NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
620817 | 5o2m | 34141 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H2 GLY 1 2H0 GLY 1 8.311 14.004 -19.477 2 H GLY 1 1H0 GLY 1 8.778 15.469 -19.976 3 HA2 GLY 1 1HA GLY 1 10.520 15.629 -18.362 4 HA3 GLY 1 2HA GLY 1 8.997 15.225 -17.567 5 H SER 2 H SER 2 9.803 14.341 -15.764 6 HA SER 2 HA SER 2 11.886 12.260 -15.901 7 HB2 SER 2 1HB SER 2 11.442 12.301 -13.360 8 HB3 SER 2 2HB SER 2 12.078 13.804 -14.091 9 HG SER 2 HG SER 2 10.296 14.218 -12.720 10 H MET 3 H MET 3 11.603 10.246 -14.707 11 HA MET 3 HA MET 3 10.666 8.202 -14.459 12 HB2 MET 3 1HB MET 3 9.688 9.917 -12.682 13 HB3 MET 3 2HB MET 3 8.158 9.420 -13.413 14 HG2 MET 3 1HG MET 3 8.648 8.018 -11.490 15 HG3 MET 3 2HG MET 3 8.778 7.035 -12.961 16 HE1 MET 3 1HE MET 3 10.203 5.139 -11.805 17 HE2 MET 3 2HE MET 3 11.682 5.419 -10.857 18 HE3 MET 3 3HE MET 3 10.115 5.967 -10.219 19 H LYS 4 H LYS 4 10.385 8.702 -17.081 20 HA LYS 4 HA LYS 4 7.589 8.074 -17.842 21 HB2 LYS 4 1HB LYS 4 10.128 8.579 -19.427 22 HB3 LYS 4 2HB LYS 4 8.572 8.155 -20.168 23 HG2 LYS 4 1HG LYS 4 7.602 10.198 -19.651 24 HG3 LYS 4 2HG LYS 4 8.684 10.494 -18.281 25 HD2 LYS 4 1HD LYS 4 9.267 12.017 -20.010 26 HD3 LYS 4 2HD LYS 4 10.565 10.800 -19.904 27 HE2 LYS 4 1HE LYS 4 9.617 9.619 -21.866 28 HE3 LYS 4 2HE LYS 4 8.328 10.858 -21.956 29 HZ1 LYS 4 1HZ LYS 4 10.211 11.397 -23.406 30 HZ2 LYS 4 2HZ LYS 4 11.236 11.409 -22.120 31 HZ3 LYS 4 3HZ LYS 4 10.040 12.536 -22.230 32 H TYR 5 H TYR 5 6.953 6.130 -18.775 33 HA TYR 5 HA TYR 5 8.739 3.811 -18.343 34 HB2 TYR 5 1HB TYR 5 5.804 4.206 -18.927 35 HB3 TYR 5 2HB TYR 5 6.566 2.687 -19.378 36 HD1 TYR 5 HD1 TYR 5 5.548 4.789 -16.508 37 HD2 TYR 5 HD2 TYR 5 7.461 1.121 -17.713 38 HE1 TYR 5 HE1 TYR 5 5.391 3.918 -14.174 39 HE2 TYR 5 HE2 TYR 5 7.297 0.271 -15.390 40 HH TYR 5 HH TYR 5 5.875 2.187 -12.743 41 H LEU 6 H LEU 6 8.853 2.159 -20.108 42 HA LEU 6 HA LEU 6 9.999 3.295 -22.455 43 HB2 LEU 6 1HB LEU 6 8.919 0.490 -21.976 44 HB3 LEU 6 2HB LEU 6 9.991 0.956 -23.299 45 HG LEU 6 HG LEU 6 10.723 1.057 -20.350 46 HD11 LEU 6 1HD1 LEU 6 12.070 -0.946 -20.871 47 HD12 LEU 6 2HD1 LEU 6 11.401 -0.979 -22.516 48 HD13 LEU 6 3HD1 LEU 6 10.349 -1.241 -21.099 49 HD21 LEU 6 1HD2 LEU 6 12.020 2.647 -21.699 50 HD22 LEU 6 2HD2 LEU 6 12.437 1.351 -22.856 51 HD23 LEU 6 3HD2 LEU 6 13.036 1.295 -21.177 52 H ASN 7 H ASN 7 6.816 1.856 -21.876 53 HA ASN 7 HA ASN 7 4.885 1.792 -23.103 54 HB2 ASN 7 1HB ASN 7 5.371 4.327 -22.829 55 HB3 ASN 7 2HB ASN 7 5.747 4.276 -24.555 56 HD21 ASN 7 1HD2 ASN 7 2.393 4.268 -25.521 57 HD22 ASN 7 2HD2 ASN 7 4.077 4.286 -25.998 58 H VAL 8 H VAL 8 6.968 0.207 -24.220 59 HA VAL 8 HA VAL 8 6.237 0.342 -27.107 60 HB VAL 8 HB VAL 8 8.241 -1.049 -27.523 61 HG11 VAL 8 1HG1 VAL 8 9.930 0.717 -27.324 62 HG12 VAL 8 2HG1 VAL 8 8.358 1.417 -27.766 63 HG13 VAL 8 3HG1 VAL 8 8.938 1.556 -26.100 64 HG21 VAL 8 1HG2 VAL 8 10.017 -1.269 -25.802 65 HG22 VAL 8 2HG2 VAL 8 8.928 -0.545 -24.596 66 HG23 VAL 8 3HG2 VAL 8 8.532 -2.113 -25.345 67 H LEU 9 H LEU 9 5.695 -1.821 -27.990 68 HA LEU 9 HA LEU 9 4.725 -3.631 -25.812 69 HB2 LEU 9 1HB LEU 9 3.374 -3.907 -28.347 70 HB3 LEU 9 2HB LEU 9 2.697 -3.784 -26.744 71 HG LEU 9 HG LEU 9 3.477 -1.456 -28.489 72 HD11 LEU 9 1HD1 LEU 9 0.777 -2.771 -27.961 73 HD12 LEU 9 2HD1 LEU 9 1.676 -2.749 -29.505 74 HD13 LEU 9 3HD1 LEU 9 1.013 -1.249 -28.835 75 HD21 LEU 9 1HD2 LEU 9 2.023 -0.108 -26.960 76 HD22 LEU 9 2HD2 LEU 9 3.392 -0.832 -26.093 77 HD23 LEU 9 3HD2 LEU 9 1.779 -1.555 -25.945 78 H ALA 10 H ALA 10 4.327 -5.868 -26.752 79 HA ALA 10 HA ALA 10 5.997 -6.381 -29.088 80 HB1 ALA 10 1HB ALA 10 7.474 -6.587 -27.017 81 HB2 ALA 10 2HB ALA 10 6.444 -7.922 -26.507 82 HB3 ALA 10 3HB ALA 10 7.383 -8.044 -28.015 83 H LYS 11 H LYS 11 5.424 -8.211 -30.222 84 HA LYS 11 HA LYS 11 2.799 -9.381 -29.443 85 HB2 LYS 11 1HB LYS 11 3.159 -8.401 -31.715 86 HB3 LYS 11 2HB LYS 11 4.414 -9.609 -32.030 87 HG2 LYS 11 1HG LYS 11 2.784 -11.400 -31.989 88 HG3 LYS 11 2HG LYS 11 1.543 -10.308 -31.353 89 HD2 LYS 11 1HD LYS 11 1.667 -8.971 -33.455 90 HD3 LYS 11 2HD LYS 11 2.770 -10.196 -34.119 91 HE2 LYS 11 1HE LYS 11 1.052 -11.928 -33.811 92 HE3 LYS 11 2HE LYS 11 -0.026 -10.743 -33.052 93 HZ1 LYS 11 1HZ LYS 11 -0.628 -11.122 -35.337 94 HZ2 LYS 11 2HZ LYS 11 0.860 -10.684 -35.868 95 HZ3 LYS 11 3HZ LYS 11 -0.116 -9.565 -35.153 96 H ALA 12 H ALA 12 2.545 -11.480 -28.908 97 HA ALA 12 HA ALA 12 4.925 -13.009 -28.229 98 HB1 ALA 12 1HB ALA 12 3.238 -14.750 -27.576 99 HB2 ALA 12 2HB ALA 12 2.978 -13.174 -26.809 100 HB3 ALA 12 3HB ALA 12 1.963 -13.667 -28.185 101 H LEU 13 H LEU 13 5.954 -14.461 -29.408 102 HA LEU 13 HA LEU 13 4.945 -15.100 -32.126 103 HB2 LEU 13 1HB LEU 13 7.577 -15.708 -30.721 104 HB3 LEU 13 2HB LEU 13 7.216 -16.025 -32.430 105 HG LEU 13 HG LEU 13 7.292 -13.255 -31.165 106 HD11 LEU 13 1HD1 LEU 13 9.489 -14.306 -31.146 107 HD12 LEU 13 2HD1 LEU 13 9.433 -13.014 -32.353 108 HD13 LEU 13 3HD1 LEU 13 9.340 -14.714 -32.871 109 HD21 LEU 13 1HD2 LEU 13 7.044 -14.190 -34.055 110 HD22 LEU 13 2HD2 LEU 13 7.370 -12.508 -33.569 111 HD23 LEU 13 3HD2 LEU 13 5.844 -13.282 -33.117 112 H TYR 14 H TYR 14 5.502 -16.462 -28.970 113 HA TYR 14 HA TYR 14 4.474 -19.102 -29.906 114 HB2 TYR 14 1HB TYR 14 6.564 -18.662 -27.754 115 HB3 TYR 14 2HB TYR 14 5.965 -20.200 -28.352 116 HD1 TYR 14 HD1 TYR 14 6.640 -21.006 -30.642 117 HD2 TYR 14 HD2 TYR 14 8.263 -17.416 -28.945 118 HE1 TYR 14 HE1 TYR 14 8.469 -21.019 -32.349 119 HE2 TYR 14 HE2 TYR 14 10.099 -17.429 -30.602 120 HH TYR 14 HH TYR 14 10.346 -19.962 -33.129 121 H ASP 15 H ASP 15 3.399 -20.266 -28.116 122 HA ASP 15 HA ASP 15 2.017 -18.359 -26.288 123 HB2 ASP 15 1HB ASP 15 0.370 -20.269 -26.113 124 HB3 ASP 15 2HB ASP 15 0.507 -19.569 -27.723 125 H ASN 16 H ASN 16 1.524 -19.104 -24.105 126 HA ASN 16 HA ASN 16 3.144 -21.347 -23.103 127 