 75 1.658 -2.592 -7.606 510 HB THR 75 HB THR 75 -0.296 -2.398 -6.291 511 HG1 THR 75 1HG THR 75 -0.765 -4.559 -5.915 512 HG21 THR 75 3HG2 THR 75 -2.138 -1.908 -7.514 513 HG22 THR 75 1HG2 THR 75 -2.422 -3.643 -7.383 514 HG23 THR 75 2HG2 THR 75 -1.677 -2.978 -8.836 515 H GLN 76 H GLN 76 2.370 -4.638 -8.065 516 HA GLN 76 HA GLN 76 1.141 -6.132 -10.240 517 HB3 GLN 76 2HB GLN 76 2.752 -4.713 -11.392 518 HG3 GLN 76 2HG GLN 76 4.498 -5.459 -9.178 519 HE21 GLN 76 1HE2 GLN 76 4.843 -7.574 -10.719 520 HE22 GLN 76 2HE2 GLN 76 6.346 -7.512 -11.568 521 H GLY 77 H GLY 77 1.484 -8.328 -10.131 522 HA2 GLY 77 2HA GLY 77 2.581 -9.280 -7.607 523 HA3 GLY 77 3HA GLY 77 1.650 -10.223 -8.763 524 H ALA 78 H ALA 78 3.845 -11.345 -7.630 525 HA ALA 78 HA ALA 78 5.817 -11.310 -9.822 526 HB1 ALA 78 1HB ALA 78 7.364 -10.836 -8.304 527 HB2 ALA 78 2HB ALA 78 6.196 -10.992 -6.992 528 HB3 ALA 78 3HB ALA 78 7.064 -12.413 -7.573 529 H ARG 79 H ARG 79 7.095 -13.423 -9.905 530 HA ARG 79 HA ARG 79 5.416 -15.734 -9.234 531 HB3 ARG 79 2HB ARG 79 4.868 -15.272 -11.525 532 HG3 ARG 79 2HG ARG 79 7.822 -15.304 -12.107 533 HD3 ARG 79 2HD ARG 79 6.203 -14.397 -14.265 534 HE ARG 79 HE ARG 79 8.397 -16.090 -13.952 535 HH11 ARG 79 1HH1 ARG 79 5.575 -15.783 -15.968 536 HH12 ARG 79 2HH1 ARG 79 6.312 -16.543 -17.340 537 HH21 ARG 79 1HH2 ARG 79 9.377 -17.093 -15.751 538 HH22 ARG 79 2HH2 ARG 79 8.474 -17.290 -17.214 539 H ASP 80 H ASP 80 6.537 -17.710 -9.022 540 HA ASP 80 HA ASP 80 9.435 -17.376 -8.631 541 HB3 ASP 80 2HB ASP 80 7.592 -19.420 -7.373 542 H PHE 81 H PHE 81 9.336 -17.743 -11.086 543 HA PHE 81 HA PHE 81 9.786 -19.059 -12.887 544 HB3 PHE 81 2HB PHE 81 11.102 -21.080 -12.481 545 HD1 PHE 81 2HD PHE 81 12.439 -19.116 -13.391 546 HD2 PHE 81 1HD PHE 81 11.920 -19.862 -9.233 547 HE1 PHE 81 2HE PHE 81 14.399 -17.712 -12.899 548 HE2 PHE 81 1HE PHE 81 13.878 -18.458 -8.733 549 HZ PHE 81 HZ PHE 81 15.121 -17.382 -10.567 550 H GLY 82 H GLY 82 7.558 -19.228 -13.447 551 HA2 GLY 82 2HA GLY 82 5.992 -20.709 -14.388 552 HA3 GLY 82 3HA GLY 82 6.609 -21.986 -13.348 553 H HIS 83 H HIS 83 6.425 -20.684 -10.872 554 HA HIS 83 HA HIS 83 3.593 -20.971 -10.395 555 HB3 HIS 83 2HB HIS 83 5.041 -20.044 -8.086 556 HD1 HIS 83 1HD HIS 83 4.199 -21.337 -6.097 557 HD2 HIS 83 2HD HIS 83 3.330 -23.195 -9.710 558 HE1 HIS 83 1HE HIS 83 2.644 -23.229 -5.524 559 H ILE 84 H ILE 84 2.146 -19.387 -10.196 560 HA ILE 84 HA ILE 84 3.106 -16.620 -10.282 561 HB ILE 84 HB ILE 84 0.270 -17.562 -10.679 562 HG13 ILE 84 2HG1 ILE 84 2.591 -17.786 -12.436 563 HG21 ILE 84 1HG2 ILE 84 1.717 -15.014 -11.383 564 HG22 ILE 84 2HG2 ILE 84 0.078 -15.407 -11.897 565 HG23 ILE 84 3HG2 ILE 84 0.441 -15.217 -10.182 566 HD11 ILE 84 3HD1 ILE 84 0.877 -19.063 -13.823 567 HD12 ILE 84 1HD1 ILE 84 1.301 -19.715 -12.240 568 HD13 ILE 84 2HD1 ILE 84 -0.213 -18.835 -12.455 569 H GLN 85 H GLN 85 3.086 -15.427 -8.504 570 HA GLN 85 HA GLN 85 1.162 -16.097 -6.377 571 HB3 GLN 85 2HB GLN 85 2.935 -15.183 -4.794 572 HG3 GLN 85 2HG GLN 85 2.538 -17.581 -4.936 573 HE21 GLN 85 1HE2 GLN 85 2.200 -19.157 -6.311 574 HE22 GLN 85 2HE2 GLN 85 3.168 -19.539 -7.690 575 H TYR 86 H TYR 86 0.306 -14.370 -5.173 576 HA TYR 86 HA TYR 86 0.995 -11.684 -5.410 577 HB3 TYR 86 2HB TYR 86 0.399 -11.711 -7.713 578 HD1 TYR 86 1HD TYR 86 0.103 -13.912 -8.707 579 HD2 TYR 86 2HD TYR 86 -3.102 -11.976 -6.687 580 HE1 TYR 86 1HE TYR 86 -1.481 -15.505 -9.707 581 HE2 TYR 86 2HE TYR 86 -4.695 -13.565 -7.681 582 HH TYR 86 HH TYR 86 -3.746 -16.416 -9.196 583 H VAL 87 H VAL 87 -0.383 -10.312 -4.228 584 HA VAL 87 HA VAL 87 -2.236 -11.755 -2.485 585 HB VAL 87 HB VAL 87 -1.713 -10.310 -0.842 586 HG11 VAL 87 1HG1 VAL 87 0.525 -9.631 -0.865 587 HG12 VAL 87 2HG1 VAL 87 0.467 -10.975 -2.008 588 HG13 VAL 87 3HG1 VAL 87 0.505 -9.313 -2.599 589 HG21 VAL 87 3HG2 VAL 87 -1.287 -7.839 -1.298 590 HG22 VAL 87 1HG2 VAL 87 -1.804 -8.172 -2.952 591 HG23 VAL 87 2HG2 VAL 87 -2.915 -8.439 -1.609 592 H ALA 88 H ALA 88 -4.231 -10.588 -1.798 593 HA ALA 88 HA ALA 88 -5.418 -9.127 -4.068 594 HB1 ALA 88 1HB ALA 88 -6.371 -11.343 -3.920 595 HB2 ALA 88 2HB ALA 88 -6.751 -11.097 -2.215 596 HB3 ALA 88 3HB ALA 88 -7.577 -10.144 -3.448 597 H SER 89 H SER 89 -6.571 -9.795 -0.777 598 HA SER 89 HA SER 89 -7.437 -7.074 -0.464 599 HB3 SER 89 2HB SER 89 -7.380 -8.719 1.965 600 HG SER 89 HG SER 89 -9.815 -8.252 1.234 601 H TYR 90 H TYR 90 -6.272 -5.442 0.285 602 HA TYR 90 HA TYR 90 -4.261 -5.866 2.332 603 HB3 TYR 90 2HB TYR 90 -2.977 -6.219 0.285 604 HD1 TYR 90 2HD TYR 90 -3.299 -2.533 0.130 605 HD2 TYR 90 1HD TYR 90 -3.836 -6.223 -1.921 606 HE1 TYR 90 2HE TYR 90 -3.706 -1.306 -1.962 607 HE2 TYR 90 1HE TYR 90 -4.242 -5.005 -4.019 608 HH TYR 90 HH TYR 90 -3.385 -2.167 -4.692 609 H LYS 91 H LYS 91 -3.880 -4.071 3.577 610 HA LYS 91 HA LYS 91 -5.652 -1.791 3.068 611 HB3 LYS 91 2HB LYS 91 -4.183 -1.986 5.632 612 HG3 LYS 91 2HG LYS 91 -7.060 -1.901 5.787 613 HD3 LYS 91 2HD LYS 91 -6.145 0.521 6.623 614 HE3 LYS 91 2HE LYS 91 -7.322 -1.480 7.824 615 HZ1 LYS 91 3HZ LYS 91 -5.670 -3.047 8.097 616 HZ2 LYS 91 1HZ LYS 91 -5.653 -2.265 9.596 617 HZ3 LYS 91 2HZ LYS 91 -4.472 -1.902 8.441 618 H VAL 92 H VAL 92 -4.716 -0.178 1.997 619 HA VAL 92 HA VAL 92 -1.883 0.415 2.497 620 HB VAL 92 HB VAL 92 -2.341 0.077 0.166 621 HG11 VAL 92 1HG1 VAL 92 -4.814 1.351 0.789 622 HG12 VAL 92 2HG1 VAL 92 -4.036 2.228 -0.529 623 HG13 VAL 92 3HG1 VAL 92 -4.347 0.498 -0.681 624 HG21 VAL 92 3HG2 VAL 92 -0.781 1.890 0.773 625 HG22 VAL 92 1HG2 VAL 92 -1.590 2.180 -0.767 626 HG23 VAL 92 2HG2 VAL 92 -2.113 3.041 0.680 627 H ALA 93 H ALA 93 -1.491 1.976 3.912 628 HA ALA 93 HA ALA 93 -3.321 4.285 4.002 629 HB1 ALA 93 1HB ALA 93 -1.804 3.695 6.452 630 HB2 ALA 93 2HB ALA 93 -3.477 4.213 6.246 631 HB3 ALA 93 3HB ALA 93 -3.047 2.518 6.028 632 H HIS 94 H HIS 94 -2.403 6.321 4.304 633 HA HIS 94 HA HIS 94 0.529 6.437 4.028 634 HB3 HIS 94 2HB HIS 94 0.188 8.503 2.670 635 HD1 HIS 94 1HD HIS 94 0.908 7.980 0.363 636 HD2 HIS 94 2HD HIS 94 -1.747 5.144 1.835 637 HE1 HIS 94 1HE HIS 94 0.759 6.210 -1.418 638 H SER 95 H SER 95 1.621 7.975 5.197 639 HA SER 95 HA SER 95 0.007 9.623 7.032 640 HB3 SER 95 2HB SER 95 1.494 7.482 7.837 641 HG SER 95 HG SER 95 3.402 8.257 8.698 642 H ASP 96 H ASP 96 0.403 11.722 6.883 643 HA ASP 96 HA ASP 96 2.750 12.624 5.401 644 HB3 ASP 96 2HB ASP 96 0.547 13.512 4.759 645 H ASP 97 H ASP 97 1.225 12.990 8.563 646 HA ASP 97 HA ASP 97 3.480 14.599 9.499 647 HB3 ASP 97 2HB ASP 97 1.384 13.903 11.438 648 H GLY 98 H GLY 98 2.512 11.380 9.373 649 HA2 GLY 98 2HA GLY 98 3.914 9.606 10.080 650 HA3 GLY 98 3HA GLY 98 4.591 10.663 11.309 651 H VAL 99 H VAL 99 1.844 11.537 12.102 652 HA VAL 99 HA VAL 99 1.265 9.229 13.815 653 HB VAL 99 HB VAL 99 0.034 10.801 15.239 654 HG11 VAL 99 1HG1 VAL 99 2.338 10.478 15.772 655 HG12 VAL 99 2HG1 VAL 99 2.844 11.612 14.518 656 HG13 VAL 99 3HG1 VAL 99 1.986 12.197 15.944 657 HG21 VAL 99 3HG2 VAL 99 0.212 13.238 14.770 658 HG22 VAL 99 1HG2 VAL 99 0.864 12.840 13.180 659 HG23 VAL 99 2HG2 VAL 99 -0.780 12.362 13.605 660 H GLN 100 H GLN 100 -0.196 11.393 11.472 661 HA GLN 100 HA GLN 100 -2.815 10.179 11.800 662 HB3 GLN 100 2HB GLN 100 -3.585 11.808 10.194 663 HG3 GLN 100 2HG GLN 100 -1.558 13.323 11.794 664 HE21 GLN 100 1HE2 GLN 100 -1.855 15.410 11.539 665 HE22 GLN 100 2HE2 GLN 100 -3.309 16.178 11.012 666 H TRP 101 H TRP 101 -2.816 8.126 11.047 667 HA TRP 101 HA TRP 101 -1.608 7.541 8.456 668 HB3 TRP 101 2HB TRP 101 -1.794 5.251 9.011 669 HD1 TRP 101 HD TRP 101 0.317 7.472 10.044 670 HE1 TRP 101 1HE TRP 101 1.650 6.986 12.193 671 HE3 TRP 101 3HE TRP 101 -2.749 3.947 12.122 672 HZ2 TRP 101 2HZ TRP 101 1.430 5.328 14.466 673 HZ3 TRP 101 3HZ TRP 101 -2.115 2.960 14.284 674 HH2 TRP 101 HH TRP 101 -0.069 3.637 15.431 675 H THR 102 H THR 102 -2.859 8.106 6.784 676 HA THR 102 HA THR 102 -5.746 7.881 6.931 677 HB THR 102 HB THR 102 -3.998 8.765 4.626 678 HG1 THR 102 1HG THR 102 -3.803 10.258 6.260 679 HG21 THR 102 3HG2 THR 102 -6.078 9.762 3.753 680 HG22 THR 102 1HG2 THR 102 -6.975 9.015 5.073 681 HG23 THR 102 2HG2 THR 102 -6.180 8.005 3.866 682 H VAL 103 H VAL 103 -6.315 5.747 6.912 683 HA VAL 103 HA VAL 103 -5.148 3.901 5.021 684 HB VAL 103 HB VAL 103 -6.794 2.279 5.957 685 HG11 VAL 103 1HG1 VAL 103 -4.757 2.136 7.023 686 HG12 VAL 103 2HG1 VAL 103 -4.860 3.774 7.671 687 HG13 VAL 103 3HG1 VAL 103 -5.833 2.482 8.376 688 HG21 VAL 103 3HG2 VAL 103 -7.972 4.703 6.960 689 HG22 VAL 103 1HG2 VAL 103 -8.623 3.063 6.947 690 HG23 VAL 103 2HG2 VAL 103 -7.613 3.600 8.288 691 H TYR 104 H TYR 104 -7.499 6.237 4.828 692 HA TYR 104 HA TYR 104 -9.129 6.740 3.324 693 HB3 TYR 104 2HB TYR 104 -8.951 5.654 1.074 694 HD1 TYR 104 2HD TYR 104 -8.420 8.283 1.860 695 HD2 TYR 104 1HD TYR 104 -5.587 5.221 1.022 696 HE1 TYR 104 2HE TYR 104 -6.737 9.994 1.325 697 HE2 TYR 104 1HE TYR 104 -3.896 6.924 0.485 698 HH TYR 104 HH TYR 104 -3.695 9.192 -0.122 699 H GLU 105 H GLU 105 -10.348 5.541 5.169 700 HA GLU 105 HA GLU 105 -11.393 2.974 4.790 701 HB3 GLU 105 2HB GLU 105 -12.994 3.516 6.468 702 HG3 GLU 105 2HG GLU 105 -10.308 4.133 6.859 703 H GLU 106 H GLU 106 -13.648 2.405 4.279 704 HA GLU 106 HA GLU 106 -14.741 4.118 2.144 705 HB3 GLU 106 2HB GLU 106 -15.326 1.219 2.056 706 HG3 GLU 106 2HG GLU 106 -14.169 2.421 -0.305 707 H GLN 107 H GLN 107 -15.444 1.881 4.767 708 HA GLN 107 HA GLN 107 -18.281 2.628 4.631 709 HB3 GLN 107 2HB GLN 107 -17.699 0.200 4.609 710 HG3 GLN 107 2HG GLN 107 -16.785 0.738 7.425 711 HE21 GLN 107 1HE2 GLN 107 -17.473 -1.712 4.972 712 HE22 GLN 107 2HE2 GLN 107 -17.716 -3.012 6.084 713 H GLY 108 H GLY 108 -15.413 2.857 6.569 714 HA2 GLY 108 2HA GLY 108 -15.489 4.875 8.062 715 HA3 GLY 108 3HA GLY 108 -16.985 4.195 8.685 716 H SER 109 H SER 109 -15.120 1.596 8.086 717 HA SER 109 HA SER 109 -13.944 1.638 10.789 718 HB3 SER 109 2HB SER 109 -15.021 -0.778 9.315 719 HG SER 109 HG SER 109 -13.990 -1.787 10.830 720 H SER 110 H SER 110 -12.847 2.270 8.037 721 HA SER 110 HA SER 110 -10.966 1.907 6.802 722 HB3 SER 110 2HB SER 110 -10.119 1.109 9.577 723 HG SER 110 HG SER 110 -8.727 -0.050 8.303 724 H LYS 111 H LYS 111 -12.010 0.300 5.503 725 HA LYS 111 HA LYS 111 -11.372 -2.484 6.155 726 HB3 LYS 111 2HB LYS 111 -12.907 -1.886 3.704 727 HG3 LYS 111 2HG LYS 111 -14.469 -3.497 5.205 728 HD3 LYS 111 2HD LYS 111 -12.482 -5.161 4.027 729 HE3 LYS 111 2HE LYS 111 -14.931 -4.239 2.586 730 HZ1 LYS 111 3HZ LYS 111 -14.655 -7.019 2.932 731 HZ2 LYS 111 1HZ LYS 111 -13.183 -6.389 2.385 732 HZ3 LYS 111 2HZ LYS 111 -14.599 -6.122 1.499 733 H VAL 112 H VAL 112 -10.257 -3.829 4.718 734 HA VAL 112 HA VAL 112 -8.160 -2.575 3.264 735 HB VAL 112 HB VAL 112 -7.589 -4.906 2.540 736 HG11 VAL 112 1HG1 VAL 112 -7.770 -5.465 5.320 737 HG12 VAL 112 2HG1 VAL 112 -6.377 -4.895 4.400 738 HG13 VAL 112 3HG1 VAL 112 -7.491 -3.735 5.123 739 HG21 VAL 112 3HG2 VAL 112 -8.805 -6.775 3.421 740 HG22 VAL 112 1HG2 VAL 112 -9.880 -5.710 4.328 741 HG23 VAL 112 2HG2 VAL 112 -9.942 -5.733 2.566 742 H PHE 113 H PHE 113 -7.659 -3.574 0.971 743 HA PHE 113 HA PHE 113 -10.094 -3.464 -0.673 744 HB3 PHE 113 2HB PHE 113 -8.463 -2.243 -2.358 745 HD1 PHE 113 1HD PHE 113 -8.701 -0.345 0.767 746 HD2 PHE 113 2HD PHE 113 -10.612 -1.332 -2.905 747 HE1 PHE 113 1HE PHE 113 -10.293 1.501 1.104 748 HE2 PHE 113 2HE PHE 113 -12.207 0.513 -2.576 749 HZ PHE 113 HZ PHE 113 -12.048 1.934 -0.570 750 H GLN 114 H GLN 114 -10.246 -5.058 -2.113 751 HA GLN 114 HA GLN 114 -8.097 -6.970 -2.336 752 HB3 GLN 114 2HB GLN 114 -10.310 -7.860 -2.150 753 HG3 GLN 114 2HG GLN 114 -11.440 -7.151 -4.684 754 HE21 GLN 114 1HE2 GLN 114 -12.052 -8.939 -2.691 755 HE22 GLN 114 2HE2 GLN 114 -13.512 -8.451 -1.907 756 H GLY 115 H GLY 115 -6.920 -7.480 -4.158 757 HA2 GLY 115 2HA GLY 115 -7.320 -5.775 -6.527 758 HA3 GLY 115 3HA GLY 115 -5.732 -5.876 -5.782 759 H ASN 116 H ASN 116 -4.806 -8.104 -5.596 760 HA ASN 116 HA ASN 116 -3.886 -9.805 -6.836 761 HB3 ASN 116 2HB ASN 116 -5.501 -11.095 -5.695 762 HD21 ASN 116 1HD2 ASN 116 -7.541 -11.297 -8.411 763 HD22 ASN 116 2HD2 ASN 116 -8.945 -10.582 -7.703 764 H LEU 117 H LEU 117 -3.166 -8.585 -8.638 765 HA LEU 117 HA LEU 117 -4.867 -8.810 -11.032 766 HB3 LEU 117 2HB LEU 117 -3.804 -6.912 -11.934 767 HG LEU 117 HG LEU 117 -4.742 -6.597 -9.187 768 HD11 LEU 117 1HD1 LEU 117 -2.878 -5.399 -8.602 769 HD12 LEU 117 2HD1 LEU 117 -3.874 -4.127 -9.308 770 HD13 LEU 117 3HD1 LEU 117 -2.572 -4.853 -10.251 771 HD21 LEU 117 3HD2 LEU 117 -5.778 -4.566 -10.299 772 HD22 LEU 117 1HD2 LEU 117 -6.238 -6.140 -10.949 773 HD23 LEU 117 2HD2 LEU 117 -5.057 -5.144 -11.801 774 H ASP 118 H ASP 118 -3.040 -10.837 -9.843 775 HA ASP 118 HA ASP 118 -1.610 -12.443 -10.588 776 HB3 ASP 118 2HB ASP 118 -1.394 -11.491 -13.355 777 H ASN 119 H ASN 119 0.473 -12.528 -12.293 778 HA ASN 119 HA ASN 119 2.238 -10.447 -11.218 779 HB3 ASN 119 2HB ASN 119 2.622 -13.035 -10.979 780 HD21 ASN 119 1HD2 ASN 119 1.563 -13.918 -12.981 781 HD22 ASN 119 2HD2 ASN 119 2.611 -14.426 -14.257 782 H ASN 120 H ASN 120 1.031 -11.820 -14.185 783 HA ASN 120 HA ASN 120 2.818 -10.135 -15.777 784 HB3 ASN 120 2HB ASN 120 0.952 -11.682 -17.345 785 HD21 ASN 120 1HD2 ASN 120 4.215 -12.054 -15.989 786 HD22 ASN 120 2HD2 ASN 120 5.032 -12.016 -17.511 787 H SER 121 H SER 121 0.579 -9.089 -14.152 788 HA SER 121 HA SER 121 -0.650 -7.489 -16.247 789 HB3 SER 121 2HB SER 121 -2.809 -7.988 -14.548 790 HG SER 121 HG SER 121 -2.847 -9.558 -16.748 791 H HIS 122 H HIS 122 0.400 -5.692 -15.480 792 HA HIS 122 HA HIS 122 0.299 -4.979 -12.686 793 HB3 HIS 122 2HB HIS 122 2.240 -4.469 -14.222 794 HD1 HIS 122 1HD HIS 122 -0.173 -4.157 -16.358 795 HD2 HIS 122 2HD HIS 122 2.544 -1.249 -15.162 796 HE1 HIS 122 1HE HIS 122 -0.106 -2.485 -18.236 797 H LYS 123 H LYS 123 -0.659 -3.047 -11.858 798 HA LYS 123 HA LYS 123 -2.794 -1.886 -13.502 799 HB3 LYS 123 2HB LYS 123 -3.235 -2.689 -10.629 800 HG3 LYS 123 2HG LYS 123 -4.724 -0.947 -11.698 801 HD3 LYS 123 2HD LYS 123 -5.345 -3.332 -13.406 802 HE3 LYS 123 2HE LYS 123 -7.339 -2.013 -12.077 803 HZ1 LYS 123 3HZ LYS 123 -6.920 -0.686 -14.694 804 HZ2 LYS 123 1HZ LYS 123 -7.060 0.046 -13.176 805 HZ3 LYS 123 2HZ LYS 123 -8.406 -0.689 -13.887 806 H LYS 124 H LYS 124 -2.258 0.193 -13.637 807 HA LYS 124 HA LYS 124 -1.226 1.542 -11.233 808 HB3 LYS 124 2HB LYS 124 0.195 1.493 -13.337 809 HG3 LYS 124 2HG LYS 124 -1.831 3.509 -14.289 810 HD3 LYS 124 2HD LYS 124 -0.339 3.350 -16.368 811 HE3 LYS 124 2HE LYS 124 0.659 4.675 -13.848 812 HZ1 LYS 124 3HZ LYS 124 1.281 5.549 -16.599 813 HZ2 LYS 124 1HZ LYS 124 2.286 4.460 -15.784 814 HZ3 LYS 124 2HZ LYS 124 2.024 6.005 -15.150 815 H ASN 125 H ASN 125 -2.295 3.241 -10.379 816 HA ASN 125 HA ASN 125 -4.795 4.045 -11.708 817 HB3 ASN 125 2HB ASN 125 -5.815 4.247 -9.653 818 HD21 ASN 125 1HD2 ASN 125 -6.582 2.254 -9.494 819 HD22 ASN 125 2HD2 ASN 125 -5.718 0.893 -8.871 820 H ILE 126 H ILE 126 -5.311 6.204 -11.932 821 HA ILE 126 HA ILE 126 -3.098 8.012 -12.089 822 HB ILE 126 HB ILE 126 -5.860 9.073 -12.281 823 HG13 ILE 126 2HG1 ILE 126 -4.899 6.729 -13.788 824 HG21 ILE 126 1HG2 ILE 126 -4.227 9.507 -14.574 825 HG22 ILE 126 2HG2 ILE 126 -4.768 10.669 -13.364 826 HG23 ILE 126 3HG2 ILE 126 -3.260 9.786 -13.126 827 HD11 ILE 126 3HD1 ILE 126 -7.206 7.369 -12.470 828 HD12 ILE 126 1HD1 ILE 126 -7.651 7.596 -14.162 829 HD13 ILE 126 2HD1 ILE 126 -7.008 6.046 -13.619 830 H PHE 127 H PHE 127 -4.122 10.446 -11.363 831 HA PHE 127 HA PHE 127 -3.721 10.401 -8.527 832 HB3 PHE 127 2HB PHE 127 -2.765 12.264 -9.580 833 HD1 PHE 127 1HD PHE 127 -6.155 13.551 -10.131 834 HD2 PHE 127 2HD PHE 127 -2.569 12.172 -11.963 835 HE1 PHE 127 1HE PHE 127 -6.922 14.440 -12.294 836 HE2 PHE 127 2HE PHE 127 -3.329 13.059 -14.128 837 HZ PHE 127 HZ PHE 127 -5.509 14.196 -14.295 838 H GLU 128 H GLU 128 -5.812 8.890 -8.626 839 HA GLU 128 HA GLU 128 -8.352 10.084 -8.761 840 HB3 GLU 128 2HB GLU 128 -8.149 7.896 -6.835 841 HG3 GLU 128 2HG GLU 128 -9.430 7.982 -9.555 842 H LYS 129 H LYS 129 -5.906 10.207 -6.359 843 HA LYS 129 HA LYS 129 -7.289 12.144 -4.829 844 HB3 LYS 129 2HB LYS 129 -6.997 10.408 -2.732 845 HG3 LYS 129 2HG LYS 129 -9.625 9.992 -3.674 846 HD3 LYS 129 2HD LYS 129 -8.286 11.719 -1.633 847 HE3 LYS 129 2HE LYS 129 -10.950 11.915 -1.028 848 HZ1 LYS 129 3HZ LYS 129 -9.628 13.771 -0.705 849 HZ2 LYS 129 1HZ LYS 129 -10.651 14.267 -1.959 850 HZ3 LYS 129 2HZ LYS 129 -9.064 13.793 -2.300 851 HA PRO 130 HA PRO 130 -2.664 12.024 -4.503 852 HB3 PRO 130 2HB PRO 130 -2.434 13.366 -6.354 853 HG3 PRO 130 2HG PRO 130 -4.168 14.749 -7.055 854 HD3 PRO 130 2HD PRO 130 -5.312 12.759 -6.830 855 H PHE 131 H PHE 131 -1.287 13.202 -3.017 856 HA PHE 131 HA PHE 131 -2.079 15.222 -1.293 857 HB3 PHE 131 2HB PHE 131 -2.180 12.984 0.531 858 HD1 PHE 131 2HD PHE 131 -2.033 15.166 1.828 859 HD2 PHE 131 1HD PHE 131 -5.395 14.083 -0.546 860 HE1 PHE 131 2HE PHE 131 -3.418 16.788 3.055 861 HE2 PHE 131 1HE PHE 131 -6.785 15.705 0.675 862 HZ PHE 131 HZ PHE 131 -5.797 17.059 2.480 863 H MET 132 H MET 132 -0.605 15.516 0.531 864 HA MET 132 HA MET 132 2.050 14.659 -0.160 865 HB3 MET 132 2HB MET 132 1.760 16.919 0.605 866 HG3 MET 132 2HG MET 132 1.233 16.398 3.404 867 HE1 MET 132 3HE MET 132 -1.571 17.601 0.943 868 HE2 MET 132 1HE MET 132 -1.021 19.229 0.545 869 HE3 MET 132 2HE MET 132 -0.098 17.829 -0.001 870 H ALA 133 H ALA 133 3.428 13.351 1.014 871 HA ALA 133 HA ALA 133 2.601 12.157 3.501 872 HB1 ALA 133 1HB ALA 133 2.843 10.402 1.061 873 HB2 ALA 133 2HB ALA 133 2.581 9.854 2.717 874 HB3 ALA 133 3HB ALA 133 1.342 10.803 1.895 875 H ARG 134 H ARG 134 4.287 11.136 4.593 876 HA ARG 134 HA ARG 134 6.921 11.297 3.283 877 HB3 ARG 134 2HB ARG 134 6.473 13.059 5.042 878 HG3 ARG 134 2HG ARG 134 5.965 10.690 6.650 879 HD3 ARG 134 2HD ARG 134 7.062 12.202 8.608 880 HE ARG 134 HE ARG 134 8.864 10.238 7.486 881 HH11 ARG 134 1HH1 ARG 134 6.006 10.817 9.387 882 HH12 ARG 134 2HH1 ARG 134 6.080 9.289 10.201 883 HH21 ARG 134 1HH2 ARG 134 8.972 8.224 8.551 884 HH22 ARG 134 2HH2 ARG 134 7.768 7.815 9.725 885 H TYR 135 H TYR 135 4.661 9.379 4.924 886 HA TYR 135 HA TYR 135 6.364 7.074 4.763 887 HB3 TYR 135 2HB TYR 135 5.579 8.197 7.451 888 HD1 TYR 135 2HD TYR 135 4.039 6.435 8.173 889 HD2 TYR 135 1HD TYR 135 7.997 5.518 6.908 890 HE1 TYR 135 2HE TYR 135 3.840 4.205 9.188 891 HE2 TYR 135 1HE TYR 135 7.808 3.284 7.920 892 HH TYR 135 HH TYR 135 5.546 2.449 10.125 893 H VAL 136 H VAL 136 5.094 5.516 4.034 894 HA VAL 136 HA VAL 136 2.249 5.534 4.805 895 HB VAL 136 HB VAL 136 1.678 4.551 2.728 896 HG11 VAL 136 1HG1 VAL 136 3.769 6.673 2.256 897 HG12 VAL 136 2HG1 VAL 136 2.552 6.166 1.082 898 HG13 VAL 136 3HG1 VAL 136 2.058 6.938 2.590 899 HG21 VAL 136 3HG2 VAL 136 4.461 3.703 2.742 900 HG22 VAL 136 1HG2 VAL 136 3.064 2.990 1.935 901 HG23 VAL 136 2HG2 VAL 136 3.942 4.317 1.171 902 H ARG 137 H ARG 137 1.218 3.534 5.215 903 HA ARG 137 HA ARG 137 3.050 1.298 5.783 904 HB3 ARG 137 2HB ARG 137 0.616 1.805 7.457 905 HG3 ARG 137 2HG ARG 137 3.176 0.308 7.794 906 HD3 ARG 137 2HD ARG 137 2.265 2.015 9.758 907 HE ARG 137 HE ARG 137 0.532 0.871 10.727 908 HH11 ARG 137 1HH1 ARG 137 3.074 -1.365 9.914 909 HH12 ARG 137 2HH1 ARG 137 2.345 -2.698 10.747 910 HH21 ARG 137 1HH2 ARG 137 -0.438 -0.876 11.825 911 HH22 ARG 137 2HH2 ARG 137 0.347 -2.419 11.833 912 H VAL 138 H VAL 138 2.409 -0.687 5.136 913 HA VAL 138 HA VAL 138 -0.331 -0.973 4.093 914 HB VAL 138 HB VAL 138 2.130 -2.168 2.812 915 HG11 VAL 138 1HG1 VAL 138 0.021 -3.440 2.553 916 HG12 VAL 138 2HG1 VAL 138 -0.712 -2.017 1.812 917 HG13 VAL 138 3HG1 VAL 138 0.649 -2.820 1.027 918 HG21 VAL 138 3HG2 VAL 138 2.452 -0.237 1.762 919 HG22 VAL 138 1HG2 VAL 138 0.824 -0.342 1.090 920 HG23 VAL 138 2HG2 VAL 138 1.093 0.480 2.627 921 H LEU 139 H LEU 139 -1.379 -2.813 4.623 922 HA LEU 139 HA LEU 139 0.143 -5.028 5.789 923 HB3 LEU 139 2HB LEU 139 -2.100 -3.512 7.076 924 HG LEU 139 HG LEU 139 -2.744 -5.879 7.276 925 HD11 LEU 139 1HD1 LEU 139 -1.224 -7.291 8.758 926 HD12 LEU 139 2HD1 LEU 139 0.047 -6.139 8.348 927 HD13 LEU 139 3HD1 LEU 139 -0.740 -7.073 7.075 928 HD21 LEU 139 3HD2 LEU 139 -3.010 -5.902 9.662 929 HD22 LEU 139 1HD2 LEU 139 -3.167 -4.240 9.094 930 HD23 LEU 139 2HD2 LEU 139 -1.672 -4.770 9.866 931 HA PRO 140 HA PRO 140 -2.675 -6.906 2.813 932 HB3 PRO 140 2HB PRO 140 -0.827 -7.843 1.822 933 HG3 PRO 140 2HG PRO 140 1.101 -8.277 3.048 934 HD3 PRO 140 2HD PRO 140 0.728 -6.085 3.656 935 H VAL 141 H VAL 141 -4.390 -8.266 3.071 936 HA VAL 141 HA VAL 141 -4.590 -9.675 5.653 937 HB VAL 141 HB VAL 141 -6.813 -8.457 4.010 938 HG11 VAL 141 1HG1 VAL 141 -7.834 -9.082 6.486 939 HG12 VAL 141 2HG1 VAL 141 -8.092 -9.998 5.000 940 HG13 VAL 141 3HG1 VAL 141 -6.810 -10.470 6.114 941 HG21 VAL 141 3HG2 VAL 141 -5.410 -7.624 6.524 942 HG22 VAL 141 1HG2 VAL 141 -5.773 -6.673 5.084 943 HG23 VAL 141 2HG2 VAL 141 -7.067 -7.117 6.198 944 H SER 142 H SER 142 -5.647 -9.752 2.260 945 HA SER 142 HA SER 142 -5.731 -12.692 2.453 946 HB3 SER 142 2HB SER 142 -7.740 -12.822 1.347 947 HG SER 142 HG SER 142 -9.112 -11.218 2.129 948 H TRP 143 H TRP 143 -4.398 -13.697 1.108 949 HA TRP 143 HA TRP 143 -3.586 -12.329 -1.367 950 HB3 TRP 143 2HB TRP 143 -1.783 -12.153 0.308 951 HD1 TRP 143 HD TRP 143 -0.413 -15.507 -0.561 952 HE1 TRP 143 1HE TRP 143 -0.221 -16.959 1.556 953 HE3 TRP 143 3HE TRP 143 -3.132 -12.612 2.659 954 HZ2 TRP 143 2HZ TRP 143 -1.105 -16.886 4.235 955 HZ3 TRP 143 3HZ TRP 143 -3.411 -13.375 4.982 956 HH2 TRP 143 HH TRP 143 -2.419 -15.469 5.751 957 H HIS 144 H HIS 144 -2.346 -13.997 -2.814 958 HA HIS 144 HA HIS 144 -3.750 -16.581 -2.706 959 HB3 HIS 144 2HB HIS 144 -3.532 -16.315 -5.349 960 HD1 HIS 144 1HD HIS 144 -5.628 -17.729 -4.160 961 HD2 HIS 144 2HD HIS 144 -6.109 -13.652 -4.799 962 HE1 HIS 144 1HE HIS 144 -8.109 -17.326 -4.091 963 H ASN 145 H ASN 145 -2.436 -18.279 -2.775 964 HA ASN 145 HA ASN 145 -0.640 -19.613 -3.233 965 HB3 ASN 145 2HB ASN 145 0.757 -19.171 -5.071 966 HD21 ASN 145 1HD2 ASN 145 -0.747 -16.455 -6.231 967 HD22 ASN 145 2HD2 ASN 145 -2.023 -17.207 -7.122 968 H ARG 146 H ARG 146 0.797 -16.352 -3.326 969 HA ARG 146 HA ARG 146 1.904 -16.619 -0.691 970 HB3 ARG 146 2HB ARG 146 4.173 -16.155 -2.392 971 HG3 ARG 146 2HG ARG 146 4.644 -18.562 -1.226 972 HD3 ARG 146 2HD ARG 146 5.076 -16.661 0.795 973 HE ARG 146 HE ARG 146 7.234 -16.883 -1.026 974 HH11 ARG 146 1HH1 ARG 146 5.266 -18.761 1.147 975 HH12 ARG 146 2HH1 ARG 146 6.498 -19.944 1.447 976 HH21 ARG 146 1HH2 ARG 146 8.862 -18.433 -0.639 977 HH22 ARG 146 2HH2 ARG 146 8.542 -19.754 0.431 978 H ILE 147 H ILE 147 2.571 -14.672 0.145 979 HA ILE 147 HA ILE 147 1.632 -12.323 -1.122 980 HB ILE 147 HB ILE 147 3.458 -12.609 1.266 981 HG13 ILE 147 2HG1 ILE 147 0.516 -12.716 0.873 982 HG21 ILE 147 1HG2 ILE 147 3.784 -10.413 0.887 983 HG22 ILE 147 2HG2 ILE 147 2.354 -10.268 -0.134 984 HG23 ILE 147 3HG2 ILE 147 2.189 -10.254 1.622 985 HD11 ILE 147 3HD1 ILE 147 2.492 -13.953 2.741 986 HD12 ILE 147 1HD1 ILE 147 0.768 -13.956 3.110 987 HD13 ILE 147 2HD1 ILE 147 1.356 -14.732 1.639 988 H THR 148 H THR 148 2.718 -12.265 -3.139 989 HA THR 148 HA THR 148 5.404 -11.102 -2.951 990 HB THR 148 HB THR 148 4.935 -12.823 -5.313 991 HG1 THR 148 1HG THR 148 4.183 -14.088 -3.477 992 HG21 THR 148 3HG2 THR 148 7.117 -12.410 -5.489 993 HG22 THR 148 1HG2 THR 148 7.391 -13.332 -4.012 994 HG23 THR 148 2HG2 THR 148 7.114 -11.592 -3.927 995 H LEU 149 H LEU 149 5.038 -9.076 -3.611 996 HA LEU 149 HA LEU 149 4.239 -8.587 -6.314 997 HB3 LEU 149 2HB LEU 149 2.061 -8.874 -5.112 998 HG LEU 149 HG LEU 149 1.177 -7.354 -3.611 999 HD11 LEU 149 1HD1 LEU 149 2.942 -8.785 -2.601 1000 HD12 LEU 149 2HD1 LEU 149 2.665 -7.273 -1.737 1001 HD13 LEU 149 3HD1 LEU 149 4.074 -7.444 -2.784 1002 HD21 LEU 149 3HD2 LEU 149 1.657 -5.153 -3.485 1003 HD22 LEU 149 1HD2 LEU 149 2.413 -5.444 -5.052 1004 HD23 LEU 149 2HD2 LEU 149 3.399 -5.415 -3.590 1005 H ARG 150 H ARG 150 3.971 -6.063 -6.593 1006 HA ARG 150 HA ARG 150 5.894 -4.692 -4.843 1007 HB3 ARG 150 2HB ARG 150 6.003 -5.049 -7.802 1008 HG3 ARG 150 2HG ARG 150 7.774 -3.082 -7.578 1009 HD3 ARG 150 2HD ARG 150 5.546 -1.607 -8.154 1010 HE ARG 150 HE ARG 150 7.444 -3.028 -9.718 1011 HH11 ARG 150 1HH1 ARG 150 4.382 -1.379 -9.895 1012 HH12 ARG 150 2HH1 ARG 150 4.557 -0.958 -11.566 1013 HH21 ARG 150 1HH2 ARG 150 7.686 -2.480 -11.920 1014 HH22 ARG 150 2HH2 ARG 150 6.436 -1.586 -12.718 1015 H LEU 151 H LEU 151 5.240 -2.743 -4.183 1016 HA LEU 151 HA LEU 151 2.907 -1.550 -5.526 1017 HB3 LEU 151 2HB LEU 151 3.833 -1.334 -2.665 1018 HG LEU 151 HG LEU 151 2.354 0.616 -3.911 1019 HD11 LEU 151 1HD1 LEU 151 0.528 -1.473 -2.791 1020 HD12 LEU 151 2HD1 LEU 151 0.391 -0.554 -4.291 1021 HD13 LEU 151 3HD1 LEU 151 0.083 0.233 -2.743 1022 HD21 LEU 151 3HD2 LEU 151 3.524 0.581 -1.673 1023 HD22 LEU 151 1HD2 LEU 151 2.056 -0.145 -1.016 1024 HD23 LEU 151 2HD2 LEU 151 1.998 1.465 -1.733 1025 H GLU 152 H GLU 152 3.942 -0.251 -7.003 1026 HA GLU 152 HA GLU 152 6.057 1.537 -6.152 1027 HB3 GLU 152 2HB GLU 152 5.125 2.217 -8.747 1028 HG3 GLU 152 2HG GLU 152 7.322 0.460 -8.968 1029 H LEU 153 H LEU 153 5.923 3.744 -5.957 1030 HA LEU 153 HA LEU 153 3.199 4.865 -5.956 1031 HB3 LEU 153 2HB LEU 153 4.048 4.776 -3.727 1032 HG LEU 153 HG LEU 153 6.595 5.106 -4.692 1033 HD11 LEU 153 1HD1 LEU 153 5.950 7.596 -4.823 1034 HD12 LEU 153 2HD1 LEU 153 7.474 7.157 -4.052 1035 HD13 LEU 153 3HD1 LEU 153 6.071 7.564 -3.063 1036 HD21 LEU 153 3HD2 LEU 153 6.389 3.952 -2.718 1037 HD22 LEU 153 1HD2 LEU 153 5.335 5.164 -1.991 1038 HD23 LEU 153 2HD2 LEU 153 7.064 5.476 -2.141 1039 H LEU 154 H LEU 154 2.815 6.770 -6.987 1040 HA LEU 154 HA LEU 154 5.099 8.016 -8.372 1041 HB3 LEU 154 2HB LEU 154 3.789 8.379 -10.288 1042 HG LEU 154 HG LEU 154 3.171 5.623 -9.257 1043 HD11 LEU 154 1HD1 LEU 154 2.593 6.679 -12.019 1044 HD12 LEU 154 2HD1 LEU 154 1.373 6.386 -10.781 1045 HD13 LEU 154 3HD1 LEU 154 2.315 5.042 -11.425 1046 HD21 LEU 154 3HD2 LEU 154 5.323 5.415 -9.856 1047 HD22 LEU 154 1HD2 LEU 154 5.305 6.900 -10.807 1048 HD23 LEU 154 2HD2 LEU 154 4.694 5.400 -11.505 1049 H GLY 155 H GLY 155 5.106 10.263 -8.577 1050 HA2 GLY 155 2HA GLY 155 3.027 11.693 -7.046 1051 HA3 GLY 155 3HA GLY 155 4.732 12.015 -6.770 1052 H CYS 156 H CYS 156 3.743 14.229 -7.294 1053 HA CYS 156 HA CYS 156 3.671 14.669 -10.199 1054 HB3 CYS 156 2HB CYS 156 2.904 16.711 -8.127 1055 H LEU 157 H LEU 157 5.576 15.136 -7.410 1056 HA LEU 157 HA LEU 157 7.508 16.264 -6.982 1057 HB3 LEU 157 2HB LEU 157 8.350 16.605 -9.735 1058 HG LEU 157 HG LEU 157 10.130 15.002 -9.160 1059 HD11 LEU 157 1HD1 LEU 157 11.185 16.378 -7.397 1060 HD12 LEU 157 2HD1 LEU 157 9.648 17.213 -7.169 1061 HD13 LEU 157 3HD1 LEU 157 10.499 17.337 -8.709 1062 HD21 LEU 157 3HD2 LEU 157 8.293 14.242 -7.134 1063 HD22 LEU 157 1HD2 LEU 157 9.756 14.839 -6.352 1064 HD23 LEU 157 2HD2 LEU 157 9.857 13.527 -7.527 1065 H GLU 158 H GLU 158 5.111 17.852 -7.524 1066 HA GLU 158 HA GLU 158 6.313 20.289 -8.650 1067 HB3 GLU 158 2HB GLU 158 3.420 20.262 -8.059 1068 HG3 GLU 158 2HG GLU 158 4.841 20.900 -10.629 Start of MODEL 17 1 H1 MET -5 H MET -5 1.169 29.884 -7.967 2 HA MET -5 HA MET -5 2.794 31.284 -8.921 3 HB3 MET -5 2HB MET -5 3.055 32.792 -7.124 4 HG3 MET -5 2HG MET -5 4.120 30.465 -5.564 5 HE1 MET -5 3HE MET -5 2.848 33.808 -4.822 6 HE2 MET -5 1HE MET -5 3.851 34.352 -3.477 7 HE3 MET -5 2HE MET -5 4.278 34.793 -5.131 8 H LYS -4 H LYS -4 2.683 28.584 -9.082 9 HA LYS -4 HA LYS -4 5.415 27.900 -9.568 10 HB3 LYS -4 2HB LYS -4 4.698 25.691 -8.023 11 HG3 LYS -4 2HG LYS -4 6.536 27.998 -7.478 12 HD3 LYS -4 2HD LYS -4 7.081 25.617 -5.934 13 HE3 LYS -4 2HE LYS -4 7.006 28.546 -5.606 14 HZ1 LYS -4 3HZ LYS -4 7.195 28.312 -3.167 15 HZ2 LYS -4 1HZ LYS -4 6.672 26.708 -3.299 16 HZ3 LYS -4 2HZ LYS -4 5.642 27.972 -3.748 17 H SER -3 H SER -3 5.277 26.956 -11.485 18 HA SER -3 HA SER -3 2.869 25.746 -12.432 19 HB3 SER -3 2HB SER -3 4.705 25.007 -14.281 20 HG SER -3 HG SER -3 4.034 26.791 -15.371 21 H GLY -2 H GLY -2 6.118 24.294 -12.466 22 HA2 GLY -2 2HA GLY -2 6.826 22.156 -12.026 23 HA3 GLY -2 3HA GLY -2 5.541 22.095 -10.828 24 H HIS -1 H HIS -1 6.245 21.644 -14.263 25 HA HIS -1 HA HIS -1 3.782 20.110 -14.593 26 HB3 HIS -1 2HB HIS -1 4.765 19.975 -17.026 27 HD1 HIS -1 1HD HIS -1 4.725 23.588 -16.194 28 HD2 HIS -1 2HD HIS -1 2.007 20.618 -17.215 29 HE1 HIS -1 1HE HIS -1 2.601 24.796 -16.786 30 H GLY 0 H GLY 0 3.805 17.974 -15.511 31 HA2 GLY 0 2HA GLY 0 4.915 15.956 -16.120 32 HA3 GLY 0 3HA GLY 0 6.352 16.531 -15.288 33 H CYS 1 H CYS 1 3.496 14.684 -15.052 34 HA CYS 1 HA CYS 1 3.761 14.435 -12.141 35 HB3 CYS 1 2HB CYS 1 1.583 13.133 -12.382 36 H SER 2 H SER 2 2.855 11.972 -11.619 37 HA SER 2 HA SER 2 3.392 9.759 -11.534 38 HB3 SER 2 2HB SER 2 3.724 8.609 -13.506 39 HG SER 2 HG SER 2 2.003 10.111 -13.857 40 H GLU 3 H GLU 3 4.946 11.061 -9.996 41 HA GLU 3 HA GLU 3 7.731 10.462 -10.733 42 HB3 GLU 3 2HB GLU 3 8.414 12.095 -9.095 43 HG3 GLU 3 2HG GLU 3 6.297 13.801 -10.033 44 HA PRO 4 HA PRO 4 6.828 7.148 -7.725 45 HB3 PRO 4 2HB PRO 4 7.066 5.610 -9.414 46 HG3 PRO 4 2HG PRO 4 8.345 6.084 -11.297 47 HD3 PRO 4 2HD PRO 4 7.030 7.975 -11.224 48 H LEU 5 H LEU 5 10.162 6.720 -8.662 49 HA LEU 5 HA LEU 5 11.085 8.007 -6.195 50 HB3 LEU 5 2HB LEU 5 11.215 5.954 -5.290 51 HG LEU 5 HG LEU 5 11.026 4.885 -8.046 52 HD11 LEU 5 1HD1 LEU 5 11.601 2.617 -6.676 53 HD12 LEU 5 2HD1 LEU 5 12.769 3.742 -5.982 54 HD13 LEU 5 3HD1 LEU 5 12.735 3.470 -7.724 55 HD21 LEU 5 3HD2 LEU 5 9.896 3.759 -5.507 56 HD22 LEU 5 1HD2 LEU 5 9.282 3.619 -7.154 57 HD23 LEU 5 2HD2 LEU 5 9.164 5.156 -6.298 58 H GLY 6 H GLY 6 12.763 5.894 -8.497 59 HA2 GLY 6 2HA GLY 6 14.349 8.238 -9.348 60 HA3 GLY 6 3HA GLY 6 15.098 6.693 -8.976 61 H LEU 7 H LEU 7 12.310 5.808 -10.340 62 HA LEU 7 HA LEU 7 13.551 5.141 -12.833 63 HB3 LEU 7 2HB LEU 7 11.555 3.948 -13.332 64 HG LEU 7 HG LEU 7 11.783 3.723 -10.333 65 HD11 LEU 7 1HD1 LEU 7 10.459 2.160 -12.468 66 HD12 LEU 7 2HD1 LEU 7 9.991 2.413 -10.788 67 HD13 LEU 7 3HD1 LEU 7 11.262 1.257 -11.185 68 HD21 LEU 7 3HD2 LEU 7 13.705 3.141 -12.394 69 HD22 LEU 7 1HD2 LEU 7 13.205 1.662 -11.572 70 HD23 LEU 7 2HD2 LEU 7 13.863 3.008 -10.641 71 H LYS 8 H LYS 8 12.011 7.885 -11.722 72 HA LYS 8 HA LYS 8 10.738 8.623 -14.214 73 HB3 LYS 8 2HB LYS 8 11.151 10.793 -12.321 74 HG3 LYS 8 2HG LYS 8 8.751 10.975 -12.370 75 HD3 LYS 8 2HD LYS 8 10.401 11.115 -14.628 76 HE3 LYS 8 2HE LYS 8 9.276 9.149 -15.545 77 HZ1 LYS 8 3HZ LYS 8 6.735 10.330 -16.006 78 HZ2 LYS 8 1HZ LYS 8 7.024 10.174 -14.346 79 HZ3 LYS 8 2HZ LYS 8 7.107 8.815 -15.350 80 H ASN 9 H ASN 9 13.389 9.985 -12.249 81 HA ASN 9 HA ASN 9 15.214 10.285 -14.318 82 HB3 ASN 9 2HB ASN 9 14.581 13.048 -14.001 83 HD21 ASN 9 1HD2 ASN 9 14.656 14.108 -15.989 84 HD22 ASN 9 2HD2 ASN 9 15.152 13.299 -17.433 85 H ASN 10 H ASN 10 15.117 9.659 -11.536 86 HA ASN 10 HA ASN 10 16.966 11.706 -10.504 87 HB3 ASN 10 2HB ASN 10 16.121 11.183 -8.219 88 HD21 ASN 10 1HD2 ASN 10 13.735 11.387 -10.843 89 HD22 ASN 10 2HD2 ASN 10 13.137 12.947 -10.405 90 H THR 11 H THR 11 16.528 9.328 -8.254 91 HA THR 11 HA THR 11 17.861 7.084 -9.070 92 HB THR 11 HB THR 11 19.814 8.138 -9.765 93 HG1 THR 11 1HG THR 11 20.564 7.809 -7.066 94 HG21 THR 11 3HG2 THR 11 19.567 10.376 -9.177 95 HG22 THR 11 1HG2 THR 11 20.942 9.867 -8.197 96 HG23 THR 11 2HG2 THR 11 19.341 10.005 -7.467 97 H ILE 12 H ILE 12 16.216 6.646 -7.411 98 HA ILE 12 HA ILE 12 16.932 7.255 -4.665 99 HB ILE 12 HB ILE 12 14.634 5.634 -5.767 100 HG13 ILE 12 2HG1 ILE 12 13.277 7.608 -5.187 101 HG21 ILE 12 1HG2 ILE 12 15.295 4.999 -3.472 102 HG22 ILE 12 2HG2 ILE 12 15.061 6.672 -2.970 103 HG23 ILE 12 3HG2 ILE 12 13.690 5.725 -3.548 104 HD11 ILE 12 3HD1 ILE 12 14.665 8.593 -3.444 105 HD12 ILE 12 1HD1 ILE 12 15.899 8.979 -4.643 106 HD13 ILE 12 2HD1 ILE 12 14.315 9.751 -4.727 107 HA PRO 13 HA PRO 13 19.238 3.525 -4.088 108 HB3 PRO 13 2HB PRO 13 20.314 4.646 -2.395 109 HG3 PRO 13 2HG PRO 13 19.203 6.237 -1.115 110 HD3 PRO 13 2HD PRO 13 18.650 6.973 -3.227 111 H ASP 14 H ASP 14 19.046 1.718 -2.161 112 HA ASP 14 HA ASP 14 16.307 0.690 -2.438 113 HB3 ASP 14 2HB ASP 14 17.999 -0.757 -3.408 114 H SER 15 H SER 15 16.604 2.591 -0.499 115 HA SER 15 HA SER 15 16.361 0.992 1.957 116 HB3 SER 15 2HB SER 15 17.294 3.766 2.323 117 HG SER 15 HG SER 15 18.170 2.869 4.043 118 H GLN 16 H GLN 16 14.351 1.956 0.075 119 HA GLN 16 HA GLN 16 12.971 4.015 1.637 120 HB3 GLN 16 2HB GLN 16 13.131 4.468 -0.739 121 HG3 GLN 16 2HG GLN 16 11.545 1.959 -1.222 122 HE21 GLN 16 1HE2 GLN 16 10.432 4.145 -2.158 123 HE22 GLN 16 2HE2 GLN 16 10.759 4.372 -3.840 124 H MET 17 H MET 17 12.502 0.762 0.313 125 HA MET 17 HA MET 17 9.937 0.456 1.592 126 HB3 MET 17 2HB MET 17 10.827 -2.074 0.830 127 HG3 MET 17 2HG MET 17 9.283 -0.072 -0.801 128 HE1 MET 17 3HE MET 17 8.598 -0.264 -2.719 129 HE2 MET 17 1HE MET 17 9.637 -1.233 -3.765 130 HE3 MET 17 2HE MET 17 7.944 -1.678 -3.546 131 H SER 18 H SER 18 9.509 -1.393 3.062 132 HA SER 18 HA SER 18 11.482 -2.724 4.516 133 HB3 SER 18 2HB SER 18 12.296 -0.768 5.501 134 HG SER 18 HG SER 18 9.708 0.191 6.077 135 H ALA 19 H ALA 19 10.274 -4.466 4.875 136 HA ALA 19 HA ALA 19 7.531 -4.115 5.875 137 HB1 ALA 19 1HB ALA 19 8.587 -6.742 4.932 138 HB2 ALA 19 2HB ALA 19 6.942 -6.107 4.884 139 HB3 ALA 19 3HB ALA 19 8.154 -5.503 3.754 140 H SER 20 H SER 20 6.910 -6.263 7.193 141 HA SER 20 HA SER 20 8.023 -6.016 9.707 142 HB3 SER 20 2HB SER 20 7.047 -8.726 9.107 143 HG SER 20 HG SER 20 6.771 -8.254 11.161 144 H SER 21 H SER 21 9.041 -8.018 7.027 145 HA SER 21 HA SER 21 11.659 -8.326 7.947 146 HB3 SER 21 2HB SER 21 9.830 -10.656 8.551 147 HG SER 21 HG SER 21 12.136 -11.418 9.243 148 H SER 22 H SER 22 9.011 -9.537 6.021 149 HA SER 22 HA SER 22 8.890 -10.189 3.842 150 HB3 SER 22 2HB SER 22 10.797 -8.284 3.789 151 HG SER 22 HG SER 22 12.148 -10.251 2.379 152 H TYR 23 H TYR 23 9.775 -11.825 2.289 153 HA TYR 23 HA TYR 23 10.121 -14.280 3.460 154 HB3 TYR 23 2HB TYR 23 10.973 -13.294 0.738 155 HD1 TYR 23 1HD TYR 23 10.541 -16.387 2.776 156 HD2 TYR 23 2HD TYR 23 12.133 -14.637 -0.760 157 HE1 TYR 23 1HE TYR 23 11.668 -18.507 2.243 158 HE2 TYR 23 2HE TYR 23 13.263 -16.754 -1.305 159 HH TYR 23 HH TYR 23 13.768 -19.173 0.845 160 H LYS 24 H LYS 24 12.781 -12.878 1.572 161 HA LYS 24 HA LYS 24 14.805 -14.389 2.703 162 HB3 LYS 24 2HB LYS 24 16.015 -11.958 2.068 163 HG3 LYS 24 2HG LYS 24 16.671 -14.225 1.271 164 HD3 LYS 24 2HD LYS 24 14.187 -13.850 -0.293 165 HE3 LYS 24 2HE LYS 24 16.156 -13.744 -1.926 166 HZ1 LYS 24 3HZ LYS 24 17.583 -15.394 -1.021 167 HZ2 LYS 24 1HZ LYS 24 17.003 -15.996 -2.492 168 HZ3 LYS 24 2HZ LYS 24 16.362 -16.565 -1.034 169 H THR 25 H THR 25 16.064 -14.246 4.483 170 HA THR 25 HA THR 25 15.631 -11.949 6.278 171 HB THR 25 HB THR 25 16.307 -14.564 7.507 172 HG1 THR 25 1HG THR 25 14.515 -15.511 6.915 173 HG21 THR 25 3HG2 THR 25 15.486 -13.598 9.371 174 HG22 THR 25 1HG2 THR 25 14.100 -12.910 8.525 175 HG23 THR 25 2HG2 THR 25 15.664 -12.098 8.462 176 H TRP 26 H TRP 26 17.823 -14.467 5.160 177 HA TRP 26 HA TRP 26 20.079 -12.758 5.888 178 HB3 TRP 26 2HB TRP 26 19.941 -14.238 7.782 179 HD1 TRP 26 HD TRP 26 20.588 -16.840 4.961 180 HE1 TRP 26 1HE TRP 26 19.274 -18.973 5.547 181 HE3 TRP 26 3HE TRP 26 18.333 -15.247 9.264 182 HZ2 TRP 26 2HZ TRP 26 17.514 -19.864 7.566 183 HZ3 TRP 26 3HZ TRP 26 16.849 -16.801 10.462 184 HH2 TRP 26 HH TRP 26 16.448 -19.061 9.628 185 H ASN 27 H ASN 27 22.119 -13.484 4.853 186 HA ASN 27 HA ASN 27 21.974 -15.365 2.691 187 HB3 ASN 27 2HB ASN 27 20.877 -13.608 1.514 188 HD21 ASN 27 1HD2 ASN 27 23.749 -11.841 1.141 189 HD22 ASN 27 2HD2 ASN 27 23.239 -10.388 1.925 190 H LEU 28 H LEU 28 23.703 -12.657 4.167 191 HA LEU 28 HA LEU 28 26.114 -14.198 4.330 192 HB3 LEU 28 2HB LEU 28 26.823 -11.736 2.996 193 HG LEU 28 HG LEU 28 27.865 -14.326 3.094 194 HD11 LEU 28 1HD1 LEU 28 26.228 -14.335 0.921 195 HD12 LEU 28 2HD1 LEU 28 27.672 -15.331 1.103 196 HD13 LEU 28 3HD1 LEU 28 27.757 -13.809 0.216 197 HD21 LEU 28 3HD2 LEU 28 28.886 -12.318 1.146 198 HD22 LEU 28 1HD2 LEU 28 29.764 -13.316 2.305 199 HD23 LEU 28 2HD2 LEU 28 28.862 -11.907 2.862 200 H ARG 29 H ARG 29 27.983 -12.418 4.927 201 HA ARG 29 HA ARG 29 27.197 -11.426 7.456 202 HB3 ARG 29 2HB ARG 29 29.520 -10.195 7.168 203 HG3 ARG 29 2HG ARG 29 30.693 -12.469 7.482 204 HD3 ARG 29 2HD ARG 29 28.817 -11.023 9.207 205 HE ARG 29 HE ARG 29 28.745 -13.777 9.503 206 HH11 ARG 29 1HH1 ARG 29 29.583 -10.998 11.426 207 HH12 ARG 29 2HH1 ARG 29 29.144 -11.741 12.928 208 HH21 ARG 29 1HH2 ARG 29 28.163 -14.767 11.475 209 HH22 ARG 29 2HH2 ARG 29 28.337 -13.885 12.955 210 H ALA 30 H ALA 30 27.799 -9.859 4.341 211 HA ALA 30 HA ALA 30 27.617 -7.199 5.150 212 HB1 ALA 30 1HB ALA 30 26.406 -7.630 2.555 213 HB2 ALA 30 2HB ALA 30 27.900 -6.793 2.980 214 HB3 ALA 30 3HB ALA 30 27.905 -8.540 2.740 215 H PHE 31 H PHE 31 25.796 -5.692 4.511 216 HA PHE 31 HA PHE 31 23.547 -6.163 6.042 217 HB3 PHE 31 2HB PHE 31 22.575 -4.394 4.220 218 HD1 PHE 31 1HD PHE 31 25.747 -3.820 6.078 219 HD2 PHE 31 2HD PHE 31 21.534 -3.230 5.924 220 HE1 PHE 31 1HE PHE 31 25.884 -2.350 8.045 221 HE2 PHE 31 2HE PHE 31 21.666 -1.758 7.891 222 HZ PHE 31 HZ PHE 31 23.842 -1.315 8.953 223 H GLY 32 H GLY 32 23.374 -5.920 2.490 224 HA2 GLY 32 2HA GLY 32 22.104 -7.061 0.955 225 HA3 GLY 32 3HA GLY 32 22.160 -8.422 2.066 226 H TRP 33 H TRP 33 20.352 -5.629 1.026 227 HA TRP 33 HA TRP 33 18.236 -5.984 2.939 228 HB3 TRP 33 2HB TRP 33 17.147 -4.170 1.842 229 HD1 TRP 33 HD TRP 33 20.527 -3.350 0.300 230 HE1 TRP 33 1HE TRP 33 21.733 -1.637 1.795 231 HE3 TRP 33 3HE TRP 33 17.355 -3.396 4.310 232 HZ2 TRP 33 2HZ TRP 33 21.387 -0.461 4.338 233 HZ3 TRP 33 3HZ TRP 33 17.865 -1.949 6.233 234 HH2 TRP 33 HH TRP 33 19.840 -0.512 6.246 235 H TYR 34 H TYR 34 16.458 -7.203 2.764 236 HA TYR 34 HA TYR 34 16.238 -9.102 0.651 237 HB3 TYR 34 2HB TYR 34 14.671 -10.137 1.956 238 HD1 TYR 34 1HD TYR 34 17.286 -10.202 2.845 239 HD2 TYR 34 2HD TYR 34 14.017 -8.206 4.698 240 HE1 TYR 34 1HE TYR 34 18.449 -10.319 5.009 241 HE2 TYR 34 2HE TYR 34 15.172 -8.317 6.867 242 HH TYR 34 HH TYR 34 17.064 -9.999 7.860 243 HA PRO 35 HA PRO 35 12.305 -6.520 -0.512 244 HB3 PRO 35 2HB PRO 35 11.442 -5.470 1.340 245 HG3 PRO 35 2HG PRO 35 12.830 -4.704 3.042 246 HD3 PRO 35 2HD PRO 35 13.620 -6.858 2.825 247 H HIS 36 H HIS 36 12.051 -3.958 -1.359 248 HA HIS 36 HA HIS 36 12.803 -2.385 -2.830 249 HB3 HIS 36 2HB HIS 36 15.077 -1.724 -2.835 250 HD1 HIS 36 1HD HIS 36 13.727 -0.334 -0.951 251 HD2 HIS 36 2HD HIS 36 15.931 -3.598 0.372 252 HE1 HIS 36 1HE HIS 36 13.986 -0.010 1.530 253 H LEU 37 H LEU 37 11.850 -4.649 -3.896 254 HA LEU 37 HA LEU 37 13.760 -5.407 -6.002 255 HB3 LEU 37 2HB LEU 37 12.369 -7.370 -6.367 256 HG LEU 37 HG LEU 37 13.053 -8.660 -4.636 257 HD11 LEU 37 1HD1 LEU 37 15.073 -7.894 -3.812 258 HD12 LEU 37 2HD1 LEU 37 14.488 -6.242 -3.622 259 HD13 LEU 37 3HD1 LEU 37 14.831 -6.875 -5.232 260 HD21 LEU 37 3HD2 LEU 37 13.004 -7.129 -2.276 261 HD22 LEU 37 1HD2 LEU 37 11.956 -8.476 -2.717 262 HD23 LEU 37 2HD2 LEU 37 11.479 -6.824 -3.109 263 H GLY 38 H GLY 38 10.774 -3.815 -5.354 264 HA2 GLY 38 2HA GLY 38 9.384 -4.004 -7.727 265 HA3 GLY 38 3HA GLY 38 9.410 -2.565 -6.718 266 H ARG 39 H ARG 39 12.379 -2.353 -7.133 267 HA ARG 39 HA ARG 39 12.437 -0.438 -9.106 268 HB3 ARG 39 2HB ARG 39 14.230 -0.873 -7.421 269 HG3 ARG 39 2HG ARG 39 15.128 -2.990 -9.364 270 HD3 ARG 39 2HD ARG 39 16.765 -1.376 -8.003 271 HE ARG 39 HE ARG 39 15.653 -2.575 -5.865 272 HH11 ARG 39 1HH1 ARG 39 18.803 -2.818 -7.329 273 HH12 ARG 39 2HH1 ARG 39 19.611 -3.175 -5.839 274 HH21 ARG 39 1HH2 ARG 39 16.707 -3.043 -3.897 275 HH22 ARG 39 2HH2 ARG 39 18.418 -3.304 -3.888 276 H LEU 40 H LEU 40 13.350 -0.421 -11.246 277 HA LEU 40 HA LEU 40 12.437 -2.645 -12.823 278 HB3 LEU 40 2HB LEU 40 12.302 -0.159 -13.405 279 HG LEU 40 HG LEU 40 14.960 0.011 -13.201 280 HD11 LEU 40 1HD1 LEU 40 14.425 -1.185 -15.840 281 HD12 LEU 40 2HD1 LEU 40 15.876 -1.236 -14.840 282 HD13 LEU 40 3HD1 LEU 40 15.530 0.189 -15.819 283 HD21 LEU 40 3HD2 LEU 40 13.884 1.583 -15.448 284 HD22 LEU 40 1HD2 LEU 40 14.668 2.113 -13.960 285 HD23 LEU 40 2HD2 LEU 40 12.963 1.659 -13.945 286 H ASP 41 H ASP 41 15.196 -2.144 -11.121 287 HA ASP 41 HA ASP 41 16.791 -3.780 -12.984 288 HB3 ASP 41 2HB ASP 41 18.039 -1.999 -10.912 289 H ASN 42 H ASN 42 15.273 -5.292 -11.553 290 HA ASN 42 HA ASN 42 15.747 -5.894 -8.929 291 HB3 ASN 42 2HB ASN 42 14.061 -7.174 -9.865 292 HD21 ASN 42 1HD2 ASN 42 13.661 -6.201 -11.917 293 HD22 ASN 42 2HD2 ASN 42 14.075 -7.036 -13.372 294 H GLN 43 H GLN 43 17.109 -7.365 -7.827 295 HA GLN 43 HA GLN 43 19.802 -7.424 -8.884 296 HB3 GLN 43 2HB GLN 43 19.575 -6.802 -6.581 297 HG3 GLN 43 2HG GLN 43 18.122 -9.407 -6.219 298 HE21 GLN 43 1HE2 GLN 43 17.638 -10.027 -4.105 299 HE22 GLN 43 2HE2 GLN 43 18.595 -9.516 -2.762 300 H GLY 44 H GLY 44 17.202 -9.676 -8.202 301 HA2 GLY 44 2HA GLY 44 18.894 -11.849 -9.276 302 HA3 GLY 44 3HA GLY 44 17.645 -12.103 -8.065 303 H LYS 45 H LYS 45 15.401 -11.334 -8.801 304 HA LYS 45 HA LYS 45 14.672 -11.105 -11.465 305 HB3 LYS 45 2HB LYS 45 15.490 -13.254 -11.980 306 HG3 LYS 45 2HG LYS 45 15.632 -13.979 -9.529 307 HD3 LYS 45 2HD LYS 45 12.776 -14.294 -10.067 308 HE3 LYS 45 2HE LYS 45 13.382 -16.628 -10.329 309 HZ1 LYS 45 3HZ LYS 45 14.868 -16.212 -7.804 310 HZ2 LYS 45 1HZ LYS 45 15.445 -16.836 -9.268 311 HZ3 LYS 45 2HZ LYS 45 14.383 -17.748 -8.319 312 H ILE 46 H ILE 46 13.958 -12.079 -8.230 313 HA ILE 46 HA ILE 46 11.278 -12.553 -8.178 314 HB ILE 46 HB ILE 46 12.657 -10.704 -6.233 315 HG13 ILE 46 2HG1 ILE 46 13.010 -13.560 -6.781 316 HG21 ILE 46 1HG2 ILE 46 10.999 -11.351 -4.668 317 HG22 ILE 46 2HG2 ILE 46 10.148 -10.927 -6.151 318 HG23 ILE 46 3HG2 ILE 46 10.394 -12.622 -5.731 319 HD11 ILE 46 3HD1 ILE 46 14.543 -11.342 -5.693 320 HD12 ILE 46 1HD1 ILE 46 14.800 -12.862 -4.834 321 HD13 ILE 46 2HD1 ILE 46 15.079 -12.772 -6.574 322 H ASN 47 H ASN 47 12.865 -9.438 -8.602 323 HA ASN 47 HA ASN 47 12.032 -7.332 -8.965 324 HB3 ASN 47 2HB ASN 47 11.787 -8.453 -11.164 325 HD21 ASN 47 1HD2 ASN 47 10.976 -10.133 -12.164 326 HD22 ASN 47 2HD2 ASN 47 9.396 -10.793 -11.940 327 H ALA 48 H ALA 48 10.904 -8.605 -6.654 328 HA ALA 48 HA ALA 48 8.803 -6.826 -6.088 329 HB1 ALA 48 1HB ALA 48 7.626 -9.534 -6.048 330 HB2 ALA 48 2HB ALA 48 6.879 -7.973 -6.388 331 HB3 ALA 48 3HB ALA 48 7.823 -8.788 -7.635 332 H TRP 49 H TRP 49 8.180 -6.880 -3.911 333 HA TRP 49 HA TRP 49 10.013 -8.352 -2.205 334 HB3 TRP 49 2HB TRP 49 8.201 -6.009 -1.871 335 HD1 TRP 49 HD TRP 49 10.403 -7.139 1.010 336 HE1 TRP 49 1HE TRP 49 8.933 -7.533 3.085 337 HE3 TRP 49 3HE TRP 49 5.795 -6.735 -1.169 338 HZ2 TRP 49 2HZ TRP 49 6.184 -7.656 3.715 339 HZ3 TRP 49 3HZ TRP 49 3.797 -7.005 0.239 340 HH2 TRP 49 HH TRP 49 3.989 -7.457 2.631 341 H THR 50 H THR 50 9.491 -10.005 -0.887 342 HA THR 50 HA THR 50 6.695 -10.931 -0.948 343 HB THR 50 HB THR 50 8.854 -12.789 -0.102 344 HG1 THR 50 1HG THR 50 9.660 -11.677 -2.012 345 HG21 THR 50 3HG2 THR 50 6.343 -13.004 -1.756 346 HG22 THR 50 1HG2 THR 50 6.615 -13.623 -0.128 347 HG23 THR 50 2HG2 THR 50 7.460 -14.344 -1.499 348 H ALA 51 H ALA 51 5.999 -12.171 0.998 349 HA ALA 51 HA ALA 51 6.660 -10.655 3.377 350 HB1 ALA 51 1HB ALA 51 4.791 -11.864 4.405 351 HB2 ALA 51 2HB ALA 51 4.324 -11.105 2.881 352 HB3 ALA 51 3HB ALA 51 4.628 -12.841 2.946 353 H GLN 52 H GLN 52 6.902 -11.862 5.477 354 HA GLN 52 HA GLN 52 8.925 -13.942 5.118 355 HB3 GLN 52 2HB GLN 52 8.204 -12.606 7.717 356 HG3 GLN 52 2HG GLN 52 10.989 -12.982 7.320 357 HE21 GLN 52 1HE2 GLN 52 8.881 -15.460 8.601 358 HE22 GLN 52 2HE2 GLN 52 9.153 -15.102 10.269 359 H SER 53 H SER 53 6.179 -13.317 7.312 360 HA SER 53 HA SER 53 6.004 -16.141 7.947 361 HB3 SER 53 2HB SER 53 3.919 -15.183 9.267 362 HG SER 53 HG SER 53 6.400 -14.264 10.199 363 H ASN 54 H ASN 54 4.671 -13.989 5.684 364 HA ASN 54 HA ASN 54 2.831 -14.057 4.309 365 HB3 ASN 54 2HB ASN 54 4.320 -15.632 3.218 366 HD21 ASN 54 1HD2 ASN 54 5.767 -16.736 4.517 367 HD22 ASN 54 2HD2 ASN 54 5.449 -18.328 5.110 368 H SER 55 H SER 55 1.797 -13.902 6.728 369 HA SER 55 HA SER 55 -0.420 -15.833 6.675 370 HB3 SER 55 2HB SER 55 -0.433 -15.576 9.236 371 HG SER 55 HG SER 55 1.517 -17.071 9.305 372 H ALA 56 H ALA 56 -0.041 -13.040 5.695 373 HA ALA 56 HA ALA 56 -1.464 -11.265 5.425 374 HB1 ALA 56 1HB ALA 56 -3.624 -11.382 6.134 375 HB2 ALA 56 2HB ALA 56 -3.174 -13.077 6.322 376 HB3 ALA 56 3HB ALA 56 -3.186 -12.009 7.725 377 H LYS 57 H LYS 57 -0.949 -12.143 8.833 378 HA LYS 57 HA LYS 57 -1.147 -9.712 10.057 379 HB3 LYS 57 2HB LYS 57 -0.662 -11.854 11.208 380 HG3 LYS 57 2HG LYS 57 2.239 -11.530 11.042 381 HD3 LYS 57 2HD LYS 57 2.089 -14.015 10.878 382 HE3 LYS 57 2HE LYS 57 0.308 -13.074 13.100 383 HZ1 LYS 57 3HZ LYS 57 1.657 -14.629 14.371 384 HZ2 LYS 57 1HZ LYS 57 2.564 -15.003 12.992 385 HZ3 LYS 57 2HZ LYS 57 0.922 -15.404 13.059 386 H GLU 58 H GLU 58 1.436 -10.854 7.994 387 HA GLU 58 HA GLU 58 3.465 -9.080 8.581 388 HB3 GLU 58 2HB GLU 58 3.573 -10.970 6.943 389 HG3 GLU 58 2HG GLU 58 3.150 -9.850 4.517 390 H TRP 59 H TRP 59 4.196 -7.238 7.124 391 HA TRP 59 HA TRP 59 2.173 -5.659 5.850 392 HB3 TRP 59 2HB TRP 59 1.555 -5.094 8.101 393 HD1 TRP 59 HD TRP 59 5.215 -3.769 8.077 394 HE1 TRP 59 1HE TRP 59 6.205 -4.163 10.421 395 HE3 TRP 59 3HE TRP 59 1.222 -6.091 10.268 396 HZ2 TRP 59 2HZ TRP 59 5.400 -5.306 12.872 397 HZ3 TRP 59 3HZ TRP 59 1.413 -6.805 12.614 398 HH2 TRP 59 HH TRP 59 3.461 -6.420 13.888 399 H LEU 60 H LEU 60 3.028 -3.983 4.626 400 HA LEU 60 HA LEU 60 5.972 -3.840 4.590 401 HB3 LEU 60 2HB LEU 60 3.944 -3.789 2.385 402 HG LEU 60 HG LEU 60 5.504 -1.906 1.927 403 HD11 LEU 60 1HD1 LEU 60 7.418 -3.666 2.938 404 HD12 LEU 60 2HD1 LEU 60 7.697 -2.083 2.214 405 HD13 LEU 60 3HD1 LEU 60 7.769 -3.534 1.215 406 HD21 LEU 60 3HD2 LEU 60 5.057 -4.261 0.249 407 HD22 LEU 60 1HD2 LEU 60 6.422 -3.265 -0.257 408 HD23 LEU 60 2HD2 LEU 60 4.816 -2.549 -0.106 409 H GLN 61 H GLN 61 6.930 -1.889 4.717 410 HA GLN 61 HA GLN 61 5.187 0.486 4.668 411 HB3 GLN 61 2HB GLN 61 6.225 1.382 6.534 412 HG3 GLN 61 2HG GLN 61 6.458 -1.580 7.015 413 HE21 GLN 61 1HE2 GLN 61 7.948 -1.743 8.572 414 HE22 GLN 61 2HE2 GLN 61 7.926 -0.862 10.058 415 H VAL 62 H VAL 62 5.956 2.327 3.679 416 HA VAL 62 HA VAL 62 8.564 2.105 2.329 417 HB VAL 62 HB VAL 62 6.475 3.655 0.932 418 HG11 VAL 62 1HG1 VAL 62 8.205 3.571 -0.482 419 HG12 VAL 62 2HG1 VAL 62 8.934 2.198 0.352 420 HG13 VAL 62 3HG1 VAL 62 7.662 1.933 -0.841 421 HG21 VAL 62 3HG2 VAL 62 5.022 1.897 1.407 422 HG22 VAL 62 1HG2 VAL 62 5.704 1.452 -0.157 423 HG23 VAL 62 2HG2 VAL 62 6.302 0.687 1.316 424 H ASP 63 H ASP 63 9.707 3.498 3.583 425 HA ASP 63 HA ASP 63 8.596 6.069 4.333 426 HB3 ASP 63 2HB ASP 63 10.763 6.394 5.493 427 H LEU 64 H LEU 64 8.797 7.863 3.175 428 HA LEU 64 HA LEU 64 10.522 7.867 0.835 429 HB3 LEU 64 2HB LEU 64 9.280 10.341 0.996 430 HG LEU 64 HG LEU 64 9.321 8.441 -0.901 431 HD11 LEU 64 1HD1 LEU 64 7.487 7.263 0.491 432 HD12 LEU 64 2HD1 LEU 64 7.286 7.397 -1.256 433 HD13 LEU 64 3HD1 LEU 64 6.418 8.494 -0.182 434 HD21 LEU 64 3HD2 LEU 64 7.206 9.979 -1.726 435 HD22 LEU 64 1HD2 LEU 64 8.909 10.407 -1.878 436 HD23 LEU 64 2HD2 LEU 64 7.972 10.997 -0.505 437 H GLY 65 H GLY 65 9.915 10.050 3.596 438 HA2 GLY 65 2HA GLY 65 11.397 11.326 4.820 439 HA3 GLY 65 3HA GLY 65 12.713 10.510 3.988 440 H THR 66 H THR 66 10.651 11.688 1.685 441 HA THR 66 HA THR 66 12.315 14.090 1.332 442 HB THR 66 HB THR 66 12.462 12.397 -0.480 443 HG1 THR 66 1HG THR 66 12.049 13.948 -2.169 444 HG21 THR 66 3HG2 THR 66 10.031 12.934 -1.840 445 HG22 THR 66 1HG2 THR 66 9.626 12.408 -0.207 446 HG23 THR 66 2HG2 THR 66 10.628 11.388 -1.239 447 H GLN 67 H GLN 67 9.172 13.025 2.029 448 HA GLN 67 HA GLN 67 7.151 14.056 2.211 449 HB3 GLN 67 2HB GLN 67 8.537 16.707 2.286 450 HG3 GLN 67 2HG GLN 67 6.181 15.466 3.598 451 HE21 GLN 67 1HE2 GLN 67 5.598 15.821 5.630 452 HE22 GLN 67 2HE2 GLN 67 6.429 16.841 6.749 453 H ARG 68 H ARG 68 6.754 13.467 -0.047 454 HA ARG 68 HA ARG 68 6.571 15.851 -1.770 455 HB3 ARG 68 2HB ARG 68 6.549 14.030 -3.645 456 HG3 ARG 68 2HG ARG 68 9.005 14.006 -3.792 457 HD3 ARG 68 2HD ARG 68 8.186 16.738 -2.875 458 HE ARG 68 HE ARG 68 10.216 15.749 -4.615 459 HH11 ARG 68 1HH1 ARG 68 8.048 18.420 -4.076 460 HH12 ARG 68 2HH1 ARG 68 9.054 19.570 -4.893 461 HH21 ARG 68 1HH2 ARG 68 11.548 17.254 -5.692 462 HH22 ARG 68 2HH2 ARG 68 11.044 18.906 -5.813 463 H GLN 69 H GLN 69 4.764 15.868 -3.274 464 HA GLN 69 HA GLN 69 2.361 14.857 -2.004 465 HB3 GLN 69 2HB GLN 69 2.842 16.721 -4.324 466 HG3 GLN 69 2HG GLN 69 0.264 15.592 -3.317 467 HE21 GLN 69 1HE2 GLN 69 -0.030 17.661 -2.098 468 HE22 GLN 69 2HE2 GLN 69 -0.734 18.988 -2.953 469 H VAL 70 H VAL 70 1.522 12.955 -2.508 470 HA VAL 70 HA VAL 70 2.326 11.576 -4.925 471 HB VAL 70 HB VAL 70 1.009 9.691 -4.047 472 HG11 VAL 70 1HG1 VAL 70 2.326 9.416 -1.886 473 HG12 VAL 70 2HG1 VAL 70 3.257 9.704 -3.357 474 HG13 VAL 70 3HG1 VAL 70 2.983 11.019 -2.212 475 HG21 VAL 70 3HG2 VAL 70 0.519 10.741 -1.407 476 HG22 VAL 70 1HG2 VAL 70 -0.344 11.676 -2.628 477 HG23 VAL 70 2HG2 VAL 70 -0.589 9.933 -2.516 478 H THR 71 H THR 71 0.925 10.830 -6.541 479 HA THR 71 HA THR 71 -1.805 11.885 -6.559 480 HB THR 71 HB THR 71 -0.102 12.220 -9.012 481 HG1 THR 71 1HG THR 71 0.852 13.415 -7.257 482 HG21 THR 71 3HG2 THR 71 -1.941 14.238 -8.929 483 HG22 THR 71 1HG2 THR 71 -2.814 12.921 -8.146 484 HG23 THR 71 2HG2 THR 71 -2.163 12.706 -9.771 485 H GLY 72 H GLY 72 -0.307 9.220 -6.467 486 HA2 GLY 72 2HA GLY 72 -2.122 7.566 -7.631 487 HA3 GLY 72 3HA GLY 72 -1.011 7.925 -8.945 488 H ILE 73 H ILE 73 -1.363 5.342 -8.059 489 HA ILE 73 HA ILE 73 1.330 4.736 -7.130 490 HB ILE 73 HB ILE 73 0.602 3.165 -5.432 491 HG13 ILE 73 2HG1 ILE 73 -2.075 3.849 -6.519 492 HG21 ILE 73 1HG2 ILE 73 -0.833 5.723 -4.817 493 HG22 ILE 73 2HG2 ILE 73 0.119 4.699 -3.743 494 HG23 ILE 73 3HG2 ILE 73 0.922 5.671 -4.977 495 HD11 ILE 73 3HD1 ILE 73 -2.124 1.430 -5.125 496 HD12 ILE 73 1HD1 ILE 73 -2.061 1.668 -6.871 497 HD13 ILE 73 2HD1 ILE 73 -0.568 1.481 -5.953 498 H ILE 74 H ILE 74 1.978 2.549 -7.546 499 HA ILE 74 HA ILE 74 0.206 1.039 -9.336 500 HB ILE 74 HB ILE 74 1.624 2.164 -10.873 501 HG13 ILE 74 2HG1 ILE 74 2.803 -0.581 -10.393 502 HG21 ILE 74 1HG2 ILE 74 3.466 3.067 -9.966 503 HG22 ILE 74 2HG2 ILE 74 3.638 1.772 -8.782 504 HG23 ILE 74 3HG2 ILE 74 4.235 1.549 -10.426 505 HD11 ILE 74 3HD1 ILE 74 0.943 -0.576 -12.517 506 HD12 ILE 74 1HD1 ILE 74 0.885 -1.482 -11.006 507 HD13 ILE 74 2HD1 ILE 74 0.149 0.119 -11.103 508 H THR 75 H THR 75 0.258 -1.129 -9.075 509 HA THR 75 HA THR 75 2.353 -2.258 -7.342 510 HB THR 75 HB THR 75 0.297 -1.976 -6.020 511 HG1 THR 75 1HG THR 75 0.679 -3.856 -5.103 512 HG21 THR 75 3HG2 THR 75 -0.933 -3.795 -8.092 513 HG22 THR 75 1HG2 THR 75 -1.358 -2.110 -7.795 514 HG23 THR 75 2HG2 THR 75 -1.691 -3.333 -6.568 515 H GLN 76 H GLN 76 2.750 -4.527 -7.627 516 HA GLN 76 HA GLN 76 1.513 -5.944 -9.799 517 HB3 GLN 76 2HB GLN 76 4.048 -4.506 -10.188 518 HG3 GLN 76 2HG GLN 76 3.803 -7.402 -10.934 519 HE21 GLN 76 1HE2 GLN 76 3.342 -5.890 -13.079 520 HE22 GLN 76 2HE2 GLN 76 4.738 -5.800 -14.093 521 H GLY 77 H GLY 77 1.894 -8.141 -9.722 522 HA2 GLY 77 2HA GLY 77 3.181 -9.069 -7.273 523 HA3 GLY 77 3HA GLY 77 2.139 -10.016 -8.325 524 H ALA 78 H ALA 78 4.189 -11.389 -7.583 525 HA ALA 78 HA ALA 78 5.902 -11.476 -9.951 526 HB1 ALA 78 1HB ALA 78 7.491 -10.424 -8.720 527 HB2 ALA 78 2HB ALA 78 6.818 -10.965 -7.181 528 HB3 ALA 78 3HB ALA 78 7.783 -12.072 -8.160 529 H ARG 79 H ARG 79 7.367 -13.534 -9.757 530 HA ARG 79 HA ARG 79 5.772 -15.726 -8.607 531 HB3 ARG 79 2HB ARG 79 5.452 -15.550 -11.068 532 HG3 ARG 79 2HG ARG 79 7.996 -14.880 -11.354 533 HD3 ARG 79 2HD ARG 79 7.931 -17.871 -11.482 534 HE ARG 79 HE ARG 79 10.217 -16.630 -12.711 535 HH11 ARG 79 1HH1 ARG 79 7.070 -18.018 -13.246 536 HH12 ARG 79 2HH1 ARG 79 7.383 -18.418 -14.902 537 HH21 ARG 79 1HH2 ARG 79 10.643 -17.151 -14.890 538 HH22 ARG 79 2HH2 ARG 79 9.417 -17.925 -15.836 539 H ASP 80 H ASP 80 7.077 -17.807 -8.518 540 HA ASP 80 HA ASP 80 9.783 -17.159 -7.561 541 HB3 ASP 80 2HB ASP 80 9.475 -19.469 -6.397 542 H PHE 81 H PHE 81 7.956 -19.115 -9.767 543 HA PHE 81 HA PHE 81 10.044 -19.671 -11.479 544 HB3 PHE 81 2HB PHE 81 11.189 -21.040 -9.971 545 HD1 PHE 81 1HD PHE 81 7.987 -22.933 -9.987 546 HD2 PHE 81 2HD PHE 81 11.037 -21.084 -7.664 547 HE1 PHE 81 1HE PHE 81 6.975 -23.844 -7.937 548 HE2 PHE 81 2HE PHE 81 10.031 -21.993 -5.611 549 HZ PHE 81 HZ PHE 81 7.997 -23.376 -5.747 550 H GLY 82 H GLY 82 6.999 -20.624 -10.097 551 HA2 GLY 82 2HA GLY 82 5.839 -20.950 -12.697 552 HA3 GLY 82 3HA GLY 82 6.022 -22.484 -11.859 553 H HIS 83 H HIS 83 5.597 -21.195 -9.225 554 HA HIS 83 HA HIS 83 2.714 -21.359 -9.239 555 HB3 HIS 83 2HB HIS 83 3.997 -20.551 -6.727 556 HD1 HIS 83 1HD HIS 83 2.307 -23.548 -8.371 557 HD2 HIS 83 2HD HIS 83 2.145 -21.264 -4.904 558 HE1 HIS 83 1HE HIS 83 0.402 -24.496 -7.030 559 H ILE 84 H ILE 84 3.628 -19.152 -10.691 560 HA ILE 84 HA ILE 84 4.011 -16.724 -9.951 561 HB ILE 84 HB ILE 84 1.402 -17.455 -11.285 562 HG13 ILE 84 2HG1 ILE 84 4.130 -17.617 -12.140 563 HG21 ILE 84 1HG2 ILE 84 2.804 -14.833 -10.910 564 HG22 ILE 84 2HG2 ILE 84 1.727 -15.107 -12.278 565 HG23 ILE 84 3HG2 ILE 84 1.110 -15.239 -10.631 566 HD11 ILE 84 3HD1 ILE 84 3.322 -18.812 -13.916 567 HD12 ILE 84 1HD1 ILE 84 2.026 -19.028 -12.740 568 HD13 ILE 84 2HD1 ILE 84 1.851 -17.847 -14.038 569 H GLN 85 H GLN 85 3.715 -15.579 -8.166 570 HA GLN 85 HA GLN 85 1.257 -15.989 -6.607 571 HB3 GLN 85 2HB GLN 85 2.461 -15.207 -4.682 572 HG3 GLN 85 2HG GLN 85 3.748 -17.293 -6.320 573 HE21 GLN 85 1HE2 GLN 85 5.605 -15.395 -6.230 574 HE22 GLN 85 2HE2 GLN 85 6.849 -15.781 -5.095 575 H TYR 86 H TYR 86 0.331 -14.091 -5.537 576 HA TYR 86 HA TYR 86 0.991 -11.451 -6.246 577 HB3 TYR 86 2HB TYR 86 -1.337 -12.604 -7.795 578 HD1 TYR 86 1HD TYR 86 0.701 -9.614 -6.989 579 HD2 TYR 86 2HD TYR 86 -2.737 -11.128 -8.987 580 HE1 TYR 86 1HE TYR 86 -0.073 -7.314 -7.390 581 HE2 TYR 86 2HE TYR 86 -3.519 -8.832 -9.394 582 HH TYR 86 HH TYR 86 -1.609 -6.165 -9.132 583 H VAL 87 H VAL 87 -0.160 -9.986 -5.054 584 HA VAL 87 HA VAL 87 -1.985 -11.107 -3.082 585 HB VAL 87 HB VAL 87 -1.029 -8.252 -3.230 586 HG11 VAL 87 1HG1 VAL 87 -1.293 -8.713 -0.642 587 HG12 VAL 87 2HG1 VAL 87 -2.672 -8.252 -1.642 588 HG13 VAL 87 3HG1 VAL 87 -2.415 -9.945 -1.217 589 HG21 VAL 87 3HG2 VAL 87 0.348 -10.689 -2.155 590 HG22 VAL 87 1HG2 VAL 87 0.995 -9.406 -3.177 591 HG23 VAL 87 2HG2 VAL 87 0.658 -9.093 -1.474 592 H ALA 88 H ALA 88 -4.029 -10.149 -2.594 593 HA ALA 88 HA ALA 88 -5.263 -8.807 -4.911 594 HB1 ALA 88 1HB ALA 88 -7.414 -9.856 -3.899 595 HB2 ALA 88 2HB ALA 88 -6.321 -10.860 -4.854 596 HB3 ALA 88 3HB ALA 88 -6.286 -10.947 -3.093 597 H SER 89 H SER 89 -6.370 -9.357 -1.581 598 HA SER 89 HA SER 89 -7.306 -6.634 -1.408 599 HB3 SER 89 2HB SER 89 -8.300 -7.277 0.676 600 HG SER 89 HG SER 89 -9.632 -8.689 -0.167 601 H TYR 90 H TYR 90 -6.102 -4.986 -0.772 602 HA TYR 90 HA TYR 90 -4.033 -5.428 1.263 603 HB3 TYR 90 2HB TYR 90 -3.208 -3.405 -0.635 604 HD1 TYR 90 1HD TYR 90 -1.813 -3.606 1.625 605 HD2 TYR 90 2HD TYR 90 -1.713 -6.425 -1.561 606 HE1 TYR 90 1HE TYR 90 0.386 -4.393 2.398 607 HE2 TYR 90 2HE TYR 90 0.485 -7.220 -0.797 608 HH TYR 90 HH TYR 90 1.710 -7.178 1.650 609 H LYS 91 H LYS 91 -3.529 -3.607 2.542 610 HA LYS 91 HA LYS 91 -5.632 -1.551 2.519 611 HB3 LYS 91 2HB LYS 91 -3.967 -1.620 4.903 612 HG3 LYS 91 2HG LYS 91 -6.364 -2.288 5.818 613 HD3 LYS 91 2HD LYS 91 -6.114 0.482 4.725 614 HE3 LYS 91 2HE LYS 91 -7.781 -0.653 6.548 615 HZ1 LYS 91 3HZ LYS 91 -6.924 0.541 8.663 616 HZ2 LYS 91 1HZ LYS 91 -5.397 0.315 7.970 617 HZ3 LYS 91 2HZ LYS 91 -6.378 -1.020 8.310 618 H VAL 92 H VAL 92 -4.746 -0.076 1.098 619 HA VAL 92 HA VAL 92 -2.033 0.828 1.333 620 HB VAL 92 HB VAL 92 -4.323 2.053 -0.212 621 HG11 VAL 92 1HG1 VAL 92 -1.358 2.539 -0.220 622 HG12 VAL 92 2HG1 VAL 92 -2.390 2.979 -1.582 623 HG13 VAL 92 3HG1 VAL 92 -2.662 3.705 0.002 624 HG21 VAL 92 3HG2 VAL 92 -2.905 0.914 -2.118 625 HG22 VAL 92 1HG2 VAL 92 -2.423 -0.160 -0.805 626 HG23 VAL 92 2HG2 VAL 92 -4.128 0.008 -1.228 627 H ALA 93 H ALA 93 -1.357 2.116 2.907 628 HA ALA 93 HA ALA 93 -3.160 4.250 3.849 629 HB1 ALA 93 1HB ALA 93 -2.694 3.840 6.043 630 HB2 ALA 93 2HB ALA 93 -2.551 2.200 5.409 631 HB3 ALA 93 3HB ALA 93 -1.102 3.164 5.696 632 H HIS 94 H HIS 94 -2.278 6.261 4.186 633 HA HIS 94 HA HIS 94 0.564 6.585 3.483 634 HB3 HIS 94 2HB HIS 94 -0.044 8.724 2.382 635 HD1 HIS 94 1HD HIS 94 0.431 8.350 -0.006 636 HD2 HIS 94 2HD HIS 94 -2.159 5.478 1.511 637 HE1 HIS 94 1HE HIS 94 -0.005 6.766 -1.909 638 H SER 95 H SER 95 1.738 8.067 4.646 639 HA SER 95 HA SER 95 0.327 9.440 6.837 640 HB3 SER 95 2HB SER 95 1.906 8.778 8.412 641 HG SER 95 HG SER 95 1.928 6.617 6.570 642 H ASP 96 H ASP 96 0.540 11.562 6.707 643 HA ASP 96 HA ASP 96 2.582 12.740 5.028 644 HB3 ASP 96 2HB ASP 96 0.420 13.721 4.832 645 H ASP 97 H ASP 97 1.646 12.860 8.452 646 HA ASP 97 HA ASP 97 4.087 14.322 9.093 647 HB3 ASP 97 2HB ASP 97 2.228 13.416 11.230 648 H GLY 98 H GLY 98 2.874 11.121 9.080 649 HA2 GLY 98 2HA GLY 98 4.507 9.328 9.264 650 HA3 GLY 98 3HA GLY 98 5.273 10.239 10.557 651 H VAL 99 H VAL 99 2.856 10.942 11.928 652 HA VAL 99 HA VAL 99 2.409 8.418 13.299 653 HB VAL 99 HB VAL 99 1.340 9.723 15.037 654 HG11 VAL 99 1HG1 VAL 99 3.300 10.384 15.888 655 