HB2 ASN 16 1HB ASN 16 4.327 -20.146 -21.529 128 HB3 ASN 16 2HB ASN 16 4.431 -19.072 -22.911 129 HD21 ASN 16 1HD2 ASN 16 3.355 -17.435 -19.580 130 HD22 ASN 16 2HD2 ASN 16 4.486 -18.740 -19.847 131 H VAL 17 H VAL 17 2.688 -21.372 -20.540 132 HA VAL 17 HA VAL 17 -0.034 -20.435 -19.907 133 HB VAL 17 HB VAL 17 -0.250 -22.907 -20.490 134 HG11 VAL 17 1HG1 VAL 17 0.833 -24.589 -19.047 135 HG12 VAL 17 2HG1 VAL 17 2.030 -23.641 -19.930 136 HG13 VAL 17 3HG1 VAL 17 1.736 -23.321 -18.201 137 HG21 VAL 17 1HG2 VAL 17 -0.530 -22.361 -17.496 138 HG22 VAL 17 2HG2 VAL 17 -1.691 -21.860 -18.743 139 HG23 VAL 17 3HG2 VAL 17 -1.407 -23.587 -18.445 140 H ALA 18 H ALA 18 0.005 -19.846 -17.615 141 HA ALA 18 HA ALA 18 2.807 -19.493 -16.642 142 HB1 ALA 18 1HB ALA 18 1.771 -17.703 -15.213 143 HB2 ALA 18 2HB ALA 18 1.603 -17.384 -16.949 144 HB3 ALA 18 3HB ALA 18 0.218 -17.992 -16.010 145 H GLU 19 H GLU 19 3.399 -20.302 -14.666 146 HA GLU 19 HA GLU 19 1.415 -22.151 -13.399 147 HB2 GLU 19 1HB GLU 19 4.417 -21.879 -13.051 148 HB3 GLU 19 2HB GLU 19 3.395 -23.099 -12.269 149 HG2 GLU 19 1HG GLU 19 2.767 -23.933 -14.541 150 HG3 GLU 19 2HG GLU 19 3.921 -22.803 -15.251 151 H SER 20 H SER 20 2.785 -19.063 -13.017 152 HA SER 20 HA SER 20 2.014 -19.002 -10.125 153 HB2 SER 20 1HB SER 20 4.450 -18.962 -10.313 154 HB3 SER 20 2HB SER 20 4.352 -17.668 -11.536 155 HG SER 20 HG SER 20 4.818 -16.918 -9.383 156 HA PRO 21 HA PRO 21 -0.352 -15.532 -11.564 157 HB2 PRO 21 1HB PRO 21 -0.585 -13.967 -9.349 158 HB3 PRO 21 2HB PRO 21 -1.447 -15.529 -9.507 159 HG2 PRO 21 1HG PRO 21 1.160 -14.953 -8.113 160 HG3 PRO 21 2HG PRO 21 -0.302 -15.787 -7.487 161 HD2 PRO 21 1HD PRO 21 1.778 -17.190 -8.460 162 HD3 PRO 21 2HD PRO 21 0.083 -17.704 -8.785 163 H ASP 22 H ASP 22 2.828 -15.219 -10.196 164 HA ASP 22 HA ASP 22 3.156 -12.368 -10.806 165 HB2 ASP 22 1HB ASP 22 5.141 -14.552 -10.071 166 HB3 ASP 22 2HB ASP 22 5.504 -12.835 -10.157 167 H GLU 23 H GLU 23 3.065 -15.211 -12.615 168 HA GLU 23 HA GLU 23 4.912 -14.212 -14.732 169 HB2 GLU 23 1HB GLU 23 5.213 -16.533 -13.755 170 HB3 GLU 23 2HB GLU 23 3.569 -16.920 -14.277 171 HG2 GLU 23 1HG GLU 23 4.246 -16.462 -16.610 172 HG3 GLU 23 2HG GLU 23 5.890 -16.164 -16.018 173 H LEU 24 H LEU 24 4.004 -13.865 -16.830 174 HA LEU 24 HA LEU 24 1.067 -13.574 -16.770 175 HB2 LEU 24 1HB LEU 24 3.299 -12.324 -18.198 176 HB3 LEU 24 2HB LEU 24 1.921 -12.706 -19.237 177 HG LEU 24 HG LEU 24 1.766 -11.072 -16.690 178 HD11 LEU 24 1HD1 LEU 24 1.499 -9.155 -18.214 179 HD12 LEU 24 2HD1 LEU 24 1.800 -10.219 -19.600 180 HD13 LEU 24 3HD1 LEU 24 3.079 -9.936 -18.395 181 HD21 LEU 24 1HD2 LEU 24 -0.299 -11.690 -18.859 182 HD22 LEU 24 2HD2 LEU 24 -0.487 -10.387 -17.648 183 HD23 LEU 24 3HD2 LEU 24 -0.386 -12.068 -17.124 184 H SER 25 H SER 25 -0.339 -14.738 -17.875 185 HA SER 25 HA SER 25 0.690 -16.934 -19.589 186 HB2 SER 25 1HB SER 25 -1.699 -17.669 -19.583 187 HB3 SER 25 2HB SER 25 -1.041 -17.529 -17.929 188 HG SER 25 HG SER 25 -2.407 -15.379 -19.194 189 H PHE 26 H PHE 26 0.816 -16.602 -21.721 190 HA PHE 26 HA PHE 26 -1.066 -14.677 -23.020 191 HB2 PHE 26 1HB PHE 26 0.862 -13.733 -24.287 192 HB3 PHE 26 2HB PHE 26 0.953 -13.371 -22.556 193 HD1 PHE 26 HD1 PHE 26 2.391 -15.446 -25.303 194 HD2 PHE 26 HD2 PHE 26 2.713 -14.235 -21.173 195 HE1 PHE 26 HE1 PHE 26 4.663 -16.458 -25.187 196 HE2 PHE 26 HE2 PHE 26 4.967 -15.275 -21.044 197 HZ PHE 26 HZ PHE 26 5.948 -16.390 -23.048 198 H ARG 27 H ARG 27 -0.959 -15.001 -25.456 199 HA ARG 27 HA ARG 27 0.038 -17.732 -26.114 200 HB2 ARG 27 1HB ARG 27 -2.700 -16.625 -26.812 201 HB3 ARG 27 2HB ARG 27 -2.008 -18.139 -27.424 202 HG2 ARG 27 1HG ARG 27 -1.804 -18.961 -25.074 203 HG3 ARG 27 2HG ARG 27 -2.629 -17.487 -24.521 204 HD2 ARG 27 1HD ARG 27 -4.597 -18.097 -25.868 205 HD3 ARG 27 2HD ARG 27 -3.774 -19.605 -26.359 206 HE ARG 27 HE ARG 27 -3.689 -19.467 -23.542 207 HH11 ARG 27 1HH1 ARG 27 -6.182 -19.812 -26.013 208 HH12 ARG 27 2HH1 ARG 27 -7.232 -20.723 -24.956 209 HH21 ARG 27 1HH2 ARG 27 -5.091 -20.569 -22.238 210 HH22 ARG 27 2HH2 ARG 27 -6.626 -21.140 -22.857 211 H LYS 28 H LYS 28 0.478 -18.035 -28.336 212 HA LYS 28 HA LYS 28 1.846 -15.840 -29.491 213 HB2 LYS 28 1HB LYS 28 2.109 -17.174 -31.488 214 HB3 LYS 28 2HB LYS 28 2.326 -18.190 -30.069 215 HG2 LYS 28 1HG LYS 28 0.063 -19.125 -30.361 216 HG3 LYS 28 2HG LYS 28 -0.151 -18.115 -31.807 217 HD2 LYS 28 1HD LYS 28 1.899 -19.171 -32.784 218 HD3 LYS 28 2HD LYS 28 1.951 -20.258 -31.373 219 HE2 LYS 28 1HE LYS 28 -0.239 -21.178 -31.962 220 HE3 LYS 28 2HE LYS 28 -0.401 -20.013 -33.295 221 HZ1 LYS 28 1HZ LYS 28 1.672 -22.131 -33.100 222 HZ2 LYS 28 2HZ LYS 28 1.554 -21.045 -34.332 223 HZ3 LYS 28 3HZ LYS 28 0.360 -22.155 -34.106 224 H GLY 29 H GLY 29 1.374 -14.307 -30.911 225 HA2 GLY 29 1HA GLY 29 -0.001 -13.253 -32.544 226 HA3 GLY 29 2HA GLY 29 -1.380 -14.223 -32.045 227 H ASP 30 H ASP 30 -0.556 -13.568 -29.114 228 HA ASP 30 HA ASP 30 -2.259 -11.212 -28.886 229 HB2 ASP 30 1HB ASP 30 -1.945 -13.310 -27.326 230 HB3 ASP 30 2HB ASP 30 -0.582 -12.401 -26.646 231 H ILE 31 H ILE 31 -1.565 -9.265 -27.619 232 HA ILE 31 HA ILE 31 1.346 -8.606 -27.991 233 HB ILE 31 HB ILE 31 -1.051 -6.843 -28.767 234 HG12 ILE 31 1HG1 ILE 31 0.682 -6.775 -30.867 235 HG13 ILE 31 2HG1 ILE 31 1.016 -8.387 -30.253 236 HG21 ILE 31 1HG2 ILE 31 0.672 -5.123 -29.397 237 HG22 ILE 31 2HG2 ILE 31 0.654 -5.439 -27.650 238 HG23 ILE 31 3HG2 ILE 31 1.931 -6.142 -28.668 239 HD11 ILE 31 1HD1 ILE 31 -1.345 -8.999 -30.503 240 HD12 ILE 31 2HD1 ILE 31 -1.701 -7.365 -31.122 241 HD13 ILE 31 3HD1 ILE 31 -0.635 -8.459 -32.031 242 H MET 32 H MET 32 2.260 -7.665 -26.272 243 HA MET 32 HA MET 32 0.486 -6.599 -24.108 244 HB2 MET 32 1HB MET 32 1.979 -7.708 -22.469 245 HB3 MET 32 2HB MET 32 1.163 -8.869 -23.525 246 HG2 MET 32 1HG MET 32 3.461 -8.529 -24.951 247 HG3 MET 32 2HG MET 32 4.068 -8.199 -23.318 248 HE1 MET 32 1HE MET 32 2.823 -10.689 -25.902 249 HE2 MET 32 2HE MET 32 2.338 -12.123 -24.968 250 HE3 MET 32 3HE MET 32 1.332 -10.663 -24.923 251 H THR 33 H THR 33 1.428 -4.981 -22.776 252 HA THR 33 HA THR 33 3.449 -3.384 -24.216 253 HB THR 33 HB THR 33 2.070 -2.823 -21.556 254 HG1 THR 33 HG1 THR 33 0.673 -1.579 -22.858 255 HG21 THR 33 1HG2 THR 33 3.491 -1.028 -23.568 256 HG22 THR 33 2HG2 THR 33 4.044 -1.386 -21.918 257 HG23 THR 33 3HG2 THR 33 2.557 -0.441 -22.184 258 H VAL 34 H VAL 34 5.596 -3.259 -23.680 259 HA VAL 34 HA VAL 34 6.548 -4.855 -21.358 260 HB VAL 34 HB VAL 34 8.068 -3.456 -23.616 261 HG11 VAL 34 1HG1 VAL 34 9.502 -3.506 -21.665 262 HG12 VAL 34 2HG1 VAL 34 9.061 -5.194 -21.312 263 HG13 VAL 34 3HG1 VAL 34 10.033 -4.799 -22.757 264 HG21 VAL 34 1HG2 VAL 34 8.513 -5.704 -24.463 265 HG22 VAL 34 2HG2 VAL 34 7.629 -6.437 -23.114 266 HG23 VAL 34 3HG2 VAL 34 6.762 -5.471 -24.344 267 H LEU 35 H LEU 35 6.991 -3.912 -19.485 268 HA LEU 35 HA LEU 35 6.864 -0.949 -19.349 269 HB2 LEU 35 1HB LEU 35 6.918 -3.063 -17.183 270 HB3 LEU 35 2HB LEU 35 6.693 -1.340 -16.914 271 HG LEU 35 HG LEU 35 4.787 -3.139 -18.467 272 HD11 LEU 35 1HD1 LEU 35 4.620 -2.002 -15.652 273 HD12 LEU 35 2HD1 LEU 35 4.822 -3.715 -16.095 274 HD13 LEU 35 3HD1 LEU 35 3.314 -2.862 -16.497 275 HD21 LEU 35 1HD2 LEU 35 4.540 -0.247 -17.595 276 HD22 LEU 35 2HD2 LEU 35 3.220 -1.215 -18.273 277 HD23 LEU 35 3HD2 LEU 35 4.650 -0.843 -19.259 278 H GLU 36 H GLU 36 9.004 -3.656 -18.468 279 HA GLU 36 HA GLU 36 11.371 -1.955 -18.759 280 HB2 GLU 36 1HB GLU 36 12.255 -2.418 -16.542 281 HB3 GLU 36 2HB GLU 36 10.755 -1.506 -16.410 282 HG2 GLU 36 1HG GLU 36 9.538 -3.528 -15.827 283 HG3 GLU 36 2HG GLU 36 11.001 -4.502 -16.035 284 H ARG 37 H ARG 37 13.357 -3.496 -18.244 285 HA ARG 37 HA ARG 37 12.662 -6.255 -19.191 286 HB2 ARG 37 1HB ARG 37 15.042 -4.576 -20.083 287 HB3 ARG 37 2HB ARG 37 14.625 -6.204 -20.634 288 HG2 ARG 37 1HG ARG 37 12.423 -5.162 -21.501 289 HG3 ARG 37 2HG ARG 37 13.228 -3.603 -21.239 290 HD2 ARG 37 1HD ARG 37 14.088 -5.844 -23.085 291 HD3 ARG 37 2HD ARG 37 13.599 -4.194 -23.518 292 HE ARG 37 HE ARG 37 15.891 -4.176 -21.766 293 HH11 ARG 37 1HH1 ARG 37 15.029 -4.764 -25.144 294 HH12 ARG 37 2HH1 ARG 37 16.635 -4.401 -25.703 295 HH21 ARG 37 1HH2 ARG 37 17.922 -3.736 -22.569 296 HH22 ARG 37 2HH2 ARG 37 18.222 -3.794 -24.282 297 H ASP 38 H ASP 38 14.157 -7.859 -18.611 298 HA ASP 38 HA ASP 38 15.470 -9.012 -17.203 299 HB2 ASP 38 1HB ASP 38 17.114 -6.488 -16.960 300 HB3 ASP 38 2HB ASP 38 17.651 -8.155 -16.703 301 H THR 39 H THR 39 13.192 -7.983 -16.287 302 HA THR 39 HA THR 39 13.285 -6.251 -14.054 303 HB THR 39 HB THR 39 11.264 -6.613 -15.418 304 HG1 THR 39 HG1 THR 39 10.819 -5.954 -13.326 305 HG21 THR 39 1HG2 THR 39 9.928 -8.670 -15.263 306 HG22 THR 39 2HG2 THR 39 11.140 -9.406 -14.206 307 HG23 THR 39 3HG2 THR 39 11.540 -9.046 -15.902 308 H GLN 40 H GLN 40 13.897 -9.671 -14.131 309 HA GLN 40 HA GLN 40 13.630 -9.758 -11.152 310 HB2 GLN 40 1HB GLN 40 12.307 -11.301 -12.920 311 HB3 GLN 40 2HB GLN 40 13.780 -12.269 -12.723 312 HG2 GLN 40 1HG GLN 40 13.421 -12.372 -10.308 313 HG3 GLN 40 2HG GLN 40 12.038 -11.283 -10.465 314 HE21 GLN 40 1HE2 GLN 40 9.800 -13.892 -10.876 315 HE22 GLN 40 2HE2 GLN 40 10.143 -12.259 -10.319 316 H GLY 41 H GLY 41 15.901 -8.981 -13.213 317 HA2 GLY 41 1HA GLY 41 18.212 -9.087 -12.977 318 HA3 GLY 41 2HA GLY 41 18.056 -10.328 -11.725 319 H LEU 42 H LEU 42 16.054 -11.328 -14.066 320 HA LEU 42 HA LEU 42 18.017 -13.216 -15.168 321 HB2 LEU 42 1HB LEU 42 15.006 -13.039 -15.470 322 HB3 LEU 42 2HB LEU 42 16.009 -14.331 -16.098 323 HG LEU 42 HG LEU 42 15.580 -13.708 -13.152 324 HD11 LEU 42 1HD1 LEU 42 13.564 -14.537 -14.257 325 HD12 LEU 42 2HD1 LEU 42 14.225 -15.769 -13.171 326 HD13 LEU 42 3HD1 LEU 42 14.460 -15.916 -14.927 327 HD21 LEU 42 1HD2 LEU 42 17.025 -16.025 -14.519 328 HD22 LEU 42 2HD2 LEU 42 16.628 -15.920 -12.787 329 HD23 LEU 42 3HD2 LEU 42 17.753 -14.756 -13.502 330 H ASP 43 H ASP 43 19.015 -12.774 -16.990 331 HA ASP 43 HA ASP 43 18.383 -10.573 -18.683 332 HB2 ASP 43 1HB ASP 43 20.603 -11.809 -18.467 333 HB3 ASP 43 2HB ASP 43 19.901 -13.111 -19.424 334 H GLY 44 H GLY 44 16.972 -10.311 -20.267 335 HA2 GLY 44 1HA GLY 44 15.755 -10.973 -22.147 336 HA3 GLY 44 2HA GLY 44 16.059 -12.663 -21.779 337 H TRP 45 H TRP 45 14.916 -11.376 -18.918 338 HA TRP 45 HA TRP 45 12.113 -12.190 -19.633 339 HB2 TRP 45 1HB TRP 45 13.658 -12.059 -17.052 340 HB3 TRP 45 2HB TRP 45 11.892 -12.126 -17.074 341 HD1 TRP 45 HD1 TRP 45 14.945 -14.264 -18.063 342 HE1 TRP 45 HE1 TRP 45 14.253 -16.702 -18.259 343 HE3 TRP 45 HE3 TRP 45 9.907 -13.629 -17.512 344 HZ2 TRP 45 HZ2 TRP 45 11.813 -18.206 -18.185 345 HZ3 TRP 45 HZ3 TRP 45 8.418 -15.638 -17.571 346 HH2 TRP 45 HH2 TRP 45 9.382 -17.901 -17.917 347 H TRP 46 H TRP 46 10.634 -10.617 -19.930 348 HA TRP 46 HA TRP 46 11.399 -7.892 -18.951 349 HB2 TRP 46 1HB TRP 46 9.550 -8.708 -21.210 350 HB3 TRP 46 2HB TRP 46 10.034 -7.062 -20.799 351 HD1 TRP 46 HD1 TRP 46 13.233 -8.423 -20.449 352 HE1 TRP 46 HE1 TRP 46 14.633 -8.606 -22.559 353 HE3 TRP 46 HE3 TRP 46 9.432 -7.976 -23.825 354 HZ2 TRP 46 HZ2 TRP 46 14.168 -8.584 -25.383 355 HZ3 TRP 46 HZ3 TRP 46 9.972 -8.093 -26.272 356 HH2 TRP 46 HH2 TRP 46 12.343 -8.405 -27.027 357 H LEU 47 H LEU 47 9.849 -6.611 -17.936 358 HA LEU 47 HA LEU 47 7.589 -8.125 -16.747 359 HB2 LEU 47 1HB LEU 47 8.907 -6.488 -15.367 360 HB3 LEU 47 2HB LEU 47 8.411 -5.218 -16.477 361 HG LEU 47 HG LEU 47 6.025 -5.640 -15.823 362 HD11 LEU 47 1HD1 LEU 47 6.231 -7.940 -15.004 363 HD12 LEU 47 2HD1 LEU 47 5.638 -6.890 -13.708 364 HD13 LEU 47 3HD1 LEU 47 7.340 -7.401 -13.713 365 HD21 LEU 47 1HD2 LEU 47 7.963 -4.935 -13.592 366 HD22 LEU 47 2HD2 LEU 47 6.235 -4.510 -13.637 367 HD23 LEU 47 3HD2 LEU 47 7.352 -3.826 -14.834 368 H CYS 48 H CYS 48 5.864 -8.339 -18.050 369 HA CYS 48 HA CYS 48 5.242 -6.055 -19.865 370 HB2 CYS 48 1HB CYS 48 4.515 -8.994 -20.108 371 HB3 CYS 48 2HB CYS 48 4.079 -7.715 -21.250 372 HG CYS 48 HG CYS 48 7.068 -8.770 -20.361 373 H SER 49 H SER 49 2.885 -5.772 -20.261 374 HA SER 49 HA SER 49 1.245 -6.650 -17.919 375 HB2 SER 49 1HB SER 49 1.835 -4.280 -17.629 376 HB3 SER 49 2HB SER 49 1.191 -3.927 -19.258 377 HG SER 49 HG SER 49 -0.281 -4.982 -17.047 378 H LEU 50 H LEU 50 -0.620 -7.556 -18.412 379 HA LEU 50 HA LEU 50 -1.940 -7.195 -21.018 380 HB2 LEU 50 1HB LEU 50 -0.084 -8.788 -21.482 381 HB3 LEU 50 2HB LEU 50 -0.630 -9.815 -20.178 382 HG LEU 50 HG LEU 50 -2.734 -10.258 -21.468 383 HD11 LEU 50 1HD1 LEU 50 -2.780 -8.250 -22.896 384 HD12 LEU 50 2HD1 LEU 50 -2.753 -9.722 -23.887 385 HD13 LEU 50 3HD1 LEU 50 -1.275 -8.761 -23.681 386 HD21 LEU 50 1HD2 LEU 50 -0.103 -10.886 -22.847 387 HD22 LEU 50 2HD2 LEU 50 -1.633 -11.755 -23.092 388 HD23 LEU 50 3HD2 LEU 50 -0.829 -11.799 -21.505 389 H HIS 51 H HIS 51 -4.082 -7.847 -20.841 390 HA HIS 51 HA HIS 51 -6.054 -8.420 -19.840 391 HB2 HIS 51 1HB HIS 51 -4.715 -10.620 -20.278 392 HB3 HIS 51 2HB HIS 51 -4.692 -10.742 -18.522 393 HD1 HIS 51 HD1 HIS 51 -7.188 -10.707 -17.363 394 HD2 HIS 51 HD2 HIS 51 -6.992 -11.457 -21.464 395 HE1 HIS 51 HE1 HIS 51 -9.404 -11.756 -18.032 396 H GLY 52 H GLY 52 -4.676 -6.467 -18.274 397 HA2 GLY 52 1HA GLY 52 -5.294 -5.401 -16.320 398 HA3 GLY 52 2HA GLY 52 -6.212 -6.839 -15.844 399 H ARG 53 H ARG 53 -3.106 -7.869 -16.586 400 HA ARG 53 HA ARG 53 -2.192 -7.451 -13.759 401 HB2 ARG 53 1HB ARG 53 -1.972 -9.949 -15.517 402 HB3 ARG 53 2HB ARG 53 -1.111 -9.708 -13.988 403 HG2 ARG 53 1HG ARG 53 -3.368 -9.432 -12.871 404 HG3 ARG 53 2HG ARG 53 -4.095 -10.016 -14.394 405 HD2 ARG 53 1HD ARG 53 -2.696 -12.055 -14.262 406 HD3 ARG 53 2HD ARG 53 -1.966 -11.468 -12.756 407 HE ARG 53 HE ARG 53 -4.792 -11.542 -12.436 408 HH11 ARG 53 1HH1 ARG 53 -2.064 -13.762 -12.720 409 HH12 ARG 53 2HH1 ARG 53 -2.862 -15.018 -11.821 410 HH21 ARG 53 1HH2 ARG 53 -5.763 -13.202 -11.292 411 HH22 ARG 53 2HH2 ARG 53 -4.920 -14.710 -11.031 412 H GLN 54 H GLN 54 0.178 -7.719 -13.581 413 HA GLN 54 HA GLN 54 1.631 -7.469 -16.153 414 HB2 GLN 54 1HB GLN 54 3.307 -6.035 -15.003 415 HB3 GLN 54 2HB GLN 54 1.766 -5.223 -15.255 416 HG2 GLN 54 1HG GLN 54 2.171 -6.545 -12.611 417 HG3 GLN 54 2HG GLN 54 3.152 -5.123 -12.967 418 HE21 GLN 54 1HE2 GLN 54 0.567 -2.844 -12.500 419 HE22 GLN 54 2HE2 GLN 54 2.259 -3.135 -12.830 420 H GLY 55 H GLY 55 3.614 -8.642 -16.085 421 HA2 GLY 55 1HA GLY 55 4.436 -10.072 -13.706 422 HA3 GLY 55 2HA GLY 55 3.417 -11.097 -14.746 423 H ILE 56 H ILE 56 5.896 -11.983 -14.404 424 HA ILE 56 HA ILE 56 7.743 -10.798 -16.320 425 HB ILE 56 HB ILE 56 9.267 -12.613 -15.731 426 HG12 ILE 56 1HG1 ILE 56 7.048 -13.821 -14.022 427 HG13 ILE 56 2HG1 ILE 56 7.500 -14.428 -15.623 428 HG21 ILE 56 1HG2 ILE 56 9.581 -12.066 -13.384 429 HG22 ILE 56 2HG2 