HG12 VAL 99 2HG1 VAL 99 3.997 9.844 14.359 656 HG13 VAL 99 3HG1 VAL 99 3.576 11.541 14.587 657 HG21 VAL 99 3HG2 VAL 99 1.241 12.213 14.821 658 HG22 VAL 99 1HG2 VAL 99 1.627 12.023 13.111 659 HG23 VAL 99 2HG2 VAL 99 0.133 11.345 13.759 660 H GLN 100 H GLN 100 0.754 10.579 11.161 661 HA GLN 100 HA GLN 100 -1.867 9.505 11.727 662 HB3 GLN 100 2HB GLN 100 -2.619 10.964 9.896 663 HG3 GLN 100 2HG GLN 100 -0.669 12.387 11.695 664 HE21 GLN 100 1HE2 GLN 100 -0.351 14.375 11.028 665 HE22 GLN 100 2HE2 GLN 100 -1.504 15.384 10.230 666 H TRP 101 H TRP 101 -3.023 8.077 10.497 667 HA TRP 101 HA TRP 101 -1.592 6.823 8.245 668 HB3 TRP 101 2HB TRP 101 -2.369 4.669 8.913 669 HD1 TRP 101 HD TRP 101 0.250 6.357 9.779 670 HE1 TRP 101 1HE TRP 101 1.466 5.701 11.950 671 HE3 TRP 101 3HE TRP 101 -3.550 3.855 12.112 672 HZ2 TRP 101 2HZ TRP 101 0.890 4.307 14.336 673 HZ3 TRP 101 3HZ TRP 101 -3.135 2.890 14.337 674 HH2 TRP 101 HH TRP 101 -0.960 3.111 15.423 675 H THR 102 H THR 102 -2.670 7.924 6.638 676 HA THR 102 HA THR 102 -5.551 8.084 6.614 677 HB THR 102 HB THR 102 -3.533 8.824 4.487 678 HG1 THR 102 1HG THR 102 -4.819 10.249 6.569 679 HG21 THR 102 3HG2 THR 102 -6.484 9.443 4.673 680 HG22 THR 102 1HG2 THR 102 -5.727 8.351 3.515 681 HG23 THR 102 2HG2 THR 102 -5.375 10.078 3.458 682 H VAL 103 H VAL 103 -6.564 6.176 6.335 683 HA VAL 103 HA VAL 103 -5.602 4.346 4.255 684 HB VAL 103 HB VAL 103 -7.274 2.750 5.239 685 HG11 VAL 103 1HG1 VAL 103 -5.037 3.859 6.915 686 HG12 VAL 103 2HG1 VAL 103 -5.938 2.411 7.371 687 HG13 VAL 103 3HG1 VAL 103 -5.022 2.443 5.864 688 HG21 VAL 103 3HG2 VAL 103 -8.734 4.461 6.254 689 HG22 VAL 103 1HG2 VAL 103 -8.225 3.232 7.411 690 HG23 VAL 103 2HG2 VAL 103 -7.465 4.823 7.423 691 H TYR 104 H TYR 104 -7.681 3.042 3.358 692 HA TYR 104 HA TYR 104 -9.312 5.106 2.057 693 HB3 TYR 104 2HB TYR 104 -9.825 3.194 0.436 694 HD1 TYR 104 1HD TYR 104 -8.701 5.908 0.333 695 HD2 TYR 104 2HD TYR 104 -6.821 2.142 -0.291 696 HE1 TYR 104 1HE TYR 104 -7.022 6.990 -1.102 697 HE2 TYR 104 2HE TYR 104 -5.136 3.215 -1.727 698 HH TYR 104 HH TYR 104 -4.280 5.188 -2.403 699 H GLU 105 H GLU 105 -10.640 5.213 4.029 700 HA GLU 105 HA GLU 105 -12.418 2.924 4.427 701 HB3 GLU 105 2HB GLU 105 -11.453 3.881 6.442 702 HG3 GLU 105 2HG GLU 105 -12.888 6.435 5.754 703 H GLU 106 H GLU 106 -14.707 3.180 4.436 704 HA GLU 106 HA GLU 106 -15.611 5.316 2.629 705 HB3 GLU 106 2HB GLU 106 -17.678 3.565 2.655 706 HG3 GLU 106 2HG GLU 106 -15.227 3.595 0.940 707 H GLN 107 H GLN 107 -16.029 3.925 5.773 708 HA GLN 107 HA GLN 107 -17.689 6.155 6.567 709 HB3 GLN 107 2HB GLN 107 -19.421 4.670 5.822 710 HG3 GLN 107 2HG GLN 107 -18.105 2.567 7.521 711 HE21 GLN 107 1HE2 GLN 107 -19.611 0.839 5.487 712 HE22 GLN 107 2HE2 GLN 107 -21.172 0.646 6.204 713 H GLY 108 H GLY 108 -15.029 4.957 7.156 714 HA2 GLY 108 2HA GLY 108 -13.831 5.251 9.180 715 HA3 GLY 108 3HA GLY 108 -15.320 4.975 10.072 716 H SER 109 H SER 109 -15.741 2.598 8.151 717 HA SER 109 HA SER 109 -14.733 0.621 9.918 718 HB3 SER 109 2HB SER 109 -15.535 -0.976 8.110 719 HG SER 109 HG SER 109 -17.469 -0.747 8.925 720 H SER 110 H SER 110 -13.521 2.091 7.020 721 HA SER 110 HA SER 110 -11.540 1.914 5.916 722 HB3 SER 110 2HB SER 110 -9.647 1.522 7.170 723 HG SER 110 HG SER 110 -10.392 2.831 8.647 724 H LYS 111 H LYS 111 -12.452 0.653 4.264 725 HA LYS 111 HA LYS 111 -12.143 -2.252 4.483 726 HB3 LYS 111 2HB LYS 111 -13.470 -0.665 2.280 727 HG3 LYS 111 2HG LYS 111 -12.771 -3.273 2.189 728 HD3 LYS 111 2HD LYS 111 -14.565 -3.428 4.161 729 HE3 LYS 111 2HE LYS 111 -16.124 -3.338 1.612 730 HZ1 LYS 111 3HZ LYS 111 -17.555 -4.924 2.214 731 HZ2 LYS 111 1HZ LYS 111 -17.494 -4.517 3.855 732 HZ3 LYS 111 2HZ LYS 111 -16.304 -5.517 3.187 733 H VAL 112 H VAL 112 -10.568 -3.319 3.469 734 HA VAL 112 HA VAL 112 -8.489 -1.915 2.128 735 HB VAL 112 HB VAL 112 -7.437 -4.064 1.806 736 HG11 VAL 112 1HG1 VAL 112 -8.322 -3.074 4.311 737 HG12 VAL 112 2HG1 VAL 112 -8.347 -4.837 4.383 738 HG13 VAL 112 3HG1 VAL 112 -6.862 -3.991 3.947 739 HG21 VAL 112 3HG2 VAL 112 -10.061 -5.270 2.679 740 HG22 VAL 112 1HG2 VAL 112 -9.384 -5.324 1.051 741 HG23 VAL 112 2HG2 VAL 112 -8.570 -6.161 2.374 742 H PHE 113 H PHE 113 -7.705 -2.389 -0.044 743 HA PHE 113 HA PHE 113 -9.942 -2.668 -1.922 744 HB3 PHE 113 2HB PHE 113 -7.818 -1.830 -3.433 745 HD1 PHE 113 1HD PHE 113 -9.864 -0.192 -0.773 746 HD2 PHE 113 2HD PHE 113 -8.799 -0.366 -4.890 747 HE1 PHE 113 1HE PHE 113 -11.470 1.608 -1.262 748 HE2 PHE 113 2HE PHE 113 -10.401 1.434 -5.385 749 HZ PHE 113 HZ PHE 113 -11.740 2.424 -3.570 750 H GLN 114 H GLN 114 -9.995 -4.222 -3.465 751 HA GLN 114 HA GLN 114 -7.980 -6.331 -3.262 752 HB3 GLN 114 2HB GLN 114 -10.315 -7.005 -3.013 753 HG3 GLN 114 2HG GLN 114 -11.593 -7.060 -5.307 754 HE21 GLN 114 1HE2 GLN 114 -11.285 -3.736 -4.770 755 HE22 GLN 114 2HE2 GLN 114 -12.586 -3.547 -3.651 756 H GLY 115 H GLY 115 -6.898 -7.172 -5.057 757 HA2 GLY 115 2HA GLY 115 -6.794 -5.323 -7.350 758 HA3 GLY 115 3HA GLY 115 -5.465 -6.340 -6.815 759 H ASN 116 H ASN 116 -5.054 -7.675 -8.461 760 HA ASN 116 HA ASN 116 -7.322 -9.181 -9.591 761 HB3 ASN 116 2HB ASN 116 -4.916 -9.015 -11.267 762 HD21 ASN 116 1HD2 ASN 116 -6.183 -7.431 -13.231 763 HD22 ASN 116 2HD2 ASN 116 -7.523 -8.328 -13.852 764 H LEU 117 H LEU 117 -5.941 -11.054 -11.037 765 HA LEU 117 HA LEU 117 -4.405 -12.489 -8.970 766 HB3 LEU 117 2HB LEU 117 -5.360 -14.548 -9.699 767 HG LEU 117 HG LEU 117 -7.488 -12.456 -9.352 768 HD11 LEU 117 1HD1 LEU 117 -7.763 -15.292 -10.160 769 HD12 LEU 117 2HD1 LEU 117 -8.800 -13.909 -10.501 770 HD13 LEU 117 3HD1 LEU 117 -8.862 -14.689 -8.920 771 HD21 LEU 117 3HD2 LEU 117 -6.964 -12.778 -7.217 772 HD22 LEU 117 1HD2 LEU 117 -5.867 -14.096 -7.628 773 HD23 LEU 117 2HD2 LEU 117 -7.581 -14.424 -7.372 774 H ASP 118 H ASP 118 -3.304 -10.764 -10.975 775 HA ASP 118 HA ASP 118 -1.736 -12.743 -12.489 776 HB3 ASP 118 2HB ASP 118 -1.511 -10.867 -14.241 777 H ASN 119 H ASN 119 0.443 -12.459 -12.509 778 HA ASN 119 HA ASN 119 1.492 -10.412 -10.710 779 HB3 ASN 119 2HB ASN 119 2.089 -12.918 -10.582 780 HD21 ASN 119 1HD2 ASN 119 5.120 -12.525 -11.432 781 HD22 ASN 119 2HD2 ASN 119 5.152 -13.320 -12.966 782 H ASN 120 H ASN 120 1.690 -11.473 -14.054 783 HA ASN 120 HA ASN 120 3.784 -9.653 -14.767 784 HB3 ASN 120 2HB ASN 120 3.385 -10.371 -17.044 785 HD21 ASN 120 1HD2 ASN 120 5.248 -11.260 -15.659 786 HD22 ASN 120 2HD2 ASN 120 5.270 -12.977 -15.464 787 H SER 121 H SER 121 0.325 -9.515 -14.580 788 HA SER 121 HA SER 121 0.095 -7.150 -16.224 789 HB3 SER 121 2HB SER 121 -2.286 -7.202 -15.556 790 HG SER 121 HG SER 121 -1.280 -9.767 -16.245 791 H HIS 122 H HIS 122 0.314 -5.121 -15.559 792 HA HIS 122 HA HIS 122 0.860 -4.573 -12.776 793 HB3 HIS 122 2HB HIS 122 2.085 -3.541 -14.768 794 HD1 HIS 122 1HD HIS 122 -0.718 -3.677 -16.192 795 HD2 HIS 122 2HD HIS 122 1.249 -0.204 -15.040 796 HE1 HIS 122 1HE HIS 122 -1.642 -1.860 -17.666 797 H LYS 123 H LYS 123 -0.243 -2.988 -11.515 798 HA LYS 123 HA LYS 123 -2.966 -2.339 -12.404 799 HB3 LYS 123 2HB LYS 123 -2.236 -3.482 -9.701 800 HG3 LYS 123 2HG LYS 123 -4.128 -1.790 -9.738 801 HD3 LYS 123 2HD LYS 123 -5.899 -3.916 -10.769 802 HE3 LYS 123 2HE LYS 123 -6.135 -1.159 -11.730 803 HZ1 LYS 123 3HZ LYS 123 -7.794 -3.284 -11.313 804 HZ2 LYS 123 1HZ LYS 123 -8.272 -1.710 -11.707 805 HZ3 LYS 123 2HZ LYS 123 -8.227 -2.200 -10.089 806 H LYS 124 H LYS 124 -2.632 -0.183 -12.656 807 HA LYS 124 HA LYS 124 -1.359 1.327 -10.504 808 HB3 LYS 124 2HB LYS 124 -2.322 2.216 -13.231 809 HG3 LYS 124 2HG LYS 124 -0.557 3.677 -11.275 810 HD3 LYS 124 2HD LYS 124 0.023 4.058 -13.636 811 HE3 LYS 124 2HE LYS 124 -2.913 4.498 -13.829 812 HZ1 LYS 124 3HZ LYS 124 -2.107 5.643 -16.077 813 HZ2 LYS 124 1HZ LYS 124 -0.899 6.212 -15.038 814 HZ3 LYS 124 2HZ LYS 124 -2.525 6.527 -14.696 815 H ASN 125 H ASN 125 -2.549 2.174 -8.939 816 HA ASN 125 HA ASN 125 -5.423 2.472 -9.303 817 HB3 ASN 125 2HB ASN 125 -5.530 2.756 -6.902 818 HD21 ASN 125 1HD2 ASN 125 -4.257 1.176 -5.184 819 HD22 ASN 125 2HD2 ASN 125 -4.192 -0.452 -5.759 820 H ILE 126 H ILE 126 -6.463 4.368 -9.485 821 HA ILE 126 HA ILE 126 -5.237 6.689 -10.295 822 HB ILE 126 HB ILE 126 -7.730 6.078 -10.357 823 HG13 ILE 126 2HG1 ILE 126 -6.386 8.426 -10.737 824 HG21 ILE 126 1HG2 ILE 126 -8.181 7.769 -8.001 825 HG22 ILE 126 2HG2 ILE 126 -9.045 6.335 -8.553 826 HG23 ILE 126 3HG2 ILE 126 -7.538 6.164 -7.653 827 HD11 ILE 126 3HD1 ILE 126 -9.230 8.870 -11.056 828 HD12 ILE 126 1HD1 ILE 126 -7.949 8.805 -12.266 829 HD13 ILE 126 2HD1 ILE 126 -8.711 7.316 -11.708 830 H PHE 127 H PHE 127 -5.253 8.840 -9.202 831 HA PHE 127 HA PHE 127 -3.533 9.001 -7.106 832 HB3 PHE 127 2HB PHE 127 -3.943 11.022 -8.197 833 HD1 PHE 127 2HD PHE 127 -7.121 11.289 -6.393 834 HD2 PHE 127 1HD PHE 127 -5.257 10.866 -10.196 835 HE1 PHE 127 2HE PHE 127 -9.253 11.831 -7.495 836 HE2 PHE 127 1HE PHE 127 -7.386 11.408 -11.304 837 HZ PHE 127 HZ PHE 127 -9.388 11.890 -9.953 838 H GLU 128 H GLU 128 -7.071 8.910 -6.888 839 HA GLU 128 HA GLU 128 -8.477 8.365 -5.183 840 HB3 GLU 128 2HB GLU 128 -6.954 7.227 -3.176 841 HG3 GLU 128 2HG GLU 128 -8.727 6.320 -5.225 842 H LYS 129 H LYS 129 -5.558 8.903 -3.237 843 HA LYS 129 HA LYS 129 -6.829 11.314 -2.119 844 HB3 LYS 129 2HB LYS 129 -5.505 10.529 0.031 845 HG3 LYS 129 2HG LYS 129 -7.537 8.981 0.590 846 HD3 LYS 129 2HD LYS 129 -7.821 11.923 -0.022 847 HE3 LYS 129 2HE LYS 129 -9.826 10.140 0.668 848 HZ1 LYS 129 3HZ LYS 129 -10.138 10.122 2.863 849 HZ2 LYS 129 1HZ LYS 129 -9.688 11.741 3.055 850 HZ3 LYS 129 2HZ LYS 129 -8.504 10.536 2.988 851 HA PRO 130 HA PRO 130 -2.535 12.220 -3.671 852 HB3 PRO 130 2HB PRO 130 -3.316 12.855 -5.737 853 HG3 PRO 130 2HG PRO 130 -5.521 13.535 -6.028 854 HD3 PRO 130 2HD PRO 130 -5.862 11.563 -4.884 855 H PHE 131 H PHE 131 -1.175 13.430 -2.497 856 HA PHE 131 HA PHE 131 -1.476 16.018 -1.636 857 HB3 PHE 131 2HB PHE 131 -1.815 14.957 0.945 858 HD1 PHE 131 1HD PHE 131 -1.574 17.622 0.021 859 HD2 PHE 131 2HD PHE 131 -5.078 15.218 0.276 860 HE1 PHE 131 1HE PHE 131 -2.952 19.653 0.188 861 HE2 PHE 131 2HE PHE 131 -6.461 17.245 0.442 862 HZ PHE 131 HZ PHE 131 -5.399 19.467 0.396 863 H MET 132 H MET 132 -0.018 16.501 0.360 864 HA MET 132 HA MET 132 2.543 15.474 -0.203 865 HB3 MET 132 2HB MET 132 2.286 17.690 0.721 866 HG3 MET 132 2HG MET 132 1.743 16.859 3.470 867 HE1 MET 132 3HE MET 132 0.641 20.182 0.646 868 HE2 MET 132 1HE MET 132 0.418 18.448 0.409 869 HE3 MET 132 2HE MET 132 -0.842 19.398 1.195 870 H ALA 133 H ALA 133 3.671 13.808 0.607 871 HA ALA 133 HA ALA 133 2.740 12.495 3.052 872 HB1 ALA 133 1HB ALA 133 2.441 11.427 0.398 873 HB2 ALA 133 2HB ALA 133 3.479 10.389 1.374 874 HB3 ALA 133 3HB ALA 133 1.856 10.791 1.936 875 H ARG 134 H ARG 134 4.334 11.412 4.205 876 HA ARG 134 HA ARG 134 7.082 11.864 3.244 877 HB3 ARG 134 2HB ARG 134 7.014 11.379 6.059 878 HG3 ARG 134 2HG ARG 134 7.781 13.784 6.155 879 HD3 ARG 134 2HD ARG 134 9.944 13.306 5.263 880 HE ARG 134 HE ARG 134 9.283 10.584 5.933 881 HH11 ARG 134 1HH1 ARG 134 9.801 13.805 7.149 882 HH12 ARG 134 2HH1 ARG 134 10.196 13.278 8.751 883 HH21 ARG 134 1HH2 ARG 134 9.802 9.877 8.040 884 HH22 ARG 134 2HH2 ARG 134 10.198 11.043 9.256 885 H TYR 135 H TYR 135 4.826 9.567 4.556 886 HA TYR 135 HA TYR 135 6.493 7.373 3.755 887 HB3 TYR 135 2HB TYR 135 6.610 8.285 6.485 888 HD1 TYR 135 2HD TYR 135 6.410 4.694 5.549 889 HD2 TYR 135 1HD TYR 135 4.945 7.798 8.062 890 HE1 TYR 135 2HE TYR 135 5.173 3.031 6.871 891 HE2 TYR 135 1HE TYR 135 3.704 6.143 9.394 892 HH TYR 135 HH TYR 135 4.124 3.416 9.791 893 H VAL 136 H VAL 136 5.233 5.755 3.091 894 HA VAL 136 HA VAL 136 2.422 5.741 3.976 895 HB VAL 136 HB VAL 136 1.768 4.868 1.877 896 HG11 VAL 136 1HG1 VAL 136 2.224 7.267 1.868 897 HG12 VAL 136 2HG1 VAL 136 3.887 6.955 1.369 898 HG13 VAL 136 3HG1 VAL 136 2.551 6.552 0.290 899 HG21 VAL 136 3HG2 VAL 136 4.705 4.465 1.328 900 HG22 VAL 136 1HG2 VAL 136 3.468 3.222 1.514 901 HG23 VAL 136 2HG2 VAL 136 3.439 4.292 0.113 902 H ARG 137 H ARG 137 1.445 3.807 4.533 903 HA ARG 137 HA ARG 137 3.220 1.468 4.748 904 HB3 ARG 137 2HB ARG 137 1.103 1.966 6.799 905 HG3 ARG 137 2HG ARG 137 3.813 0.994 7.470 906 HD3 ARG 137 2HD ARG 137 1.213 -0.258 8.235 907 HE ARG 137 HE ARG 137 3.876 -0.272 9.309 908 HH11 ARG 137 1HH1 ARG 137 0.500 -0.706 10.037 909 HH12 ARG 137 2HH1 ARG 137 0.791 -1.718 11.413 910 HH21 ARG 137 1HH2 ARG 137 4.274 -1.604 11.119 911 HH22 ARG 137 2HH2 ARG 137 2.939 -2.226 12.028 912 H VAL 138 H VAL 138 2.356 -0.483 4.222 913 HA VAL 138 HA VAL 138 -0.501 -0.539 3.498 914 HB VAL 138 HB VAL 138 0.349 -2.348 1.792 915 HG11 VAL 138 1HG1 VAL 138 -0.773 -0.619 0.810 916 HG12 VAL 138 2HG1 VAL 138 0.235 0.614 1.568 917 HG13 VAL 138 3HG1 VAL 138 0.848 -0.305 0.192 918 HG21 VAL 138 3HG2 VAL 138 2.777 -0.578 2.072 919 HG22 VAL 138 1HG2 VAL 138 2.683 -2.276 2.541 920 HG23 VAL 138 2HG2 VAL 138 2.530 -1.819 0.845 921 H LEU 139 H LEU 139 -1.634 -2.410 3.942 922 HA LEU 139 HA LEU 139 -0.182 -4.548 5.343 923 HB3 LEU 139 2HB LEU 139 -2.631 -3.062 6.229 924 HG LEU 139 HG LEU 139 -3.168 -5.476 6.463 925 HD11 LEU 139 1HD1 LEU 139 -1.470 -6.838 6.933 926 HD12 LEU 139 2HD1 LEU 139 -1.626 -6.283 8.599 927 HD13 LEU 139 3HD1 LEU 139 -0.462 -5.515 7.520 928 HD21 LEU 139 3HD2 LEU 139 -3.780 -3.562 8.115 929 HD22 LEU 139 1HD2 LEU 139 -2.660 -4.388 9.199 930 HD23 LEU 139 2HD2 LEU 139 -4.072 -5.240 8.574 931 HA PRO 140 HA PRO 140 -2.442 -6.833 2.226 932 HB3 PRO 140 2HB PRO 140 -0.474 -7.946 1.815 933 HG3 PRO 140 2HG PRO 140 1.112 -8.236 3.491 934 HD3 PRO 140 2HD PRO 140 0.733 -5.971 3.690 935 H VAL 141 H VAL 141 -4.242 -8.103 2.277 936 HA VAL 141 HA VAL 141 -5.003 -9.274 4.872 937 HB VAL 141 HB VAL 141 -6.848 -7.862 2.938 938 HG11 VAL 141 1HG1 VAL 141 -8.358 -9.268 3.828 939 HG12 VAL 141 2HG1 VAL 141 -7.315 -9.693 5.185 940 HG13 VAL 141 3HG1 VAL 141 -8.261 -8.205 5.230 941 HG21 VAL 141 3HG2 VAL 141 -5.745 -6.148 4.048 942 HG22 VAL 141 1HG2 VAL 141 -7.171 -6.404 5.053 943 HG23 VAL 141 2HG2 VAL 141 -5.612 -7.067 5.547 944 H SER 142 H SER 142 -5.424 -9.356 1.360 945 HA SER 142 HA SER 142 -5.875 -12.250 1.554 946 HB3 SER 142 2HB SER 142 -7.753 -12.243 0.166 947 HG SER 142 HG SER 142 -8.606 -11.378 1.947 948 H TRP 143 H TRP 143 -4.344 -13.246 0.443 949 HA TRP 143 HA TRP 143 -3.338 -11.976 -2.019 950 HB3 TRP 143 2HB TRP 143 -1.666 -11.912 -0.200 951 HD1 TRP 143 HD TRP 143 -0.489 -15.362 -1.036 952 HE1 TRP 143 1HE TRP 143 -0.516 -16.831 1.077 953 HE3 TRP 143 3HE TRP 143 -3.124 -12.272 2.069 954 HZ2 TRP 143 2HZ TRP 143 -1.522 -16.699 3.710 955 HZ3 TRP 143 3HZ TRP 143 -3.577 -13.018 4.369 956 HH2 TRP 143 HH TRP 143 -2.792 -15.186 5.172 957 H HIS 144 H HIS 144 -1.993 -13.796 -3.272 958 HA HIS 144 HA HIS 144 -3.591 -16.263 -3.314 959 HB3 HIS 144 2HB HIS 144 -2.758 -15.553 -5.977 960 HD1 HIS 144 1HD HIS 144 -4.408 -16.611 -7.514 961 HD2 HIS 144 2HD HIS 144 -5.989 -15.939 -3.731 962 HE1 HIS 144 1HE HIS 144 -6.671 -17.708 -7.526 963 H ASN 145 H ASN 145 -2.337 -17.989 -3.134 964 HA ASN 145 HA ASN 145 -0.600 -19.443 -3.464 965 HB3 ASN 145 2HB ASN 145 0.941 -19.134 -5.204 966 HD21 ASN 145 1HD2 ASN 145 -1.347 -20.067 -5.679 967 HD22 ASN 145 2HD2 ASN 145 -2.184 -19.293 -6.977 968 H ARG 146 H ARG 146 0.662 -16.112 -3.235 969 HA ARG 146 HA ARG 146 1.662 -16.452 -0.617 970 HB3 ARG 146 2HB ARG 146 4.068 -16.054 -2.166 971 HG3 ARG 146 2HG ARG 146 4.696 -18.210 -0.883 972 HD3 ARG 146 2HD ARG 146 3.901 -15.936 0.893 973 HE ARG 146 HE ARG 146 5.403 -17.089 2.159 974 HH11 ARG 146 1HH1 ARG 146 6.484 -17.132 -1.149 975 HH12 ARG 146 2HH1 ARG 146 7.980 -17.928 -0.787 976 HH21 ARG 146 1HH2 ARG 146 7.369 -18.137 2.649 977 HH22 ARG 146 2HH2 ARG 146 8.481 -18.500 1.374 978 H ILE 147 H ILE 147 2.555 -14.540 0.234 979 HA ILE 147 HA ILE 147 1.670 -12.155 -1.045 980 HB ILE 147 HB ILE 147 3.432 -12.487 1.387 981 HG13 ILE 147 2HG1 ILE 147 0.471 -12.427 0.955 982 HG21 ILE 147 1HG2 ILE 147 3.790 -10.294 1.067 983 HG22 ILE 147 2HG2 ILE 147 2.436 -10.134 -0.050 984 HG23 ILE 147 3HG2 ILE 147 2.151 -10.110 1.689 985 HD11 ILE 147 3HD1 ILE 147 2.406 -14.110 2.400 986 HD12 ILE 147 1HD1 ILE 147 0.859 -13.835 3.199 987 HD13 ILE 147 2HD1 ILE 147 0.904 -14.542 1.584 988 H THR 148 H THR 148 2.905 -12.416 -3.053 989 HA THR 148 HA THR 148 5.611 -11.288 -2.780 990 HB THR 148 HB THR 148 4.999 -12.986 -5.150 991 HG1 THR 148 1HG THR 148 4.370 -14.406 -3.572 992 HG21 THR 148 3HG2 THR 148 7.490 -13.622 -4.298 993 HG22 THR 148 1HG2 THR 148 7.345 -11.978 -3.679 994 HG23 THR 148 2HG2 THR 148 7.135 -12.293 -5.401 995 H LEU 149 H LEU 149 5.203 -9.199 -3.291 996 HA LEU 149 HA LEU 149 4.621 -8.578 -6.031 997 HB3 LEU 149 2HB LEU 149 2.376 -8.892 -4.789 998 HG LEU 149 HG LEU 149 3.009 -6.085 -3.873 999 HD11 LEU 149 1HD1 LEU 149 0.826 -5.750 -4.131 1000 HD12 LEU 149 2HD1 LEU 149 0.587 -6.896 -2.813 1001 HD13 LEU 149 3HD1 LEU 149 0.529 -7.453 -4.485 1002 HD21 LEU 149 3HD2 LEU 149 2.290 -7.208 -1.642 1003 HD22 LEU 149 1HD2 LEU 149 3.940 -7.416 -2.231 1004 HD23 LEU 149 2HD2 LEU 149 2.756 -8.703 -2.454 1005 H ARG 150 H ARG 150 4.221 -5.966 -6.042 1006 HA ARG 150 HA ARG 150 6.059 -4.716 -4.142 1007 HB3 ARG 150 2HB ARG 150 7.297 -5.472 -6.238 1008 HG3 ARG 150 2HG ARG 150 6.429 -3.040 -7.632 1009 HD3 ARG 150 2HD ARG 150 6.480 -5.519 -9.118 1010 HE ARG 150 HE ARG 150 7.429 -2.901 -9.471 1011 HH11 ARG 150 1HH1 ARG 150 8.262 -6.185 -10.269 1012 HH12 ARG 150 2HH1 ARG 150 9.103 -5.757 -11.723 1013 HH21 ARG 150 1HH2 ARG 150 8.532 -2.325 -11.384 1014 HH22 ARG 150 2HH2 ARG 150 9.256 -3.561 -12.355 1015 H LEU 151 H LEU 151 5.479 -2.692 -3.583 1016 HA LEU 151 HA LEU 151 3.324 -1.417 -5.138 1017 HB3 LEU 151 2HB LEU 151 3.464 -0.614 -2.350 1018 HG LEU 151 HG LEU 151 1.394 -1.099 -4.294 1019 HD11 LEU 151 1HD1 LEU 151 1.091 -2.409 -1.604 1020 HD12 LEU 151 2HD1 LEU 151 0.880 -3.133 -3.198 1021 HD13 LEU 151 3HD1 LEU 151 -0.278 -1.939 -2.612 1022 HD21 LEU 151 3HD2 LEU 151 1.822 0.452 -1.796 1023 HD22 LEU 151 1HD2 LEU 151 0.165 0.202 -2.346 1024 HD23 LEU 151 2HD2 LEU 151 1.333 0.999 -3.401 1025 H GLU 152 H GLU 152 3.729 0.569 -5.862 1026 HA GLU 152 HA GLU 152 5.815 2.161 -4.536 1027 HB3 GLU 152 2HB GLU 152 6.435 2.969 -6.880 1028 HG3 GLU 152 2HG GLU 152 7.005 0.076 -6.274 1029 H LEU 153 H LEU 153 5.480 4.361 -4.479 1030 HA LEU 153 HA LEU 153 2.830 5.255 -5.397 1031 HB3 LEU 153 2HB LEU 153 3.084 5.301 -2.986 1032 HG LEU 153 HG LEU 153 5.567 6.865 -3.516 1033 HD11 LEU 153 1HD1 LEU 153 5.039 8.495 -2.111 1034 HD12 LEU 153 2HD1 LEU 153 4.867 7.294 -0.830 1035 HD13 LEU 153 3HD1 LEU 153 3.466 7.765 -1.790 1036 HD21 LEU 153 3HD2 LEU 153 5.880 5.601 -1.160 1037 HD22 LEU 153 1HD2 LEU 153 6.236 4.864 -2.723 1038 HD23 LEU 153 2HD2 LEU 153 4.696 4.540 -1.926 1039 H LEU 154 H LEU 154 2.640 7.034 -6.662 1040 HA LEU 154 HA LEU 154 5.126 8.447 -7.374 1041 HB3 LEU 154 2HB LEU 154 4.560 8.469 -9.615 1042 HG LEU 154 HG LEU 154 4.785 6.011 -8.668 1043 HD11 LEU 154 1HD1 LEU 154 2.030 6.310 -8.611 1044 HD12 LEU 154 2HD1 LEU 154 2.930 4.797 -8.505 1045 HD13 LEU 154 3HD1 LEU 154 2.336 5.362 -10.067 1046 HD21 LEU 154 3HD2 LEU 154 4.335 7.145 -11.326 1047 HD22 LEU 154 1HD2 LEU 154 4.010 5.414 -11.217 1048 HD23 LEU 154 2HD2 LEU 154 5.592 6.046 -10.756 1049 H GLY 155 H GLY 155 4.973 10.669 -7.831 1050 HA2 GLY 155 2HA GLY 155 2.469 11.919 -6.876 1051 HA3 GLY 155 3HA GLY 155 4.064 12.569 -6.529 1052 H CYS 156 H CYS 156 2.560 14.395 -7.517 1053 HA CYS 156 HA CYS 156 2.790 14.411 -10.436 1054 HB3 CYS 156 2HB CYS 156 1.588 16.797 -9.651 1055 H LEU 157 H LEU 157 4.194 15.764 -7.596 1056 HA LEU 157 HA LEU 157 5.913 17.210 -7.246 1057 HB3 LEU 157 2HB LEU 157 6.799 17.258 -10.047 1058 HG LEU 157 HG LEU 157 8.935 16.524 -9.194 1059 HD11 LEU 157 1HD1 LEU 157 8.350 18.906 -9.015 1060 HD12 LEU 157 2HD1 LEU 157 9.457 18.389 -7.744 1061 HD13 LEU 157 3HD1 LEU 157 7.747 18.621 -7.382 1062 HD21 LEU 157 3HD2 LEU 157 7.798 16.438 -6.421 1063 HD22 LEU 157 1HD2 LEU 157 9.336 15.809 -7.009 1064 HD23 LEU 157 2HD2 LEU 157 7.829 15.003 -7.447 1065 H GLU 158 H GLU 158 3.347 18.270 -8.030 1066 HA GLU 158 HA GLU 158 3.678 20.407 -9.874 1067 HB3 GLU 158 2HB GLU 158 1.631 20.208 -7.663 1068 HG3 GLU 158 2HG GLU 158 0.620 21.168 -10.148 Start of MODEL 18 1 H1 MET -5 H MET -5 13.217 24.951 -5.753 2 HA MET -5 HA MET -5 14.687 23.683 -7.079 3 HB3 MET -5 2HB MET -5 15.646 21.557 -6.129 4 HG3 MET -5 2HG MET -5 16.228 24.223 -4.942 5 HE1 MET -5 3HE MET -5 16.261 23.347 -1.815 6 HE2 MET -5 1HE MET -5 17.872 24.057 -1.918 7 HE3 MET -5 2HE MET -5 16.578 24.652 -2.959 8 H LYS -4 H LYS -4 12.242 23.711 -7.702 9 HA LYS -4 HA LYS -4 11.462 20.908 -8.075 10 HB3 LYS -4 2HB LYS -4 10.006 21.558 -6.326 11 HG3 LYS -4 2HG LYS -4 8.528 23.741 -7.310 12 HD3 LYS -4 2HD LYS -4 10.550 24.111 -5.163 13 HE3 LYS -4 2HE LYS -4 7.957 25.127 -5.904 14 HZ1 LYS -4 3HZ LYS -4 8.234 23.971 -3.194 15 HZ2 LYS -4 1HZ LYS -4 6.963 23.771 -4.292 16 HZ3 LYS -4 2HZ LYS -4 7.187 25.259 -3.520 17 H SER -3 H SER -3 11.097 20.453 -10.143 18 HA SER -3 HA SER -3 9.701 22.120 -11.939 19 HB3 SER -3 2HB SER -3 11.343 23.524 -12.567 20 HG SER -3 HG SER -3 13.668 22.595 -12.063 21 H GLY -2 H GLY -2 9.527 21.192 -14.081 22 HA2 GLY -2 2HA GLY -2 10.567 19.216 -15.403 23 HA3 GLY -2 3HA GLY -2 10.021 18.296 -14.010 24 H HIS -1 H HIS -1 9.264 18.404 -16.965 25 HA HIS -1 HA HIS -1 6.420 19.052 -16.745 26 HB3 HIS -1 2HB HIS -1 6.856 18.132 -19.321 27 HD1 HIS -1 1HD HIS -1 6.998 21.201 -17.150 28 HD2 HIS -1 2HD HIS -1 5.927 20.112 -21.014 29 HE1 HIS -1 1HE HIS -1 5.839 23.212 -18.119 30 H GLY 0 H GLY 0 4.782 17.551 -17.219 31 HA2 GLY 0 2HA GLY 0 3.883 15.429 -17.626 32 HA3 GLY 0 3HA GLY 0 5.510 14.765 -17.630 33 H CYS 1 H CYS 1 2.703 14.605 -16.044 34 HA CYS 1 HA CYS 1 3.704 14.617 -13.328 35 HB3 CYS 1 2HB CYS 1 1.244 13.490 -13.132 36 H SER 2 H SER 2 2.728 12.565 -12.031 37 HA SER 2 HA SER 2 3.008 10.368 -11.508 38 HB3 SER 2 2HB SER 2 3.274 9.621 -14.397 39 HG SER 2 HG SER 2 2.174 7.851 -13.716 40 H GLU 3 H GLU 3 5.150 11.289 -10.816 41 HA GLU 3 HA GLU 3 7.374 10.223 -12.413 42 HB3 GLU 3 2HB GLU 3 7.369 12.659 -11.763 43 HG3 GLU 3 2HG GLU 3 6.905 11.638 -9.181 44 HA PRO 4 HA PRO 4 8.219 7.041 -9.510 45 HB3 PRO 4 2HB PRO 4 9.830 6.304 -10.974 46 HG3 PRO 4 2HG PRO 4 11.122 7.806 -12.190 47 HD3 PRO 4 2HD PRO 4 9.020 8.640 -12.636 48 H LEU 5 H LEU 5 10.283 6.615 -7.848 49 HA LEU 5 HA LEU 5 10.364 8.997 -6.114 50 HB3 LEU 5 2HB LEU 5 8.912 7.576 -4.992 51 HG LEU 5 HG LEU 5 9.463 5.168 -4.454 52 HD11 LEU 5 1HD1 LEU 5 9.059 5.169 -7.350 53 HD12 LEU 5 2HD1 LEU 5 8.008 6.280 -6.473 54 HD13 LEU 5 3HD1 LEU 5 8.024 4.565 -6.056 55 HD21 LEU 5 3HD2 LEU 5 11.014 3.977 -5.744 56 HD22 LEU 5 1HD2 LEU 5 11.863 5.452 -5.280 57 HD23 LEU 5 2HD2 LEU 5 11.194 5.294 -6.905 58 H GLY 6 H GLY 6 12.196 7.168 -8.041 59 HA2 GLY 6 2HA GLY 6 14.649 8.076 -7.050 60 HA3 GLY 6 3HA GLY 6 14.417 6.435 -6.463 61 H LEU 7 H LEU 7 13.245 7.608 -9.558 62 HA LEU 7 HA LEU 7 15.340 6.052 -10.913 63 HB3 LEU 7 2HB LEU 7 13.748 5.103 -12.426 64 HG LEU 7 HG LEU 7 12.921 4.758 -9.563 65 HD11 LEU 7 1HD1 LEU 7 11.562 3.745 -12.025 66 HD12 LEU 7 2HD1 LEU 7 10.859 4.380 -10.537 67 HD13 LEU 7 3HD1 LEU 7 11.585 2.773 -10.553 68 HD21 LEU 7 3HD2 LEU 7 13.879 2.570 -9.842 69 HD22 LEU 7 1HD2 LEU 7 15.043 3.775 -10.393 70 HD23 LEU 7 2HD2 LEU 7 14.113 2.847 -11.569 71 H LYS 8 H LYS 8 14.541 8.998 -10.423 72 HA LYS 8 HA LYS 8 15.087 9.844 -13.169 73 HB3 LYS 8 2HB LYS 8 12.864 10.959 -11.450 74 HG3 LYS 8 2HG LYS 8 14.340 12.198 -13.600 75 HD3 LYS 8 2HD LYS 8 11.350 12.149 -13.939 76 HE3 LYS 8 2HE LYS 8 13.658 13.264 -15.510 77 HZ1 LYS 8 3HZ LYS 8 10.854 13.210 -16.456 78 HZ2 LYS 8 1HZ LYS 8 11.987 12.048 -16.934 79 HZ3 LYS 8 2HZ LYS 8 12.237 13.678 -17.310 80 H ASN 9 H ASN 9 14.226 11.607 -10.205 81 HA ASN 9 HA ASN 9 16.904 12.838 -10.274 82 HB3 ASN 9 2HB ASN 9 15.276 14.592 -8.864 83 HD21 ASN 9 1HD2 ASN 9 15.668 16.617 -9.559 84 HD22 ASN 9 2HD2 ASN 9 16.498 16.998 -11.027 85 H ASN 10 H ASN 10 14.359 11.465 -8.309 86 HA ASN 10 HA ASN 10 15.289 12.085 -5.761 87 HB3 ASN 10 2HB ASN 10 14.186 9.781 -5.191 88 HD21 ASN 10 1HD2 ASN 10 13.189 12.491 -7.228 89 HD22 ASN 10 2HD2 ASN 10 11.845 12.961 -6.248 90 H THR 11 H THR 11 16.051 9.275 -7.801 91 HA THR 11 HA THR 11 17.689 7.690 -7.664 92 HB THR 11 HB THR 11 19.911 8.487 -7.478 93 HG1 THR 11 1HG THR 11 18.962 10.851 -6.214 94 HG21 THR 11 3HG2 THR 11 18.039 9.793 -9.057 95 HG22 THR 11 1HG2 THR 11 19.790 9.830 -9.261 96 HG23 THR 11 2HG2 THR 11 18.982 11.096 -8.337 97 H ILE 12 H ILE 12 15.986 7.552 -5.504 98 HA ILE 12 HA ILE 12 17.577 7.378 -3.082 99 HB ILE 12 HB ILE 12 14.674 6.721 -3.590 100 HG13 ILE 12 2HG1 ILE 12 14.195 8.781 -2.425 101 HG21 ILE 12 1HG2 ILE 12 16.168 6.835 -0.974 102 HG22 ILE 12 2HG2 ILE 12 14.442 6.542 -1.179 103 HG23 ILE 12 3HG2 ILE 12 15.612 5.365 -1.775 104 HD11 ILE 12 3HD1 ILE 12 16.490 10.229 -2.198 105 HD12 ILE 12 1HD1 ILE 12 15.634 9.455 -0.863 106 HD13 ILE 12 2HD1 ILE 12 16.998 8.639 -1.630 107 HA PRO 13 HA PRO 13 18.670 3.138 -3.725 108 HB3 PRO 13 2HB PRO 13 20.480 3.572 -2.377 109 HG3 PRO 13 2HG PRO 13 20.339 5.105 -0.636 110 HD3 PRO 13 2HD PRO 13 19.464 6.372 -2.351 111 H ASP 14 H ASP 14 18.499 1.115 -1.987 112 HA ASP 14 HA ASP 14 15.638 0.701 -1.776 113 HB3 ASP 14 2HB ASP 14 16.821 -1.136 -2.703 114 H SER 15 H SER 15 16.221 2.628 -0.025 115 HA SER 15 HA SER 15 16.164 1.263 2.586 116 HB3 SER 15 2HB SER 15 17.035 4.117 2.374 117 HG SER 15 HG SER 15 18.505 2.625 3.988 118 H GLN 16 H GLN 16 14.204 2.571 0.453 119 HA GLN 16 HA GLN 16 12.755 4.416 2.151 120 HB3 GLN 16 2HB GLN 16 12.895 4.872 -0.241 121 HG3 GLN 16 2HG GLN 16 11.003 2.716 -0.945 122 HE21 GLN 16 1HE2 GLN 16 14.191 4.028 -1.802 123 HE22 GLN 16 2HE2 GLN 16 13.788 4.391 -3.443 124 H MET 17 H MET 17 12.351 1.153 0.858 125 HA MET 17 HA MET 17 9.847 0.835 2.325 126 HB3 MET 17 2HB MET 17 9.786 -1.399 1.193 127 HG3 MET 17 2HG MET 17 10.296 0.596 -0.957 128 HE1 MET 17 3HE MET 17 8.622 0.001 -3.389 129 HE2 MET 17 1HE MET 17 10.249 -0.403 -2.841 130 HE3 MET 17 2HE MET 17 9.192 -1.666 -3.472 131 H SER 18 H SER 18 9.536 -0.676 3.954 132 HA SER 18 HA SER 18 11.708 -2.346 4.858 133 HB3 SER 18 2HB SER 18 12.547 -0.551 6.053 134 HG SER 18 HG SER 18 9.864 0.306 6.389 135 H ALA 19 H ALA 19 10.545 -4.166 4.982 136 HA ALA 19 HA ALA 19 7.958 -4.090 6.378 137 HB1 ALA 19 1HB ALA 19 7.197 -5.355 4.726 138 HB2 ALA 19 2HB ALA 19 8.793 -5.351 3.975 139 HB3 ALA 19 3HB ALA 19 8.369 -6.606 5.140 140 H SER 20 H SER 20 7.450 -6.228 7.531 141 HA SER 20 HA SER 20 9.069 -6.522 9.737 142 HB3 SER 20 2HB SER 20 7.432 -8.817 8.668 143 HG SER 20 HG SER 20 6.917 -8.851 10.992 144 H SER 21 H SER 21 8.992 -8.576 6.835 145 HA SER 21 HA SER 21 11.786 -9.110 6.985 146 HB3 SER 21 2HB SER 21 11.386 -11.665 7.198 147 HG SER 21 HG SER 21 12.432 -10.981 8.910 148 H SER 22 H SER 22 12.175 -11.210 5.454 149 HA SER 22 HA SER 22 10.370 -10.993 3.149 150 HB3 SER 22 2HB SER 22 11.971 -9.653 2.228 151 HG SER 22 HG SER 22 13.320 -9.411 3.958 152 H TYR 23 H TYR 23 10.525 -12.772 1.648 153 HA TYR 23 HA TYR 23 10.475 -15.270 2.804 154 HB3 TYR 23 2HB TYR 23 11.075 -14.531 -0.066 155 HD1 TYR 23 1HD TYR 23 10.076 -17.296 2.217 156 HD2 TYR 23 2HD TYR 23 11.351 -16.187 -1.688 157 HE1 TYR 23 1HE TYR 23 10.320 -19.671 1.628 158 HE2 TYR 23 2HE TYR 23 11.598 -18.559 -2.287 159 HH TYR 23 HH TYR 23 11.856 -20.691 -1.296 160 H LYS 24 H LYS 24 11.928 -16.786 3.338 161 HA LYS 24 HA LYS 24 14.689 -16.124 3.448 162 HB3 LYS 24 2HB LYS 24 14.973 -18.413 4.341 163 HG3 LYS 24 2HG LYS 24 13.323 -16.404 5.487 164 HD3 LYS 24 2HD LYS 24 11.561 -18.205 5.263 165 HE3 LYS 24 2HE LYS 24 13.659 -19.691 6.651 166 HZ1 LYS 24 3HZ LYS 24 12.095 -19.215 8.503 167 HZ2 LYS 24 1HZ LYS 24 12.240 -20.860 8.135 168 HZ3 LYS 24 2HZ LYS 24 10.876 -19.997 7.630 169 H THR 25 H THR 25 16.417 -16.895 2.284 170 HA THR 25 HA THR 25 16.190 -18.925 0.297 171 HB THR 25 HB THR 25 16.999 -16.883 -1.400 172 HG1 THR 25 1HG THR 25 14.555 -16.038 -0.248 173 HG21 THR 25 3HG2 THR 25 15.402 -18.963 -1.617 174 HG22 THR 25 1HG2 THR 25 15.262 -17.602 -2.730 175 HG23 THR 25 2HG2 THR 25 14.144 -17.752 -1.374 176 H TRP 26 H TRP 26 18.205 -19.330 -0.808 177 HA TRP 26 HA TRP 26 20.467 -18.814 0.860 178 HB3 TRP 26 2HB TRP 26 21.374 -19.864 -1.589 179 HD1 TRP 26 HD TRP 26 22.671 -19.835 1.196 180 HE1 TRP 26 1HE TRP 26 23.201 -22.010 2.464 181 HE3 TRP 26 3HE TRP 26 19.408 -22.974 -1.178 182 HZ2 TRP 26 2HZ TRP 26 22.349 -24.702 2.459 183 HZ3 TRP 26 3HZ TRP 26 19.328 -25.335 -0.487 184 HH2 TRP 26 HH TRP 26 20.770 -26.178 1.293 185 H ASN 27 H ASN 27 21.841 -17.168 0.766 186 HA ASN 27 HA ASN 27 22.032 -15.640 -1.745 187 HB3 ASN 27 2HB ASN 27 22.717 -13.831 0.217 188 HD21 ASN 27 1HD2 ASN 27 19.557 -15.183 -0.678 189 HD22 ASN 27 2HD2 ASN 27 19.006 -13.777 -1.517 190 H LEU 28 H LEU 28 23.770 -15.533 1.357 191 HA LEU 28 HA LEU 28 25.961 -15.880 1.886 192 HB3 LEU 28 2HB LEU 28 26.518 -16.892 -0.872 193 HG LEU 28 HG LEU 28 28.348 -16.870 0.869 194 HD11 LEU 28 1HD1 LEU 28 27.571 -17.488 2.898 195 HD12 LEU 28 2HD1 LEU 28 28.010 -19.093 2.317 196 HD13 LEU 28 3HD1 LEU 28 26.333 -18.552 2.227 197 HD21 LEU 28 3HD2 LEU 28 28.159 -19.694 0.335 198 HD22 LEU 28 1HD2 LEU 28 29.251 -18.491 -0.351 199 HD23 LEU 28 2HD2 LEU 28 27.664 -18.756 -1.075 200 H ARG 29 H ARG 29 26.075 -15.154 -1.604 201 HA ARG 29 HA ARG 29 27.450 -12.637 -0.954 202 HB3 ARG 29 2HB ARG 29 29.099 -14.336 -1.670 203 HG3 ARG 29 2HG ARG 29 27.431 -14.404 -4.164 204 HD3 ARG 29 2HD ARG 29 30.338 -14.638 -3.845 205 HE ARG 29 HE ARG 29 29.065 -17.008 -4.486 206 HH11 ARG 29 1HH1 ARG 29 31.363 -14.848 -5.960 207 HH12 ARG 29 2HH1 ARG 29 32.154 -16.096 -6.864 208 HH21 ARG 29 1HH2 ARG 29 30.098 -18.662 -5.671 209 HH22 ARG 29 2HH2 ARG 29 31.433 -18.265 -6.700 210 H ALA 30 H ALA 30 24.663 -13.329 -1.726 211 HA ALA 30 HA ALA 30 24.487 -11.968 -4.326 212 HB1 ALA 30 1HB ALA 30 21.984 -13.003 -3.279 213 HB2 ALA 30 2HB ALA 30 22.771 -13.296 -4.831 214 HB3 ALA 30 3HB ALA 30 23.225 -14.249 -3.418 215 H PHE 31 H PHE 31 21.981 -10.945 -4.260 216 HA PHE 31 HA PHE 31 21.658 -9.315 -1.881 217 HB3 PHE 31 2HB PHE 31 21.567 -7.231 -3.432 218 HD1 PHE 31 1HD PHE 31 22.465 -6.802 -1.114 219 HD2 PHE 31 2HD PHE 31 24.833 -8.449 -4.244 220 HE1 PHE 31 1HE PHE 31 24.507 -6.169 0.103 221 HE2 PHE 31 2HE PHE 31 26.879 -7.820 -3.031 222 HZ PHE 31 HZ PHE 31 26.718 -6.678 -0.855 223 H GLY 32 H GLY 32 19.834 -11.023 -2.308 224 HA2 GLY 32 2HA GLY 32 17.766 -9.816 -4.028 225 HA3 GLY 32 3HA GLY 32 17.801 -11.500 -3.528 226 H TRP 33 H TRP 33 18.511 -10.738 -0.749 227 HA TRP 33 HA TRP 33 15.916 -10.669 0.324 228 HB3 TRP 33 2HB TRP 33 17.795 -9.695 2.250 229 HD1 TRP 33 HD TRP 33 16.817 -13.275 1.072 230 HE1 TRP 33 1HE TRP 33 15.598 -14.433 3.020 231 HE3 TRP 33 3HE TRP 33 16.883 -9.448 4.462 232 HZ2 TRP 33 2HZ TRP 33 14.772 -13.808 5.646 233 HZ3 TRP 33 3HZ TRP 33 15.857 -9.810 6.669 234 HH2 TRP 33 HH TRP 33 14.824 -11.945 7.247 235 H TYR 34 H TYR 34 15.677 -8.905 2.286 236 HA TYR 34 HA TYR 34 15.077 -6.775 2.812 237 HB3 TYR 34 2HB TYR 34 16.487 -4.976 2.155 238 HD1 TYR 34 2HD TYR 34 17.175 -5.946 4.421 239 HD2 TYR 34 1HD TYR 34 18.958 -7.137 0.746 240 HE1 TYR 34 2HE TYR 34 19.118 -6.817 5.652 241 HE2 TYR 34 1HE TYR 34 20.906 -8.012 1.967 242 HH TYR 34 HH TYR 34 20.960 -8.162 5.472 243 HA PRO 35 HA PRO 35 11.945 -5.635 -0.046 244 HB3 PRO 35 2HB PRO 35 10.973 -4.465 1.676 245 HG3 PRO 35 2HG PRO 35 12.269 -3.325 3.234 246 HD3 PRO 35 2HD PRO 35 13.314 -5.378 3.276 247 H HIS 36 H HIS 36 11.334 -3.450 -1.360 248 HA HIS 36 HA HIS 36 11.826 -2.106 -3.129 249 HB3 HIS 36 2HB HIS 36 14.698 -2.056 -2.224 250 HD1 HIS 36 1HD HIS 36 12.192 0.710 -2.856 251 HD2 HIS 36 2HD HIS 36 15.701 -0.836 -4.455 252 HE1 HIS 36 1HE HIS 36 12.884 2.331 -4.650 253 H LEU 37 H LEU 37 11.519 -4.462 -4.017 254 HA LEU 37 HA LEU 37 13.930 -5.252 -5.505 255 HB3 LEU 37 2HB LEU 37 12.807 -7.405 -5.850 256 HG LEU 37 HG LEU 37 13.092 -8.384 -3.775 257 HD11 LEU 37 1HD1 LEU 37 14.577 -5.889 -3.122 258 HD12 LEU 37 2HD1 LEU 37 14.992 -6.770 -4.591 259 HD13 LEU 37 3HD1 LEU 37 15.095 -7.572 -3.024 260 HD21 LEU 37 3HD2 LEU 37 11.428 -6.289 -2.879 261 HD22 LEU 37 1HD2 LEU 37 12.896 -6.237 -1.904 262 HD23 LEU 37 2HD2 LEU 37 11.949 -7.722 -1.993 263 H GLY 38 H GLY 38 10.544 -4.366 -5.814 264 HA2 GLY 38 2HA GLY 38 10.617 -4.698 -8.709 265 HA3 GLY 38 3HA GLY 38 9.224 -4.223 -7.749 266 H ARG 39 H ARG 39 12.412 -2.731 -7.612 267 HA ARG 39 HA ARG 39 11.579 -0.124 -7.612 268 HB3 ARG 39 2HB ARG 39 13.830 -0.414 -7.119 269 HG3 ARG 39 2HG ARG 39 13.766 -2.477 -9.069 270 HD3 ARG 39 2HD ARG 39 15.655 -0.250 -9.615 271 HE ARG 39 HE ARG 39 16.708 -2.709 -10.571 272 HH11 ARG 39 1HH1 ARG 39 16.603 -0.640 -7.773 273 HH12 ARG 39 2HH1 ARG 39 18.124 -1.186 -7.150 274 HH21 ARG 39 1HH2 ARG 39 18.712 -3.435 -9.762 275 HH22 ARG 39 2HH2 ARG 39 19.324 -2.776 -8.284 276 H LEU 40 H LEU 40 12.755 -1.871 -10.495 277 HA LEU 40 HA LEU 40 10.750 -1.040 -12.226 278 HB3 LEU 40 2HB LEU 40 13.103 0.808 -12.050 279 HG LEU 40 HG LEU 40 11.867 0.016 -14.530 280 HD11 LEU 40 1HD1 LEU 40 11.836 2.968 -14.266 281 HD12 LEU 40 2HD1 LEU 40 10.466 2.076 -13.607 282 HD13 LEU 40 3HD1 LEU 40 10.888 1.909 -15.312 283 HD21 LEU 40 3HD2 LEU 40 14.312 0.863 -13.625 284 HD22 LEU 40 1HD2 LEU 40 13.740 2.253 -14.546 285 HD23 LEU 40 2HD2 LEU 40 13.854 0.671 -15.318 286 H ASP 41 H ASP 41 14.270 -0.850 -12.715 287 HA ASP 41 HA ASP 41 14.191 -2.546 -14.992 288 HB3 ASP 41 2HB ASP 41 16.723 -2.103 -13.466 289 H ASN 42 H ASN 42 14.585 -3.095 -11.593 290 HA ASN 42 HA ASN 42 15.250 -4.961 -10.400 291 HB3 ASN 42 2HB ASN 42 12.825 -5.234 -10.906 292 HD21 ASN 42 1HD2 ASN 42 12.320 -4.564 -13.054 293 HD22 ASN 42 2HD2 ASN 42 12.115 -5.738 -14.306 294 H GLN 43 H GLN 43 17.181 -4.515 -12.304 295 HA GLN 43 HA GLN 43 17.814 -6.400 -14.158 296 HB3 GLN 43 2HB GLN 43 19.319 -4.612 -13.917 297 HG3 GLN 43 2HG GLN 43 19.726 -5.472 -11.063 298 HE21 GLN 43 1HE2 GLN 43 21.395 -4.592 -9.952 299 HE22 GLN 43 2HE2 GLN 43 22.668 -3.682 -10.682 300 H GLY 44 H GLY 44 17.935 -6.748 -10.671 301 HA2 GLY 44 2HA GLY 44 19.470 -9.052 -10.430 302 HA3 GLY 44 3HA GLY 44 18.163 -8.607 -9.344 303 H LYS 45 H LYS 45 16.138 -9.535 -9.593 304 HA LYS 45 HA LYS 45 15.282 -11.068 -11.765 305 HB3 LYS 45 2HB LYS 45 17.132 -12.564 -11.158 306 HG3 LYS 45 2HG LYS 45 16.856 -13.945 -9.065 307 HD3 LYS 45 2HD LYS 45 17.419 -11.152 -8.219 308 HE3 LYS 45 2HE LYS 45 18.137 -13.770 -7.425 309 HZ1 LYS 45 3HZ LYS 45 20.511 -13.659 -7.413 310 HZ2 LYS 45 1HZ LYS 45 20.509 -12.156 -8.191 311 HZ3 LYS 45 2HZ LYS 45 19.990 -13.537 -9.019 312 H ILE 46 H ILE 46 15.218 -10.472 -8.324 313 HA ILE 46 HA ILE 46 12.833 -11.700 -7.612 314 HB ILE 46 HB ILE 46 13.740 -9.025 -6.552 315 HG13 ILE 46 2HG1 ILE 46 14.995 -11.664 -6.386 316 HG21 ILE 46 1HG2 ILE 46 12.777 -10.557 -4.476 317 HG22 ILE 46 2HG2 ILE 46 11.900 -9.279 -5.317 318 HG23 ILE 46 3HG2 ILE 46 11.700 -10.960 -5.812 319 HD11 ILE 46 3HD1 ILE 46 15.983 -9.282 -6.886 320 HD12 ILE 46 1HD1 ILE 46 16.142 -9.234 -5.131 321 HD13 ILE 46 2HD1 ILE 46 16.929 -10.515 -6.053 322 H ASN 47 H ASN 47 13.111 -8.187 -8.143 323 HA ASN 47 HA ASN 47 11.646 -6.654 -8.967 324 HB3 ASN 47 2HB ASN 47 10.692 -8.991 -10.639 325 HD21 ASN 47 1HD2 ASN 47 11.015 -5.474 -10.395 326 HD22 ASN 47 2HD2 ASN 47 9.655 -5.106 -11.394 327 H ALA 48 H ALA 48 10.899 -8.251 -6.626 328 HA ALA 48 HA ALA 48 8.356 -7.260 -6.142 329 HB1 ALA 48 1HB ALA 48 8.275 -9.593 -7.763 330 HB2 ALA 48 2HB ALA 48 7.611 -9.992 -6.179 331 HB3 ALA 48 3HB ALA 48 6.931 -8.657 -7.108 332 H TRP 49 H TRP 49 8.468 -7.013 -4.017 333 HA TRP 49 HA TRP 49 10.196 -8.551 -2.367 334 HB3 TRP 49 2HB TRP 49 8.106 -6.456 -1.816 335 HD1 TRP 49 HD TRP 49 10.984 -7.274 0.555 336 HE1 TRP 49 1HE TRP 49 10.012 -7.864 2.865 337 HE3 TRP 49 3HE TRP 49 6.022 -7.420 -0.667 338 HZ2 TRP 49 2HZ TRP 49 7.477 -8.330 4.016 339 HZ3 TRP 49 3HZ TRP 49 4.389 -7.946 1.096 340 HH2 TRP 49 HH TRP 49 5.103 -8.392 3.388 341 H THR 50 H THR 50 9.821 -10.317 -1.171 342 HA THR 50 HA THR 50 7.074 -11.381 -1.142 343 HB THR 50 HB THR 50 9.411 -13.146 -0.576 344 HG1 THR 50 1HG THR 50 9.866 -11.868 -2.531 345 HG21 THR 50 3HG2 THR 50 7.170 -14.055 -0.396 346 HG22 THR 50 1HG2 THR 50 7.991 -14.775 -1.780 347 HG23 THR 50 2HG2 THR 50 6.789 -13.509 -2.029 348 H ALA 51 H ALA 51 6.461 -12.655 0.754 349 HA ALA 51 HA ALA 51 7.285 -11.317 3.186 350 HB1 ALA 51 1HB ALA 51 4.903 -11.761 2.702 351 HB2 ALA 51 2HB ALA 51 5.228 -13.491 2.820 352 HB3 ALA 51 3HB ALA 51 5.435 -12.457 4.234 353 H GLN 52 H GLN 52 7.800 -12.538 5.149 354 HA GLN 52 HA GLN 52 9.652 -14.709 4.534 355 HB3 GLN 52 2HB GLN 52 9.250 -13.038 7.018 356 HG3 GLN 52 2HG GLN 52 11.687 -14.145 7.338 357 HE21 GLN 52 1HE2 GLN 52 10.306 -16.837 8.183 358 HE22 GLN 52 2HE2 GLN 52 9.564 -16.407 9.683 359 H SER 53 H SER 53 6.907 -14.007 6.667 360 HA SER 53 HA SER 53 6.815 -16.766 7.574 361 HB3 SER 53 2HB SER 53 4.621 -14.875 8.248 362 HG SER 53 HG SER 53 6.278 -16.484 9.892 363 H ASN 54 H ASN 54 5.493 -14.871 5.081 364 HA ASN 54 HA ASN 54 4.000 -15.311 3.422 365 HB3 ASN 54 2HB ASN 54 3.753 -17.508 2.707 366 HD21 ASN 54 1HD2 ASN 54 5.420 -19.246 4.913 367 HD22 ASN 54 2HD2 ASN 54 7.027 -19.010 4.324 368 H SER 55 H SER 55 3.075 -14.380 5.972 369 HA SER 55 HA SER 55 0.318 -15.403 5.873 370 HB3 SER 55 2HB SER 55 0.979 -14.372 8.492 371 HG SER 55 HG SER 55 0.388 -16.722 8.894 372 H ALA 56 H ALA 56 -0.974 -13.718 7.485 373 HA ALA 56 HA ALA 56 -0.784 -11.199 6.045 374 HB1 ALA 56 1HB ALA 56 -2.835 -11.530 8.140 375 HB2 ALA 56 2HB ALA 56 -2.978 -10.907 6.496 376 HB3 ALA 56 3HB ALA 56 -2.925 -12.646 6.777 377 H LYS 57 H LYS 57 0.450 -12.471 8.870 378 HA LYS 57 HA LYS 57 0.214 -10.242 10.618 379 HB3 LYS 57 2HB LYS 57 1.960 -11.352 11.938 380 HG3 LYS 57 2HG LYS 57 -0.445 -12.707 11.063 381 HD3 LYS 57 2HD LYS 57 1.520 -14.393 10.653 382 HE3 LYS 57 2HE LYS 57 1.151 -15.324 13.381 383 HZ1 LYS 57 3HZ LYS 57 3.170 -16.181 13.013 384 HZ2 LYS 57 1HZ LYS 57 3.804 -14.736 12.401 385 HZ3 LYS 57 2HZ LYS 57 2.905 -15.758 11.397 386 H GLU 58 H GLU 58 2.048 -10.765 7.828 387 HA GLU 58 HA GLU 58 4.325 -9.172 8.546 388 HB3 GLU 58 2HB GLU 58 3.912 -9.326 5.701 389 HG3 GLU 58 2HG GLU 58 6.091 -9.284 7.008 390 H TRP 59 H TRP 59 4.878 -7.290 6.958 391 HA TRP 59 HA TRP 59 2.853 -5.700 5.856 392 HB3 TRP 59 2HB TRP 59 1.926 -5.213 7.939 393 HD1 TRP 59 HD TRP 59 5.663 -4.502 8.779 394 HE1 TRP 59 1HE TRP 59 6.084 -5.289 11.194 395 HE3 TRP 59 3HE TRP 59 0.986 -6.242 9.893 396 HZ2 TRP 59 2HZ TRP 59 4.626 -6.489 13.292 397 HZ3 TRP 59 3HZ TRP 59 0.584 -7.195 12.126 398 HH2 TRP 59 HH TRP 59 2.368 -7.316 13.789 399 H LEU 60 H LEU 60 3.661 -3.840 4.876 400 HA LEU 60 HA LEU 60 6.581 -3.498 5.091 401 HB3 LEU 60 2HB LEU 60 4.895 -2.880 2.676 402 HG LEU 60 HG LEU 60 7.679 -2.481 3.197 403 HD11 LEU 60 1HD1 LEU 60 7.316 -4.126 0.738 404 HD12 LEU 60 2HD1 LEU 60 7.583 -4.930 2.285 405 HD13 LEU 60 3HD1 LEU 60 8.779 -3.790 1.666 406 HD21 LEU 60 3HD2 LEU 60 5.833 -1.195 1.839 407 HD22 LEU 60 1HD2 LEU 60 6.439 -2.176 0.506 408 HD23 LEU 60 2HD2 LEU 60 7.533 -1.099 1.374 409 H GLN 61 H GLN 61 7.272 -1.581 5.766 410 HA GLN 61 HA GLN 61 5.387 0.677 5.718 411 HB3 GLN 61 2HB GLN 61 6.405 1.525 7.675 412 HG3 GLN 61 2HG GLN 61 5.125 -0.745 7.893 413 HE21 GLN 61 1HE2 GLN 61 8.029 -0.900 9.843 414 HE22 GLN 61 2HE2 GLN 61 8.449 -2.525 9.431 415 H VAL 62 H VAL 62 5.898 2.483 4.639 416 HA VAL 62 HA VAL 62 8.592 2.645 3.455 417 HB VAL 62 HB VAL 62 6.175 4.065 2.369 418 HG11 VAL 62 1HG1 VAL 62 7.978 4.972 1.303 419 HG12 VAL 62 2HG1 VAL 62 8.953 3.510 1.469 420 HG13 VAL 62 3HG1 VAL 62 7.682 3.590 0.248 421 HG21 VAL 62 3HG2 VAL 62 6.324 2.054 0.665 422 HG22 VAL 62 1HG2 VAL 62 6.953 1.210 2.079 423 HG23 VAL 62 2HG2 VAL 62 5.351 1.944 2.131 424 H ASP 63 H ASP 63 9.848 4.191 4.237 425 HA ASP 63 HA ASP 63 8.589 6.533 5.499 426 HB3 ASP 63 2HB ASP 63 10.493 6.738 6.900 427 H LEU 64 H LEU 64 8.769 8.431 4.515 428 HA LEU 64 HA LEU 64 10.770 8.717 2.382 429 HB3 LEU 64 2HB LEU 64 9.223 10.754 1.840 430 HG LEU 64 HG LEU 64 9.359 8.829 0.321 431 HD11 LEU 64 1HD1 LEU 64 8.851 7.062 1.921 432 HD12 LEU 64 2HD1 LEU 64 7.766 6.991 0.533 433 HD13 LEU 64 3HD1 LEU 64 7.195 7.655 2.063 434 HD21 LEU 64 3HD2 LEU 64 7.540 10.727 0.282 435 HD22 LEU 64 1HD2 LEU 64 6.445 9.380 0.595 436 HD23 LEU 64 2HD2 LEU 64 7.464 9.371 -0.845 437 H GLY 65 H GLY 65 9.100 10.797 4.762 438 HA2 GLY 65 2HA GLY 65 9.917 12.441 6.145 439 HA3 GLY 65 3HA GLY 65 11.521 11.773 5.881 440 H THR 66 H THR 66 10.108 12.449 2.937 441 HA THR 66 HA THR 66 11.563 15.003 2.776 442 HB THR 66 HB THR 66 12.370 13.166 1.291 443 HG1 THR 66 1HG THR 66 12.384 15.540 0.770 444 HG21 THR 66 3HG2 THR 66 10.361 13.395 -0.735 445 HG22 THR 66 1HG2 THR 66 9.611 12.860 0.768 446 HG23 THR 66 2HG2 THR 66 10.954 11.947 0.079 447 H GLN 67 H GLN 67 8.497 13.805 3.019 448 HA GLN 67 HA GLN 67 6.407 14.580 2.542 449 HB3 GLN 67 2HB GLN 67 7.501 17.345 2.257 450 HG3 GLN 67 2HG GLN 67 5.063 16.080 3.322 451 HE21 GLN 67 1HE2 GLN 67 6.561 19.260 3.806 452 HE22 GLN 67 2HE2 GLN 67 6.100 19.416 5.463 453 H ARG 68 H ARG 68 6.266 13.574 0.490 454 HA ARG 68 HA ARG 68 6.564 15.431 -1.780 455 HB3 ARG 68 2HB ARG 68 6.486 13.020 -2.993 456 HG3 ARG 68 2HG ARG 68 8.947 13.034 -3.071 457 HD3 ARG 68 2HD ARG 68 7.253 15.368 -3.648 458 HE ARG 68 HE ARG 68 10.040 15.798 -3.099 459 HH11 ARG 68 1HH1 ARG 68 7.319 16.783 -5.033 460 HH12 ARG 68 2HH1 ARG 68 7.949 18.365 -5.348 461 HH21 ARG 68 1HH2 ARG 68 10.882 17.879 -3.507 462 HH22 ARG 68 2HH2 ARG 68 9.976 18.987 -4.481 463 H GLN 69 H GLN 69 4.916 15.528 -3.306 464 HA GLN 69 HA GLN 69 2.313 14.690 -2.316 465 HB3 GLN 69 2HB GLN 69 3.241 16.592 -4.443 466 HG3 GLN 69 2HG GLN 69 0.532 15.375 -4.184 467 HE21 GLN 69 1HE2 GLN 69 -1.287 16.457 -4.934 468 HE22 GLN 69 2HE2 GLN 69 -1.380 18.181 -4.980 469 H VAL 70 H VAL 70 1.439 12.837 -2.932 470 HA VAL 70 HA VAL 70 2.437 11.463 -5.294 471 HB VAL 70 HB VAL 70 1.198 9.542 -4.532 472 HG11 VAL 70 1HG1 VAL 70 2.235 9.182 -2.353 473 HG12 VAL 70 2HG1 VAL 70 3.352 9.980 -3.462 474 HG13 VAL 70 3HG1 VAL 70 2.539 10.911 -2.204 475 HG21 VAL 70 3HG2 VAL 70 -0.783 9.912 -3.570 476 HG22 VAL 70 1HG2 VAL 70 0.113 10.182 -2.074 477 HG23 VAL 70 2HG2 VAL 70 -0.334 11.550 -3.094 478 H THR 71 H THR 71 1.186 10.853 -7.049 479 HA THR 71 HA THR 71 -1.551 11.890 -7.201 480 HB THR 71 HB THR 71 -0.003 12.239 -9.683 481 HG1 THR 71 1HG THR 71 1.263 13.010 -7.639 482 HG21 THR 71 3HG2 THR 71 -2.410 13.143 -8.553 483 HG22 THR 71 1HG2 THR 71 -1.728 13.582 -10.119 484 HG23 THR 71 2HG2 THR 71 -1.375 14.564 -8.697 485 H GLY 72 H GLY 72 -0.142 9.209 -7.051 486 HA2 GLY 72 2HA GLY 72 -1.887 7.663 -8.498 487 HA3 GLY 72 3HA GLY 72 -0.546 7.957 -9.597 488 H ILE 73 H ILE 73 -1.240 5.400 -8.755 489 HA ILE 73 HA ILE 73 1.243 4.614 -7.460 490 HB ILE 73 HB ILE 73 -0.110 2.966 -6.012 491 HG13 ILE 73 2HG1 ILE 73 -2.246 4.108 -7.305 492 HG21 ILE 73 1HG2 ILE 73 1.022 5.418 -5.523 493 HG22 ILE 73 2HG2 ILE 73 -0.591 5.586 -4.831 494 HG23 ILE 73 3HG2 ILE 73 0.465 4.278 -4.298 495 HD11 ILE 73 3HD1 ILE 73 -2.373 2.905 -4.552 496 HD12 ILE 73 1HD1 ILE 73 -3.686 3.013 -5.724 497 HD13 ILE 73 2HD1 ILE 73 -2.290 1.988 -6.055 498 H ILE 74 H ILE 74 1.722 2.343 -7.705 499 HA ILE 74 HA ILE 74 0.023 0.744 -9.411 500 HB ILE 74 HB ILE 74 1.293 2.173 -11.013 501 HG13 ILE 74 2HG1 ILE 74 1.462 0.469 -12.531 502 HG21 ILE 74 1HG2 ILE 74 3.346 2.463 -9.789 503 HG22 ILE 74 2HG2 ILE 74 3.666 0.730 -9.842 504 HG23 ILE 74 3HG2 ILE 74 3.700 1.679 -11.328 505 HD11 ILE 74 3HD1 ILE 74 2.829 -1.189 -10.430 506 HD12 ILE 74 1HD1 ILE 74 2.361 -1.791 -12.020 507 HD13 ILE 74 2HD1 ILE 74 3.543 -0.489 -11.882 508 H THR 75 H THR 75 0.353 -1.402 -9.127 509 HA THR 75 HA THR 75 2.757 -2.240 -7.651 510 HB THR 75 HB THR 75 1.029 -2.199 -5.996 511 HG1 THR 75 1HG THR 75 2.049 -4.033 -5.557 512 HG21 THR 75 3HG2 THR 75 -0.926 -2.127 -7.426 513 HG22 THR 75 1HG2 THR 75 -1.081 -3.461 -6.284 514 HG23 THR 75 2HG2 THR 75 -0.633 -3.782 -7.960 515 H GLN 76 H GLN 76 3.224 -4.559 -7.832 516 HA GLN 76 HA GLN 76 1.952 -5.994 -10.007 517 HB3 GLN 76 2HB GLN 76 3.643 -4.611 -11.149 518 HG3 GLN 76 2HG GLN 76 5.307 -5.380 -8.964 519 HE21 GLN 76 1HE2 GLN 76 5.627 -7.697 -9.583 520 HE22 GLN 76 2HE2 GLN 76 6.987 -8.066 -10.583 521 H GLY 77 H GLY 77 2.149 -8.190 -9.831 522 HA2 GLY 77 2HA GLY 77 3.378 -9.146 -7.356 523 HA3 GLY 77 3HA GLY 77 2.229 -10.027 -8.352 524 H ALA 78 H ALA 78 4.132 -11.581 -7.631 525 HA ALA 78 HA ALA 78 5.945 -11.726 -9.945 526 HB1 ALA 78 1HB ALA 78 7.345 -12.968 -7.923 527 HB2 ALA 78 2HB ALA 78 7.649 -11.350 -8.555 528 HB3 ALA 78 3HB ALA 78 6.638 -11.562 -7.126 529 H ARG 79 H ARG 79 6.574 -13.846 -10.577 530 HA ARG 79 HA ARG 79 4.879 -15.992 -9.482 531 HB3 ARG 79 2HB ARG 79 4.052 -15.207 -11.680 532 HG3 ARG 79 2HG ARG 79 6.742 -16.120 -12.669 533 HD3 ARG 79 2HD ARG 79 4.404 -15.222 -14.334 534 HE ARG 79 HE ARG 79 7.083 -15.723 -14.993 535 HH11 ARG 79 1HH1 ARG 79 3.871 -16.490 -16.090 536 HH12 ARG 79 2HH1 ARG 79 4.339 -16.667 -17.749 537 HH21 ARG 79 1HH2 ARG 79 7.713 -15.955 -17.173 538 HH22 ARG 79 2HH2 ARG 79 6.525 -16.364 -18.363 539 H ASP 80 H ASP 80 5.753 -18.093 -9.503 540 HA ASP 80 HA ASP 80 8.683 -18.164 -9.810 541 HB3 ASP 80 2HB ASP 80 7.035 -19.988 -8.056 542 H PHE 81 H PHE 81 6.928 -18.596 -11.994 543 HA PHE 81 HA PHE 81 6.659 -20.014 -13.752 544 HB3 PHE 81 2HB PHE 81 8.258 -21.766 -14.090 545 HD1 PHE 81 2HD PHE 81 8.977 -19.766 -15.393 546 HD2 PHE 81 1HD PHE 81 10.233 -20.450 -11.384 547 HE1 PHE 81 2HE PHE 81 10.822 -18.167 -15.703 548 HE2 PHE 81 1HE PHE 81 12.079 -18.851 -11.687 549 HZ PHE 81 HZ PHE 81 12.377 -17.709 -13.849 550 H GLY 82 H GLY 82 4.542 -20.591 -13.435 551 HA2 GLY 82 2HA GLY 82 2.964 -22.325 -13.363 552 HA3 GLY 82 3HA GLY 82 4.119 -23.311 -12.480 553 H HIS 83 H HIS 83 4.746 -21.658 -10.363 554 HA HIS 83 HA HIS 83 2.247 -21.773 -8.853 555 HB3 HIS 83 2HB HIS 83 3.950 -21.268 -6.921 556 HD1 HIS 83 1HD HIS 83 1.938 -23.186 -6.666 557 HD2 HIS 83 2HD HIS 83 5.649 -24.396 -8.091 558 HE1 HIS 83 1HE HIS 83 2.014 -25.675 -6.317 559 H ILE 84 H ILE 84 2.513 -19.654 -10.714 560 HA ILE 84 HA ILE 84 3.455 -17.243 -10.028 561 HB ILE 84 HB ILE 84 0.601 -17.715 -10.898 562 HG13 ILE 84 2HG1 ILE 84 2.988 -18.356 -12.209 563 HG21 ILE 84 1HG2 ILE 84 2.288 -15.282 -10.649 564 HG22 ILE 84 2HG2 ILE 84 1.181 -15.395 -12.017 565 HG23 ILE 84 3HG2 ILE 84 0.559 -15.494 -10.370 566 HD11 ILE 84 3HD1 ILE 84 0.233 -18.615 -12.686 567 HD12 ILE 84 1HD1 ILE 84 0.936 -17.897 -14.136 568 HD13 ILE 84 2HD1 ILE 84 1.563 -19.424 -13.514 569 H GLN 85 H GLN 85 3.146 -15.665 -8.541 570 HA GLN 85 HA GLN 85 1.112 -16.151 -6.465 571 HB3 GLN 85 2HB GLN 85 2.607 -15.476 -4.769 572 HG3 GLN 85 2HG GLN 85 3.895 -17.277 -6.758 573 HE21 GLN 85 1HE2 GLN 85 5.565 -15.220 -6.429 574 HE22 GLN 85 2HE2 GLN 85 6.880 -15.646 -5.394 575 H TYR 86 H TYR 86 0.258 -14.274 -5.413 576 HA TYR 86 HA TYR 86 0.873 -11.632 -6.165 577 HB3 TYR 86 2HB TYR 86 -1.697 -12.576 -7.421 578 HD1 TYR 86 1HD TYR 86 -2.369 -10.294 -6.354 579 HD2 TYR 86 2HD TYR 86 0.482 -10.707 -9.486 580 HE1 TYR 86 1HE TYR 86 -2.693 -7.931 -6.952 581 HE2 TYR 86 2HE TYR 86 0.165 -8.344 -10.092 582 HH TYR 86 HH TYR 86 -1.962 -6.617 -9.714 583 H VAL 87 H VAL 87 -0.165 -10.168 -4.876 584 HA VAL 87 HA VAL 87 -1.908 -11.297 -2.818 585 HB VAL 87 HB VAL 87 -0.771 -8.509 -2.839 586 HG11 VAL 87 1HG1 VAL 87 -2.205 -8.489 -1.089 587 HG12 VAL 87 2HG1 VAL 87 -2.173 -10.244 -0.902 588 HG13 VAL 87 3HG1 VAL 87 -0.850 -9.264 -0.268 589 HG21 VAL 87 3HG2 VAL 87 0.540 -11.086 -2.029 590 HG22 VAL 87 1HG2 VAL 87 1.171 -9.801 -3.058 591 HG23 VAL 87 2HG2 VAL 87 1.012 -9.542 -1.320 592 H ALA 88 H ALA 88 -3.993 -10.729 -2.541 593 HA ALA 88 HA ALA 88 -5.205 -9.048 -4.597 594 HB1 ALA 88 1HB ALA 88 -6.182 -11.182 -2.779 595 HB2 ALA 88 2HB ALA 88 -7.334 -9.954 -3.308 596 HB3 ALA 88 3HB ALA 88 -6.479 -10.934 -4.500 597 H SER 89 H SER 89 -6.223 -9.507 -1.234 598 HA SER 89 HA SER 89 -6.922 -6.728 -1.011 599 HB3 SER 89 2HB SER 89 -7.584 -7.361 1.320 600 HG SER 89 HG SER 89 -8.911 -7.767 -0.654 601 H TYR 90 H TYR 90 -5.623 -5.143 -0.397 602 HA TYR 90 HA TYR 90 -3.450 -5.708 1.486 603 HB3 TYR 90 2HB TYR 90 -2.591 -3.767 -0.474 604 HD1 TYR 90 1HD TYR 90 -1.280 -4.374 1.925 605 HD2 TYR 90 2HD TYR 90 -1.198 -6.596 -1.702 606 HE1 TYR 90 1HE TYR 90 0.892 -5.331 2.568 607 HE2 TYR 90 2HE TYR 90 0.974 -7.561 -1.069 608 HH TYR 90 HH TYR 90 2.210 -7.443 2.014 609 H LYS 91 H LYS 91 -3.670 -4.392 3.156 610 HA LYS 91 HA LYS 91 -5.150 -1.899 2.863 611 HB3 LYS 91 2HB LYS 91 -4.913 -1.842 5.387 612 HG3 LYS 91 2HG LYS 91 -6.151 -4.360 5.336 613 HD3 LYS 91 2HD LYS 91 -7.532 -1.727 4.886 614 HE3 LYS 91 2HE LYS 91 -8.345 -4.373 5.612 615 HZ1 LYS 91 3HZ LYS 91 -8.649 -4.203 7.788 616 HZ2 LYS 91 1HZ LYS 91 -9.796 -2.994 7.492 617 HZ3 LYS 91 2HZ LYS 91 -8.188 -2.575 7.808 618 H VAL 92 H VAL 92 -4.057 -0.136 2.317 619 HA VAL 92 HA VAL 92 -1.402 0.293 3.522 620 HB VAL 92 HB VAL 92 -2.238 1.185 0.760 621 HG11 VAL 92 1HG1 VAL 92 0.051 1.769 2.503 622 HG12 VAL 92 2HG1 VAL 92 0.471 1.325 0.847 623 HG13 VAL 92 3HG1 VAL 92 -0.610 2.685 1.149 624 HG21 VAL 92 3HG2 VAL 92 -0.109 -0.546 0.488 625 HG22 VAL 92 1HG2 VAL 92 -1.105 -1.315 1.724 626 HG23 VAL 92 2HG2 VAL 92 -1.799 -0.920 0.151 627 H ALA 93 H ALA 93 -1.278 2.061 4.730 628 HA ALA 93 HA ALA 93 -3.257 4.201 4.292 629 HB1 ALA 93 1HB ALA 93 -2.218 2.933 6.752 630 HB2 ALA 93 2HB ALA 93 -2.494 4.673 6.809 631 HB3 ALA 93 3HB ALA 93 -3.819 3.584 6.397 632 H HIS 94 H HIS 94 -2.581 6.315 4.239 633 HA HIS 94 HA HIS 94 0.333 6.716 4.117 634 HB3 HIS 94 2HB HIS 94 -0.160 8.642 2.641 635 HD1 HIS 94 1HD HIS 94 0.500 8.043 0.332 636 HD2 HIS 94 2HD HIS 94 -1.922 5.140 2.054 637 HE1 HIS 94 1HE HIS 94 0.401 6.170 -1.343 638 H SER 95 H SER 95 1.281 8.364 5.243 639 HA SER 95 HA SER 95 -0.477 10.003 6.945 640 HB3 SER 95 2HB SER 95 1.458 8.043 7.767 641 HG SER 95 HG SER 95 3.043 9.454 8.064 642 H ASP 96 H ASP 96 -0.266 12.038 6.306 643 HA ASP 96 HA ASP 96 2.172 12.973 5.053 644 HB3 ASP 96 2HB ASP 96 0.251 13.817 4.005 645 H ASP 97 H ASP 97 0.183 14.121 7.785 646 HA ASP 97 HA ASP 97 2.525 15.496 8.866 647 HB3 ASP 97 2HB ASP 97 0.746 16.336 10.549 648 H GLY 98 H GLY 98 1.227 12.498 9.075 649 HA2 GLY 98 2HA GLY 98 1.889 10.772 10.491 650 HA3 GLY 98 3HA GLY 98 2.604 11.963 11.568 651 H VAL 99 H VAL 99 -0.297 13.231 11.095 652 HA VAL 99 HA VAL 99 -1.423 11.885 13.450 653 HB VAL 99 HB VAL 99 -1.142 14.243 13.793 654 HG11 VAL 99 1HG1 VAL 99 -1.064 14.898 11.420 655 HG12 VAL 99 2HG1 VAL 99 -2.812 14.677 11.318 656 HG13 VAL 99 3HG1 VAL 99 -2.140 15.927 12.365 657 HG21 VAL 99 3HG2 VAL 99 -3.296 14.813 14.521 658 HG22 VAL 99 1HG2 VAL 99 -4.068 13.923 13.208 659 HG23 VAL 99 2HG2 VAL 99 -3.284 13.049 14.524 660 H GLN 100 H GLN 100 -2.277 13.042 10.214 661 HA GLN 100 HA GLN 100 -4.854 11.675 10.381 662 HB3 GLN 100 2HB GLN 100 -5.382 12.805 8.282 663 HG3 GLN 100 2HG GLN 100 -4.059 14.992 9.787 664 HE21 GLN 100 1HE2 GLN 100 -7.389 13.872 9.433 665 HE22 GLN 100 2HE2 GLN 100 -7.935 15.226 8.509 666 H TRP 101 H TRP 101 -4.175 9.519 10.300 667 HA TRP 101 HA TRP 101 -2.523 8.572 8.143 668 HB3 TRP 101 2HB TRP 101 -2.622 6.472 9.168 669 HD1 TRP 101 HD TRP 101 -1.044 9.001 10.239 670 HE1 TRP 101 1HE TRP 101 -0.476 9.183 12.742 671 HE3 TRP 101 3HE TRP 101 -4.572 5.806 12.106 672 HZ2 TRP 101 2HZ TRP 101 -1.400 8.113 15.186 673 HZ3 TRP 101 3HZ TRP 101 -4.662 5.439 14.537 674 HH2 TRP 101 HH TRP 101 -3.109 6.570 16.043 675 H THR 102 H THR 102 -3.440 8.818 6.173 676 HA THR 102 HA THR 102 -6.183 8.505 5.599 677 HB THR 102 HB THR 102 -3.837 8.280 3.702 678 HG1 THR 102 1HG THR 102 -5.448 10.504 4.474 679 HG21 THR 102 3HG2 THR 102 -5.519 8.963 1.996 680 HG22 THR 102 1HG2 THR 102 -6.779 8.756 3.212 681 HG23 THR 102 2HG2 THR 102 -5.824 7.369 2.687 682 H VAL 103 H VAL 103 -6.820 6.521 6.532 683 HA VAL 103 HA VAL 103 -5.754 4.031 6.278 684 HB VAL 103 HB VAL 103 -8.288 3.294 6.047 685 HG11 VAL 103 1HG1 VAL 103 -7.892 4.661 8.606 686 HG12 VAL 103 2HG1 VAL 103 -8.159 2.951 8.260 687 HG13 VAL 103 3HG1 VAL 103 -6.542 3.641 8.111 688 HG21 VAL 103 3HG2 VAL 103 -8.800 5.950 7.271 689 HG22 VAL 103 1HG2 VAL 103 -8.713 5.857 5.511 690 HG23 VAL 103 2HG2 VAL 103 -9.890 4.881 6.389 691 H TYR 104 H TYR 104 -8.657 4.222 4.401 692 HA TYR 104 HA TYR 104 -7.442 4.151 1.826 693 HB3 TYR 104 2HB TYR 104 -7.063 1.969 1.516 694 HD1 TYR 104 1HD TYR 104 -9.103 1.494 4.602 695 HD2 TYR 104 2HD TYR 104 -5.255 1.275 2.801 696 HE1 TYR 104 1HE TYR 104 -8.212 0.456 6.646 697 HE2 TYR 104 2HE TYR 104 -4.354 0.236 4.838 698 HH TYR 104 HH TYR 104 -5.777 0.329 7.733 699 H GLU 105 H GLU 105 -9.665 5.390 3.311 700 HA GLU 105 HA GLU 105 -12.140 4.360 2.424 701 HB3 GLU 105 2HB GLU 105 -11.741 6.038 4.292 702 HG3 GLU 105 2HG GLU 105 -12.224 8.259 2.446 703 H GLU 106 H GLU 106 -13.370 4.778 0.644 704 HA GLU 106 HA GLU 106 -12.237 6.561 -1.402 705 HB3 GLU 106 2HB GLU 106 -13.499 3.893 -2.027 706 HG3 GLU 106 2HG GLU 106 -11.985 4.289 -4.112 707 H GLN 107 H GLN 107 -15.067 4.926 -0.097 708 HA GLN 107 HA GLN 107 -16.736 7.060 -1.234 709 HB3 GLN 107 2HB GLN 107 -17.189 5.213 -2.659 710 HG3 GLN 107 2HG GLN 107 -17.256 3.579 -0.155 711 HE21 GLN 107 1HE2 GLN 107 -17.250 1.135 -1.402 712 HE22 GLN 107 2HE2 GLN 107 -18.815 0.821 -2.064 713 H GLY 108 H GLY 108 -15.563 5.840 1.485 714 HA2 GLY 108 2HA GLY 108 -16.343 6.714 3.591 715 HA3 GLY 108 3HA GLY 108 -17.990 6.542 3.002 716 H SER 109 H SER 109 -15.634 4.027 2.507 717 HA SER 109 HA SER 109 -17.016 2.400 4.542 718 HB3 SER 109 2HB SER 109 -15.935 1.574 1.839 719 HG SER 109 HG SER 109 -16.496 -0.508 2.414 720 H SER 110 H SER 110 -13.965 3.062 2.899 721 HA SER 110 HA SER 110 -11.798 2.806 3.547 722 HB3 SER 110 2HB SER 110 -12.860 2.240 6.321 723 HG SER 110 HG SER 110 -10.408 3.134 5.252 724 H LYS 111 H LYS 111 -12.288 0.775 2.201 725 HA LYS 111 HA LYS 111 -11.991 -1.665 3.805 726 HB3 LYS 111 2HB LYS 111 -12.251 -1.981 0.903 727 HG3 LYS 111 2HG LYS 111 -12.574 -3.819 2.521 728 HD3 LYS 111 2HD LYS 111 -14.285 -1.926 3.776 729 HE3 LYS 111 2HE LYS 111 -15.662 -4.434 2.823 730 HZ1 LYS 111 3HZ LYS 111 -17.046 -4.315 4.539 731 HZ2 LYS 111 1HZ LYS 111 -17.219 -2.637 4.404 732 HZ3 LYS 111 2HZ LYS 111 -15.931 -3.287 5.287 733 H VAL 112 H VAL 112 -10.805 -3.292 1.882 734 HA VAL 112 HA VAL 112 -8.056 -2.330 2.025 735 HB VAL 112 HB VAL 112 -7.344 -4.537 1.755 736 HG11 VAL 112 1HG1 VAL 112 -8.089 -5.175 3.746 737 HG12 VAL 112 2HG1 VAL 112 -9.378 -3.975 3.629 738 HG13 VAL 112 3HG1 VAL 112 -9.647 -5.619 3.050 739 HG21 VAL 112 3HG2 VAL 112 -8.256 -5.536 -0.050 740 HG22 VAL 112 1HG2 VAL 112 -9.341 -6.249 1.143 741 HG23 VAL 112 2HG2 VAL 112 -9.847 -4.828 0.230 742 H PHE 113 H PHE 113 -6.639 -3.085 0.099 743 HA PHE 113 HA PHE 113 -7.921 -2.079 -2.344 744 HB3 PHE 113 2HB PHE 113 -5.131 -2.241 -2.725 745 HD1 PHE 113 2HD PHE 113 -7.661 0.073 -1.257 746 HD2 PHE 113 1HD PHE 113 -4.601 -0.526 -4.154 747 HE1 PHE 113 2HE PHE 113 -8.115 2.303 -2.192 748 HE2 PHE 113 1HE PHE 113 -5.050 1.702 -5.094 749 HZ PHE 113 HZ PHE 113 -6.810 3.120 -4.114 750 H GLN 114 H GLN 114 -8.659 -3.702 -3.559 751 HA GLN 114 HA GLN 114 -7.497 -6.311 -3.556 752 HB3 GLN 114 2HB GLN 114 -9.844 -6.168 -3.932 753 HG3 GLN 114 2HG GLN 114 -10.054 -5.046 -6.527 754 HE21 GLN 114 1HE2 GLN 114 -10.400 -4.312 -3.081 755 HE22 GLN 114 2HE2 GLN 114 -12.083 -3.929 -3.153 756 H GLY 115 H GLY 115 -6.139 -7.259 -4.998 757 HA2 GLY 115 2HA GLY 115 -4.955 -5.470 -7.021 758 HA3 GLY 115 3HA GLY 115 -4.124 -6.816 -6.256 759 H ASN 116 H ASN 116 -4.676 -8.968 -6.880 760 HA ASN 116 HA ASN 116 -5.169 -10.608 -8.378 761 HB3 ASN 116 2HB ASN 116 -7.242 -10.543 -9.524 762 HD21 ASN 116 1HD2 ASN 116 -8.315 -7.726 -8.048 763 HD22 ASN 116 2HD2 ASN 116 -8.936 -8.422 -6.593 764 H LEU 117 H LEU 117 -6.101 -10.302 -11.086 765 HA LEU 117 HA LEU 117 -5.366 -9.856 -13.197 766 HB3 LEU 117 2HB LEU 117 -4.236 -7.876 -13.678 767 HG LEU 117 HG LEU 117 -5.698 -7.407 -11.091 768 HD11 LEU 117 1HD1 LEU 117 -4.685 -5.269 -12.948 769 HD12 LEU 117 2HD1 LEU 117 -3.854 -5.739 -11.465 770 HD13 LEU 117 3HD1 LEU 117 -5.483 -5.066 -11.388 771 HD21 LEU 117 3HD2 LEU 117 -7.497 -6.825 -12.382 772 HD22 LEU 117 1HD2 LEU 117 -6.764 -8.062 -13.403 773 HD23 LEU 117 2HD2 LEU 117 -6.499 -6.355 -13.758 774 H ASP 118 H ASP 118 -3.783 -11.371 -10.914 775 HA ASP 118 HA ASP 118 -1.952 -12.718 -10.786 776 HB3 ASP 118 2HB ASP 118 -1.253 -13.817 -12.794 777 H ASN 119 H ASN 119 0.438 -12.934 -11.651 778 HA ASN 119 HA ASN 119 1.721 -10.480 -11.010 779 HB3 ASN 119 2HB ASN 119 2.517 -12.952 -10.665 780 HD21 ASN 119 1HD2 ASN 119 4.988 -11.854 -12.703 781 HD22 ASN 119 2HD2 ASN 119 4.872 -13.087 -13.909 782 H ASN 120 H ASN 120 1.049 -12.185 -14.003 783 HA ASN 120 HA ASN 120 2.742 -10.917 -15.769 784 HB3 ASN 120 2HB ASN 120 0.153 -11.160 -16.990 785 HD21 ASN 120 1HD2 ASN 120 2.084 -13.977 -16.427 786 HD22 ASN 120 2HD2 ASN 120 2.889 -13.984 -17.956 787 H SER 121 H SER 121 -0.559 -9.887 -14.895 788 HA SER 121 HA SER 121 -0.053 -7.280 -16.107 789 HB3 SER 121 2HB SER 121 -2.256 -7.249 -16.537 790 HG SER 121 HG SER 121 -3.212 -9.456 -15.475 791 H HIS 122 H HIS 122 -0.294 -5.324 -14.975 792 HA HIS 122 HA HIS 122 0.220 -5.569 -12.096 793 HB3 HIS 122 2HB HIS 122 1.114 -3.265 -12.268 794 HD1 HIS 122 1HD HIS 122 3.536 -2.750 -13.628 795 HD2 HIS 122 2HD HIS 122 2.105 -6.646 -13.465 796 HE1 HIS 122 1HE HIS 122 5.526 -4.216 -14.088 797 H LYS 123 H LYS 123 -0.440 -3.173 -11.111 798 HA LYS 123 HA LYS 123 -3.199 -2.589 -11.883 799 HB3 LYS 123 2HB LYS 123 -2.369 -3.341 -9.073 800 HG3 LYS 123 2HG LYS 123 -5.195 -2.910 -9.932 801 HD3 LYS 123 2HD LYS 123 -3.998 -3.824 -7.618 802 HE3 LYS 123 2HE LYS 123 -5.191 -1.428 -6.539 803 HZ1 LYS 123 3HZ LYS 123 -2.565 -1.598 -5.771 804 HZ2 LYS 123 1HZ LYS 123 -3.034 -3.206 -6.010 805 HZ3 LYS 123 2HZ LYS 123 -3.898 -2.223 -4.939 806 H LYS 124 H LYS 124 -2.913 -0.504 -12.426 807 HA LYS 124 HA LYS 124 -1.506 1.246 -10.524 808 HB3 LYS 124 2HB LYS 124 -2.148 1.747 -13.436 809 HG3 LYS 124 2HG LYS 124 0.055 3.232 -12.272 810 HD3 LYS 124 2HD LYS 124 -2.363 3.778 -13.951 811 HE3 LYS 124 2HE LYS 124 -1.075 5.665 -12.192 812 HZ1 LYS 124 3HZ LYS 124 -0.830 7.409 -13.928 813 HZ2 LYS 124 1HZ LYS 124 -0.893 6.194 -15.105 814 HZ3 LYS 124 2HZ LYS 124 0.367 6.215 -13.978 815 H ASN 125 H ASN 125 -2.614 2.748 -9.440 816 HA ASN 125 HA ASN 125 -5.427 3.176 -10.175 817 HB3 ASN 125 2HB ASN 125 -5.887 3.646 -7.898 818 HD21 ASN 125 1HD2 ASN 125 -6.760 1.775 -7.388 819 HD22 ASN 125 2HD2 ASN 125 -5.906 0.302 -7.094 820 H ILE 126 H ILE 126 -6.138 5.146 -10.737 821 HA ILE 126 HA ILE 126 -4.323 7.204 -11.376 822 HB ILE 126 HB ILE 126 -6.780 6.688 -12.229 823 HG13 ILE 126 2HG1 ILE 126 -4.908 8.709 -12.604 824 HG21 ILE 126 1HG2 ILE 126 -7.609 7.376 -9.881 825 HG22 ILE 126 2HG2 ILE 126 -7.367 9.025 -10.455 826 HG23 ILE 126 3HG2 ILE 126 -8.487 7.955 -11.296 827 HD11 ILE 126 3HD1 ILE 126 -7.166 9.160 -14.308 828 HD12 ILE 126 1HD1 ILE 126 -5.578 8.499 -14.698 829 HD13 ILE 126 2HD1 ILE 126 -6.863 7.432 -14.132 830 H PHE 127 H PHE 127 -5.007 9.570 -10.622 831 HA PHE 127 HA PHE 127 -4.262 9.717 -7.869 832 HB3 PHE 127 2HB PHE 127 -3.377 11.482 -9.074 833 HD1 PHE 127 2HD PHE 127 -6.812 12.660 -9.680 834 HD2 PHE 127 1HD PHE 127 -3.207 11.216 -11.423 835 HE1 PHE 127 2HE PHE 127 -7.633 13.309 -11.906 836 HE2 PHE 127 1HE PHE 127 -4.023 11.865 -13.653 837 HZ PHE 127 HZ PHE 127 -6.238 12.911 -13.897 838 H GLU 128 H GLU 128 -6.263 8.372 -7.302 839 HA GLU 128 HA GLU 128 -8.833 9.511 -7.326 840 HB3 GLU 128 2HB GLU 128 -7.864 7.617 -5.197 841 HG3 GLU 128 2HG GLU 128 -10.186 8.301 -5.014 842 H LYS 129 H LYS 129 -6.078 10.157 -5.393 843 HA LYS 129 HA LYS 129 -7.306 12.364 -4.114 844 HB3 LYS 129 2HB LYS 129 -6.625 11.128 -1.769 845 HG3 LYS 129 2HG LYS 129 -9.327 10.469 -2.131 846 HD3 LYS 129 2HD LYS 129 -8.201 13.066 -1.092 847 HE3 LYS 129 2HE LYS 129 -10.719 11.504 -0.644 848 HZ1 LYS 129 3HZ LYS 129 -11.040 12.332 1.411 849 HZ2 LYS 129 1HZ LYS 129 -10.165 13.749 1.118 850 HZ3 LYS 129 2HZ LYS 129 -9.350 12.311 1.474 851 HA PRO 130 HA PRO 130 -2.683 12.378 -4.495 852 HB3 PRO 130 2HB PRO 130 -2.795 13.285 -6.603 853 HG3 PRO 130 2HG PRO 130 -4.675 14.458 -7.307 854 HD3 PRO 130 2HD PRO 130 -5.679 12.552 -6.486 855 H PHE 131 H PHE 131 -1.275 13.427 -3.150 856 HA PHE 131 HA PHE 131 -1.584 15.933 -1.995 857 HB3 PHE 131 2HB PHE 131 -2.114 14.157 0.266 858 HD1 PHE 131 1HD PHE 131 -3.636 16.855 -1.817 859 HD2 PHE 131 2HD PHE 131 -2.558 15.494 2.069 860 HE1 PHE 131 1HE PHE 131 -4.412 18.986 -0.860 861 HE2 PHE 131 2HE PHE 131 -3.333 17.621 3.033 862 HZ PHE 131 HZ PHE 131 -4.263 19.370 1.568 863 H MET 132 H MET 132 -0.164 16.185 0.017 864 HA MET 132 HA MET 132 2.363 14.990 -0.549 865 HB3 MET 132 2HB MET 132 2.247 17.274 0.260 866 HG3 MET 132 2HG MET 132 1.672 16.594 3.045 867 HE1 MET 132 3HE MET 132 1.134 19.163 -0.174 868 HE2 MET 132 1HE MET 132 -0.274 18.195 0.263 869 HE3 MET 132 2HE MET 132 -0.259 19.927 0.594 870 H ALA 133 H ALA 133 3.667 13.764 0.939 871 HA ALA 133 HA ALA 133 2.336 12.429 3.142 872 HB1 ALA 133 1HB ALA 133 2.051 11.226 0.753 873 HB2 ALA 133 2HB ALA 133 3.579 10.516 1.276 874 HB3 ALA 133 3HB ALA 133 2.140 10.352 2.282 875 H ARG 134 H ARG 134 3.754 11.496 4.616 876 HA ARG 134 HA ARG 134 6.608 12.029 4.103 877 HB3 ARG 134 2HB ARG 134 5.871 11.785 6.912 878 HG3 ARG 134 2HG ARG 134 6.781 14.392 6.164 879 HD3 ARG 134 2HD ARG 134 7.212 13.434 8.323 880 HE ARG 134 HE ARG 134 8.071 11.111 6.916 881 HH11 ARG 134 1HH1 ARG 134 8.555 12.952 9.830 882 HH12 ARG 134 2HH1 ARG 134 9.101 11.593 10.754 883 HH21 ARG 134 1HH2 ARG 134 8.789 9.312 8.121 884 HH22 ARG 134 2HH2 ARG 134 9.235 9.523 9.781 885 H TYR 135 H TYR 135 4.263 9.815 5.508 886 HA TYR 135 HA TYR 135 6.060 7.599 5.090 887 HB3 TYR 135 2HB TYR 135 5.320 8.534 7.850 888 HD1 TYR 135 2HD TYR 135 7.564 5.751 7.049 889 HD2 TYR 135 1HD TYR 135 3.757 6.841 8.603 890 HE1 TYR 135 2HE TYR 135 7.289 3.479 7.951 891 HE2 TYR 135 1HE TYR 135 3.472 4.572 9.511 892 HH TYR 135 HH TYR 135 5.507 2.600 10.205 893 H VAL 136 H VAL 136 4.952 5.805 4.585 894 HA VAL 136 HA VAL 136 2.089 5.703 5.275 895 HB VAL 136 HB VAL 136 1.497 4.894 3.149 896 HG11 VAL 136 1HG1 VAL 136 3.599 6.970 2.556 897 HG12 VAL 136 2HG1 VAL 136 2.115 6.651 1.656 898 HG13 VAL 136 3HG1 VAL 136 2.034 7.336 3.281 899 HG21 VAL 136 3HG2 VAL 136 2.903 3.365 2.298 900 HG22 VAL 136 1HG2 VAL 136 3.660 4.741 1.495 901 HG23 VAL 136 2HG2 VAL 136 4.323 4.131 3.011 902 H ARG 137 H ARG 137 1.204 3.659 5.662 903 HA ARG 137 HA ARG 137 3.194 1.533 6.110 904 HB3 ARG 137 2HB ARG 137 0.632 2.105 7.607 905 HG3 ARG 137 2HG ARG 137 2.104 0.362 9.133 906 HD3 ARG 137 2HD ARG 137 -0.079 -0.472 7.237 907 HE ARG 137 HE ARG 137 0.201 -2.332 8.544 908 HH11 ARG 137 1HH1 ARG 137 0.340 0.512 10.548 909 HH12 ARG 137 2HH1 ARG 137 0.335 -0.377 12.035 910 HH21 ARG 137 1HH2 ARG 137 0.194 -3.512 10.495 911 HH22 ARG 137 2HH2 ARG 137 0.254 -2.665 12.005 912 H VAL 138 H VAL 138 2.694 -0.571 5.527 913 HA VAL 138 HA VAL 138 0.190 -0.971 4.035 914 HB VAL 138 HB VAL 138 2.895 -1.972 3.134 915 HG11 VAL 138 1HG1 VAL 138 1.032 -2.084 1.053 916 HG12 VAL 138 2HG1 VAL 138 1.718 -3.441 1.950 917 HG13 VAL 138 3HG1 VAL 138 0.195 -2.718 2.470 918 HG21 VAL 138 3HG2 VAL 138 3.192 -0.003 2.149 919 HG22 VAL 138 1HG2 VAL 138 1.722 -0.273 1.213 920 HG23 VAL 138 2HG2 VAL 138 1.641 0.569 2.761 921 H LEU 139 H LEU 139 -0.744 -2.972 4.215 922 HA LEU 139 HA LEU 139 0.675 -5.139 5.519 923 HB3 LEU 139 2HB LEU 139 -1.593 -3.646 6.776 924 HG LEU 139 HG LEU 139 -1.091 -6.559 7.059 925 HD11 LEU 139 1HD1 LEU 139 -0.722 -4.845 9.250 926 HD12 LEU 139 2HD1 LEU 139 -0.909 -6.598 9.267 927 HD13 LEU 139 3HD1 LEU 139 -2.323 -5.560 9.443 928 HD21 LEU 139 3HD2 LEU 139 -3.171 -6.285 6.210 929 HD22 LEU 139 1HD2 LEU 139 -3.365 -4.677 6.908 930 HD23 LEU 139 2HD2 LEU 139 -3.587 -6.106 7.915 931 HA PRO 140 HA PRO 140 -1.893 -7.163 2.496 932 HB3 PRO 140 2HB PRO 140 -0.056 -8.465 2.037 933 HG3 PRO 140 2HG PRO 140 1.509 -8.955 3.686 934 HD3 PRO 140 2HD PRO 140 1.370 -6.668 3.937 935 H VAL 141 H VAL 141 -3.796 -8.288 2.531 936 HA VAL 141 HA VAL 141 -4.690 -9.306 5.151 937 HB VAL 141 HB VAL 141 -6.363 -7.919 3.050 938 HG11 VAL 141 1HG1 VAL 141 -7.941 -8.074 5.235 939 HG12 VAL 141 2HG1 VAL 141 -7.973 -9.241 3.912 940 HG13 VAL 141 3HG1 VAL 141 -7.051 -9.589 5.376 941 HG21 VAL 141 3HG2 VAL 141 -5.077 -7.039 5.569 942 HG22 VAL 141 1HG2 VAL 141 -5.416 -6.138 4.092 943 HG23 VAL 141 2HG2 VAL 141 -6.709 -6.450 5.251 944 H SER 142 H SER 142 -5.115 -9.571 1.635 945 HA SER 142 HA SER 142 -5.557 -12.449 1.973 946 HB3 SER 142 2HB SER 142 -7.500 -12.509 0.640 947 HG SER 142 HG SER 142 -7.909 -11.572 2.706 948 H TRP 143 H TRP 143 -3.914 -13.338 0.916 949 HA TRP 143 HA TRP 143 -3.156 -12.207 -1.699 950 HB3 TRP 143 2HB TRP 143 -1.384 -11.996 0.005 951 HD1 TRP 143 HD TRP 143 -0.233 -15.499 -0.722 952 HE1 TRP 143 1HE TRP 143 -0.060 -16.825 1.478 953 HE3 TRP 143 3HE TRP 143 -2.580 -12.201 2.401 954 HZ2 TRP 143 2HZ TRP 143 -0.817 -16.515 4.179 955 HZ3 TRP 143 3HZ TRP 143 -2.814 -12.792 4.778 956 HH2 TRP 143 HH TRP 143 -1.951 -14.904 5.647 957 H HIS 144 H HIS 144 -1.910 -13.988 -3.019 958 HA HIS 144 HA HIS 144 -3.336 -16.547 -2.794 959 HB3 HIS 144 2HB HIS 144 -3.347 -16.487 -5.388 960 HD1 HIS 144 1HD HIS 144 -5.074 -13.553 -3.707 961 HD2 HIS 144 2HD HIS 144 -5.934 -17.311 -5.258 962 HE1 HIS 144 1HE HIS 144 -7.578 -13.765 -3.610 963 H ASN 145 H ASN 145 -2.045 -18.268 -2.925 964 HA ASN 145 HA ASN 145 -0.268 -19.608 -3.454 965 HB3 ASN 145 2HB ASN 145 1.317 -17.636 -4.936 966 HD21 ASN 145 1HD2 ASN 145 2.467 -19.743 -4.433 967 HD22 ASN 145 2HD2 ASN 145 2.321 -20.993 -5.615 968 H ARG 146 H ARG 146 0.955 -16.265 -3.176 969 HA ARG 146 HA ARG 146 2.042 -16.596 -0.609 970 HB3 ARG 146 2HB ARG 146 3.966 -16.992 -2.900 971 HG3 ARG 146 2HG ARG 146 4.856 -15.399 -1.170 972 HD3 ARG 146 2HD ARG 146 3.752 -16.517 0.766 973 HE ARG 146 HE ARG 146 4.150 -18.750 0.958 974 HH11 ARG 146 1HH1 ARG 146 7.113 -17.176 0.034 975 HH12 ARG 146 2HH1 ARG 146 8.068 -18.618 0.147 976 HH21 ARG 146 1HH2 ARG 146 5.395 -20.656 1.111 977 HH22 ARG 146 2HH2 ARG 146 7.089 -20.597 0.758 978 H ILE 147 H ILE 147 2.774 -14.671 0.220 979 HA ILE 147 HA ILE 147 2.029 -12.302 -1.086 980 HB ILE 147 HB ILE 147 3.863 -12.693 1.280 981 HG13 ILE 147 2HG1 ILE 147 0.919 -12.444 0.912 982 HG21 ILE 147 1HG2 ILE 147 4.419 -10.559 0.612 983 HG22 ILE 147 2HG2 ILE 147 2.816 -10.234 -0.047 984 HG23 ILE 147 3HG2 ILE 147 3.065 -10.246 1.699 985 HD11 ILE 147 3HD1 ILE 147 1.492 -14.560 1.644 986 HD12 ILE 147 1HD1 ILE 147 2.746 -13.956 2.726 987 HD13 ILE 147 2HD1 ILE 147 1.045 -13.731 3.134 988 H THR 148 H THR 148 3.018 -12.127 -3.087 989 HA THR 148 HA THR 148 5.807 -11.251 -2.995 990 HB THR 148 HB THR 148 5.050 -12.914 -5.342 991 HG1 THR 148 1HG THR 148 4.452 -14.361 -3.796 992 HG21 THR 148 3HG2 THR 148 7.331 -11.643 -4.517 993 HG22 THR 148 1HG2 THR 148 7.271 -12.958 -5.690 994 HG23 THR 148 2HG2 THR 148 7.623 -13.302 -3.997 995 H LEU 149 H LEU 149 5.536 -9.174 -3.560 996 HA LEU 149 HA LEU 149 4.828 -8.507 -6.224 997 HB3 LEU 149 2HB LEU 149 2.594 -8.879 -4.983 998 HG LEU 149 HG LEU 149 3.159 -6.073 -4.029 999 HD11 LEU 149 1HD1 LEU 149 0.750 -7.327 -4.779 1000 HD12 LEU 149 2HD1 LEU 149 0.966 -5.772 -3.978 1001 HD13 LEU 149 3HD1 LEU 149 0.759 -7.236 -3.017 1002 HD21 LEU 149 3HD2 LEU 149 2.755 -8.646 -2.510 1003 HD22 LEU 149 1HD2 LEU 149 2.768 -7.039 -1.783 1004 HD23 LEU 149 2HD2 LEU 149 4.220 -7.664 -2.565 1005 H ARG 150 H ARG 150 4.362 -5.897 -6.172 1006 HA ARG 150 HA ARG 150 6.232 -4.664 -4.287 1007 HB3 ARG 150 2HB ARG 150 6.489 -4.711 -7.273 1008 HG3 ARG 150 2HG ARG 150 8.356 -2.899 -6.630 1009 HD3 ARG 150 2HD ARG 150 6.744 -1.170 -7.504 1010 HE ARG 150 HE ARG 150 7.459 -3.574 -8.932 1011 HH11 ARG 150 1HH1 ARG 150 5.967 -0.434 -9.114 1012 HH12 ARG 150 2HH1 ARG 150 6.196 -0.279 -10.824 1013 HH21 ARG 150 1HH2 ARG 150 7.765 -3.383 -11.185 1014 HH22 ARG 150 2HH2 ARG 150 7.219 -1.958 -12.001 1015 H LEU 151 H LEU 151 5.696 -2.621 -3.691 1016 HA LEU 151 HA LEU 151 3.348 -1.427 -5.011 1017 HB3 LEU 151 2HB LEU 151 2.654 -2.104 -2.868 1018 HG LEU 151 HG LEU 151 5.320 -1.660 -1.987 1019 HD11 LEU 151 1HD1 LEU 151 3.261 0.109 -0.742 1020 HD12 LEU 151 2HD1 LEU 151 4.948 0.446 -1.129 1021 HD13 LEU 151 3HD1 LEU 151 4.548 -0.580 0.249 1022 HD21 LEU 151 3HD2 LEU 151 4.132 -3.647 -1.459 1023 HD22 LEU 151 1HD2 LEU 151 2.818 -2.741 -0.706 1024 HD23 LEU 151 2HD2 LEU 151 4.406 -2.796 0.062 1025 H GLU 152 H GLU 152 3.984 0.248 -6.199 1026 HA GLU 152 HA GLU 152 6.026 2.055 -5.082 1027 HB3 GLU 152 2HB GLU 152 5.666 2.371 -7.927 1028 HG3 GLU 152 2HG GLU 152 8.151 1.138 -7.047 1029 H LEU 153 H LEU 153 5.665 4.249 -5.142 1030 HA LEU 153 HA LEU 153 2.947 5.070 -5.931 1031 HB3 LEU 153 2HB LEU 153 3.190 5.221 -3.561 1032 HG LEU 153 HG LEU 153 5.838 5.648 -3.789 1033 HD11 LEU 153 1HD1 LEU 153 5.107 8.046 -4.566 1034 HD12 LEU 153 2HD1 LEU 153 6.495 7.823 -3.500 1035 HD13 LEU 153 3HD1 LEU 153 4.941 8.320 -2.831 1036 HD21 LEU 153 3HD2 LEU 153 3.871 6.136 -1.605 1037 HD22 LEU 153 1HD2 LEU 153 5.563 6.553 -1.340 1038 HD23 LEU 153 2HD2 LEU 153 5.118 4.896 -1.745 1039 H LEU 154 H LEU 154 2.684 6.843 -7.202 1040 HA LEU 154 HA LEU 154 5.145 8.162 -8.145 1041 HB3 LEU 154 2HB LEU 154 4.181 8.399 -10.288 1042 HG LEU 154 HG LEU 154 4.665 5.883 -9.436 1043 HD11 LEU 154 1HD1 LEU 154 1.867 6.074 -9.359 1044 HD12 LEU 154 2HD1 LEU 154 2.856 4.622 -9.218 1045 HD13 LEU 154 3HD1 LEU 154 2.260 5.132 -10.797 1046 HD21 LEU 154 3HD2 LEU 154 3.949 5.353 -11.957 1047 HD22 LEU 154 1HD2 LEU 154 5.405 6.259 -11.543 1048 HD23 LEU 154 2HD2 LEU 154 3.941 7.116 -12.026 1049 H GLY 155 H GLY 155 5.090 10.401 -8.552 1050 HA2 GLY 155 2HA GLY 155 2.808 11.801 -7.298 1051 HA3 GLY 155 3HA GLY 155 4.476 12.311 -7.079 1052 H CYS 156 H CYS 156 3.243 14.339 -7.846 1053 HA CYS 156 HA CYS 156 3.204 14.435 -10.787 1054 HB3 CYS 156 2HB CYS 156 2.147 16.834 -9.832 1055 H LEU 157 H LEU 157 4.924 15.445 -8.029 1056 HA LEU 157 HA LEU 157 6.657 16.882 -7.675 1057 HB3 LEU 157 2HB LEU 157 7.461 16.908 -10.505 1058 HG LEU 157 HG LEU 157 9.590 16.147 -9.745 1059 HD11 LEU 157 1HD1 LEU 157 9.134 18.505 -9.385 1060 HD12 LEU 157 2HD1 LEU 157 10.168 17.872 -8.105 1061 HD13 LEU 157 3HD1 LEU 157 8.454 18.148 -7.797 1062 HD21 LEU 157 3HD2 LEU 157 9.913 14.866 -7.954 1063 HD22 LEU 157 1HD2 LEU 157 8.158 14.786 -7.806 1064 HD23 LEU 157 2HD2 LEU 157 9.065 15.997 -6.900 1065 H GLU 158 H GLU 158 4.147 18.107 -8.338 1066 HA GLU 158 HA GLU 158 5.120 20.586 -9.599 1067 HB3 GLU 158 2HB GLU 158 2.224 20.251 -9.636 1068 HG3 GLU 158 2HG GLU 158 2.867 20.453 -12.204 Start of MODEL 19 1 H1 MET -5 H MET -5 3.760 28.416 -12.552 2 HA MET -5 HA MET -5 3.346 26.068 -12.428 3 HB3 MET -5 2HB MET -5 1.012 25.290 -11.991 4 HG3 MET -5 2HG MET -5 2.840 25.994 -10.143 5 HE1 MET -5 3HE MET -5 2.224 27.500 -7.016 6 HE2 MET -5 1HE MET -5 0.538 26.986 -7.042 7 HE3 MET -5 2HE MET -5 1.802 25.890 -7.600 8 H LYS -4 H LYS -4 3.784 27.449 -14.619 9 HA LYS -4 HA LYS -4 1.669 26.590 -16.484 10 HB3 LYS -4 2HB LYS -4 2.457 28.487 -17.959 11 HG3 LYS -4 2HG LYS -4 0.763 28.639 -15.663 12 HD3 LYS -4 2HD LYS -4 1.856 31.321 -16.428 13 HE3 LYS -4 2HE LYS -4 0.990 31.109 -13.738 14 HZ1 LYS -4 3HZ LYS -4 0.396 32.627 -16.089 15 HZ2 LYS -4 1HZ LYS -4 0.389 33.107 -14.466 16 HZ3 LYS -4 2HZ LYS -4 -0.979 32.372 -15.135 17 H SER -3 H SER -3 2.420 26.030 -18.642 18 HA SER -3 HA SER -3 3.712 24.752 -20.014 19 HB3 SER -3 2HB SER -3 6.151 26.095 -18.887 20 HG SER -3 HG SER -3 6.882 25.302 -20.677 21 H GLY -2 H GLY -2 3.139 23.706 -17.380 22 HA2 GLY -2 2HA GLY -2 5.349 22.520 -16.136 23 HA3 GLY -2 3HA GLY -2 3.703 21.906 -16.074 24 H HIS -1 H HIS -1 6.480 20.671 -16.431 25 HA HIS -1 HA HIS -1 6.635 19.551 -19.010 26 HB3 HIS -1 2HB HIS -1 8.044 17.776 -17.814 27 HD1 HIS -1 1HD HIS -1 9.056 20.835 -15.993 28 HD2 HIS -1 2HD HIS -1 9.690 19.107 -19.718 29 HE1 HIS -1 1HE HIS -1 11.001 22.080 -16.988 30 H GLY 0 H GLY 0 5.939 17.668 -16.069 31 HA2 GLY 0 2HA GLY 0 3.438 16.682 -16.871 32 HA3 GLY 0 3HA GLY 0 4.671 15.573 -17.453 33 H CYS 1 H CYS 1 2.849 14.600 -15.734 34 HA CYS 1 HA CYS 1 4.275 14.473 -13.158 35 HB3 CYS 1 2HB CYS 1 2.182 13.972 -12.081 36 H SER 2 H SER 2 3.064 12.241 -12.098 37 HA SER 2 HA SER 2 3.167 9.967 -12.042 38 HB3 SER 2 2HB SER 2 2.324 8.838 -13.837 39 HG SER 2 HG SER 2 1.326 10.374 -15.352 40 H GLU 3 H GLU 3 5.507 11.203 -11.598 41 HA GLU 3 HA GLU 3 7.523 9.863 -13.250 42 HB3 GLU 3 2HB GLU 3 9.112 11.399 -12.395 43 HG3 GLU 3 2HG GLU 3 8.110 13.634 -12.665 44 HA PRO 4 HA PRO 4 8.478 6.837 -10.218 45 HB3 PRO 4 2HB PRO 4 9.937 5.939 -11.749 46 HG3 PRO 4 2HG PRO 4 11.188 7.304 -13.157 47 HD3 PRO 4 2HD PRO 4 9.092 8.202 -13.494 48 H LEU 5 H LEU 5 10.574 6.404 -8.650 49 HA LEU 5 HA LEU 5 10.956 8.896 -7.125 50 HB3 LEU 5 2HB LEU 5 9.466 7.707 -5.806 51 HG LEU 5 HG LEU 5 9.820 5.306 -5.112 52 HD11 LEU 5 1HD1 LEU 5 9.229 4.933 -7.894 53 HD12 LEU 5 2HD1 LEU 5 8.489 6.424 -7.310 54 HD13 LEU 5 3HD1 LEU 5 8.145 4.894 -6.504 55 HD21 LEU 5 3HD2 LEU 5 12.189 5.308 -6.090 56 HD22 LEU 5 1HD2 LEU 5 11.403 5.062 -7.650 57 HD23 LEU 5 2HD2 LEU 5 11.188 3.879 -6.358 58 H GLY 6 H GLY 6 12.448 6.504 -8.857 59 HA2 GLY 6 2HA GLY 6 15.054 7.330 -8.005 60 HA3 GLY 6 3HA GLY 6 14.675 5.700 -7.467 61 H LEU 7 H LEU 7 13.482 7.040 -10.472 62 HA LEU 7 HA LEU 7 15.422 5.412 -11.963 63 HB3 LEU 7 2HB LEU 7 13.805 4.380 -13.261 64 HG LEU 7 HG LEU 7 12.397 4.614 -10.602 65 HD11 LEU 7 1HD1 LEU 7 11.392 3.617 -12.966 66 HD12 LEU 7 2HD1 LEU 7 10.831 3.214 -11.344 67 HD13 LEU 7 3HD1 LEU 7 12.016 2.184 -12.148 68 HD21 LEU 7 3HD2 LEU 7 14.092 3.404 -9.826 69 HD22 LEU 7 1HD2 LEU 7 14.795 3.247 -11.435 70 HD23 LEU 7 2HD2 LEU 7 13.567 2.102 -10.895 71 H LYS 8 H LYS 8 14.933 8.355 -11.388 72 HA LYS 8 HA LYS 8 15.166 9.227 -14.179 73 HB3 LYS 8 2HB LYS 8 13.434 10.536 -12.075 74 HG3 LYS 8 2HG LYS 8 14.620 12.200 -13.498 75 HD3 LYS 8 2HD LYS 8 12.935 11.650 -15.818 76 HE3 LYS 8 2HE LYS 8 15.219 13.099 -15.218 77 HZ1 LYS 8 3HZ LYS 8 15.959 10.583 -16.393 78 HZ2 LYS 8 1HZ LYS 8 16.928 11.766 -15.672 79 HZ3 LYS 8 2HZ LYS 8 16.482 11.915 -17.296 80 H ASN 9 H ASN 9 15.065 10.964 -11.078 81 HA ASN 9 HA ASN 9 17.905 11.633 -11.415 82 HB3 ASN 9 2HB ASN 9 16.937 13.946 -10.354 83 HD21 ASN 9 1HD2 ASN 9 19.132 13.757 -11.442 84 HD22 ASN 9 2HD2 ASN 9 19.233 14.361 -13.058 85 H ASN 10 H ASN 10 15.095 11.494 -9.285 86 HA ASN 10 HA ASN 10 16.243 12.133 -6.860 87 HB3 ASN 10 2HB ASN 10 14.535 10.347 -5.969 88 HD21 ASN 10 1HD2 ASN 10 14.341 12.945 -8.355 89 HD22 ASN 10 2HD2 ASN 10 13.221 13.916 -7.467 90 H THR 11 H THR 11 16.154 8.970 -8.470 91 HA THR 11 HA THR 11 17.267 7.017 -8.067 92 HB THR 11 HB THR 11 19.630 7.171 -7.885 93 HG1 THR 11 1HG THR 11 20.396 8.489 -6.427 94 HG21 THR 11 3HG2 THR 11 19.508 9.772 -9.144 95 HG22 THR 11 1HG2 THR 11 18.199 8.731 -9.701 96 HG23 THR 11 2HG2 THR 11 19.873 8.199 -9.853 97 H ILE 12 H ILE 12 15.600 7.683 -5.966 98 HA ILE 12 HA ILE 12 16.718 7.794 -3.425 99 HB ILE 12 HB ILE 12 14.152 6.550 -4.393 100 HG13 ILE 12 2HG1 ILE 12 13.133 8.507 -3.361 101 HG21 ILE 12 1HG2 ILE 12 13.485 6.504 -1.980 102 HG22 ILE 12 2HG2 ILE 12 14.706 5.315 -2.432 103 HG23 ILE 12 3HG2 ILE 12 15.179 6.780 -1.571 104 HD11 ILE 12 3HD1 ILE 12 15.905 9.468 -2.707 105 HD12 ILE 12 1HD1 ILE 12 14.384 10.311 -2.414 106 HD13 ILE 12 2HD1 ILE 12 14.759 8.833 -1.526 107 HA PRO 13 HA PRO 13 18.755 3.872 -3.099 108 HB3 PRO 13 2HB PRO 13 20.182 4.921 -1.635 109 HG3 PRO 13 2HG PRO 13 19.440 6.647 -0.265 110 HD3 PRO 13 2HD PRO 13 18.640 7.381 -2.298 111 H ASP 14 H ASP 14 18.690 2.191 -1.008 112 HA ASP 14 HA ASP 14 16.102 1.003 -1.222 113 HB3 ASP 14 2HB ASP 14 17.017 -0.755 0.220 114 H SER 15 H SER 15 17.272 3.448 0.703 115 HA SER 15 HA SER 15 15.900 2.798 3.142 116 HB3 SER 15 2HB SER 15 16.790 5.569 2.383 117 HG SER 15 HG SER 15 16.772 5.850 4.484 118 H GLN 16 H GLN 16 14.009 2.428 1.347 119 HA GLN 16 HA GLN 16 12.216 4.718 1.747 120 HB3 GLN 16 2HB GLN 16 12.828 4.965 -0.527 121 HG3 GLN 16 2HG GLN 16 12.179 2.079 -1.052 122 HE21 GLN 16 1HE2 GLN 16 14.216 1.842 -2.941 123 HE22 GLN 16 2HE2 GLN 16 13.804 2.798 -4.320 124 H MET 17 H MET 17 12.390 1.312 0.726 125 HA MET 17 HA MET 17 9.760 0.874 1.963 126 HB3 MET 17 2HB MET 17 10.531 -1.454 0.602 127 HG3 MET 17 2HG MET 17 8.443 0.502 0.455 128 HE1 MET 17 3HE MET 17 8.335 -1.315 -3.649 129 HE2 MET 17 1HE MET 17 9.623 -1.936 -2.617 130 HE3 MET 17 2HE MET 17 7.947 -2.012 -2.075 131 H SER 18 H SER 18 9.469 -0.632 3.558 132 HA SER 18 HA SER 18 11.595 -2.417 4.343 133 HB3 SER 18 2HB SER 18 12.546 -1.043 5.845 134 HG SER 18 HG SER 18 10.355 0.720 5.947 135 H ALA 19 H ALA 19 10.717 -4.237 5.072 136 HA ALA 19 HA ALA 19 8.026 -4.122 6.265 137 HB1 ALA 19 1HB ALA 19 7.214 -5.437 4.678 138 HB2 ALA 19 2HB ALA 19 8.768 -5.370 3.847 139 HB3 ALA 19 3HB ALA 19 8.449 -6.651 5.016 140 H SER 20 H SER 20 7.510 -6.141 7.531 141 HA SER 20 HA SER 20 9.234 -6.465 9.653 142 HB3 SER 20 2HB SER 20 7.344 -7.442 10.369 143 HG SER 20 HG SER 20 6.761 -8.060 7.659 144 H SER 21 H SER 21 8.990 -8.410 6.711 145 HA SER 21 HA SER 21 11.681 -9.126 6.646 146 HB3 SER 21 2HB SER 21 11.424 -10.479 8.578 147 HG SER 21 HG SER 21 9.085 -10.540 8.478 148 H SER 22 H SER 22 12.204 -10.472 4.868 149 HA SER 22 HA SER 22 9.946 -10.908 3.026 150 HB3 SER 22 2HB SER 22 11.518 -10.556 1.186 151 HG SER 22 HG SER 22 11.888 -8.370 1.537 152 H TYR 23 H TYR 23 10.549 -12.593 1.281 153 HA TYR 23 HA TYR 23 10.667 -15.097 2.410 154 HB3 TYR 23 2HB TYR 23 10.037 -14.416 0.012 155 HD1 TYR 23 2HD TYR 23 11.926 -12.416 -0.219 156 HD2 TYR 23 1HD TYR 23 12.372 -16.482 -1.393 157 HE1 TYR 23 2HE TYR 23 13.660 -11.755 -1.834 158 HE2 TYR 23 1HE TYR 23 14.108 -15.831 -3.010 159 HH TYR 23 HH TYR 23 14.909 -13.953 -4.195 160 H LYS 24 H LYS 24 12.228 -16.554 2.924 161 HA LYS 24 HA LYS 24 14.842 -15.570 3.482 162 HB3 LYS 24 2HB LYS 24 13.599 -17.324 4.808 163 HG3 LYS 24 2HG LYS 24 14.736 -19.438 3.091 164 HD3 LYS 24 2HD LYS 24 12.043 -19.354 4.410 165 HE3 LYS 24 2HE LYS 24 13.522 -21.288 2.999 166 HZ1 LYS 24 3HZ LYS 24 14.687 -22.264 4.633 167 HZ2 LYS 24 1HZ LYS 24 13.204 -22.961 5.048 168 HZ3 LYS 24 2HZ LYS 24 13.753 -21.591 5.872 169 H THR 25 H THR 25 16.848 -16.448 2.690 170 HA THR 25 HA THR 25 16.761 -17.850 0.135 171 HB THR 25 HB THR 25 18.671 -15.734 -0.147 172 HG1 THR 25 1HG THR 25 16.033 -14.729 0.044 173 HG21 THR 25 3HG2 THR 25 16.194 -15.714 -1.754 174 HG22 THR 25 1HG2 THR 25 17.112 -17.219 -1.771 175 HG23 THR 25 2HG2 THR 25 17.880 -15.711 -2.270 176 H TRP 26 H TRP 26 19.022 -18.364 -0.633 177 HA TRP 26 HA TRP 26 20.424 -19.728 1.365 178 HB3 TRP 26 2HB TRP 26 22.257 -19.300 -0.706 179 HD1 TRP 26 HD TRP 26 22.766 -21.575 0.846 180 HE1 TRP 26 1HE TRP 26 22.111 -24.016 0.361 181 HE3 TRP 26 3HE TRP 26 19.026 -20.754 -2.542 182 HZ2 TRP 26 2HZ TRP 26 20.255 -25.410 -1.245 183 HZ3 TRP 26 3HZ TRP 26 17.861 -22.695 -3.505 184 HH2 TRP 26 HH TRP 26 18.465 -24.974 -2.870 185 H ASN 27 H ASN 27 20.914 -16.538 -0.042 186 HA ASN 27 HA ASN 27 22.188 -14.766 0.599 187 HB3 ASN 27 2HB ASN 27 23.130 -15.439 3.166 188 HD21 ASN 27 1HD2 ASN 27 23.352 -13.184 2.916 189 HD22 ASN 27 2HD2 ASN 27 22.011 -12.124 3.170 190 H LEU 28 H LEU 28 24.440 -14.134 1.306 191 HA LEU 28 HA LEU 28 26.503 -16.040 1.512 192 HB3 LEU 28 2HB LEU 28 27.054 -14.832 -1.038 193 HG LEU 28 HG LEU 28 26.833 -17.688 -0.130 194 HD11 LEU 28 1HD1 LEU 28 26.673 -16.636 -2.834 195 HD12 LEU 28 2HD1 LEU 28 26.394 -18.271 -2.233 196 HD13 LEU 28 3HD1 LEU 28 28.032 -17.738 -2.609 197 HD21 LEU 28 3HD2 LEU 28 28.811 -16.034 0.341 198 HD22 LEU 28 1HD2 LEU 28 29.237 -16.399 -1.331 199 HD23 LEU 28 2HD2 LEU 28 29.128 -17.700 -0.145 200 H ARG 29 H ARG 29 26.040 -12.940 -0.199 201 HA ARG 29 HA ARG 29 27.247 -11.367 1.796 202 HB3 ARG 29 2HB ARG 29 29.332 -12.368 1.279 203 HG3 ARG 29 2HG ARG 29 28.346 -12.378 -1.477 204 HD3 ARG 29 2HD ARG 29 31.277 -11.919 -0.953 205 HE ARG 29 HE ARG 29 31.309 -12.913 -3.020 206 HH11 ARG 29 1HH1 ARG 29 28.691 -10.623 -2.880 207 HH12 ARG 29 2HH1 ARG 29 28.334 -10.731 -4.572 208 HH21 ARG 29 1HH2 ARG 29 30.849 -13.065 -5.249 209 HH22 ARG 29 2HH2 ARG 29 29.561 -12.121 -5.918 210 H ALA 30 H ALA 30 25.997 -9.644 1.486 211 HA ALA 30 HA ALA 30 26.218 -8.125 -0.944 212 HB1 ALA 30 1HB ALA 30 23.562 -8.100 -1.012 213 HB2 ALA 30 2HB ALA 30 24.517 -9.274 -1.920 214 HB3 ALA 30 3HB ALA 30 23.791 -9.731 -0.379 215 H PHE 31 H PHE 31 24.675 -6.153 -0.803 216 HA PHE 31 HA PHE 31 24.880 -5.126 1.934 217 HB3 PHE 31 2HB PHE 31 24.519 -3.660 -0.687 218 HD1 PHE 31 2HD PHE 31 25.383 -3.241 2.918 219 HD2 PHE 31 1HD PHE 31 23.843 -1.469 -0.633 220 HE1 PHE 31 2HE PHE 31 24.878 -1.183 4.168 221 HE2 PHE 31 1HE PHE 31 23.337 0.593 0.613 222 HZ PHE 31 HZ PHE 31 23.853 0.737 3.015 223 H GLY 32 H GLY 32 22.598 -5.578 -0.711 224 HA2 GLY 32 2HA GLY 32 20.412 -4.163 0.219 225 HA3 GLY 32 3HA GLY 32 20.301 -5.648 -0.717 226 H TRP 33 H TRP 33 18.632 -4.632 1.500 227 HA TRP 33 HA TRP 33 19.186 -6.426 3.706 228 HB3 TRP 33 2HB TRP 33 16.585 -5.283 3.921 229 HD1 TRP 33 HD TRP 33 19.647 -3.248 4.976 230 HE1 TRP 33 1HE TRP 33 19.950 -3.476 7.522 231 HE3 TRP 33 3HE TRP 33 16.122 -6.836 5.894 232 HZ2 TRP 33 2HZ TRP 33 18.841 -4.979 9.640 233 HZ3 TRP 33 3HZ TRP 33 15.806 -7.614 8.206 234 HH2 TRP 33 HH TRP 33 17.137 -6.704 10.039 235 H TYR 34 H TYR 34 16.321 -5.900 1.641 236 HA TYR 34 HA TYR 34 16.021 -8.562 0.848 237 HB3 TYR 34 2HB TYR 34 13.771 -8.587 2.478 238 HD1 TYR 34 2HD TYR 34 14.990 -10.564 0.830 239 HD2 TYR 34 1HD TYR 34 15.808 -9.660 4.906 240 HE1 TYR 34 2HE TYR 34 15.803 -12.861 1.170 241 HE2 TYR 34 1HE TYR 34 16.626 -11.953 5.258 242 HH TYR 34 HH TYR 34 17.675 -13.848 3.320 243 HA PRO 35 HA PRO 35 11.880 -6.232 0.005 244 HB3 PRO 35 2HB PRO 35 11.038 -5.346 1.950 245 HG3 PRO 35 2HG PRO 35 12.451 -4.517 3.601 246 HD3 PRO 35 2HD PRO 35 13.426 -6.575 3.239 247 H HIS 36 H HIS 36 11.412 -3.530 -0.539 248 HA HIS 36 HA HIS 36 11.796 -2.087 -2.272 249 HB3 HIS 36 2HB HIS 36 13.176 -1.050 -0.577 250 HD1 HIS 36 1HD HIS 36 14.296 -2.468 1.238 251 HD2 HIS 36 2HD HIS 36 16.345 -2.466 -2.375 252 HE1 HIS 36 1HE HIS 36 16.535 -3.500 1.734 253 H LEU 37 H LEU 37 11.655 -4.375 -3.457 254 HA LEU 37 HA LEU 37 14.054 -4.604 -5.154 255 HB3 LEU 37 2HB LEU 37 13.635 -6.891 -5.457 256 HG LEU 37 HG LEU 37 13.323 -6.076 -2.625 257 HD11 LEU 37 1HD1 LEU 37 13.362 -8.902 -2.667 258 HD12 LEU 37 2HD1 LEU 37 11.989 -8.375 -3.640 259 HD13 LEU 37 3HD1 LEU 37 12.146 -7.833 -1.970 260 HD21 LEU 37 3HD2 LEU 37 15.111 -8.261 -3.381 261 HD22 LEU 37 1HD2 LEU 37 15.442 -6.780 -2.483 262 HD23 LEU 37 2HD2 LEU 37 15.415 -6.756 -4.247 263 H GLY 38 H GLY 38 10.827 -3.664 -5.050 264 HA2 GLY 38 2HA GLY 38 10.208 -4.316 -7.807 265 HA3 GLY 38 3HA GLY 38 9.183 -3.432 -6.687 266 H ARG 39 H ARG 39 12.375 -2.284 -6.796 267 HA ARG 39 HA ARG 39 11.775 0.289 -7.521 268 HB3 ARG 39 2HB ARG 39 13.915 -0.153 -6.598 269 HG3 ARG 39 2HG ARG 39 14.670 -1.731 -9.042 270 HD3 ARG 39 2HD ARG 39 16.424 -2.459 -7.196 271 HE ARG 39 HE ARG 39 16.626 -0.773 -9.338 272 HH11 ARG 39 1HH1 ARG 39 18.068 -0.940 -6.174 273 HH12 ARG 39 2HH1 ARG 39 19.554 -0.199 -6.669 274 HH21 ARG 39 1HH2 ARG 39 18.578 0.204 -10.001 275 HH22 ARG 39 2HH2 ARG 39 19.842 0.453 -8.846 276 H LEU 40 H LEU 40 12.894 -2.311 -9.677 277 HA LEU 40 HA LEU 40 11.311 -1.484 -11.848 278 HB3 LEU 40 2HB LEU 40 14.223 -0.719 -12.019 279 HG LEU 40 HG LEU 40 12.585 -1.384 -14.173 280 HD11 LEU 40 1HD1 LEU 40 12.909 1.608 -14.065 281 HD12 LEU 40 2HD1 LEU 40 11.394 0.769 -13.735 282 HD13 LEU 40 3HD1 LEU 40 12.137 0.652 -15.331 283 HD21 LEU 40 3HD2 LEU 40 15.145 0.149 -13.861 284 HD22 LEU 40 1HD2 LEU 40 14.450 -0.174 -15.451 285 HD23 LEU 40 2HD2 LEU 40 14.904 -1.514 -14.399 286 H ASP 41 H ASP 41 11.302 -3.882 -11.072 287 HA ASP 41 HA ASP 41 11.795 -6.081 -11.452 288 HB3 ASP 41 2HB ASP 41 12.351 -6.539 -13.922 289 H ASN 42 H ASN 42 13.831 -5.056 -10.082 290 HA ASN 42 HA ASN 42 16.364 -4.895 -11.041 291 HB3 ASN 42 2HB ASN 42 15.591 -4.750 -8.619 292 HD21 ASN 42 1HD2 ASN 42 13.860 -5.995 -7.947 293 HD22 ASN 42 2HD2 ASN 42 14.057 -7.599 -7.335 294 H GLN 43 H GLN 43 17.894 -6.215 -11.864 295 HA GLN 43 HA GLN 43 17.266 -8.556 -13.162 296 HB3 GLN 43 2HB GLN 43 19.329 -7.157 -13.485 297 HG3 GLN 43 2HG GLN 43 20.869 -8.835 -11.640 298 HE21 GLN 43 1HE2 GLN 43 21.932 -6.703 -10.212 299 HE22 GLN 43 2HE2 GLN 43 22.798 -5.679 -11.301 300 H GLY 44 H GLY 44 18.275 -10.754 -12.750 301 HA2 GLY 44 2HA GLY 44 19.050 -12.349 -11.096 302 HA3 GLY 44 3HA GLY 44 18.189 -11.420 -9.877 303 H LYS 45 H LYS 45 15.913 -11.580 -9.749 304 HA LYS 45 HA LYS 45 14.285 -13.090 -11.436 305 HB3 LYS 45 2HB LYS 45 15.675 -14.989 -10.737 306 HG3 LYS 45 2HG LYS 45 15.344 -15.835 -8.375 307 HD3 LYS 45 2HD LYS 45 16.908 -13.318 -8.213 308 HE3 LYS 45 2HE LYS 45 17.139 -16.155 -7.378 309 HZ1 LYS 45 3HZ LYS 45 19.584 -14.526 -7.409 310 HZ2 LYS 45 1HZ LYS 45 19.178 -15.426 -8.784 311 HZ3 LYS 45 2HZ LYS 45 19.415 -16.205 -7.302 312 H ILE 46 H ILE 46 14.991 -11.852 -8.266 313 HA ILE 46 HA ILE 46 12.524 -12.133 -7.011 314 HB ILE 46 HB ILE 46 14.310 -9.722 -6.718 315 HG13 ILE 46 2HG1 ILE 46 14.800 -12.538 -6.086 316 HG21 ILE 46 1HG2 ILE 46 12.514 -9.240 -5.404 317 HG22 ILE 46 2HG2 ILE 46 12.103 -10.936 -5.152 318 HG23 ILE 46 3HG2 ILE 46 13.440 -10.211 -4.259 319 HD11 ILE 46 3HD1 ILE 46 16.892 -12.007 -6.586 320 HD12 ILE 46 1HD1 ILE 46 16.279 -10.424 -7.060 321 HD13 ILE 46 2HD1 ILE 46 16.910 -10.674 -5.433 322 H ASN 47 H ASN 47 13.679 -9.063 -8.407 323 HA ASN 47 HA ASN 47 12.474 -7.246 -9.132 324 HB3 ASN 47 2HB ASN 47 12.433 -7.966 -11.274 325 HD21 ASN 47 1HD2 ASN 47 13.821 -9.676 -11.464 326 HD22 ASN 47 2HD2 ASN 47 13.290 -11.318 -11.553 327 H ALA 48 H ALA 48 11.410 -8.313 -6.727 328 HA ALA 48 HA ALA 48 9.033 -6.948 -6.472 329 HB1 ALA 48 1HB ALA 48 7.822 -8.332 -7.884 330 HB2 ALA 48 2HB ALA 48 8.642 -9.790 -7.324 331 HB3 ALA 48 3HB ALA 48 7.460 -8.989 -6.288 332 H TRP 49 H TRP 49 8.454 -6.810 -4.359 333 HA TRP 49 HA TRP 49 10.152 -8.107 -2.438 334 HB3 TRP 49 2HB TRP 49 8.026 -6.010 -2.345 335 HD1 TRP 49 HD TRP 49 10.189 -7.083 0.648 336 HE1 TRP 49 1HE TRP 49 8.642 -7.475 2.667 337 HE3 TRP 49 3HE TRP 49 5.668 -6.550 -1.678 338 HZ2 TRP 49 2HZ TRP 49 5.871 -7.548 3.203 339 HZ3 TRP 49 3HZ TRP 49 3.618 -6.797 -0.342 340 HH2 TRP 49 HH TRP 49 3.718 -7.286 2.048 341 H THR 50 H THR 50 9.774 -9.957 -1.422 342 HA THR 50 HA THR 50 7.031 -11.034 -1.449 343 HB THR 50 HB THR 50 9.376 -12.810 -0.947 344 HG1 THR 50 1HG THR 50 10.042 -11.723 -2.799 345 HG21 THR 50 3HG2 THR 50 7.746 -14.136 -2.618 346 HG22 THR 50 1HG2 THR 50 6.581 -13.026 -1.897 347 HG23 THR 50 2HG2 THR 50 7.516 -14.113 -0.870 348 H ALA 51 H ALA 51 6.548 -12.535 0.395 349 HA ALA 51 HA ALA 51 7.249 -11.211 2.877 350 HB1 ALA 51 1HB ALA 51 4.963 -11.670 2.729 351 HB2 ALA 51 2HB ALA 51 5.237 -13.307 2.130 352 HB3 ALA 51 3HB ALA 51 5.581 -12.915 3.815 353 H GLN 52 H GLN 52 7.912 -12.416 4.782 354 HA GLN 52 HA GLN 52 9.996 -14.315 4.131 355 HB3 GLN 52 2HB GLN 52 9.161 -13.046 6.743 356 HG3 GLN 52 2HG GLN 52 10.217 -15.067 7.370 357 HE21 GLN 52 1HE2 GLN 52 13.308 -14.013 6.579 358 HE22 GLN 52 2HE2 GLN 52 13.695 -15.219 5.405 359 H SER 53 H SER 53 7.351 -14.288 6.527 360 HA SER 53 HA SER 53 7.429 -17.197 6.633 361 HB3 SER 53 2HB SER 53 5.311 -16.086 8.219 362 HG SER 53 HG SER 53 6.574 -17.974 8.674 363 H ASN 54 H ASN 54 6.077 -15.075 4.606 364 HA ASN 54 HA ASN 54 4.152 -14.954 3.357 365 HB3 ASN 54 2HB ASN 54 5.332 -16.745 2.242 366 HD21 ASN 54 1HD2 ASN 54 6.751 -17.936 3.501 367 HD22 ASN 54 2HD2 ASN 54 6.309 -19.454 4.200 368 H SER 55 H SER 55 3.246 -14.491 5.739 369 HA SER 55 HA SER 55 0.867 -16.205 6.002 370 HB3 SER 55 2HB SER 55 1.543 -14.987 8.525 371 HG SER 55 HG SER 55 0.987 -16.930 9.190 372 H ALA 56 H ALA 56 -0.509 -14.822 7.895 373 HA ALA 56 HA ALA 56 -1.111 -12.322 6.484 374 HB1 ALA 56 1HB ALA 56 -3.293 -12.602 7.023 375 HB2 ALA 56 2HB ALA 56 -2.796 -14.292 7.120 376 HB3 ALA 56 3HB ALA 56 -2.930 -13.326 8.590 377 H LYS 57 H LYS 57 1.068 -12.731 8.500 378 HA LYS 57 HA LYS 57 0.191 -10.708 10.457 379 HB3 LYS 57 2HB LYS 57 0.660 -12.773 11.604 380 HG3 LYS 57 2HG LYS 57 2.265 -13.589 9.732 381 HD3 LYS 57 2HD LYS 57 3.979 -11.835 11.393 382 HE3 LYS 57 2HE LYS 57 4.989 -14.446 10.266 383 HZ1 LYS 57 3HZ LYS 57 6.850 -13.207 10.208 384 HZ2 LYS 57 1HZ LYS 57 6.893 -13.521 11.870 385 HZ3 LYS 57 2HZ LYS 57 6.271 -12.054 11.303 386 H GLU 58 H GLU 58 1.988 -11.136 7.749 387 HA GLU 58 HA GLU 58 4.301 -9.579 8.493 388 HB3 GLU 58 2HB GLU 58 4.324 -11.389 6.745 389 HG3 GLU 58 2HG GLU 58 2.173 -10.144 5.650 390 H TRP 59 H TRP 59 4.667 -7.450 8.116 391 HA TRP 59 HA TRP 59 2.569 -5.919 6.738 392 HB3 TRP 59 2HB TRP 59 2.059 -5.498 8.998 393 HD1 TRP 59 HD TRP 59 5.746 -4.297 9.197 394 HE1 TRP 59 1HE TRP 59 6.736 -5.156 11.412 395 HE3 TRP 59 3HE TRP 59 1.744 -6.997 10.881 396 HZ2 TRP 59 2HZ TRP 59 5.928 -6.766 13.585 397 HZ3 TRP 59 3HZ TRP 59 1.935 -8.167 13.037 398 HH2 TRP 59 HH TRP 59 3.984 -8.053 14.360 399 H LEU 60 H LEU 60 3.278 -4.351 5.392 400 HA LEU 60 HA LEU 60 6.183 -3.859 5.326 401 HB3 LEU 60 2HB LEU 60 4.168 -4.045 3.102 402 HG LEU 60 HG LEU 60 5.641 -2.169 2.529 403 HD11 LEU 60 1HD1 LEU 60 7.951 -4.079 2.559 404 HD12 LEU 60 2HD1 LEU 60 7.547 -3.097 3.966 405 HD13 LEU 60 3HD1 LEU 60 7.967 -2.319 2.441 406 HD21 LEU 60 3HD2 LEU 60 6.598 -4.438 0.852 407 HD22 LEU 60 1HD2 LEU 60 6.003 -2.849 0.370 408 HD23 LEU 60 2HD2 LEU 60 4.870 -4.087 0.914 409 H GLN 61 H GLN 61 6.819 -1.839 5.679 410 HA GLN 61 HA GLN 61 4.870 0.334 5.277 411 HB3 GLN 61 2HB GLN 61 5.464 -0.268 7.692 412 HG3 GLN 61 2HG GLN 61 7.904 1.392 7.289 413 HE21 GLN 61 1HE2 GLN 61 8.455 -1.508 8.789 414 HE22 GLN 61 2HE2 GLN 61 8.243 -1.015 10.431 415 H VAL 62 H VAL 62 5.549 2.147 4.237 416 HA VAL 62 HA VAL 62 8.305 2.100 3.198 417 HB VAL 62 HB VAL 62 6.051 3.638 1.938 418 HG11 VAL 62 1HG1 VAL 62 7.443 3.423 -0.069 419 HG12 VAL 62 2HG1 VAL 62 8.315 4.209 1.249 420 HG13 VAL 62 3HG1 VAL 62 8.637 2.518 0.862 421 HG21 VAL 62 3HG2 VAL 62 6.702 0.725 1.670 422 HG22 VAL 62 1HG2 VAL 62 5.131 1.502 1.869 423 HG23 VAL 62 2HG2 VAL 62 5.985 1.621 0.331 424 H ASP 63 H ASP 63 9.590 3.520 4.160 425 HA ASP 63 HA ASP 63 8.437 5.999 5.230 426 HB3 ASP 63 2HB ASP 63 11.059 4.611 5.810 427 H LEU 64 H LEU 64 8.768 7.858 4.215 428 HA LEU 64 HA LEU 64 10.860 7.972 2.152 429 HB3 LEU 64 2HB LEU 64 9.458 10.099 1.531 430 HG LEU 64 HG LEU 64 9.546 8.187 0.015 431 HD11 LEU 64 1HD1 LEU 64 7.300 7.064 1.683 432 HD12 LEU 64 2HD1 LEU 64 8.948 6.440 1.621 433 HD13 LEU 64 3HD1 LEU 64 7.927 6.380 0.183 434 HD21 LEU 64 3HD2 LEU 64 6.642 8.804 0.215 435 HD22 LEU 64 1HD2 LEU 64 7.700 8.785 -1.196 436 HD23 LEU 64 2HD2 LEU 64 7.772 10.131 -0.057 437 H GLY 65 H GLY 65 9.257 10.167 4.474 438 HA2 GLY 65 2HA GLY 65 10.149 11.757 5.880 439 HA3 GLY 65 3HA GLY 65 11.728 11.038 5.592 440 H THR 66 H THR 66 10.320 11.773 2.666 441 HA THR 66 HA THR 66 11.857 14.277 2.505 442 HB THR 66 HB THR 66 12.555 12.406 0.992 443 HG1 THR 66 1HG THR 66 13.087 14.454 0.317 444 HG21 THR 66 3HG2 THR 66 9.883 12.032 0.582 445 HG22 THR 66 1HG2 THR 66 11.158 11.398 -0.457 446 HG23 THR 66 2HG2 THR 66 10.349 12.909 -0.875 447 H GLN 67 H GLN 67 8.721 13.053 2.562 448 HA GLN 67 HA GLN 67 6.662 13.902 2.077 449 HB3 GLN 67 2HB GLN 67 7.802 16.665 2.175 450 HG3 GLN 67 2HG GLN 67 5.344 15.328 3.248 451 HE21 GLN 67 1HE2 GLN 67 4.742 15.873 5.206 452 HE22 GLN 67 2HE2 GLN 67 5.037 17.385 5.987 453 H ARG 68 H ARG 68 6.630 13.136 -0.083 454 HA ARG 68 HA ARG 68 7.024 15.248 -2.102 455 HB3 ARG 68 2HB ARG 68 7.077 13.018 -3.607 456 HG3 ARG 68 2HG ARG 68 9.551 13.034 -3.463 457 HD3 ARG 68 2HD ARG 68 7.910 15.471 -3.873 458 HE ARG 68 HE ARG 68 9.720 16.776 -3.359 459 HH11 ARG 68 1HH1 ARG 68 10.803 13.935 -5.053 460 HH12 ARG 68 2HH1 ARG 68 12.434 14.497 -5.219 461 HH21 ARG 68 1HH2 ARG 68 11.864 17.527 -3.570 462 HH22 ARG 68 2HH2 ARG 68 13.036 16.540 -4.374 463 H GLN 69 H GLN 69 5.408 15.620 -3.568 464 HA GLN 69 HA GLN 69 2.780 14.737 -2.837 465 HB3 GLN 69 2HB GLN 69 3.911 16.608 -4.875 466 HG3 GLN 69 2HG GLN 69 1.129 15.491 -4.904 467 HE21 GLN 69 1HE2 GLN 69 -0.185 17.160 -4.401 468 HE22 GLN 69 2HE2 GLN 69 -0.228 18.656 -5.265 469 H VAL 70 H VAL 70 1.902 12.886 -3.451 470 HA VAL 70 HA VAL 70 2.961 11.465 -5.764 471 HB VAL 70 HB VAL 70 1.636 9.571 -5.009 472 HG11 VAL 70 1HG1 VAL 70 2.700 9.202 -2.822 473 HG12 VAL 70 2HG1 VAL 70 3.824 9.876 -4.005 474 HG13 VAL 70 3HG1 VAL 70 3.129 10.911 -2.758 475 HG21 VAL 70 3HG2 VAL 70 0.654 10.274 -2.516 476 HG22 VAL 70 1HG2 VAL 70 0.211 11.631 -3.550 477 HG23 VAL 70 2HG2 VAL 70 -0.295 9.997 -3.976 478 H THR 71 H THR 71 1.863 11.068 -7.619 479 HA THR 71 HA THR 71 -0.758 12.381 -7.904 480 HB THR 71 HB THR 71 0.751 11.635 -10.342 481 HG1 THR 71 1HG THR 71 2.176 13.366 -10.126 482 HG21 THR 71 3HG2 THR 71 -0.095 14.364 -10.184 483 HG22 THR 71 1HG2 THR 71 -1.398 13.319 -9.619 484 HG23 THR 71 2HG2 THR 71 -0.703 13.074 -11.222 485 H GLY 72 H GLY 72 0.422 9.428 -7.365 486 HA2 GLY 72 2HA GLY 72 -1.738 7.906 -7.761 487 HA3 GLY 72 3HA GLY 72 -1.077 7.974 -9.388 488 H ILE 73 H ILE 73 -1.411 5.677 -7.599 489 HA ILE 73 HA ILE 73 1.394 4.791 -7.576 490 HB ILE 73 HB ILE 73 0.716 3.321 -5.592 491 HG13 ILE 73 2HG1 ILE 73 -1.774 4.229 -6.032 492 HG21 ILE 73 1HG2 ILE 73 1.607 6.051 -5.735 493 HG22 ILE 73 2HG2 ILE 73 0.731 5.763 -4.233 494 HG23 ILE 73 3HG2 ILE 73 2.121 4.761 -4.649 495 HD11 ILE 73 3HD1 ILE 73 -0.849 2.540 -4.272 496 HD12 ILE 73 1HD1 ILE 73 -1.055 3.898 -3.165 497 HD13 ILE 73 2HD1 ILE 73 -2.438 3.275 -4.064 498 H ILE 74 H ILE 74 1.730 2.558 -7.958 499 HA ILE 74 HA ILE 74 -0.594 1.026 -8.874 500 HB ILE 74 HB ILE 74 0.139 1.838 -10.943 501 HG13 ILE 74 2HG1 ILE 74 1.570 -0.794 -10.511 502 HG21 ILE 74 1HG2 ILE 74 2.110 2.885 -10.950 503 HG22 ILE 74 2HG2 ILE 74 2.740 1.885 -9.641 504 HG23 ILE 74 3HG2 ILE 74 2.814 1.307 -11.306 505 HD11 ILE 74 3HD1 ILE 74 -1.064 -0.440 -10.148 506 HD12 ILE 74 1HD1 ILE 74 -1.025 -0.708 -11.891 507 HD13 ILE 74 2HD1 ILE 74 -0.352 -1.917 -10.797 508 H THR 75 H THR 75 -0.502 -1.111 -8.424 509 HA THR 75 HA THR 75 2.006 -2.129 -7.252 510 HB THR 75 HB THR 75 -0.840 -2.822 -6.498 511 HG1 THR 75 1HG THR 75 0.607 -0.867 -5.685 512 HG21 THR 75 3HG2 THR 75 1.788 -4.067 -5.757 513 HG22 THR 75 1HG2 THR 75 0.293 -4.851 -6.260 514 HG23 THR 75 2HG2 THR 75 0.413 -4.127 -4.656 515 H GLN 76 H GLN 76 2.799 -4.027 -7.981 516 HA GLN 76 HA GLN 76 1.156 -5.555 -9.888 517 HB3 GLN 76 2HB GLN 76 2.984 -5.837 -11.359 518 HG3 GLN 76 2HG GLN 76 3.014 -3.011 -10.341 519 HE21 GLN 76 1HE2 GLN 76 4.091 -5.188 -12.902 520 HE22 GLN 76 2HE2 GLN 76 5.322 -4.144 -13.518 521 H GLY 77 H GLY 77 2.189 -7.789 -10.295 522 HA2 GLY 77 2HA GLY 77 3.112 -8.859 -7.699 523 HA3 GLY 77 3HA GLY 77 1.972 -9.706 -8.733 524 H ALA 78 H ALA 78 4.133 -11.075 -7.935 525 HA ALA 78 HA ALA 78 5.616 -11.389 -10.438 526 HB1 ALA 78 1HB ALA 78 6.901 -11.064 -7.732 527 HB2 ALA 78 2HB ALA 78 7.738 -11.687 -9.154 528 HB3 ALA 78 3HB ALA 78 7.109 -10.039 -9.152 529 H ARG 79 H ARG 79 7.094 -13.443 -10.182 530 HA ARG 79 HA ARG 79 5.667 -15.501 -8.649 531 HB3 ARG 79 2HB ARG 79 5.030 -15.361 -11.152 532 HG3 ARG 79 2HG ARG 79 7.354 -17.126 -11.648 533 HD3 ARG 79 2HD ARG 79 5.802 -15.166 -13.335 534 HE ARG 79 HE ARG 79 8.210 -16.530 -13.943 535 HH11 ARG 79 1HH1 ARG 79 5.114 -15.678 -15.288 536 HH12 ARG 79 2HH1 ARG 79 5.676 -15.692 -16.926 537 HH21 ARG 79 1HH2 ARG 79 8.962 -16.551 -16.096 538 HH22 ARG 79 2HH2 ARG 79 7.864 -16.189 -17.385 539 H ASP 80 H ASP 80 6.978 -17.663 -8.869 540 HA ASP 80 HA ASP 80 9.805 -16.989 -8.392 541 HB3 ASP 80 2HB ASP 80 9.916 -18.773 -6.811 542 H PHE 81 H PHE 81 7.595 -19.047 -10.111 543 HA PHE 81 HA PHE 81 9.276 -19.670 -12.191 544 HB3 PHE 81 2HB PHE 81 9.299 -22.266 -10.986 545 HD1 PHE 81 2HD PHE 81 11.267 -19.234 -11.804 546 HD2 PHE 81 1HD PHE 81 11.138 -23.487 -11.732 547 HE1 PHE 81 2HE PHE 81 13.368 -19.316 -13.082 548 HE2 PHE 81 1HE PHE 81 13.240 -23.576 -13.009 549 HZ PHE 81 HZ PHE 81 14.356 -21.489 -13.687 550 H GLY 82 H GLY 82 7.030 -19.171 -12.856 551 HA2 GLY 82 2HA GLY 82 5.189 -19.955 -14.011 552 HA3 GLY 82 3HA GLY 82 5.680 -21.592 -13.602 553 H HIS 83 H HIS 83 5.642 -19.971 -10.760 554 HA HIS 83 HA HIS 83 2.945 -20.947 -10.146 555 HB3 HIS 83 2HB HIS 83 3.682 -20.826 -7.774 556 HD1 HIS 83 1HD HIS 83 6.778 -22.172 -7.859 557 HD2 HIS 83 2HD HIS 83 3.247 -23.396 -9.676 558 HE1 HIS 83 1HE HIS 83 7.072 -24.628 -8.313 559 H ILE 84 H ILE 84 3.155 -18.519 -11.541 560 HA ILE 84 HA ILE 84 3.268 -16.111 -10.687 561 HB ILE 84 HB ILE 84 0.527 -17.169 -11.391 562 HG13 ILE 84 2HG1 ILE 84 2.987 -16.788 -12.962 563 HG21 ILE 84 1HG2 ILE 84 1.266 -14.638 -10.574 564 HG22 ILE 84 2HG2 ILE 84 1.244 -14.519 -12.332 565 HG23 ILE 84 3HG2 ILE 84 -0.193 -15.060 -11.468 566 HD11 ILE 84 3HD1 ILE 84 2.135 -18.433 -14.348 567 HD12 ILE 84 1HD1 ILE 84 1.530 -18.891 -12.756 568 HD13 ILE 84 2HD1 ILE 84 0.464 -18.081 -13.905 569 H GLN 85 H GLN 85 3.287 -15.213 -8.741 570 HA GLN 85 HA GLN 85 1.209 -15.999 -6.806 571 HB3 GLN 85 2HB GLN 85 2.730 -15.595 -5.034 572 HG3 GLN 85 2HG GLN 85 4.453 -16.812 -7.176 573 HE21 GLN 85 1HE2 GLN 85 4.465 -19.108 -5.223 574 HE22 GLN 85 2HE2 GLN 85 5.646 -18.660 -4.045 575 H TYR 86 H TYR 86 0.405 -14.337 -5.384 576 HA TYR 86 HA TYR 86 0.977 -11.612 -5.616 577 HB3 TYR 86 2HB TYR 86 0.162 -11.572 -7.831 578 HD1 TYR 86 2HD TYR 86 -2.876 -12.796 -6.028 579 HD2 TYR 86 1HD TYR 86 -0.338 -13.168 -9.421 580 HE1 TYR 86 2HE TYR 86 -4.390 -14.493 -6.966 581 HE2 TYR 86 1HE TYR 86 -1.844 -14.865 -10.369 582 HH TYR 86 HH TYR 86 -3.704 -16.606 -9.073 583 H VAL 87 H VAL 87 -0.497 -10.269 -4.413 584 HA VAL 87 HA VAL 87 -1.949 -11.808 -2.398 585 HB VAL 87 HB VAL 87 -1.417 -8.840 -2.366 586 HG11 VAL 87 1HG1 VAL 87 -3.022 -9.316 -0.751 587 HG12 VAL 87 2HG1 VAL 87 -2.292 -10.869 -0.342 588 HG13 VAL 87 3HG1 VAL 87 -1.510 -9.368 0.155 589 HG21 VAL 87 3HG2 VAL 87 0.563 -9.294 -1.031 590 HG22 VAL 87 1HG2 VAL 87 0.299 -11.030 -1.199 591 HG23 VAL 87 2HG2 VAL 87 0.705 -10.059 -2.613 592 H ALA 88 H ALA 88 -4.063 -11.157 -1.686 593 HA ALA 88 HA ALA 88 -5.669 -10.015 -3.874 594 HB1 ALA 88 1HB ALA 88 -7.430 -11.238 -2.125 595 HB2 ALA 88 2HB ALA 88 -6.840 -11.895 -3.652 596 HB3 ALA 88 3HB ALA 88 -6.030 -12.310 -2.142 597 H SER 89 H SER 89 -6.306 -10.414 -0.400 598 HA SER 89 HA SER 89 -7.344 -7.690 -0.320 599 HB3 SER 89 2HB SER 89 -7.467 -9.970 1.664 600 HG SER 89 HG SER 89 -8.963 -8.520 2.747 601 H TYR 90 H TYR 90 -6.237 -6.037 0.486 602 HA TYR 90 HA TYR 90 -4.358 -6.373 2.645 603 HB3 TYR 90 2HB TYR 90 -2.813 -6.930 0.945 604 HD1 TYR 90 2HD TYR 90 -3.978 -7.562 -1.144 605 HD2 TYR 90 1HD TYR 90 -2.877 -3.532 -0.335 606 HE1 TYR 90 2HE TYR 90 -4.279 -7.008 -3.522 607 HE2 TYR 90 1HE TYR 90 -3.177 -2.967 -2.710 608 HH TYR 90 HH TYR 90 -4.853 -4.549 -4.778 609 H LYS 91 H LYS 91 -4.165 -4.551 3.833 610 HA LYS 91 HA LYS 91 -5.723 -2.240 2.966 611 HB3 LYS 91 2HB LYS 91 -4.860 -1.658 5.502 612 HG3 LYS 91 2HG LYS 91 -7.118 -3.246 5.920 613 HD3 LYS 91 2HD LYS 91 -6.797 -0.317 5.275 614 HE3 LYS 91 2HE LYS 91 -9.098 -1.271 6.861 615 HZ1 LYS 91 3HZ LYS 91 -8.777 1.067 6.401 616 HZ2 LYS 91 1HZ LYS 91 -10.188 0.521 5.644 617 HZ3 LYS 91 2HZ LYS 91 -8.786 0.778 4.734 618 H VAL 92 H VAL 92 -4.781 -0.515 2.113 619 HA VAL 92 HA VAL 92 -1.952 0.009 2.763 620 HB VAL 92 HB VAL 92 -3.355 0.627 0.159 621 HG11 VAL 92 1HG1 VAL 92 -1.732 2.157 -0.017 622 HG12 VAL 92 2HG1 VAL 92 -0.823 1.482 1.336 623 HG13 VAL 92 3HG1 VAL 92 -0.654 0.786 -0.276 624 HG21 VAL 92 3HG2 VAL 92 -2.789 -1.396 -0.569 625 HG22 VAL 92 1HG2 VAL 92 -1.116 -1.152 -0.067 626 HG23 VAL 92 2HG2 VAL 92 -2.292 -1.807 1.072 627 H ALA 93 H ALA 93 -1.729 1.776 3.951 628 HA ALA 93 HA ALA 93 -3.542 4.048 3.452 629 HB1 ALA 93 1HB ALA 93 -2.339 3.684 6.147 630 HB2 ALA 93 2HB ALA 93 -3.872 4.420 5.682 631 HB3 ALA 93 3HB ALA 93 -3.704 2.665 5.692 632 H HIS 94 H HIS 94 -2.654 6.097 3.465 633 HA HIS 94 HA HIS 94 0.289 6.198 3.508 634 HB3 HIS 94 2HB HIS 94 0.079 8.124 1.946 635 HD1 HIS 94 1HD HIS 94 0.962 7.354 -0.228 636 HD2 HIS 94 2HD HIS 94 -1.928 4.769 1.264 637 HE1 HIS 94 1HE HIS 94 0.865 5.442 -1.858 638 H SER 95 H SER 95 1.309 7.814 4.627 639 HA SER 95 HA SER 95 -0.408 9.643 6.170 640 HB3 SER 95 2HB SER 95 0.446 8.945 8.131 641 HG SER 95 HG SER 95 0.380 6.923 6.656 642 H ASP 96 H ASP 96 0.080 11.721 5.945 643 HA ASP 96 HA ASP 96 2.508 12.454 4.514 644 HB3 ASP 96 2HB ASP 96 0.353 13.404 3.789 645 H ASP 97 H ASP 97 1.020 12.828 7.663 646 HA ASP 97 HA ASP 97 3.213 14.534 8.573 647 HB3 ASP 97 2HB ASP 97 1.184 13.697 10.535 648 H GLY 98 H GLY 98 2.150 11.264 8.666 649 HA2 GLY 98 2HA GLY 98 3.811 9.582 9.236 650 HA3 GLY 98 3HA GLY 98 4.358 10.643 10.525 651 H VAL 99 H VAL 99 1.665 11.325 11.399 652 HA VAL 99 HA VAL 99 1.099 8.849 12.866 653 HB VAL 99 HB VAL 99 1.556 10.783 14.263 654 HG11 VAL 99 1HG1 VAL 99 -0.784 12.070 12.861 655 HG12 VAL 99 2HG1 VAL 99 0.067 12.736 14.257 656 HG13 VAL 99 3HG1 VAL 99 0.908 12.544 12.717 657 HG21 VAL 99 3HG2 VAL 99 -0.336 9.040 14.734 658 HG22 VAL 99 1HG2 VAL 99 -0.153 10.454 15.771 659 HG23 VAL 99 2HG2 VAL 99 -1.397 10.433 14.522 660 H GLN 100 H GLN 100 -0.343 11.198 10.716 661 HA GLN 100 HA GLN 100 -3.002 10.094 10.992 662 HB3 GLN 100 2HB GLN 100 -3.635 11.733 9.290 663 HG3 GLN 100 2HG GLN 100 -1.726 13.059 11.196 664 HE21 GLN 100 1HE2 GLN 100 -1.497 14.956 10.153 665 HE22 GLN 100 2HE2 GLN 100 -2.807 15.991 9.710 666 H TRP 101 H TRP 101 -3.133 8.045 10.245 667 HA TRP 101 HA TRP 101 -1.940 7.372 7.668 668 HB3 TRP 101 2HB TRP 101 -2.307 5.095 8.227 669 HD1 TRP 101 HD TRP 101 -0.060 7.229 9.254 670 HE1 TRP 101 1HE TRP 101 1.283 6.634 11.367 671 HE3 TRP 101 3HE TRP 101 -3.246 3.795 11.301 672 HZ2 TRP 101 2HZ TRP 101 1.025 4.934 13.606 673 HZ3 TRP 101 3HZ TRP 101 -2.623 2.731 13.430 674 HH2 TRP 101 HH TRP 101 -0.532 3.290 14.557 675 H THR 102 H THR 102 -3.142 8.035 5.993 676 HA THR 102 HA THR 102 -6.035 8.005 6.107 677 HB THR 102 HB THR 102 -4.155 8.753 3.858 678 HG1 THR 102 1HG THR 102 -4.007 10.411 5.215 679 HG21 THR 102 3HG2 THR 102 -7.155 9.006 4.086 680 HG22 THR 102 1HG2 THR 102 -6.257 8.040 2.916 681 HG23 THR 102 2HG2 THR 102 -6.178 9.802 2.853 682 H VAL 103 H VAL 103 -7.114 6.181 5.772 683 HA VAL 103 HA VAL 103 -5.959 4.097 4.077 684 HB VAL 103 HB VAL 103 -7.837 2.692 4.942 685 HG11 VAL 103 1HG1 VAL 103 -5.769 3.928 6.695 686 HG12 VAL 103 2HG1 VAL 103 -6.939 2.814 7.404 687 HG13 VAL 103 3HG1 VAL 103 -5.893 2.277 6.089 688 HG21 VAL 103 3HG2 VAL 103 -8.338 4.753 7.038 689 HG22 VAL 103 1HG2 VAL 103 -9.173 4.880 5.489 690 HG23 VAL 103 2HG2 VAL 103 -9.373 3.437 6.483 691 H TYR 104 H TYR 104 -7.945 2.769 3.006 692 HA TYR 104 HA TYR 104 -9.370 4.738 1.340 693 HB3 TYR 104 2HB TYR 104 -9.305 3.070 -0.467 694 HD1 TYR 104 1HD TYR 104 -8.110 5.511 -0.548 695 HD2 TYR 104 2HD TYR 104 -6.171 1.805 0.238 696 HE1 TYR 104 1HE TYR 104 -5.973 6.478 -1.290 697 HE2 TYR 104 2HE TYR 104 -4.030 2.762 -0.501 698 HH TYR 104 HH TYR 104 -3.551 6.074 -0.944 699 H GLU 105 H GLU 105 -11.441 4.837 1.892 700 HA GLU 105 HA GLU 105 -12.803 2.369 2.735 701 HB3 GLU 105 2HB GLU 105 -12.991 3.984 4.451 702 HG3 GLU 105 2HG GLU 105 -13.133 5.906 2.268 703 H GLU 106 H GLU 106 -15.363 2.795 2.303 704 HA GLU 106 HA GLU 106 -15.625 3.513 -0.540 705 HB3 GLU 106 2HB GLU 106 -17.225 1.624 -0.783 706 HG3 GLU 106 2HG GLU 106 -14.537 0.697 0.204 707 H GLN 107 H GLN 107 -17.396 2.876 2.475 708 HA GLN 107 HA GLN 107 -19.005 5.243 2.045 709 HB3 GLN 107 2HB GLN 107 -20.304 3.625 0.804 710 HG3 GLN 107 2HG GLN 107 -20.201 1.952 3.300 711 HE21 GLN 107 1HE2 GLN 107 -20.801 -0.056 0.952 712 HE22 GLN 107 2HE2 GLN 107 -22.528 -0.104 0.954 713 H GLY 108 H GLY 108 -17.168 4.947 3.980 714 HA2 GLY 108 2HA GLY 108 -17.027 5.386 6.248 715 HA3 GLY 108 3HA GLY 108 -18.763 5.149 6.363 716 H SER 109 H SER 109 -17.006 2.631 4.848 717 HA SER 109 HA SER 109 -17.313 0.991 7.273 718 HB3 SER 109 2HB SER 109 -18.693 0.119 5.528 719 HG SER 109 HG SER 109 -17.333 -0.556 3.536 720 H SER 110 H SER 110 -15.089 2.144 4.892 721 HA SER 110 HA SER 110 -12.825 2.008 4.702 722 HB3 SER 110 2HB SER 110 -11.571 1.896 6.647 723 HG SER 110 HG SER 110 -12.694 3.102 7.981 724 H LYS 111 H LYS 111 -13.190 0.418 3.038 725 HA LYS 111 HA LYS 111 -12.848 -2.377 3.785 726 HB3 LYS 111 2HB LYS 111 -12.843 -2.097 0.972 727 HG3 LYS 111 2HG LYS 111 -15.219 -2.942 1.183 728 HD3 LYS 111 2HD LYS 111 -13.214 -4.504 2.799 729 HE3 LYS 111 2HE LYS 111 -15.177 -5.507 0.758 730 HZ1 LYS 111 3HZ LYS 111 -14.191 -7.414 1.243 731 HZ2 LYS 111 1HZ LYS 111 -14.745 -7.284 2.836 732 HZ3 LYS 111 2HZ LYS 111 -13.220 -6.686 2.421 733 H VAL 112 H VAL 112 -11.355 -3.653 2.220 734 HA VAL 112 HA VAL 112 -8.734 -2.346 2.320 735 HB VAL 112 HB VAL 112 -7.761 -4.554 2.176 736 HG11 VAL 112 1HG1 VAL 112 -9.134 -3.587 4.316 737 HG12 VAL 112 2HG1 VAL 112 -9.847 -5.191 4.136 738 HG13 VAL 112 3HG1 VAL 112 -8.104 -5.018 4.346 739 HG21 VAL 112 3HG2 VAL 112 -8.824 -6.184 1.102 740 HG22 VAL 112 1HG2 VAL 112 -9.967 -6.285 2.442 741 HG23 VAL 112 2HG2 VAL 112 -10.310 -5.235 1.066 742 H PHE 113 H PHE 113 -7.258 -3.647 0.525 743 HA PHE 113 HA PHE 113 -8.465 -2.847 -2.028 744 HB3 PHE 113 2HB PHE 113 -5.827 -3.233 -2.595 745 HD1 PHE 113 1HD PHE 113 -8.215 -0.923 -1.021 746 HD2 PHE 113 2HD PHE 113 -4.777 -1.300 -3.502 747 HE1 PHE 113 1HE PHE 113 -8.446 1.432 -1.693 748 HE2 PHE 113 2HE PHE 113 -5.002 1.055 -4.178 749 HZ PHE 113 HZ PHE 113 -6.838 2.425 -3.272 750 H GLN 114 H GLN 114 -8.636 -4.232 -3.726 751 HA GLN 114 HA GLN 114 -8.081 -7.053 -3.153 752 HB3 GLN 114 2HB GLN 114 -9.698 -7.576 -4.877 753 HG3 GLN 114 2HG GLN 114 -10.406 -5.890 -2.639 754 HE21 GLN 114 1HE2 GLN 114 -11.840 -6.470 -5.817 755 HE22 GLN 114 2HE2 GLN 114 -12.999 -5.192 -5.723 756 H GLY 115 H GLY 115 -6.790 -8.300 -4.432 757 HA2 GLY 115 2HA GLY 115 -4.979 -6.878 -6.196 758 HA3 GLY 115 3HA GLY 115 -4.841 -8.554 -5.686 759 H ASN 116 H ASN 116 -4.704 -9.696 -7.515 760 HA ASN 116 HA ASN 116 -6.963 -10.042 -9.170 761 HB3 ASN 116 2HB ASN 116 -4.948 -9.102 -11.029 762 HD21 ASN 116 1HD2 ASN 116 -6.335 -6.705 -11.656 763 HD22 ASN 116 2HD2 ASN 116 -7.888 -7.148 -12.270 764 H LEU 117 H LEU 117 -5.886 -11.040 -11.464 765 HA LEU 117 HA LEU 117 -4.074 -13.148 -10.485 766 HB3 LEU 117 2HB LEU 117 -5.199 -14.748 -11.721 767 HG LEU 117 HG LEU 117 -7.431 -12.851 -10.991 768 HD11 LEU 117 1HD1 LEU 117 -7.865 -14.758 -12.679 769 HD12 LEU 117 2HD1 LEU 117 -8.942 -14.580 -11.295 770 HD13 LEU 117 3HD1 LEU 117 -7.686 -15.818 -11.281 771 HD21 LEU 117 3HD2 LEU 117 -6.962 -15.227 -9.359 772 HD22 LEU 117 1HD2 LEU 117 -7.267 -13.558 -8.876 773 HD23 LEU 117 2HD2 LEU 117 -5.636 -14.063 -9.317 774 H ASP 118 H ASP 118 -2.896 -10.902 -11.407 775 HA ASP 118 HA ASP 118 -1.545 -11.878 -13.779 776 HB3 ASP 118 2HB ASP 118 -1.848 -9.899 -15.102 777 H ASN 119 H ASN 119 0.530 -11.791 -13.257 778 HA ASN 119 HA ASN 119 1.515 -10.109 -11.168 779 HB3 ASN 119 2HB ASN 119 3.770 -11.034 -11.983 780 HD21 ASN 119 1HD2 ASN 119 4.119 -13.600 -11.705 781 HD22 ASN 119 2HD2 ASN 119 3.279 -14.237 -10.335 782 H ASN 120 H ASN 120 1.264 -9.855 -14.605 783 HA ASN 120 HA ASN 120 3.293 -8.133 -15.291 784 HB3 ASN 120 2HB ASN 120 1.720 -7.237 -17.026 785 HD21 ASN 120 1HD2 ASN 120 3.753 -8.726 -17.349 786 HD22 ASN 120 2HD2 ASN 120 3.409 -10.224 -18.138 787 H SER 121 H SER 121 0.103 -7.265 -13.979 788 HA SER 121 HA SER 121 1.022 -5.162 -12.396 789 HB3 SER 121 2HB SER 121 1.562 -3.778 -14.177 790 HG SER 121 HG SER 121 -0.488 -5.145 -15.507 791 H HIS 122 H HIS 122 -0.549 -4.534 -11.012 792 HA HIS 122 HA HIS 122 -3.253 -5.561 -11.537 793 HB3 HIS 122 2HB HIS 122 -3.430 -5.090 -8.960 794 HD1 HIS 122 1HD HIS 122 -2.350 -7.248 -7.364 795 HD2 HIS 122 2HD HIS 122 -2.820 -7.696 -11.468 796 HE1 HIS 122 1HE HIS 122 -2.422 -9.730 -7.766 797 H LYS 123 H LYS 123 -2.383 -3.106 -9.179 798 HA LYS 123 HA LYS 123 -2.949 -0.771 -10.483 799 HB3 LYS 123 2HB LYS 123 -5.496 -0.926 -9.252 800 HG3 LYS 123 2HG LYS 123 -4.419 -0.460 -11.940 801 HD3 LYS 123 2HD LYS 123 -7.248 -1.429 -11.527 802 HE3 LYS 123 2HE LYS 123 -6.192 -0.625 -14.186 803 HZ1 LYS 123 3HZ LYS 123 -8.868 -0.101 -13.056 804 HZ2 LYS 123 1HZ LYS 123 -8.465 -1.633 -13.648 805 HZ3 LYS 123 2HZ LYS 123 -8.419 -0.290 -14.675 806 H LYS 124 H LYS 124 -4.488 0.676 -8.715 807 HA LYS 124 HA LYS 124 -4.076 0.188 -5.998 808 HB3 LYS 124 2HB LYS 124 -2.233 2.296 -6.180 809 HG3 LYS 124 2HG LYS 124 -0.637 0.788 -5.219 810 HD3 LYS 124 2HD LYS 124 -3.120 -0.370 -4.090 811 HE3 LYS 124 2HE LYS 124 -2.050 0.715 -2.025 812 HZ1 LYS 124 3HZ LYS 124 -0.739 -1.469 -3.536 813 HZ2 LYS 124 1HZ LYS 124 -1.848 -1.602 -2.265 814 HZ3 LYS 124 2HZ LYS 124 -0.279 -1.045 -1.964 815 H ASN 125 H ASN 125 -3.271 3.206 -7.672 816 HA ASN 125 HA ASN 125 -5.912 4.288 -7.405 817 HB3 ASN 125 2HB ASN 125 -4.900 6.220 -5.915 818 HD21 ASN 125 1HD2 ASN 125 -7.253 4.983 -6.175 819 HD22 ASN 125 2HD2 ASN 125 -7.768 4.308 -4.670 820 H ILE 126 H ILE 126 -6.175 6.229 -8.518 821 HA ILE 126 HA ILE 126 -3.922 6.926 -10.260 822 HB ILE 126 HB ILE 126 -6.353 6.308 -11.065 823 HG13 ILE 126 2HG1 ILE 126 -4.178 7.786 -12.131 824 HG21 ILE 126 1HG2 ILE 126 -7.916 8.003 -11.159 825 HG22 ILE 126 2HG2 ILE 126 -7.196 8.264 -9.571 826 HG23 ILE 126 3HG2 ILE 126 -6.711 9.270 -10.935 827 HD11 ILE 126 3HD1 ILE 126 -4.965 6.967 -14.295 828 HD12 ILE 126 1HD1 ILE 126 -4.947 5.695 -13.075 829 HD13 ILE 126 2HD1 ILE 126 -6.472 6.447 -13.543 830 H PHE 127 H PHE 127 -4.410 9.401 -11.075 831 HA PHE 127 HA PHE 127 -3.665 10.993 -8.814 832 HB3 PHE 127 2HB PHE 127 -2.818 11.242 -11.215 833 HD1 PHE 127 1HD PHE 127 -4.576 10.261 -12.784 834 HD2 PHE 127 2HD PHE 127 -4.742 14.233 -11.267 835 HE1 PHE 127 1HE PHE 127 -6.101 10.891 -14.611 836 HE2 PHE 127 2HE PHE 127 -6.268 14.870 -13.089 837 HZ PHE 127 HZ PHE 127 -6.950 13.198 -14.764 838 H GLU 128 H GLU 128 -6.374 9.828 -8.826 839 HA GLU 128 HA GLU 128 -8.337 11.756 -9.358 840 HB3 GLU 128 2HB GLU 128 -8.421 9.639 -7.204 841 HG3 GLU 128 2HG GLU 128 -10.331 11.006 -6.974 842 H LYS 129 H LYS 129 -5.978 11.602 -6.902 843 HA LYS 129 HA LYS 129 -6.629 14.135 -5.859 844 HB3 LYS 129 2HB LYS 129 -6.964 12.833 -3.454 845 HG3 LYS 129 2HG LYS 129 -9.559 13.274 -4.505 846 HD3 LYS 129 2HD LYS 129 -8.182 15.440 -3.043 847 HE3 LYS 129 2HE LYS 129 -10.635 13.787 -2.447 848 HZ1 LYS 129 3HZ LYS 129 -10.814 16.311 -1.353 849 HZ2 LYS 129 1HZ LYS 129 -9.259 15.772 -0.962 850 HZ3 LYS 129 2HZ LYS 129 -10.608 14.853 -0.520 851 HA PRO 130 HA PRO 130 -2.310 12.739 -5.174 852 HB3 PRO 130 2HB PRO 130 -1.649 13.900 -7.043 853 HG3 PRO 130 2HG PRO 130 -2.890 15.699 -7.838 854 HD3 PRO 130 2HD PRO 130 -4.563 14.129 -7.616 855 H PHE 131 H PHE 131 -0.654 13.613 -3.712 856 HA PHE 131 HA PHE 131 -1.055 15.799 -2.013 857 HB3 PHE 131 2HB PHE 131 -1.432 13.640 -0.150 858 HD1 PHE 131 1HD PHE 131 -0.968 15.907 0.988 859 HD2 PHE 131 2HD PHE 131 -4.542 15.007 -1.142 860 HE1 PHE 131 1HE PHE 131 -2.129 17.721 2.177 861 HE2 PHE 131 2HE PHE 131 -5.709 16.821 0.043 862 HZ PHE 131 HZ PHE 131 -4.503 18.181 1.704 863 H MET 132 H MET 132 0.560 15.964 -0.358 864 HA MET 132 HA MET 132 2.991 14.609 -1.068 865 HB3 MET 132 2HB MET 132 3.035 16.968 -0.454 866 HG3 MET 132 2HG MET 132 2.586 16.323 2.413 867 HE1 MET 132 3HE MET 132 2.491 19.736 -0.402 868 HE2 MET 132 1HE MET 132 1.434 18.325 -0.443 869 HE3 MET 132 2HE MET 132 0.905 19.799 0.368 870 H ALA 133 H ALA 133 3.667 12.741 -0.266 871 HA ALA 133 HA ALA 133 2.571 11.835 2.313 872 HB1 ALA 133 1HB ALA 133 3.861 9.844 0.575 873 HB2 ALA 133 2HB ALA 133 2.361 9.747 1.498 874 HB3 ALA 133 3HB ALA 133 2.383 10.562 -0.065 875 H ARG 134 H ARG 134 3.939 10.902 3.845 876 HA ARG 134 HA ARG 134 6.816 11.357 3.391 877 HB3 ARG 134 2HB ARG 134 5.944 11.379 6.187 878 HG3 ARG 134 2HG ARG 134 7.126 13.820 5.208 879 HD3 ARG 134 2HD ARG 134 7.233 13.133 7.523 880 HE ARG 134 HE ARG 134 8.132 10.613 6.520 881 HH11 ARG 134 1HH1 ARG 134 8.293 12.786 9.233 882 HH12 ARG 134 2HH1 ARG 134 8.633 11.536 10.383 883 HH21 ARG 134 1HH2 ARG 134 8.577 8.956 8.023 884 HH22 ARG 134 2HH2 ARG 134 8.794 9.357 9.693 885 H TYR 135 H TYR 135 4.334 9.266 4.642 886 HA TYR 135 HA TYR 135 6.063 6.997 4.539 887 HB3 TYR 135 2HB TYR 135 5.326 8.175 7.201 888 HD1 TYR 135 1HD TYR 135 3.593 6.628 7.970 889 HD2 TYR 135 2HD TYR 135 7.420 5.218 6.761 890 HE1 TYR 135 1HE TYR 135 3.131 4.468 9.051 891 HE2 TYR 135 2HE TYR 135 6.968 3.053 7.838 892 HH TYR 135 HH TYR 135 5.595 2.022 9.393 893 H VAL 136 H VAL 136 4.889 5.238 4.087 894 HA VAL 136 HA VAL 136 1.997 5.325 4.658 895 HB VAL 136 HB VAL 136 1.519 4.211 2.622 896 HG11 VAL 136 1HG1 VAL 136 1.863 6.582 2.344 897 HG12 VAL 136 2HG1 VAL 136 3.597 6.339 2.126 898 HG13 VAL 136 3HG1 VAL 136 2.462 5.735 0.918 899 HG21 VAL 136 3HG2 VAL 136 3.872 3.932 1.190 900 HG22 VAL 136 1HG2 VAL 136 4.290 3.378 2.812 901 HG23 VAL 136 2HG2 VAL 136 2.945 2.635 1.946 902 H ARG 137 H ARG 137 0.958 3.306 5.072 903 HA ARG 137 HA ARG 137 2.790 1.152 5.898 904 HB3 ARG 137 2HB ARG 137 0.333 2.140 7.356 905 HG3 ARG 137 2HG ARG 137 2.209 -0.068 8.171 906 HD3 ARG 137 2HD ARG 137 0.075 1.457 9.512 907 HE ARG 137 HE ARG 137 -0.152 -1.400 9.358 908 HH11 ARG 137 1HH1 ARG 137 -0.652 1.399 11.366 909 HH12 ARG 137 2HH1 ARG 137 -1.880 0.650 12.330 910 HH21 ARG 137 1HH2 ARG 137 -1.768 -2.398 10.622 911 HH22 ARG 137 2HH2 ARG 137 -2.513 -1.510 11.908 912 H VAL 138 H VAL 138 2.183 -0.913 5.426 913 HA VAL 138 HA VAL 138 -0.452 -1.311 4.179 914 HB VAL 138 HB VAL 138 2.117 -2.510 3.135 915 HG11 VAL 138 1HG1 VAL 138 0.116 -3.890 2.799 916 HG12 VAL 138 2HG1 VAL 138 -0.679 -2.531 2.002 917 HG13 VAL 138 3HG1 VAL 138 0.748 -3.269 1.274 918 HG21 VAL 138 3HG2 VAL 138 0.903 -0.846 1.210 919 HG22 VAL 138 1HG2 VAL 138 0.995 0.082 2.705 920 HG23 VAL 138 2HG2 VAL 138 2.456 -0.622 2.014 921 H LEU 139 H LEU 139 -1.494 -3.144 4.745 922 HA LEU 139 HA LEU 139 -0.008 -5.250 6.139 923 HB3 LEU 139 2HB LEU 139 -2.563 -4.024 7.168 924 HG LEU 139 HG LEU 139 -0.991 -6.367 8.098 925 HD11 LEU 139 1HD1 LEU 139 -0.564 -4.895 9.919 926 HD12 LEU 139 2HD1 LEU 139 -1.864 -5.981 10.410 927 HD13 LEU 139 3HD1 LEU 139 -2.234 -4.325 9.929 928 HD21 LEU 139 3HD2 LEU 139 -3.055 -6.987 7.279 929 HD22 LEU 139 1HD2 LEU 139 -3.851 -5.534 7.883 930 HD23 LEU 139 2HD2 LEU 139 -3.393 -6.819 9.002 931 HA PRO 140 HA PRO 140 -2.668 -7.233 3.038 932 HB3 PRO 140 2HB PRO 140 -0.764 -7.963 1.979 933 HG3 PRO 140 2HG PRO 140 1.226 -8.247 3.150 934 HD3 PRO 140 2HD PRO 140 0.663 -6.120 3.835 935 H VAL 141 H VAL 141 -4.242 -8.756 3.289 936 HA VAL 141 HA VAL 141 -4.251 -10.245 5.834 937 HB VAL 141 HB VAL 141 -6.613 -9.219 4.255 938 HG11 VAL 141 1HG1 VAL 141 -7.721 -10.893 5.232 939 HG12 VAL 141 2HG1 VAL 141 -6.372 -11.271 6.306 940 HG13 VAL 141 3HG1 VAL 141 -7.515 -9.998 6.737 941 HG21 VAL 141 3HG2 VAL 141 -5.306 -8.326 6.807 942 HG22 VAL 141 1HG2 VAL 141 -5.671 -7.378 5.366 943 HG23 VAL 141 2HG2 VAL 141 -6.977 -7.919 6.420 944 H SER 142 H SER 142 -5.479 -10.355 2.492 945 HA SER 142 HA SER 142 -5.260 -13.291 2.612 946 HB3 SER 142 2HB SER 142 -7.201 -13.541 1.340 947 HG SER 142 HG SER 142 -8.680 -12.538 2.532 948 H TRP 143 H TRP 143 -3.948 -14.227 1.183 949 HA TRP 143 HA TRP 143 -3.186 -12.733 -1.231 950 HB3 TRP 143 2HB TRP 143 -1.401 -12.478 0.453 951 HD1 TRP 143 HD TRP 143 0.207 -15.699 -0.484 952 HE1 TRP 143 1HE TRP 143 0.484 -17.191 1.595 953 HE3 TRP 143 3HE TRP 143 -2.750 -13.101 2.779 954 HZ2 TRP 143 2HZ TRP 143 -0.431 -17.258 4.264 955 HZ3 TRP 143 3HZ TRP 143 -2.997 -13.947 5.076 956 HH2 TRP 143 HH TRP 143 -1.862 -15.983 5.802 957 H HIS 144 H HIS 144 -1.989 -14.209 -2.806 958 HA HIS 144 HA HIS 144 -3.106 -16.932 -2.701 959 HB3 HIS 144 2HB HIS 144 -2.981 -16.424 -5.384 960 HD1 HIS 144 1HD HIS 144 -4.604 -18.268 -3.585 961 HD2 HIS 144 2HD HIS 144 -6.106 -14.761 -5.232 962 HE1 HIS 144 1HE HIS 144 -7.102 -18.558 -3.622 963 H ASN 145 H ASN 145 -1.626 -18.474 -2.889 964 HA ASN 145 HA ASN 145 0.247 -19.611 -3.550 965 HB3 ASN 145 2HB ASN 145 1.470 -17.411 -5.087 966 HD21 ASN 145 1HD2 ASN 145 2.791 -19.525 -4.409 967 HD22 ASN 145 2HD2 ASN 145 2.879 -20.700 -5.673 968 H ARG 146 H ARG 146 1.082 -16.154 -3.230 969 HA ARG 146 HA ARG 146 2.370 -16.413 -0.757 970 HB3 ARG 146 2HB ARG 146 4.585 -15.878 -2.560 971 HG3 ARG 146 2HG ARG 146 5.350 -18.050 -1.189 972 HD3 ARG 146 2HD ARG 146 5.269 -15.696 0.540 973 HE ARG 146 HE ARG 146 7.245 -16.747 0.955 974 HH11 ARG 146 1HH1 ARG 146 6.746 -16.654 -2.489 975 HH12 ARG 146 2HH1 ARG 146 8.292 -17.342 -2.863 976 HH21 ARG 146 1HH2 ARG 146 9.284 -17.653 0.476 977 HH22 ARG 146 2HH2 ARG 146 9.733 -17.912 -1.176 978 H ILE 147 H ILE 147 3.026 -14.435 0.059 979 HA ILE 147 HA ILE 147 1.950 -12.134 -1.205 980 HB ILE 147 HB ILE 147 3.854 -12.253 1.137 981 HG13 ILE 147 2HG1 ILE 147 0.951 -12.776 0.860 982 HG21 ILE 147 1HG2 ILE 147 3.879 -10.034 0.693 983 HG22 ILE 147 2HG2 ILE 147 2.351 -10.081 -0.185 984 HG23 ILE 147 3HG2 ILE 147 2.355 -10.078 1.578 985 HD11 ILE 147 3HD1 ILE 147 3.078 -14.144 1.939 986 HD12 ILE 147 1HD1 ILE 147 2.240 -13.503 3.352 987 HD13 ILE 147 2HD1 ILE 147 1.370 -14.504 2.188 988 H THR 148 H THR 148 3.049 -12.133 -3.245 989 HA THR 148 HA THR 148 5.712 -10.891 -3.077 990 HB THR 148 HB THR 148 5.080 -12.565 -5.461 991 HG1 THR 148 1HG THR 148 4.639 -14.073 -3.913 992 HG21 THR 148 3HG2 THR 148 7.657 -13.049 -4.722 993 HG22 THR 148 1HG2 THR 148 7.423 -11.410 -4.115 994 HG23 THR 148 2HG2 THR 148 7.155 -11.765 -5.822 995 H LEU 149 H LEU 149 4.964 -8.821 -3.405 996 HA LEU 149 HA LEU 149 3.938 -8.276 -6.099 997 HB3 LEU 149 2HB LEU 149 2.449 -6.544 -5.185 998 HG LEU 149 HG LEU 149 1.886 -9.256 -3.988 999 HD11 LEU 149 1HD1 LEU 149 0.220 -6.770 -4.219 1000 HD12 LEU 149 2HD1 LEU 149 0.527 -7.767 -2.796 1001 HD13 LEU 149 3HD1 LEU 149 -0.502 -8.375 -4.093 1002 HD21 LEU 149 3HD2 LEU 149 1.311 -7.976 -6.632 1003 HD22 LEU 149 1HD2 LEU 149 0.237 -9.216 -5.983 1004 HD23 LEU 149 2HD2 LEU 149 1.936 -9.588 -6.281 1005 H ARG 150 H ARG 150 3.859 -5.631 -6.190 1006 HA ARG 150 HA ARG 150 6.324 -4.563 -5.043 1007 HB3 ARG 150 2HB ARG 150 7.286 -3.932 -7.093 1008 HG3 ARG 150 2HG ARG 150 7.094 -6.524 -6.640 1009 HD3 ARG 150 2HD ARG 150 5.070 -6.034 -8.628 1010 HE ARG 150 HE ARG 150 6.582 -8.222 -9.657 1011 HH11 ARG 150 1HH1 ARG 150 6.207 -4.764 -9.798 1012 HH12 ARG 150 2HH1 ARG 150 6.846 -4.629 -11.402 1013 HH21 ARG 150 1HH2 ARG 150 7.425 -8.058 -11.769 1014 HH22 ARG 150 2HH2 ARG 150 7.537 -6.504 -12.524 1015 H LEU 151 H LEU 151 5.640 -2.811 -4.005 1016 HA LEU 151 HA LEU 151 3.392 -1.273 -5.026 1017 HB3 LEU 151 2HB LEU 151 3.383 -0.157 -2.923 1018 HG LEU 151 HG LEU 151 2.919 -1.802 -1.385 1019 HD11 LEU 151 1HD1 LEU 151 2.919 -3.724 -3.633 1020 HD12 LEU 151 2HD1 LEU 151 2.034 -2.216 -3.865 1021 HD13 LEU 151 3HD1 LEU 151 1.628 -3.279 -2.517 1022 HD21 LEU 151 3HD2 LEU 151 5.409 -2.570 -1.516 1023 HD22 LEU 151 1HD2 LEU 151 4.765 -3.824 -2.575 1024 HD23 LEU 151 2HD2 LEU 151 4.173 -3.678 -0.920 1025 H GLU 152 H GLU 152 3.784 0.248 -6.487 1026 HA GLU 152 HA GLU 152 6.276 1.804 -6.262 1027 HB3 GLU 152 2HB GLU 152 4.687 1.745 -8.789 1028 HG3 GLU 152 2HG GLU 152 7.651 1.733 -8.265 1029 H LEU 153 H LEU 153 6.188 4.002 -6.218 1030 HA LEU 153 HA LEU 153 3.500 5.211 -6.213 1031 HB3 LEU 153 2HB LEU 153 4.152 5.470 -4.033 1032 HG LEU 153 HG LEU 153 6.919 5.359 -4.996 1033 HD11 LEU 153 1HD1 LEU 153 7.914 6.779 -3.447 1034 HD12 LEU 153 2HD1 LEU 153 6.430 6.957 -2.511 1035 HD13 LEU 153 3HD1 LEU 153 6.578 7.739 -4.085 1036 HD21 LEU 153 3HD2 LEU 153 5.435 3.785 -3.465 1037 HD22 LEU 153 1HD2 LEU 153 6.083 4.828 -2.198 1038 HD23 LEU 153 2HD2 LEU 153 7.179 3.926 -3.244 1039 H LEU 154 H LEU 154 3.161 7.043 -7.381 1040 HA LEU 154 HA LEU 154 5.461 8.116 -8.878 1041 HB3 LEU 154 2HB LEU 154 3.922 8.563 -10.737 1042 HG LEU 154 HG LEU 154 3.710 6.438 -11.676 1043 HD11 LEU 154 1HD1 LEU 154 5.790 5.718 -9.677 1044 HD12 LEU 154 2HD1 LEU 154 6.040 7.151 -10.674 1045 HD13 LEU 154 3HD1 LEU 154 5.810 5.577 -11.435 1046 HD21 LEU 154 3HD2 LEU 154 3.268 4.441 -10.549 1047 HD22 LEU 154 1HD2 LEU 154 2.275 5.632 -9.710 1048 HD23 LEU 154 2HD2 LEU 154 3.794 5.092 -8.995 1049 H GLY 155 H GLY 155 5.549 10.336 -9.215 1050 HA2 GLY 155 2HA GLY 155 3.499 11.934 -7.816 1051 HA3 GLY 155 3HA GLY 155 5.211 12.220 -7.542 1052 H CYS 156 H CYS 156 4.100 14.401 -8.254 1053 HA CYS 156 HA CYS 156 4.289 14.636 -11.181 1054 HB3 CYS 156 2HB CYS 156 3.088 16.641 -9.267 1055 H LEU 157 H LEU 157 5.784 15.493 -8.221 1056 HA LEU 157 HA LEU 157 7.638 16.701 -7.701 1057 HB3 LEU 157 2HB LEU 157 8.779 17.225 -10.239 1058 HG LEU 157 HG LEU 157 10.481 15.651 -9.689 1059 HD11 LEU 157 1HD1 LEU 157 11.286 16.934 -8.066 1060 HD12 LEU 157 2HD1 LEU 157 10.065 16.373 -6.925 1061 HD13 LEU 157 3HD1 LEU 157 9.709 17.721 -8.004 1062 HD21 LEU 157 3HD2 LEU 157 8.906 13.821 -9.046 1063 HD22 LEU 157 1HD2 LEU 157 8.720 14.609 -7.478 1064 HD23 LEU 157 2HD2 LEU 157 10.298 13.997 -7.976 1065 H GLU 158 H GLU 158 5.096 18.023 -8.657 1066 HA GLU 158 HA GLU 158 6.139 20.569 -9.649 1067 HB3 GLU 158 2HB GLU 158 3.340 20.715 -9.241 1068 HG3 GLU 158 2HG GLU 158 4.591 20.077 -11.881 Start of MODEL 20 1 H1 MET -5 H MET -5 17.546 11.660 -26.183 2 HA MET -5 HA MET -5 16.923 14.158 -25.107 3 HB3 MET -5 2HB MET -5 17.038 15.523 -27.230 4 HG3 MET -5 2HG MET -5 19.640 14.588 -26.046 5 HE1 MET -5 3HE MET -5 19.159 18.480 -26.592 6 HE2 MET -5 1HE MET -5 19.085 18.517 -28.354 7 HE3 MET -5 2HE MET -5 17.845 17.661 -27.438 8 H LYS -4 H LYS -4 15.509 11.872 -25.308 9 HA LYS -4 HA LYS -4 13.227 12.720 -26.893 10 HB3 LYS -4 2HB LYS -4 13.015 10.230 -27.663 11 HG3 LYS -4 2HG LYS -4 13.772 12.447 -28.996 12 HD3 LYS -4 2HD LYS -4 16.207 11.466 -28.430 13 HE3 LYS -4 2HE LYS -4 15.146 9.860 -30.663 14 HZ1 LYS -4 3HZ LYS -4 17.942 10.099 -30.990 15 HZ2 LYS -4 1HZ LYS -4 17.218 11.614 -31.208 16 HZ3 LYS -4 2HZ LYS -4 16.718 10.294 -32.141 17 H SER -3 H SER -3 12.347 13.092 -24.801 18 HA SER -3 HA SER -3 10.925 10.844 -23.758 19 HB3 SER -3 2HB SER -3 12.550 10.207 -22.307 20 HG SER -3 HG SER -3 14.245 11.631 -21.661 21 H GLY -2 H GLY -2 9.804 11.604 -21.573 22 HA2 GLY -2 2HA GLY -2 9.274 13.993 -20.625 23 HA3 GLY -2 3HA GLY -2 8.590 14.187 -22.233 24 H HIS -1 H HIS -1 8.467 11.971 -19.447 25 HA HIS -1 HA HIS -1 5.989 10.814 -20.120 26 HB3 HIS -1 2HB HIS -1 6.423 10.904 -17.259 27 HD1 HIS -1 1HD HIS -1 7.743 8.341 -19.710 28 HD2 HIS -1 2HD HIS -1 4.609 8.870 -17.035 29 HE1 HIS -1 1HE HIS -1 6.564 6.122 -19.610 30 H GLY 0 H GLY 0 4.333 10.996 -17.968 31 HA2 GLY 0 2HA GLY 0 3.381 13.770 -18.205 32 HA3 GLY 0 3HA GLY 0 2.379 12.377 -17.827 33 H CYS 1 H CYS 1 1.514 13.397 -15.997 34 HA CYS 1 HA CYS 1 3.078 14.507 -13.923 35 HB3 CYS 1 2HB CYS 1 0.241 13.644 -14.227 36 H SER 2 H SER 2 1.304 11.410 -14.001 37 HA SER 2 HA SER 2 2.239 10.347 -11.635 38 HB3 SER 2 2HB SER 2 0.465 9.269 -12.893 39 HG SER 2 HG SER 2 0.720 8.576 -14.889 40 H GLU 3 H GLU 3 4.351 10.520 -11.108 41 HA GLU 3 HA GLU 3 6.288 9.221 -12.908 42 HB3 GLU 3 2HB GLU 3 6.498 11.743 -12.673 43 HG3 GLU 3 2HG GLU 3 6.552 11.085 -9.903 44 HA PRO 4 HA PRO 4 7.354 6.516 -9.620 45 HB3 PRO 4 2HB PRO 4 8.692 5.412 -11.127 46 HG3 PRO 4 2HG PRO 4 9.885 6.574 -12.749 47 HD3 PRO 4 2HD PRO 4 7.794 7.493 -13.059 48 H LEU 5 H LEU 5 9.643 6.213 -8.219 49 HA LEU 5 HA LEU 5 10.081 8.832 -6.942 50 HB3 LEU 5 2HB LEU 5 8.757 7.713 -5.400 51 HG LEU 5 HG LEU 5 9.274 5.390 -4.549 52 HD11 LEU 5 1HD1 LEU 5 7.482 4.824 -5.722 53 HD12 LEU 5 2HD1 LEU 5 8.424 4.758 -7.211 54 HD13 LEU 5 3HD1 LEU 5 7.697 6.280 -6.694 55 HD21 LEU 5 3HD2 LEU 5 11.532 5.377 -5.752 56 HD22 LEU 5 1HD2 LEU 5 10.611 4.994 -7.207 57 HD23 LEU 5 2HD2 LEU 5 10.562 3.906 -5.820 58 H GLY 6 H GLY 6 11.501 6.434 -8.672 59 HA2 GLY 6 2HA GLY 6 14.132 7.376 -8.169 60 HA3 GLY 6 3HA GLY 6 13.885 5.820 -7.391 61 H LEU 7 H LEU 7 12.327 6.714 -10.394 62 HA LEU 7 HA LEU 7 14.119 4.872 -11.831 63 HB3 LEU 7 2HB LEU 7 12.170 4.134 -13.149 64 HG LEU 7 HG LEU 7 11.785 3.707 -10.187 65 HD11 LEU 7 1HD1 LEU 7 9.823 2.820 -10.751 66 HD12 LEU 7 2HD1 LEU 7 10.742 1.541 -11.543 67 HD13 LEU 7 3HD1 LEU 7 10.177 2.928 -12.475 68 HD21 LEU 7 3HD2 LEU 7 13.428 2.217 -10.303 69 HD22 LEU 7 1HD2 LEU 7 13.802 2.840 -11.909 70 HD23 LEU 7 2HD2 LEU 7 12.719 1.459 -11.730 71 H LYS 8 H LYS 8 13.705 7.918 -11.553 72 HA LYS 8 HA LYS 8 13.886 8.450 -14.433 73 HB3 LYS 8 2HB LYS 8 12.748 10.760 -13.454 74 HG3 LYS 8 2HG LYS 8 10.693 8.919 -14.321 75 HD3 LYS 8 2HD LYS 8 10.858 11.470 -14.525 76 HE3 LYS 8 2HE LYS 8 13.143 10.817 -15.975 77 HZ1 LYS 8 3HZ LYS 8 12.318 10.437 -18.027 78 HZ2 LYS 8 1HZ LYS 8 12.284 12.127 -18.099 79 HZ3 LYS 8 2HZ LYS 8 10.872 11.268 -17.742 80 H ASN 9 H ASN 9 13.946 10.531 -11.552 81 HA ASN 9 HA ASN 9 16.747 11.187 -12.190 82 HB3 ASN 9 2HB ASN 9 15.812 13.442 -10.936 83 HD21 ASN 9 1HD2 ASN 9 17.890 13.507 -12.159 84 HD22 ASN 9 2HD2 ASN 9 17.838 14.106 -13.778 85 H ASN 10 H ASN 10 14.285 10.779 -9.719 86 HA ASN 10 HA ASN 10 15.700 11.482 -7.446 87 HB3 ASN 10 2HB ASN 10 14.254 9.571 -6.381 88 HD21 ASN 10 1HD2 ASN 10 13.546 12.164 -8.675 89 HD22 ASN 10 2HD2 ASN 10 12.490 13.041 -7.626 90 H THR 11 H THR 11 15.600 8.344 -9.105 91 HA THR 11 HA THR 11 16.892 6.473 -8.913 92 HB THR 11 HB THR 11 19.236 6.787 -9.059 93 HG1 THR 11 1HG THR 11 19.834 9.217 -8.521 94 HG21 THR 11 3HG2 THR 11 19.194 7.939 -10.981 95 HG22 THR 11 1HG2 THR 11 18.705 9.427 -10.172 96 HG23 THR 11 2HG2 THR 11 17.491 8.235 -10.635 97 H ILE 12 H ILE 12 15.481 6.950 -6.598 98 HA ILE 12 HA ILE 12 17.193 6.875 -4.298 99 HB ILE 12 HB ILE 12 14.242 6.387 -4.653 100 HG13 ILE 12 2HG1 ILE 12 13.991 8.493 -3.502 101 HG21 ILE 12 1HG2 ILE 12 14.135 6.386 -2.159 102 HG22 ILE 12 2HG2 ILE 12 14.905 4.961 -2.855 103 HG23 ILE 12 3HG2 ILE 12 15.891 6.235 -2.138 104 HD11 ILE 12 3HD1 ILE 12 16.990 8.580 -3.274 105 HD12 ILE 12 1HD1 ILE 12 15.875 9.879 -2.848 106 HD13 ILE 12 2HD1 ILE 12 15.856 8.366 -1.941 107 HA PRO 13 HA PRO 13 18.123 2.547 -4.490 108 HB3 PRO 13 2HB PRO 13 20.063 3.082 -3.381 109 HG3 PRO 13 2HG PRO 13 20.129 4.840 -1.859 110 HD3 PRO 13 2HD PRO 13 19.133 5.900 -3.648 111 H ASP 14 H ASP 14 18.067 0.795 -2.458 112 HA ASP 14 HA ASP 14 15.221 0.555 -1.918 113 HB3 ASP 14 2HB ASP 14 15.650 -1.729 -1.406 114 H SER 15 H SER 15 16.192 2.627 -0.477 115 HA SER 15 HA SER 15 16.364 1.552 2.262 116 HB3 SER 15 2HB SER 15 17.347 4.006 2.632 117 HG SER 15 HG SER 15 18.660 2.384 3.185 118 H GLN 16 H GLN 16 14.096 2.489 0.389 119 HA GLN 16 HA GLN 16 12.942 4.555 2.125 120 HB3 GLN 16 2HB GLN 16 12.968 5.148 -0.222 121 HG3 GLN 16 2HG GLN 16 11.280 2.710 -0.733 122 HE21 GLN 16 1HE2 GLN 16 10.193 2.734 -2.577 123 HE22 GLN 16 2HE2 GLN 16 10.335 3.931 -3.814 124 H MET 17 H MET 17 12.258 1.398 0.679 125 HA MET 17 HA MET 17 9.822 1.144 2.258 126 HB3 MET 17 2HB MET 17 10.195 -1.271 0.982 127 HG3 MET 17 2HG MET 17 8.726 1.206 0.202 128 HE1 MET 17 3HE MET 17 6.397 -0.712 -0.659 129 HE2 MET 17 1HE MET 17 6.472 -1.145 -2.368 130 HE3 MET 17 2HE MET 17 7.132 -2.239 -1.152 131 H SER 18 H SER 18 9.453 -0.656 3.665 132 HA SER 18 HA SER 18 11.480 -2.465 4.439 133 HB3 SER 18 2HB SER 18 12.720 -0.951 5.620 134 HG SER 18 HG SER 18 11.236 0.778 6.801 135 H ALA 19 H ALA 19 10.341 -4.165 5.056 136 HA ALA 19 HA ALA 19 7.862 -3.723 6.592 137 HB1 ALA 19 1HB ALA 19 8.388 -6.029 4.727 138 HB2 ALA 19 2HB ALA 19 6.871 -5.619 5.529 139 HB3 ALA 19 3HB ALA 19 7.514 -4.567 4.269 140 H SER 20 H SER 20 7.251 -6.140 7.491 141 HA SER 20 HA SER 20 8.840 -6.541 9.709 142 HB3 SER 20 2HB SER 20 7.377 -8.871 8.513 143 HG SER 20 HG SER 20 8.385 -8.798 10.683 144 H SER 21 H SER 21 9.041 -8.077 6.543 145 HA SER 21 HA SER 21 11.746 -8.535 6.538 146 HB3 SER 21 2HB SER 21 11.356 -11.217 6.916 147 HG SER 21 HG SER 21 12.996 -10.638 8.085 148 H SER 22 H SER 22 12.265 -10.630 5.088 149 HA SER 22 HA SER 22 10.249 -10.679 2.939 150 HB3 SER 22 2HB SER 22 11.858 -10.369 1.299 151 HG SER 22 HG SER 22 13.561 -8.956 2.698 152 H TYR 23 H TYR 23 10.274 -12.588 1.584 153 HA TYR 23 HA TYR 23 10.162 -14.968 2.958 154 HB3 TYR 23 2HB TYR 23 9.257 -14.444 0.637 155 HD1 TYR 23 1HD TYR 23 11.166 -12.671 -0.134 156 HD2 TYR 23 2HD TYR 23 11.215 -16.863 -0.855 157 HE1 TYR 23 1HE TYR 23 12.668 -12.317 -2.050 158 HE2 TYR 23 2HE TYR 23 12.718 -16.521 -2.772 159 HH TYR 23 HH TYR 23 13.538 -14.940 -4.209 160 H LYS 24 H LYS 24 11.487 -16.876 2.894 161 HA LYS 24 HA LYS 24 14.113 -16.496 3.672 162 HB3 LYS 24 2HB LYS 24 12.705 -18.555 4.026 163 HG3 LYS 24 2HG LYS 24 13.737 -19.390 1.327 164 HD3 LYS 24 2HD LYS 24 13.204 -20.994 3.377 165 HE3 LYS 24 2HE LYS 24 10.827 -21.880 2.837 166 HZ1 LYS 24 3HZ LYS 24 10.033 -20.811 4.686 167 HZ2 LYS 24 1HZ LYS 24 10.746 -19.329 4.293 168 HZ3 LYS 24 2HZ LYS 24 11.696 -20.589 4.901 169 H THR 25 H THR 25 16.091 -16.579 2.678 170 HA THR 25 HA THR 25 16.101 -16.770 -0.261 171 HB THR 25 HB THR 25 17.962 -15.038 -0.206 172 HG1 THR 25 1HG THR 25 16.853 -14.135 2.214 173 HG21 THR 25 3HG2 THR 25 15.081 -14.478 0.355 174 HG22 THR 25 1HG2 THR 25 16.007 -14.220 -1.123 175 HG23 THR 25 2HG2 THR 25 16.220 -13.136 0.252 176 H TRP 26 H TRP 26 18.466 -16.952 -1.063 177 HA TRP 26 HA TRP 26 19.570 -19.299 0.133 178 HB3 TRP 26 2HB TRP 26 21.449 -18.717 -1.633 179 HD1 TRP 26 HD TRP 26 18.528 -18.577 -3.887 180 HE1 TRP 26 1HE TRP 26 17.842 -20.945 -4.628 181 HE3 TRP 26 3HE TRP 26 21.275 -21.301 -0.545 182 HZ2 TRP 26 2HZ TRP 26 18.393 -23.614 -3.892 183 HZ3 TRP 26 3HZ TRP 26 21.139 -23.756 -0.630 184 HH2 TRP 26 HH TRP 26 19.727 -24.886 -2.269 185 H ASN 27 H ASN 27 21.047 -16.113 -0.521 186 HA ASN 27 HA ASN 27 23.172 -16.614 1.346 187 HB3 ASN 27 2HB ASN 27 23.743 -14.184 0.830 188 HD21 ASN 27 1HD2 ASN 27 22.639 -15.053 -2.259 189 HD22 ASN 27 2HD2 ASN 27 24.084 -15.815 -2.822 190 H LEU 28 H LEU 28 23.672 -14.611 2.871 191 HA LEU 28 HA LEU 28 21.215 -14.037 4.393 192 HB3 LEU 28 2HB LEU 28 23.525 -13.965 6.071 193 HG LEU 28 HG LEU 28 20.912 -14.862 6.342 194 HD11 LEU 28 1HD1 LEU 28 22.307 -17.079 5.552 195 HD12 LEU 28 2HD1 LEU 28 20.820 -17.088 6.501 196 HD13 LEU 28 3HD1 LEU 28 22.383 -17.188 7.311 197 HD21 LEU 28 3HD2 LEU 28 21.493 -15.124 8.664 198 HD22 LEU 28 1HD2 LEU 28 22.347 -13.727 8.008 199 HD23 LEU 28 2HD2 LEU 28 23.207 -15.246 8.260 200 H ARG 29 H ARG 29 24.628 -12.991 4.306 201 HA ARG 29 HA ARG 29 23.782 -10.250 4.814 202 HB3 ARG 29 2HB ARG 29 26.565 -11.405 4.571 203 HG3 ARG 29 2HG ARG 29 25.885 -8.911 6.057 204 HD3 ARG 29 2HD ARG 29 28.387 -9.335 4.529 205 HE ARG 29 HE ARG 29 28.776 -7.549 5.894 206 HH11 ARG 29 1HH1 ARG 29 27.105 -10.003 7.711 207 HH12 ARG 29 2HH1 ARG 29 27.242 -9.164 9.221 208 HH21 ARG 29 1HH2 ARG 29 28.964 -6.433 7.875 209 HH22 ARG 29 2HH2 ARG 29 28.299 -7.132 9.312 210 H ALA 30 H ALA 30 23.069 -9.236 3.037 211 HA ALA 30 HA ALA 30 24.873 -8.541 0.968 212 HB1 ALA 30 1HB ALA 30 23.801 -9.623 -0.923 213 HB2 ALA 30 2HB ALA 30 24.390 -10.828 0.222 214 HB3 ALA 30 3HB ALA 30 22.672 -10.438 0.160 215 H PHE 31 H PHE 31 23.468 -7.553 -0.969 216 HA PHE 31 HA PHE 31 21.362 -5.937 0.311 217 HB3 PHE 31 2HB PHE 31 23.281 -4.561 -0.209 218 HD1 PHE 31 1HD PHE 31 25.226 -5.830 -0.996 219 HD2 PHE 31 2HD PHE 31 22.166 -4.546 -3.660 220 HE1 PHE 31 1HE PHE 31 26.726 -6.228 -2.904 221 HE2 PHE 31 2HE PHE 31 23.661 -4.943 -5.573 222 HZ PHE 31 HZ PHE 31 25.944 -5.786 -5.198 223 H GLY 32 H GLY 32 21.029 -8.493 -1.072 224 HA2 GLY 32 2HA GLY 32 19.532 -7.624 -3.461 225 HA3 GLY 32 3HA GLY 32 20.141 -9.252 -3.193 226 H TRP 33 H TRP 33 19.170 -8.872 -0.290 227 HA TRP 33 HA TRP 33 16.469 -9.850 -0.832 228 HB3 TRP 33 2HB TRP 33 18.053 -11.180 0.588 229 HD1 TRP 33 HD TRP 33 20.170 -9.503 1.351 230 HE1 TRP 33 1HE TRP 33 20.684 -8.556 3.687 231 HE3 TRP 33 3HE TRP 33 15.558 -10.059 3.486 232 HZ2 TRP 33 2HZ TRP 33 19.317 -8.103 6.115 233 HZ3 TRP 33 3HZ TRP 33 15.245 -9.344 5.819 234 HH2 TRP 33 HH TRP 33 17.087 -8.387 7.105 235 H TYR 34 H TYR 34 17.180 -6.993 -0.951 236 HA TYR 34 HA TYR 34 15.721 -5.908 1.345 237 HB3 TYR 34 2HB TYR 34 16.436 -3.703 0.003 238 HD1 TYR 34 1HD TYR 34 19.011 -6.144 1.154 239 HD2 TYR 34 2HD TYR 34 16.796 -2.618 2.027 240 HE1 TYR 34 1HE TYR 34 20.360 -5.806 3.182 241 HE2 TYR 34 2HE TYR 34 18.139 -2.269 4.057 242 HH TYR 34 HH TYR 34 19.625 -4.205 5.633 243 HA PRO 35 HA PRO 35 12.024 -5.065 -0.860 244 HB3 PRO 35 2HB PRO 35 11.213 -4.095 1.060 245 HG3 PRO 35 2HG PRO 35 12.587 -2.811 2.428 246 HD3 PRO 35 2HD PRO 35 13.907 -4.686 2.187 247 H HIS 36 H HIS 36 10.879 -2.992 -1.959 248 HA HIS 36 HA HIS 36 10.841 -1.624 -3.776 249 HB3 HIS 36 2HB HIS 36 13.707 -0.928 -3.140 250 HD1 HIS 36 1HD HIS 36 11.596 -0.604 -5.775 251 HD2 HIS 36 2HD HIS 36 13.279 2.253 -3.272 252 HE1 HIS 36 1HE HIS 36 11.542 1.546 -7.078 253 H LEU 37 H LEU 37 11.204 -4.179 -4.455 254 HA LEU 37 HA LEU 37 13.442 -4.267 -6.350 255 HB3 LEU 37 2HB LEU 37 13.183 -6.613 -6.413 256 HG LEU 37 HG LEU 37 13.014 -5.508 -3.664 257 HD11 LEU 37 1HD1 LEU 37 12.271 -8.287 -4.410 258 HD12 LEU 37 2HD1 LEU 37 11.690 -7.274 -3.088 259 HD13 LEU 37 3HD1 LEU 37 13.274 -8.043 -2.980 260 HD21 LEU 37 3HD2 LEU 37 15.076 -7.053 -3.544 261 HD22 LEU 37 1HD2 LEU 37 15.177 -5.579 -4.507 262 HD23 LEU 37 2HD2 LEU 37 14.926 -7.133 -5.301 263 H GLY 38 H GLY 38 9.981 -4.108 -6.154 264 HA2 GLY 38 2HA GLY 38 9.159 -5.061 -8.606 265 HA3 GLY 38 3HA GLY 38 8.404 -3.708 -7.777 266 H ARG 39 H ARG 39 11.022 -2.215 -7.944 267 HA ARG 39 HA ARG 39 10.499 -0.570 -10.070 268 HB3 ARG 39 2HB ARG 39 12.113 -0.051 -8.286 269 HG3 ARG 39 2HG ARG 39 13.838 -2.067 -9.692 270 HD3 ARG 39 2HD ARG 39 14.868 0.288 -9.151 271 HE ARG 39 HE ARG 39 14.125 -0.306 -6.602 272 HH11 ARG 39 1HH1 ARG 39 17.178 0.136 -8.214 273 HH12 ARG 39 2HH1 ARG 39 17.985 0.736 -6.804 274 HH21 ARG 39 1HH2 ARG 39 15.175 0.481 -4.737 275 HH22 ARG 39 2HH2 ARG 39 16.845 0.931 -4.826 276 H LEU 40 H LEU 40 11.782 -0.225 -12.072 277 HA LEU 40 HA LEU 40 12.048 -2.760 -13.492 278 HB3 LEU 40 2HB LEU 40 10.680 -1.239 -14.639 279 HG LEU 40 HG LEU 40 12.335 0.845 -13.597 280 HD11 LEU 40 1HD1 LEU 40 11.975 0.898 -16.590 281 HD12 LEU 40 2HD1 LEU 40 13.509 0.771 -15.729 282 HD13 LEU 40 3HD1 LEU 40 12.540 2.238 -15.592 283 HD21 LEU 40 3HD2 LEU 40 10.435 2.234 -14.399 284 HD22 LEU 40 1HD2 LEU 40 9.944 0.847 -13.424 285 HD23 LEU 40 2HD2 LEU 40 9.770 0.798 -15.180 286 H ASP 41 H ASP 41 14.090 -2.114 -11.627 287 HA ASP 41 HA ASP 41 16.374 -1.919 -13.468 288 HB3 ASP 41 2HB ASP 41 16.315 -0.668 -10.717 289 H ASN 42 H ASN 42 14.734 -3.849 -11.474 290 HA ASN 42 HA ASN 42 16.933 -4.991 -9.981 291 HB3 ASN 42 2HB ASN 42 14.871 -6.796 -9.780 292 HD21 ASN 42 1HD2 ASN 42 15.187 -3.419 -8.724 293 HD22 ASN 42 2HD2 ASN 42 15.382 -3.787 -7.046 294 H GLN 43 H GLN 43 18.233 -6.564 -10.657 295 HA GLN 43 HA GLN 43 17.543 -7.963 -13.146 296 HB3 GLN 43 2HB GLN 43 19.597 -6.817 -13.410 297 HG3 GLN 43 2HG GLN 43 21.472 -7.745 -11.676 298 HE21 GLN 43 1HE2 GLN 43 21.942 -5.837 -13.075 299 HE22 GLN 43 2HE2 GLN 43 21.737 -4.270 -12.377 300 H GLY 44 H GLY 44 18.173 -10.235 -13.336 301 HA2 GLY 44 2HA GLY 44 18.911 -12.263 -12.177 302 HA3 GLY 44 3HA GLY 44 18.144 -11.626 -10.729 303 H LYS 45 H LYS 45 15.859 -11.631 -10.580 304 HA LYS 45 HA LYS 45 14.105 -12.541 -12.553 305 HB3 LYS 45 2HB LYS 45 15.333 -14.655 -12.375 306 HG3 LYS 45 2HG LYS 45 14.957 -16.027 -10.283 307 HD3 LYS 45 2HD LYS 45 16.711 -13.745 -9.551 308 HE3 LYS 45 2HE LYS 45 17.933 -16.334 -9.909 309 HZ1 LYS 45 3HZ LYS 45 17.799 -15.765 -7.247 310 HZ2 LYS 45 1HZ LYS 45 17.800 -14.237 -7.972 311 HZ3 LYS 45 2HZ LYS 45 19.052 -15.327 -8.293 312 H ILE 46 H ILE 46 14.917 -12.197 -9.187 313 HA ILE 46 HA ILE 46 12.425 -12.568 -8.001 314 HB ILE 46 HB ILE 46 14.571 -10.603 -7.190 315 HG13 ILE 46 2HG1 ILE 46 14.378 -13.507 -7.070 316 HG21 ILE 46 1HG2 ILE 46 11.995 -11.383 -5.999 317 HG22 ILE 46 2HG2 ILE 46 13.367 -11.353 -4.892 318 HG23 ILE 46 3HG2 ILE 46 12.938 -9.906 -5.804 319 HD11 ILE 46 3HD1 ILE 46 16.374 -12.489 -7.893 320 HD12 ILE 46 1HD1 ILE 46 16.569 -11.558 -6.408 321 HD13 ILE 46 2HD1 ILE 46 16.750 -13.313 -6.381 322 H ASN 47 H ASN 47 13.851 -9.339 -8.437 323 HA ASN 47 HA ASN 47 12.796 -7.304 -8.608 324 HB3 ASN 47 2HB ASN 47 13.081 -7.834 -10.927 325 HD21 ASN 47 1HD2 ASN 47 9.667 -8.635 -10.609 326 HD22 ASN 47 2HD2 ASN 47 9.748 -10.122 -11.485 327 H ALA 48 H ALA 48 11.522 -8.901 -6.681 328 HA ALA 48 HA ALA 48 8.973 -7.601 -6.567 329 HB1 ALA 48 1HB ALA 48 7.807 -9.910 -6.214 330 HB2 ALA 48 2HB ALA 48 8.037 -9.272 -7.843 331 HB3 ALA 48 3HB ALA 48 9.129 -10.509 -7.219 332 H TRP 49 H TRP 49 8.408 -7.260 -4.499 333 HA TRP 49 HA TRP 49 10.119 -8.351 -2.426 334 HB3 TRP 49 2HB TRP 49 7.834 -6.395 -2.128 335 HD1 TRP 49 HD TRP 49 9.860 -8.641 -0.165 336 HE1 TRP 49 1HE TRP 49 10.209 -7.773 2.233 337 HE3 TRP 49 3HE TRP 49 8.391 -3.790 -0.837 338 HZ2 TRP 49 2HZ TRP 49 9.900 -5.352 3.653 339 HZ3 TRP 49 3HZ TRP 49 8.447 -2.263 1.092 340 HH2 TRP 49 HH TRP 49 9.185 -3.030 3.290 341 H THR 50 H THR 50 9.631 -10.147 -1.370 342 HA THR 50 HA THR 50 6.812 -10.979 -1.219 343 HB THR 50 HB THR 50 8.994 -12.892 -0.553 344 HG1 THR 50 1HG THR 50 9.839 -12.133 -2.447 345 HG21 THR 50 3HG2 THR 50 6.300 -13.020 -1.887 346 HG22 THR 50 1HG2 THR 50 6.803 -13.752 -0.364 347 HG23 THR 50 2HG2 THR 50 7.419 -14.383 -1.891 348 H ALA 51 H ALA 51 6.252 -12.265 0.763 349 HA ALA 51 HA ALA 51 7.157 -10.797 3.107 350 HB1 ALA 51 1HB ALA 51 5.263 -11.787 4.244 351 HB2 ALA 51 2HB ALA 51 4.747 -11.097 2.703 352 HB3 ALA 51 3HB ALA 51 4.955 -12.842 2.863 353 H GLN 52 H GLN 52 7.558 -11.991 5.143 354 HA GLN 52 HA GLN 52 9.298 -14.277 4.609 355 HB3 GLN 52 2HB GLN 52 9.010 -12.425 6.971 356 HG3 GLN 52 2HG GLN 52 11.242 -13.704 7.588 357 HE21 GLN 52 1HE2 GLN 52 10.034 -12.581 9.306 358 HE22 GLN 52 2HE2 GLN 52 8.995 -13.518 10.320 359 H SER 53 H SER 53 6.810 -13.340 6.987 360 HA SER 53 HA SER 53 6.503 -16.047 7.905 361 HB3 SER 53 2HB SER 53 4.790 -13.609 8.453 362 HG SER 53 HG SER 53 4.998 -16.126 9.749 363 H ASN 54 H ASN 54 5.526 -14.527 5.160 364 HA ASN 54 HA ASN 54 3.807 -14.780 3.663 365 HB3 ASN 54 2HB ASN 54 5.112 -16.892 3.463 366 HD21 ASN 54 1HD2 ASN 54 5.921 -17.914 5.252 367 HD22 ASN 54 2HD2 ASN 54 5.035 -19.101 6.141 368 H SER 55 H SER 55 2.912 -13.988 6.263 369 HA SER 55 HA SER 55 0.211 -15.158 6.210 370 HB3 SER 55 2HB SER 55 1.549 -14.246 8.757 371 HG SER 55 HG SER 55 -0.196 -16.169 9.127 372 H ALA 56 H ALA 56 -1.269 -13.660 7.666 373 HA ALA 56 HA ALA 56 -1.208 -11.076 6.392 374 HB1 ALA 56 1HB ALA 56 -3.404 -10.984 6.837 375 HB2 ALA 56 2HB ALA 56 -3.225 -12.698 7.217 376 HB3 ALA 56 3HB ALA 56 -3.190 -11.501 8.510 377 H LYS 57 H LYS 57 0.073 -12.361 9.226 378 HA LYS 57 HA LYS 57 -0.210 -10.123 10.961 379 HB3 LYS 57 2HB LYS 57 0.283 -12.407 11.767 380 HG3 LYS 57 2HG LYS 57 3.165 -12.124 11.193 381 HD3 LYS 57 2HD LYS 57 2.532 -14.690 10.736 382 HE3 LYS 57 2HE LYS 57 2.604 -13.680 13.562 383 HZ1 LYS 57 3HZ LYS 57 2.838 -15.868 13.841 384 HZ2 LYS 57 1HZ LYS 57 4.414 -15.656 13.262 385 HZ3 LYS 57 2HZ LYS 57 3.186 -16.154 12.211 386 H GLU 58 H GLU 58 1.601 -10.590 8.176 387 HA GLU 58 HA GLU 58 3.911 -9.050 8.910 388 HB3 GLU 58 2HB GLU 58 3.316 -9.195 6.052 389 HG3 GLU 58 2HG GLU 58 5.485 -10.776 6.474 390 H TRP 59 H TRP 59 4.487 -6.996 7.945 391 HA TRP 59 HA TRP 59 2.320 -5.368 6.895 392 HB3 TRP 59 2HB TRP 59 1.927 -4.940 9.185 393 HD1 TRP 59 HD TRP 59 5.659 -3.852 9.130 394 HE1 TRP 59 1HE TRP 59 6.747 -4.667 11.315 395 HE3 TRP 59 3HE TRP 59 1.662 -6.309 11.160 396 HZ2 TRP 59 2HZ TRP 59 6.010 -6.155 13.597 397 HZ3 TRP 59 3HZ TRP 59 1.936 -7.403 13.348 398 HH2 TRP 59 HH TRP 59 4.066 -7.326 14.539 399 H LEU 60 H LEU 60 3.016 -3.713 5.609 400 HA LEU 60 HA LEU 60 5.927 -3.511 5.239 401 HB3 LEU 60 2HB LEU 60 4.052 -2.463 3.196 402 HG LEU 60 HG LEU 60 6.779 -3.072 3.182 403 HD11 LEU 60 1HD1 LEU 60 7.012 -5.153 2.455 404 HD12 LEU 60 2HD1 LEU 60 6.173 -4.688 0.975 405 HD13 LEU 60 3HD1 LEU 60 5.264 -5.355 2.331 406 HD21 LEU 60 3HD2 LEU 60 4.718 -2.176 1.250 407 HD22 LEU 60 1HD2 LEU 60 6.273 -2.694 0.599 408 HD23 LEU 60 2HD2 LEU 60 6.203 -1.383 1.776 409 H GLN 61 H GLN 61 6.917 -1.650 5.673 410 HA GLN 61 HA GLN 61 5.270 0.781 5.923 411 HB3 GLN 61 2HB GLN 61 6.052 1.185 7.985 412 HG3 GLN 61 2HG GLN 61 7.240 -1.574 7.777 413 HE21 GLN 61 1HE2 GLN 61 8.665 -1.878 9.324 414 HE22 GLN 61 2HE2 GLN 61 8.573 -1.257 10.933 415 H VAL 62 H VAL 62 5.929 2.518 4.813 416 HA VAL 62 HA VAL 62 8.643 2.483 3.665 417 HB VAL 62 HB VAL 62 6.269 3.681 2.253 418 HG11 VAL 62 1HG1 VAL 62 7.825 3.283 0.278 419 HG12 VAL 62 2HG1 VAL 62 8.282 4.558 1.411 420 HG13 VAL 62 3HG1 VAL 62 9.087 2.989 1.474 421 HG21 VAL 62 3HG2 VAL 62 7.244 0.859 2.273 422 HG22 VAL 62 1HG2 VAL 62 5.593 1.479 2.250 423 HG23 VAL 62 2HG2 VAL 62 6.578 1.541 0.789 424 H ASP 63 H ASP 63 9.813 4.123 4.387 425 HA ASP 63 HA ASP 63 8.458 6.671 4.979 426 HB3 ASP 63 2HB ASP 63 10.974 5.901 6.402 427 H LEU 64 H LEU 64 9.161 8.354 3.846 428 HA LEU 64 HA LEU 64 11.777 8.139 2.511 429 HB3 LEU 64 2HB LEU 64 10.497 8.381 0.688 430 HG LEU 64 HG LEU 64 8.357 9.459 2.469 431 HD11 LEU 64 1HD1 LEU 64 7.098 9.772 0.201 432 HD12 LEU 64 2HD1 LEU 64 8.721 10.049 -0.431 433 HD13 LEU 64 3HD1 LEU 64 8.090 11.073 0.859 434 HD21 LEU 64 3HD2 LEU 64 8.076 7.199 2.234 435 HD22 LEU 64 1HD2 LEU 64 8.763 7.169 0.610 436 HD23 LEU 64 2HD2 LEU 64 7.126 7.775 0.863 437 H GLY 65 H GLY 65 9.584 10.301 4.240 438 HA2 GLY 65 2HA GLY 65 10.002 12.184 5.487 439 HA3 GLY 65 3HA GLY 65 11.689 11.692 5.510 440 H THR 66 H THR 66 10.437 12.002 2.378 441 HA THR 66 HA THR 66 11.931 14.497 2.026 442 HB THR 66 HB THR 66 12.505 12.593 0.553 443 HG1 THR 66 1HG THR 66 12.759 13.912 -1.148 444 HG21 THR 66 3HG2 THR 66 10.876 11.325 -0.285 445 HG22 THR 66 1HG2 THR 66 10.414 12.671 -1.325 446 HG23 THR 66 2HG2 THR 66 9.650 12.473 0.253 447 H GLN 67 H GLN 67 8.801 13.525 2.522 448 HA GLN 67 HA GLN 67 6.739 14.427 2.140 449 HB3 GLN 67 2HB GLN 67 7.965 17.125 1.814 450 HG3 GLN 67 2HG GLN 67 5.562 15.967 3.057 451 HE21 GLN 67 1HE2 GLN 67 4.723 18.674 3.813 452 HE22 GLN 67 2HE2 GLN 67 5.390 18.952 5.382 453 H ARG 68 H ARG 68 6.414 13.468 0.092 454 HA ARG 68 HA ARG 68 6.676 15.351 -2.161 455 HB3 ARG 68 2HB ARG 68 6.649 13.183 -3.567 456 HG3 ARG 68 2HG ARG 68 9.086 12.751 -3.195 457 HD3 ARG 68 2HD ARG 68 8.939 15.680 -3.261 458 HE ARG 68 HE ARG 68 10.196 13.610 -4.821 459 HH11 ARG 68 1HH1 ARG 68 9.329 16.978 -4.665 460 HH12 ARG 68 2HH1 ARG 68 10.553 17.480 -5.784 461 HH21 ARG 68 1HH2 ARG 68 11.811 14.258 -6.295 462 HH22 ARG 68 2HH2 ARG 68 11.965 15.931 -6.710 463 H GLN 69 H GLN 69 4.968 15.460 -3.640 464 HA GLN 69 HA GLN 69 2.394 14.700 -2.520 465 HB3 GLN 69 2HB GLN 69 3.284 16.551 -4.704 466 HG3 GLN 69 2HG GLN 69 0.579 15.349 -4.396 467 HE21 GLN 69 1HE2 GLN 69 -1.140 16.556 -4.118 468 HE22 GLN 69 2HE2 GLN 69 -1.290 18.232 -4.506 469 H VAL 70 H VAL 70 1.453 12.855 -3.054 470 HA VAL 70 HA VAL 70 2.278 11.452 -5.476 471 HB VAL 70 HB VAL 70 1.098 9.528 -4.587 472 HG11 VAL 70 1HG1 VAL 70 2.419 9.133 -2.590 473 HG12 VAL 70 2HG1 VAL 70 3.386 9.984 -3.798 474 HG13 VAL 70 3HG1 VAL 70 2.720 10.863 -2.421 475 HG21 VAL 70 3HG2 VAL 70 -0.199 11.554 -2.947 476 HG22 VAL 70 1HG2 VAL 70 -0.744 9.938 -3.392 477 HG23 VAL 70 2HG2 VAL 70 0.337 10.156 -2.017 478 H THR 71 H THR 71 0.825 10.720 -7.051 479 HA THR 71 HA THR 71 -1.915 11.730 -6.960 480 HB THR 71 HB THR 71 -0.929 12.172 -9.612 481 HG1 THR 71 1HG THR 71 1.073 12.691 -8.934 482 HG21 THR 71 3HG2 THR 71 -2.812 13.232 -7.988 483 HG22 THR 71 1HG2 THR 71 -2.234 14.012 -9.459 484 HG23 THR 71 2HG2 THR 71 -1.570 14.480 -7.894 485 H GLY 72 H GLY 72 -0.475 9.087 -6.941 486 HA2 GLY 72 2HA GLY 72 -2.303 7.558 -8.345 487 HA3 GLY 72 3HA GLY 72 -0.954 7.814 -9.442 488 H ILE 73 H ILE 73 -1.642 5.276 -8.650 489 HA ILE 73 HA ILE 73 0.762 4.501 -7.184 490 HB ILE 73 HB ILE 73 -0.386 2.966 -5.734 491 HG13 ILE 73 2HG1 ILE 73 -2.636 3.542 -7.531 492 HG21 ILE 73 1HG2 ILE 73 -1.930 5.526 -5.488 493 HG22 ILE 73 2HG2 ILE 73 -1.313 4.479 -4.211 494 HG23 ILE 73 3HG2 ILE 73 -0.197 5.453 -5.168 495 HD11 ILE 73 3HD1 ILE 73 -2.152 1.323 -7.582 496 HD12 ILE 73 1HD1 ILE 73 -1.678 1.271 -5.885 497 HD13 ILE 73 2HD1 ILE 73 -3.385 1.329 -6.322 498 H ILE 74 H ILE 74 1.257 2.189 -7.410 499 HA ILE 74 HA ILE 74 -0.108 0.781 -9.559 500 HB ILE 74 HB ILE 74 1.474 1.984 -10.869 501 HG13 ILE 74 2HG1 ILE 74 2.633 -0.758 -10.324 502 HG21 ILE 74 1HG2 ILE 74 4.010 1.251 -9.976 503 HG22 ILE 74 2HG2 ILE 74 3.265 2.844 -9.877 504 HG23 ILE 74 3HG2 ILE 74 3.126 1.720 -8.525 505 HD11 ILE 74 3HD1 ILE 74 0.786 -1.648 -11.135 506 HD12 ILE 74 1HD1 ILE 74 0.076 -0.052 -11.375 507 HD13 ILE 74 2HD1 ILE 74 1.061 -0.780 -12.645 508 H THR 75 H THR 75 -0.030 -1.391 -9.335 509 HA THR 75 HA THR 75 1.848 -2.504 -7.358 510 HB THR 75 HB THR 75 -0.418 -2.281 -6.362 511 HG1 THR 75 1HG THR 75 -0.376 -4.343 -5.514 512 HG21 THR 75 3HG2 THR 75 -2.307 -3.191 -7.259 513 HG22 THR 75 1HG2 THR 75 -1.434 -4.498 -8.057 514 HG23 THR 75 2HG2 THR 75 -1.429 -2.879 -8.755 515 H GLN 76 H GLN 76 2.683 -4.511 -7.805 516 HA GLN 76 HA GLN 76 1.706 -5.955 -10.146 517 HB3 GLN 76 2HB GLN 76 4.539 -6.032 -10.290 518 HG3 GLN 76 2HG GLN 76 2.939 -4.350 -12.151 519 HE21 GLN 76 1HE2 GLN 76 3.929 -7.335 -13.297 520 HE22 GLN 76 2HE2 GLN 76 5.421 -6.854 -14.021 521 H GLY 77 H GLY 77 1.967 -8.143 -10.031 522 HA2 GLY 77 2HA GLY 77 2.989 -9.159 -7.476 523 HA3 GLY 77 3HA GLY 77 1.918 -10.017 -8.573 524 H ALA 78 H ALA 78 3.905 -11.475 -7.657 525 HA ALA 78 HA ALA 78 5.860 -11.543 -9.864 526 HB1 ALA 78 1HB ALA 78 7.538 -11.544 -8.414 527 HB2 ALA 78 2HB ALA 78 6.377 -11.272 -7.115 528 HB3 ALA 78 3HB ALA 78 6.843 -12.916 -7.552 529 H ARG 79 H ARG 79 6.935 -13.852 -9.880 530 HA ARG 79 HA ARG 79 4.890 -15.914 -9.464 531 HB3 ARG 79 2HB ARG 79 4.680 -15.240 -11.791 532 HG3 ARG 79 2HG ARG 79 7.457 -14.897 -11.732 533 HD3 ARG 79 2HD ARG 79 6.840 -16.734 -13.994 534 HE ARG 79 HE ARG 79 9.235 -15.628 -12.838 535 HH11 ARG 79 1HH1 ARG 79 7.897 -18.135 -14.848 536 HH12 ARG 79 2HH1 ARG 79 9.380 -18.426 -15.695 537 HH21 ARG 79 1HH2 ARG 79 11.193 -16.002 -13.946 538 HH22 ARG 79 2HH2 ARG 79 11.254 -17.214 -15.181 539 H ASP 80 H ASP 80 5.727 -18.084 -9.409 540 HA ASP 80 HA ASP 80 8.571 -18.162 -8.644 541 HB3 ASP 80 2HB ASP 80 6.411 -20.095 -7.790 542 H PHE 81 H PHE 81 8.505 -18.313 -11.200 543 HA PHE 81 HA PHE 81 8.868 -19.553 -13.077 544 HB3 PHE 81 2HB PHE 81 10.169 -21.636 -12.733 545 HD1 PHE 81 1HD PHE 81 10.760 -19.655 -9.679 546 HD2 PHE 81 2HD PHE 81 11.893 -20.362 -13.720 547 HE1 PHE 81 1HE PHE 81 12.752 -18.245 -9.363 548 HE2 PHE 81 2HE PHE 81 13.887 -18.954 -13.411 549 HZ PHE 81 HZ PHE 81 14.319 -17.894 -11.230 550 H GLY 82 H GLY 82 6.701 -19.783 -13.711 551 HA2 GLY 82 2HA GLY 82 5.279 -21.427 -14.715 552 HA3 GLY 82 3HA GLY 82 5.690 -22.528 -13.409 553 H HIS 83 H HIS 83 5.186 -21.162 -11.161 554 HA HIS 83 HA HIS 83 2.286 -20.871 -11.269 555 HB3 HIS 83 2HB HIS 83 2.777 -20.686 -8.656 556 HD1 HIS 83 1HD HIS 83 3.816 -23.738 -10.684 557 HD2 HIS 83 2HD HIS 83 0.802 -22.451 -8.131 558 HE1 HIS 83 1HE HIS 83 2.312 -25.728 -10.364 559 H ILE 84 H ILE 84 1.191 -19.029 -10.794 560 HA ILE 84 HA ILE 84 2.800 -16.588 -10.565 561 HB ILE 84 HB ILE 84 -0.145 -16.772 -11.189 562 HG13 ILE 84 2HG1 ILE 84 1.158 -18.005 -12.876 563 HG21 ILE 84 1HG2 ILE 84 -0.007 -14.526 -11.841 564 HG22 ILE 84 2HG2 ILE 84 0.915 -14.612 -10.341 565 HG23 ILE 84 3HG2 ILE 84 1.756 -14.558 -11.890 566 HD11 ILE 84 3HD1 ILE 84 0.755 -15.668 -14.519 567 HD12 ILE 84 1HD1 ILE 84 -0.073 -17.224 -14.543 568 HD13 ILE 84 2HD1 ILE 84 -0.612 -15.955 -13.443 569 H GLN 85 H GLN 85 2.897 -15.507 -8.714 570 HA GLN 85 HA GLN 85 0.869 -16.076 -6.656 571 HB3 GLN 85 2HB GLN 85 2.617 -15.418 -5.009 572 HG3 GLN 85 2HG GLN 85 2.328 -17.835 -6.068 573 HE21 GLN 85 1HE2 GLN 85 3.255 -19.318 -7.319 574 HE22 GLN 85 2HE2 GLN 85 4.758 -19.126 -8.149 575 H TYR 86 H TYR 86 0.116 -14.356 -5.358 576 HA TYR 86 HA TYR 86 0.897 -11.697 -5.498 577 HB3 TYR 86 2HB TYR 86 0.317 -11.521 -7.770 578 HD1 TYR 86 1HD TYR 86 -2.981 -12.579 -6.364 579 HD2 TYR 86 2HD TYR 86 -0.089 -13.056 -9.449 580 HE1 TYR 86 1HE TYR 86 -4.483 -14.145 -7.521 581 HE2 TYR 86 2HE TYR 86 -1.584 -14.622 -10.616 582 HH TYR 86 HH TYR 86 -3.498 -16.181 -9.948 583 H VAL 87 H VAL 87 -0.437 -10.315 -4.273 584 HA VAL 87 HA VAL 87 -2.330 -11.751 -2.572 585 HB VAL 87 HB VAL 87 -1.844 -10.298 -0.903 586 HG11 VAL 87 1HG1 VAL 87 0.325 -11.156 -1.938 587 HG12 VAL 87 2HG1 VAL 87 0.526 -9.524 -2.579 588 HG13 VAL 87 3HG1 VAL 87 0.444 -9.785 -0.837 589 HG21 VAL 87 3HG2 VAL 87 -2.833 -8.334 -1.680 590 HG22 VAL 87 1HG2 VAL 87 -1.152 -7.872 -1.411 591 HG23 VAL 87 2HG2 VAL 87 -1.725 -8.203 -3.046 592 H ALA 88 H ALA 88 -4.275 -10.488 -1.825 593 HA ALA 88 HA ALA 88 -5.468 -9.049 -4.105 594 HB1 ALA 88 1HB ALA 88 -6.548 -11.168 -2.326 595 HB2 ALA 88 2HB ALA 88 -7.657 -9.922 -2.901 596 HB3 ALA 88 3HB ALA 88 -6.773 -10.919 -4.058 597 H SER 89 H SER 89 -6.577 -9.507 -0.768 598 HA SER 89 HA SER 89 -7.301 -6.744 -0.549 599 HB3 SER 89 2HB SER 89 -8.290 -7.311 1.499 600 HG SER 89 HG SER 89 -9.191 -9.423 1.147 601 H TYR 90 H TYR 90 -5.846 -5.199 -0.240 602 HA TYR 90 HA TYR 90 -3.743 -5.634 1.765 603 HB3 TYR 90 2HB TYR 90 -3.039 -3.924 -0.551 604 HD1 TYR 90 2HD TYR 90 -2.089 -4.283 2.383 605 HD2 TYR 90 1HD TYR 90 -0.794 -5.936 -1.317 606 HE1 TYR 90 2HE TYR 90 0.169 -4.577 3.311 607 HE2 TYR 90 1HE TYR 90 1.468 -6.236 -0.399 608 HH TYR 90 HH TYR 90 2.342 -6.509 2.283 609 H LYS 91 H LYS 91 -3.988 -4.205 3.334 610 HA LYS 91 HA LYS 91 -5.531 -1.802 2.953 611 HB3 LYS 91 2HB LYS 91 -4.211 -1.787 5.475 612 HG3 LYS 91 2HG LYS 91 -6.750 -2.856 5.874 613 HD3 LYS 91 2HD LYS 91 -6.086 0.072 5.636 614 HE3 LYS 91 2HE LYS 91 -8.010 -1.532 7.306 615 HZ1 LYS 91 3HZ LYS 91 -6.657 0.766 8.091 616 HZ2 LYS 91 1HZ LYS 91 -7.975 0.029 8.855 617 HZ3 LYS 91 2HZ LYS 91 -8.235 1.245 7.708 618 H VAL 92 H VAL 92 -4.394 -0.453 1.592 619 HA VAL 92 HA VAL 92 -1.681 0.329 2.371 620 HB VAL 92 HB VAL 92 -1.905 -0.205 0.038 621 HG11 VAL 92 1HG1 VAL 92 -4.448 1.030 0.315 622 HG12 VAL 92 2HG1 VAL 92 -3.560 1.871 -0.956 623 HG13 VAL 92 3HG1 VAL 92 -3.806 0.127 -1.056 624 HG21 VAL 92 3HG2 VAL 92 -0.870 1.667 -0.880 625 HG22 VAL 92 1HG2 VAL 92 -1.847 2.790 0.066 626 HG23 VAL 92 2HG2 VAL 92 -0.574 1.853 0.847 627 H ALA 93 H ALA 93 -1.459 2.019 3.668 628 HA ALA 93 HA ALA 93 -3.359 4.256 3.404 629 HB1 ALA 93 1HB ALA 93 -3.140 2.636 5.608 630 HB2 ALA 93 2HB ALA 93 -2.121 4.012 6.032 631 HB3 ALA 93 3HB ALA 93 -3.809 4.267 5.592 632 H HIS 94 H HIS 94 -2.529 6.351 3.738 633 HA HIS 94 HA HIS 94 0.410 6.531 3.605 634 HB3 HIS 94 2HB HIS 94 0.048 8.615 2.255 635 HD1 HIS 94 1HD HIS 94 0.851 8.178 -0.048 636 HD2 HIS 94 2HD HIS 94 -1.614 5.136 1.343 637 HE1 HIS 94 1HE HIS 94 0.894 6.407 -1.834 638 H SER 95 H SER 95 1.429 8.065 4.832 639 HA SER 95 HA SER 95 -0.272 9.717 6.578 640 HB3 SER 95 2HB SER 95 0.635 8.859 8.451 641 HG SER 95 HG SER 95 2.087 6.946 7.013 642 H ASP 96 H ASP 96 0.352 11.793 6.876 643 HA ASP 96 HA ASP 96 2.662 12.702 5.320 644 HB3 ASP 96 2HB ASP 96 0.318 14.237 6.459 645 H ASP 97 H ASP 97 1.259 12.839 8.550 646 HA ASP 97 HA ASP 97 3.587 14.299 9.546 647 HB3 ASP 97 2HB ASP 97 1.560 13.460 11.497 648 H GLY 98 H GLY 98 2.500 11.122 9.184 649 HA2 GLY 98 2HA GLY 98 3.921 9.269 9.648 650 HA3 GLY 98 3HA GLY 98 4.640 10.186 10.964 651 H VAL 99 H VAL 99 1.945 11.010 11.928 652 HA VAL 99 HA VAL 99 1.350 8.533 13.380 653 HB VAL 99 HB VAL 99 0.271 9.914 15.050 654 HG11 VAL 99 1HG1 VAL 99 2.701 9.615 15.189 655 HG12 VAL 99 2HG1 VAL 99 2.931 11.095 14.254 656 HG13 VAL 99 3HG1 VAL 99 2.195 11.167 15.855 657 HG21 VAL 99 3HG2 VAL 99 0.821 12.532 14.496 658 HG22 VAL 99 1HG2 VAL 99 0.360 11.908 12.912 659 HG23 VAL 99 2HG2 VAL 99 -0.747 11.756 14.277 660 H GLN 100 H GLN 100 -0.013 10.820 11.160 661 HA GLN 100 HA GLN 100 -2.705 9.754 11.503 662 HB3 GLN 100 2HB GLN 100 -3.440 11.522 10.066 663 HG3 GLN 100 2HG GLN 100 -1.239 12.571 11.831 664 HE21 GLN 100 1HE2 GLN 100 -0.841 14.651 11.672 665 HE22 GLN 100 2HE2 GLN 100 -1.859 15.832 10.929 666 H TRP 101 H TRP 101 -2.703 7.714 10.662 667 HA TRP 101 HA TRP 101 -1.631 7.276 7.985 668 HB3 TRP 101 2HB TRP 101 -1.793 4.964 8.418 669 HD1 TRP 101 HD TRP 101 0.359 7.108 9.514 670 HE1 TRP 101 1HE TRP 101 1.752 6.497 11.590 671 HE3 TRP 101 3HE TRP 101 -2.664 3.485 11.482 672 HZ2 TRP 101 2HZ TRP 101 1.590 4.715 13.773 673 HZ3 TRP 101 3HZ TRP 101 -1.972 2.376 13.566 674 HH2 TRP 101 HH TRP 101 0.111 2.979 14.686 675 H THR 102 H THR 102 -2.944 7.910 6.393 676 HA THR 102 HA THR 102 -5.832 7.602 6.666 677 HB THR 102 HB THR 102 -4.195 8.920 4.491 678 HG1 THR 102 1HG THR 102 -4.142 10.342 6.104 679 HG21 THR 102 3HG2 THR 102 -7.176 8.698 4.890 680 HG22 THR 102 1HG2 THR 102 -6.231 8.159 3.502 681 HG23 THR 102 2HG2 THR 102 -6.423 9.883 3.823 682 H VAL 103 H VAL 103 -6.749 5.773 6.029 683 HA VAL 103 HA VAL 103 -5.401 3.991 4.187 684 HB VAL 103 HB VAL 103 -8.072 3.697 5.571 685 HG11 VAL 103 1HG1 VAL 103 -7.951 2.359 3.540 686 HG12 VAL 103 2HG1 VAL 103 -6.413 1.674 4.069 687 HG13 VAL 103 3HG1 VAL 103 -7.890 1.329 4.970 688 HG21 VAL 103 3HG2 VAL 103 -7.001 2.945 7.377 689 HG22 VAL 103 1HG2 VAL 103 -5.930 1.930 6.409 690 HG23 VAL 103 2HG2 VAL 103 -5.534 3.628 6.675 691 H TYR 104 H TYR 104 -5.963 3.565 2.117 692 HA TYR 104 HA TYR 104 -7.437 5.469 0.659 693 HB3 TYR 104 2HB TYR 104 -7.337 3.462 -1.099 694 HD1 TYR 104 2HD TYR 104 -4.880 5.377 0.937 695 HD2 TYR 104 1HD TYR 104 -6.053 4.092 -2.946 696 HE1 TYR 104 2HE TYR 104 -3.162 6.829 -0.057 697 HE2 TYR 104 1HE TYR 104 -4.337 5.541 -3.950 698 HH TYR 104 HH TYR 104 -2.330 7.669 -1.949 699 H GLU 105 H GLU 105 -9.528 5.687 1.368 700 HA GLU 105 HA GLU 105 -11.261 3.433 1.738 701 HB3 GLU 105 2HB GLU 105 -11.551 5.500 3.032 702 HG3 GLU 105 2HG GLU 105 -12.876 6.920 0.820 703 H GLU 106 H GLU 106 -13.080 2.872 0.488 704 HA GLU 106 HA GLU 106 -13.124 3.947 -2.248 705 HB3 GLU 106 2HB GLU 106 -13.821 1.113 -2.065 706 HG3 GLU 106 2HG GLU 106 -11.544 1.917 -3.712 707 H GLN 107 H GLN 107 -14.793 4.420 0.144 708 HA GLN 107 HA GLN 107 -17.313 4.455 -1.089 709 HB3 GLN 107 2HB GLN 107 -17.369 2.069 -0.738 710 HG3 GLN 107 2HG GLN 107 -17.380 2.168 2.191 711 HE21 GLN 107 1HE2 GLN 107 -14.724 0.729 0.638 712 HE22 GLN 107 2HE2 GLN 107 -15.325 -0.890 0.589 713 H GLY 108 H GLY 108 -15.477 4.430 1.910 714 HA2 GLY 108 2HA GLY 108 -15.748 6.769 2.970 715 HA3 GLY 108 3HA GLY 108 -17.428 6.275 3.112 716 H SER 109 H SER 109 -15.915 3.472 3.482 717 HA SER 109 HA SER 109 -15.764 3.779 6.404 718 HB3 SER 109 2HB SER 109 -15.984 1.165 6.231 719 HG SER 109 HG SER 109 -18.036 3.064 5.827 720 H SER 110 H SER 110 -13.676 4.067 4.135 721 HA SER 110 HA SER 110 -11.494 3.518 3.730 722 HB3 SER 110 2HB SER 110 -11.335 4.720 5.894 723 HG SER 110 HG SER 110 -11.480 3.680 7.763 724 H LYS 111 H LYS 111 -11.995 1.565 2.603 725 HA LYS 111 HA LYS 111 -11.692 -0.917 4.131 726 HB3 LYS 111 2HB LYS 111 -12.151 -1.172 1.253 727 HG3 LYS 111 2HG LYS 111 -12.514 -3.002 2.861 728 HD3 LYS 111 2HD LYS 111 -13.788 -1.090 4.389 729 HE3 LYS 111 2HE LYS 111 -15.781 -1.385 2.888 730 HZ1 LYS 111 3HZ LYS 111 -15.656 -3.728 2.463 731 HZ2 LYS 111 1HZ LYS 111 -17.099 -3.406 3.284 732 HZ3 LYS 111 2HZ LYS 111 -15.791 -4.090 4.110 733 H VAL 112 H VAL 112 -10.671 -2.625 2.290 734 HA VAL 112 HA VAL 112 -7.907 -1.691 2.087 735 HB VAL 112 HB VAL 112 -7.281 -4.011 1.815 736 HG11 VAL 112 1HG1 VAL 112 -7.338 -4.199 4.025 737 HG12 VAL 112 2HG1 VAL 112 -8.581 -2.948 4.092 738 HG13 VAL 112 3HG1 VAL 112 -9.042 -4.646 3.963 739 HG21 VAL 112 3HG2 VAL 112 -8.753 -5.251 0.651 740 HG22 VAL 112 1HG2 VAL 112 -9.451 -5.588 2.235 741 HG23 VAL 112 2HG2 VAL 112 -10.140 -4.321 1.220 742 H PHE 113 H PHE 113 -6.644 -2.214 0.171 743 HA PHE 113 HA PHE 113 -8.211 -1.768 -2.253 744 HB3 PHE 113 2HB PHE 113 -5.449 -1.764 -2.854 745 HD1 PHE 113 1HD PHE 113 -8.165 0.441 -1.579 746 HD2 PHE 113 2HD PHE 113 -5.089 -0.151 -4.460 747 HE1 PHE 113 1HE PHE 113 -8.887 2.473 -2.764 748 HE2 PHE 113 2HE PHE 113 -5.806 1.880 -5.649 749 HZ PHE 113 HZ PHE 113 -7.707 3.196 -4.800 750 H GLN 114 H GLN 114 -8.505 -3.270 -3.773 751 HA GLN 114 HA GLN 114 -7.517 -5.936 -3.329 752 HB3 GLN 114 2HB GLN 114 -9.773 -5.728 -4.098 753 HG3 GLN 114 2HG GLN 114 -9.367 -4.847 -6.800 754 HE21 GLN 114 1HE2 GLN 114 -11.433 -6.007 -5.406 755 HE22 GLN 114 2HE2 GLN 114 -12.719 -4.866 -5.230 756 H GLY 115 H GLY 115 -6.065 -7.084 -4.556 757 HA2 GLY 115 2HA GLY 115 -4.173 -5.492 -6.067 758 HA3 GLY 115 3HA GLY 115 -4.005 -7.188 -5.636 759 H ASN 116 H ASN 116 -3.825 -8.390 -7.398 760 HA ASN 116 HA ASN 116 -5.814 -8.126 -9.506 761 HB3 ASN 116 2HB ASN 116 -4.171 -6.714 -10.452 762 HD21 ASN 116 1HD2 ASN 116 -2.363 -5.763 -9.900 763 HD22 ASN 116 2HD2 ASN 116 -0.895 -6.545 -9.431 764 H LEU 117 H LEU 117 -5.034 -9.881 -11.318 765 HA LEU 117 HA LEU 117 -4.488 -12.355 -9.813 766 HB3 LEU 117 2HB LEU 117 -5.894 -13.480 -11.574 767 HG LEU 117 HG LEU 117 -7.052 -11.666 -9.534 768 HD11 LEU 117 1HD1 LEU 117 -9.233 -12.996 -10.684 769 HD12 LEU 117 2HD1 LEU 117 -8.386 -12.207 -12.014 770 HD13 LEU 117 3HD1 LEU 117 -8.933 -11.259 -10.632 771 HD21 LEU 117 3HD2 LEU 117 -6.286 -13.950 -9.017 772 HD22 LEU 117 1HD2 LEU 117 -7.457 -14.586 -10.171 773 HD23 LEU 117 2HD2 LEU 117 -8.013 -13.738 -8.730 774 H ASP 118 H ASP 118 -2.499 -10.734 -11.051 775 HA ASP 118 HA ASP 118 -1.287 -12.734 -12.740 776 HB3 ASP 118 2HB ASP 118 -2.379 -11.640 -14.514 777 H ASN 119 H ASN 119 0.971 -12.034 -13.393 778 HA ASN 119 HA ASN 119 2.124 -10.304 -11.304 779 HB3 ASN 119 2HB ASN 119 2.521 -12.866 -11.159 780 HD21 ASN 119 1HD2 ASN 119 2.140 -13.525 -13.500 781 HD22 ASN 119 2HD2 ASN 119 3.546 -13.976 -14.396 782 H ASN 120 H ASN 120 2.280 -11.425 -14.626 783 HA ASN 120 HA ASN 120 4.524 -9.785 -15.332 784 HB3 ASN 120 2HB ASN 120 3.490 -10.365 -17.724 785 HD21 ASN 120 1HD2 ASN 120 3.610 -13.439 -17.168 786 HD22 ASN 120 2HD2 ASN 120 5.312 -13.728 -17.077 787 H SER 121 H SER 121 1.120 -9.334 -15.090 788 HA SER 121 HA SER 121 1.185 -6.913 -16.727 789 HB3 SER 121 2HB SER 121 -1.022 -7.236 -17.071 790 HG SER 121 HG SER 121 -0.563 -9.346 -17.374 791 H HIS 122 H HIS 122 0.690 -4.870 -15.929 792 HA HIS 122 HA HIS 122 1.095 -4.573 -13.038 793 HB3 HIS 122 2HB HIS 122 2.631 -3.418 -14.704 794 HD1 HIS 122 1HD HIS 122 1.413 -0.201 -14.470 795 HD2 HIS 122 2HD HIS 122 0.549 -3.326 -17.068 796 HE1 HIS 122 1HE HIS 122 0.429 0.878 -16.517 797 H LYS 123 H LYS 123 -0.262 -3.312 -11.774 798 HA LYS 123 HA LYS 123 -2.817 -2.541 -13.028 799 HB3 LYS 123 2HB LYS 123 -2.324 -3.844 -10.349 800 HG3 LYS 123 2HG LYS 123 -4.885 -2.668 -11.409 801 HD3 LYS 123 2HD LYS 123 -4.489 -4.209 -8.851 802 HE3 LYS 123 2HE LYS 123 -6.975 -4.355 -8.989 803 HZ1 LYS 123 3HZ LYS 123 -7.294 -1.845 -8.598 804 HZ2 LYS 123 1HZ LYS 123 -5.611 -1.757 -8.739 805 HZ3 LYS 123 2HZ LYS 123 -6.309 -2.715 -7.533 806 H LYS 124 H LYS 124 -2.519 -0.375 -13.205 807 HA LYS 124 HA LYS 124 -1.522 1.131 -10.912 808 HB3 LYS 124 2HB LYS 124 -0.687 1.597 -13.225 809 HG3 LYS 124 2HG LYS 124 -3.288 3.008 -13.707 810 HD3 LYS 124 2HD LYS 124 -2.072 2.304 -16.094 811 HE3 LYS 124 2HE LYS 124 -1.954 4.863 -14.505 812 HZ1 LYS 124 3HZ LYS 124 -1.043 4.234 -17.225 813 HZ2 LYS 124 1HZ LYS 124 -0.359 5.269 -16.076 814 HZ3 LYS 124 2HZ LYS 124 -1.741 5.745 -16.926 815 H ASN 125 H ASN 125 -2.769 2.333 -9.608 816 HA ASN 125 HA ASN 125 -5.627 2.556 -10.287 817 HB3 ASN 125 2HB ASN 125 -4.748 2.868 -7.466 818 HD21 ASN 125 1HD2 ASN 125 -6.829 3.948 -7.575 819 HD22 ASN 125 2HD2 ASN 125 -8.272 3.000 -7.502 820 H ILE 126 H ILE 126 -6.706 4.496 -9.873 821 HA ILE 126 HA ILE 126 -5.326 6.852 -10.396 822 HB ILE 126 HB ILE 126 -7.825 6.427 -10.624 823 HG13 ILE 126 2HG1 ILE 126 -6.431 8.706 -10.618 824 HG21 ILE 126 1HG2 ILE 126 -9.248 6.568 -8.839 825 HG22 ILE 126 2HG2 ILE 126 -7.854 5.817 -8.063 826 HG23 ILE 126 3HG2 ILE 126 -8.134 7.549 -7.887 827 HD11 ILE 126 3HD1 ILE 126 -8.072 9.353 -11.941 828 HD12 ILE 126 1HD1 ILE 126 -9.060 8.017 -11.354 829 HD13 ILE 126 2HD1 ILE 126 -9.131 9.586 -10.550 830 H PHE 127 H PHE 127 -5.113 8.773 -9.032 831 HA PHE 127 HA PHE 127 -3.495 8.501 -6.883 832 HB3 PHE 127 2HB PHE 127 -3.572 10.701 -7.429 833 HD1 PHE 127 2HD PHE 127 -7.149 10.907 -6.652 834 HD2 PHE 127 1HD PHE 127 -4.204 10.945 -9.725 835 HE1 PHE 127 2HE PHE 127 -8.826 11.751 -8.244 836 HE2 PHE 127 1HE PHE 127 -5.876 11.789 -11.321 837 HZ PHE 127 HZ PHE 127 -8.190 12.192 -10.582 838 H GLU 128 H GLU 128 -7.022 8.972 -6.655 839 HA GLU 128 HA GLU 128 -8.534 8.369 -5.066 840 HB3 GLU 128 2HB GLU 128 -6.765 6.582 -3.551 841 HG3 GLU 128 2HG GLU 128 -9.255 6.516 -3.490 842 H LYS 129 H LYS 129 -5.872 10.088 -4.503 843 HA LYS 129 HA LYS 129 -6.736 11.524 -2.360 844 HB3 LYS 129 2HB LYS 129 -4.797 10.247 -0.798 845 HG3 LYS 129 2HG LYS 129 -7.519 9.359 -0.246 846 HD3 LYS 129 2HD LYS 129 -5.214 10.049 1.161 847 HE3 LYS 129 2HE LYS 129 -6.156 12.424 0.956 848 HZ1 LYS 129 3HZ LYS 129 -8.046 12.984 2.018 849 HZ2 LYS 129 1HZ LYS 129 -7.860 11.822 3.234 850 HZ3 LYS 129 2HZ LYS 129 -8.465 11.372 1.720 851 HA PRO 130 HA PRO 130 -2.754 12.745 -4.463 852 HB3 PRO 130 2HB PRO 130 -3.847 13.542 -6.320 853 HG3 PRO 130 2HG PRO 130 -6.087 14.158 -6.220 854 HD3 PRO 130 2HD PRO 130 -6.204 12.074 -5.244 855 H PHE 131 H PHE 131 -1.368 13.540 -3.020 856 HA PHE 131 HA PHE 131 -1.415 16.130 -2.031 857 HB3 PHE 131 2HB PHE 131 -1.863 14.572 0.399 858 HD1 PHE 131 2HD PHE 131 -3.380 17.197 -1.778 859 HD2 PHE 131 1HD PHE 131 -2.093 16.066 2.118 860 HE1 PHE 131 2HE PHE 131 -3.949 19.440 -0.943 861 HE2 PHE 131 1HE PHE 131 -2.661 18.307 2.960 862 HZ PHE 131 HZ PHE 131 -3.588 19.999 1.428 863 H MET 132 H MET 132 0.117 16.327 -0.018 864 HA MET 132 HA MET 132 2.548 15.019 -0.746 865 HB3 MET 132 2HB MET 132 2.629 17.293 0.049 866 HG3 MET 132 2HG MET 132 2.163 16.794 2.864 867 HE1 MET 132 3HE MET 132 -0.608 18.625 0.674 868 HE2 MET 132 1HE MET 132 0.335 20.005 0.109 869 HE3 MET 132 2HE MET 132 0.780 18.370 -0.384 870 H ALA 133 H ALA 133 3.877 13.718 0.647 871 HA ALA 133 HA ALA 133 2.617 12.452 2.936 872 HB1 ALA 133 1HB ALA 133 2.173 10.449 2.051 873 HB2 ALA 133 2HB ALA 133 2.266 11.264 0.490 874 HB3 ALA 133 3HB ALA 133 3.676 10.421 1.131 875 H ARG 134 H ARG 134 4.075 11.431 4.320 876 HA ARG 134 HA ARG 134 6.916 11.849 3.654 877 HB3 ARG 134 2HB ARG 134 6.392 11.642 6.495 878 HG3 ARG 134 2HG ARG 134 7.226 14.236 5.444 879 HD3 ARG 134 2HD ARG 134 7.540 13.628 7.765 880 HE ARG 134 HE ARG 134 8.467 11.145 6.802 881 HH11 ARG 134 1HH1 ARG 134 9.084 13.493 9.297 882 HH12 ARG 134 2HH1 ARG 134 9.722 12.332 10.413 883 HH21 ARG 134 1HH2 ARG 134 9.306 9.607 8.263 884 HH22 ARG 134 2HH2 ARG 134 9.848 10.121 9.824 885 H TYR 135 H TYR 135 4.526 9.710 5.049 886 HA TYR 135 HA TYR 135 6.235 7.438 4.612 887 HB3 TYR 135 2HB TYR 135 5.687 8.464 7.366 888 HD1 TYR 135 1HD TYR 135 7.420 5.325 6.597 889 HD2 TYR 135 2HD TYR 135 3.907 7.073 8.244 890 HE1 TYR 135 1HE TYR 135 6.821 3.162 7.601 891 HE2 TYR 135 2HE TYR 135 3.299 4.914 9.253 892 HH TYR 135 HH TYR 135 4.817 2.739 10.000 893 H VAL 136 H VAL 136 5.027 5.755 4.017 894 HA VAL 136 HA VAL 136 2.146 5.841 4.628 895 HB VAL 136 HB VAL 136 1.690 4.714 2.599 896 HG11 VAL 136 1HG1 VAL 136 2.560 6.213 0.919 897 HG12 VAL 136 2HG1 VAL 136 2.225 7.120 2.395 898 HG13 VAL 136 3HG1 VAL 136 3.884 6.688 1.982 899 HG21 VAL 136 3HG2 VAL 136 4.066 4.341 1.229 900 HG22 VAL 136 1HG2 VAL 136 4.431 3.807 2.870 901 HG23 VAL 136 2HG2 VAL 136 3.087 3.086 1.986 902 H ARG 137 H ARG 137 1.066 3.893 5.134 903 HA ARG 137 HA ARG 137 2.836 1.704 6.009 904 HB3 ARG 137 2HB ARG 137 0.436 2.889 7.398 905 HG3 ARG 137 2HG ARG 137 1.664 0.207 7.725 906 HD3 ARG 137 2HD ARG 137 0.282 1.326 10.083 907 HE ARG 137 HE ARG 137 2.680 -0.193 10.438 908 HH11 ARG 137 1HH1 ARG 137 -0.708 -0.399 9.666 909 HH12 ARG 137 2HH1 ARG 137 -0.867 -2.035 10.212 910 HH21 ARG 137 1HH2 ARG 137 2.484 -2.348 11.160 911 HH22 ARG 137 2HH2 ARG 137 0.950 -3.143 11.063 912 H VAL 138 H VAL 138 2.263 -0.328 5.454 913 HA VAL 138 HA VAL 138 -0.352 -0.699 4.143 914 HB VAL 138 HB VAL 138 1.837 -2.455 3.243 915 HG11 VAL 138 1HG1 VAL 138 -0.062 -0.842 1.573 916 HG12 VAL 138 2HG1 VAL 138 0.703 -2.387 1.199 917 HG13 VAL 138 3HG1 VAL 138 -0.580 -2.307 2.407 918 HG21 VAL 138 3HG2 VAL 138 3.200 -0.561 3.219 919 HG22 VAL 138 1HG2 VAL 138 2.538 -0.617 1.585 920 HG23 VAL 138 2HG2 VAL 138 1.870 0.507 2.768 921 H LEU 139 H LEU 139 -1.292 -2.780 4.316 922 HA LEU 139 HA LEU 139 -0.047 -4.767 6.006 923 HB3 LEU 139 2HB LEU 139 -2.526 -3.283 6.859 924 HG LEU 139 HG LEU 139 -2.259 -4.752 8.975 925 HD11 LEU 139 1HD1 LEU 139 -3.424 -6.274 6.700 926 HD12 LEU 139 2HD1 LEU 139 -4.087 -4.687 7.088 927 HD13 LEU 139 3HD1 LEU 139 -4.080 -5.962 8.307 928 HD21 LEU 139 3HD2 LEU 139 -0.180 -5.835 7.735 929 HD22 LEU 139 1HD2 LEU 139 -1.436 -6.894 7.094 930 HD23 LEU 139 2HD2 LEU 139 -1.199 -6.763 8.836 931 HA PRO 140 HA PRO 140 -2.456 -6.955 2.916 932 HB3 PRO 140 2HB PRO 140 -0.532 -8.113 2.428 933 HG3 PRO 140 2HG PRO 140 1.105 -8.455 4.045 934 HD3 PRO 140 2HD PRO 140 0.790 -6.183 4.272 935 H VAL 141 H VAL 141 -4.300 -8.143 3.033 936 HA VAL 141 HA VAL 141 -5.019 -9.263 5.665 937 HB VAL 141 HB VAL 141 -6.967 -8.088 3.682 938 HG11 VAL 141 1HG1 VAL 141 -8.558 -8.220 5.491 939 HG12 VAL 141 2HG1 VAL 141 -7.835 -9.809 5.235 940 HG13 VAL 141 3HG1 VAL 141 -7.311 -8.808 6.590 941 HG21 VAL 141 3HG2 VAL 141 -5.666 -6.252 4.413 942 HG22 VAL 141 1HG2 VAL 141 -7.136 -6.227 5.387 943 HG23 VAL 141 2HG2 VAL 141 -5.633 -6.841 6.074 944 H SER 142 H SER 142 -5.476 -9.508 2.162 945 HA SER 142 HA SER 142 -5.836 -12.399 2.476 946 HB3 SER 142 2HB SER 142 -7.824 -12.518 1.316 947 HG SER 142 HG SER 142 -9.147 -11.152 2.311 948 H TRP 143 H TRP 143 -4.281 -13.335 1.345 949 HA TRP 143 HA TRP 143 -3.466 -12.110 -1.210 950 HB3 TRP 143 2HB TRP 143 -1.702 -11.960 0.503 951 HD1 TRP 143 HD TRP 143 -0.544 -15.442 -0.269 952 HE1 TRP 143 1HE TRP 143 -0.421 -16.819 1.901 953 HE3 TRP 143 3HE TRP 143 -2.980 -12.226 2.871 954 HZ2 TRP 143 2HZ TRP 143 -1.248 -16.575 4.589 955 HZ3 TRP 143 3HZ TRP 143 -3.273 -12.874 5.226 956 HH2 TRP 143 HH TRP 143 -2.425 -15.003 6.065 957 H HIS 144 H HIS 144 -2.336 -13.789 -2.659 958 HA HIS 144 HA HIS 144 -3.727 -16.376 -2.488 959 HB3 HIS 144 2HB HIS 144 -3.305 -15.639 -5.232 960 HD1 HIS 144 1HD HIS 144 -6.618 -14.638 -4.638 961 HD2 HIS 144 2HD HIS 144 -4.657 -18.297 -4.467 962 HE1 HIS 144 1HE HIS 144 -8.424 -16.378 -4.820 963 H ASN 145 H ASN 145 -2.403 -18.062 -2.612 964 HA ASN 145 HA ASN 145 -0.634 -19.389 -3.200 965 HB3 ASN 145 2HB ASN 145 0.888 -17.419 -4.745 966 HD21 ASN 145 1HD2 ASN 145 -0.764 -18.957 -6.981 967 HD22 ASN 145 2HD2 ASN 145 0.130 -20.429 -7.112 968 H ARG 146 H ARG 146 0.544 -16.026 -2.958 969 HA ARG 146 HA ARG 146 1.744 -16.362 -0.439 970 HB3 ARG 146 2HB ARG 146 3.577 -16.675 -2.816 971 HG3 ARG 146 2HG ARG 146 4.559 -15.094 -1.183 972 HD3 ARG 146 2HD ARG 146 3.369 -16.304 0.776 973 HE ARG 146 HE ARG 146 4.220 -18.406 1.081 974 HH11 ARG 146 1HH1 ARG 146 6.838 -16.193 0.475 975 HH12 ARG 146 2HH1 ARG 146 8.075 -17.355 0.826 976 HH21 ARG 146 1HH2 ARG 146 5.837 -19.944 1.547 977 HH22 ARG 146 2HH2 ARG 146 7.504 -19.488 1.436 978 H ILE 147 H ILE 147 2.674 -14.448 0.340 979 HA ILE 147 HA ILE 147 1.759 -12.068 -0.915 980 HB ILE 147 HB ILE 147 3.674 -12.386 1.400 981 HG13 ILE 147 2HG1 ILE 147 0.708 -12.424 1.151 982 HG21 ILE 147 1HG2 ILE 147 4.008 -10.197 1.047 983 HG22 ILE 147 2HG2 ILE 147 2.596 -10.051 0.001 984 HG23 ILE 147 3HG2 ILE 147 2.404 -10.003 1.754 985 HD11 ILE 147 3HD1 ILE 147 2.661 -14.127 2.219 986 HD12 ILE 147 1HD1 ILE 147 1.749 -13.489 3.587 987 HD13 ILE 147 2HD1 ILE 147 0.908 -14.314 2.274 988 H THR 148 H THR 148 2.854 -12.353 -2.994 989 HA THR 148 HA THR 148 5.581 -11.247 -2.908 990 HB THR 148 HB THR 148 4.857 -12.980 -5.212 991 HG1 THR 148 1HG THR 148 4.288 -14.449 -3.716 992 HG21 THR 148 3HG2 THR 148 7.412 -13.426 -3.939 993 HG22 THR 148 1HG2 THR 148 7.150 -11.710 -4.247 994 HG23 THR 148 2HG2 THR 148 7.057 -12.868 -5.573 995 H LEU 149 H LEU 149 5.145 -9.170 -3.447 996 HA LEU 149 HA LEU 149 4.383 -8.627 -6.164 997 HB3 LEU 149 2HB LEU 149 2.211 -8.866 -4.906 998 HG LEU 149 HG LEU 149 3.114 -6.310 -3.591 999 HD11 LEU 149 1HD1 LEU 149 0.456 -7.163 -4.466 1000 HD12 LEU 149 2HD1 LEU 149 1.042 -5.568 -3.997 1001 HD13 LEU 149 3HD1 LEU 149 0.551 -6.724 -2.761 1002 HD21 LEU 149 3HD2 LEU 149 3.625 -7.877 -2.041 1003 HD22 LEU 149 1HD2 LEU 149 2.497 -9.061 -2.704 1004 HD23 LEU 149 2HD2 LEU 149 1.901 -7.750 -1.685 1005 H ARG 150 H ARG 150 3.804 -5.917 -5.914 1006 HA ARG 150 HA ARG 150 5.833 -4.661 -4.287 1007 HB3 ARG 150 2HB ARG 150 7.186 -5.375 -6.173 1008 HG3 ARG 150 2HG ARG 150 4.988 -5.058 -7.749 1009 HD3 ARG 150 2HD ARG 150 6.546 -2.579 -7.815 1010 HE ARG 150 HE ARG 150 6.624 -4.130 -10.159 1011 HH11 ARG 150 1HH1 ARG 150 5.849 -0.913 -9.079 1012 HH12 ARG 150 2HH1 ARG 150 6.254 -0.167 -10.589 1013 HH21 ARG 150 1HH2 ARG 150 7.160 -3.161 -12.154 1014 HH22 ARG 150 2HH2 ARG 150 6.998 -1.447 -12.338 1015 H LEU 151 H LEU 151 4.969 -2.840 -3.562 1016 HA LEU 151 HA LEU 151 2.833 -1.568 -5.127 1017 HB3 LEU 151 2HB LEU 151 3.001 -0.393 -2.577 1018 HG LEU 151 HG LEU 151 1.060 -2.331 -3.784 1019 HD11 LEU 151 1HD1 LEU 151 -0.260 -1.640 -1.589 1020 HD12 LEU 151 2HD1 LEU 151 1.373 -1.613 -0.924 1021 HD13 LEU 151 3HD1 LEU 151 0.747 -3.086 -1.663 1022 HD21 LEU 151 3HD2 LEU 151 0.852 -0.082 -4.545 1023 HD22 LEU 151 1HD2 LEU 151 0.957 0.547 -2.901 1024 HD23 LEU 151 2HD2 LEU 151 -0.460 -0.375 -3.402 1025 H GLU 152 H GLU 152 3.550 0.036 -6.367 1026 HA GLU 152 HA GLU 152 5.696 1.766 -5.344 1027 HB3 GLU 152 2HB GLU 152 5.297 2.422 -8.013 1028 HG3 GLU 152 2HG GLU 152 7.446 1.919 -6.660 1029 H LEU 153 H LEU 153 5.461 3.982 -5.289 1030 HA LEU 153 HA LEU 153 2.700 4.953 -5.581 1031 HB3 LEU 153 2HB LEU 153 3.570 5.113 -3.327 1032 HG LEU 153 HG LEU 153 5.995 6.091 -4.544 1033 HD11 LEU 153 1HD1 LEU 153 4.451 7.982 -2.891 1034 HD12 LEU 153 2HD1 LEU 153 5.704 8.281 -4.093 1035 HD13 LEU 153 3HD1 LEU 153 6.150 7.781 -2.462 1036 HD21 LEU 153 3HD2 LEU 153 5.482 5.630 -1.625 1037 HD22 LEU 153 1HD2 LEU 153 6.958 5.354 -2.551 1038 HD23 LEU 153 2HD2 LEU 153 5.570 4.289 -2.768 1039 H LEU 154 H LEU 154 2.239 6.699 -6.833 1040 HA LEU 154 HA LEU 154 4.484 7.874 -8.336 1041 HB3 LEU 154 2HB LEU 154 3.222 7.923 -10.264 1042 HG LEU 154 HG LEU 154 2.195 5.476 -8.836 1043 HD11 LEU 154 1HD1 LEU 154 1.486 4.650 -10.996 1044 HD12 LEU 154 2HD1 LEU 154 1.998 6.151 -11.768 1045 HD13 LEU 154 3HD1 LEU 154 0.653 6.161 -10.628 1046 HD21 LEU 154 3HD2 LEU 154 4.697 6.152 -9.954 1047 HD22 LEU 154 1HD2 LEU 154 3.943 4.983 -11.036 1048 HD23 LEU 154 2HD2 LEU 154 4.166 4.589 -9.331 1049 H GLY 155 H GLY 155 4.423 10.096 -8.805 1050 HA2 GLY 155 2HA GLY 155 2.299 11.680 -7.559 1051 HA3 GLY 155 3HA GLY 155 3.943 11.934 -6.992 1052 H CYS 156 H CYS 156 2.749 14.096 -7.930 1053 HA CYS 156 HA CYS 156 3.381 14.403 -10.761 1054 HB3 CYS 156 2HB CYS 156 2.478 16.794 -10.238 1055 H LEU 157 H LEU 157 5.483 14.039 -8.723 1056 HA LEU 157 HA LEU 157 6.787 16.440 -8.115 1057 HB3 LEU 157 2HB LEU 157 8.717 15.128 -7.655 1058 HG LEU 157 HG LEU 157 7.991 13.726 -6.043 1059 HD11 LEU 157 1HD1 LEU 157 6.384 15.771 -6.279 1060 HD12 LEU 157 2HD1 LEU 157 6.016 14.478 -5.139 1061 HD13 LEU 157 3HD1 LEU 157 5.196 14.538 -6.699 1062 HD21 LEU 157 3HD2 LEU 157 7.425 11.753 -6.979 1063 HD22 LEU 157 1HD2 LEU 157 6.473 12.509 -8.257 1064 HD23 LEU 157 2HD2 LEU 157 5.783 12.305 -6.646 1065 H GLU 158 H GLU 158 6.133 15.179 -11.107 1066 HA GLU 158 HA GLU 158 8.408 15.481 -12.631 1067 HB3 GLU 158 2HB GLU 158 5.694 16.415 -13.550 1068 HG3 GLU 158 2HG GLU 158 7.721 16.551 -15.080
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