ILE 56 8.877 -10.638 -14.164 430 HG23 ILE 56 3HG2 ILE 56 7.847 -11.695 -13.181 431 HD11 ILE 56 1HD1 ILE 56 9.249 -14.390 -13.149 432 HD12 ILE 56 2HD1 ILE 56 8.574 -15.810 -13.965 433 HD13 ILE 56 3HD1 ILE 56 9.835 -14.837 -14.765 434 H VAL 57 H VAL 57 8.348 -11.476 -18.308 435 HA VAL 57 HA VAL 57 6.926 -13.796 -19.541 436 HB VAL 57 HB VAL 57 7.091 -10.959 -20.675 437 HG11 VAL 57 1HG1 VAL 57 5.793 -11.932 -22.610 438 HG12 VAL 57 2HG1 VAL 57 7.488 -12.434 -22.514 439 HG13 VAL 57 3HG1 VAL 57 6.215 -13.536 -21.985 440 HG21 VAL 57 1HG2 VAL 57 4.603 -11.152 -20.778 441 HG22 VAL 57 2HG2 VAL 57 4.738 -12.699 -19.913 442 HG23 VAL 57 3HG2 VAL 57 5.248 -11.192 -19.118 443 HA PRO 58 HA PRO 58 11.152 -14.102 -21.003 444 HB2 PRO 58 1HB PRO 58 10.956 -16.178 -22.759 445 HB3 PRO 58 2HB PRO 58 10.883 -16.414 -20.986 446 HG2 PRO 58 1HG PRO 58 8.615 -16.207 -22.952 447 HG3 PRO 58 2HG PRO 58 8.894 -17.420 -21.670 448 HD2 PRO 58 1HD PRO 58 7.244 -15.303 -21.337 449 HD3 PRO 58 2HD PRO 58 8.207 -15.990 -19.982 450 H GLY 59 H GLY 59 11.772 -12.406 -22.208 451 HA2 GLY 59 1HA GLY 59 10.264 -11.387 -24.407 452 HA3 GLY 59 2HA GLY 59 11.911 -10.924 -23.944 453 H ASN 60 H ASN 60 12.640 -13.898 -24.208 454 HA ASN 60 HA ASN 60 13.580 -13.843 -26.918 455 HB2 ASN 60 1HB ASN 60 14.569 -15.128 -24.963 456 HB3 ASN 60 2HB ASN 60 13.226 -16.269 -25.133 457 HD21 ASN 60 1HD2 ASN 60 15.017 -18.144 -27.405 458 HD22 ASN 60 2HD2 ASN 60 13.961 -18.064 -26.018 459 H ARG 61 H ARG 61 10.439 -14.324 -25.792 460 HA ARG 61 HA ARG 61 9.739 -15.966 -28.210 461 HB2 ARG 61 1HB ARG 61 8.233 -15.698 -25.589 462 HB3 ARG 61 2HB ARG 61 7.740 -16.677 -26.970 463 HG2 ARG 61 1HG ARG 61 9.880 -17.997 -26.684 464 HG3 ARG 61 2HG ARG 61 10.147 -17.099 -25.162 465 HD2 ARG 61 1HD ARG 61 7.828 -17.867 -24.452 466 HD3 ARG 61 2HD ARG 61 7.809 -18.935 -25.861 467 HE ARG 61 HE ARG 61 9.368 -19.246 -23.388 468 HH11 ARG 61 1HH1 ARG 61 8.972 -20.403 -26.701 469 HH12 ARG 61 2HH1 ARG 61 9.791 -21.897 -26.377 470 HH21 ARG 61 1HH2 ARG 61 10.402 -21.172 -23.037 471 HH22 ARG 61 2HH2 ARG 61 10.584 -22.327 -24.329 472 H LEU 62 H LEU 62 10.012 -12.878 -27.460 473 HA LEU 62 HA LEU 62 7.310 -12.114 -28.512 474 HB2 LEU 62 1HB LEU 62 9.154 -10.532 -26.703 475 HB3 LEU 62 2HB LEU 62 7.590 -10.030 -27.305 476 HG LEU 62 HG LEU 62 8.074 -12.199 -25.252 477 HD11 LEU 62 1HD1 LEU 62 6.984 -10.499 -23.751 478 HD12 LEU 62 2HD1 LEU 62 7.000 -9.352 -25.082 479 HD13 LEU 62 3HD1 LEU 62 8.524 -9.953 -24.407 480 HD21 LEU 62 1HD2 LEU 62 6.097 -12.747 -26.528 481 HD22 LEU 62 2HD2 LEU 62 5.495 -11.072 -26.396 482 HD23 LEU 62 3HD2 LEU 62 5.612 -12.102 -24.956 483 H LYS 63 H LYS 63 7.219 -10.308 -29.911 484 HA LYS 63 HA LYS 63 9.863 -9.405 -31.039 485 HB2 LYS 63 1HB LYS 63 8.607 -10.795 -32.667 486 HB3 LYS 63 2HB LYS 63 7.199 -9.737 -32.482 487 HG2 LYS 63 1HG LYS 63 8.578 -7.834 -33.342 488 HG3 LYS 63 2HG LYS 63 9.908 -8.975 -33.640 489 HD2 LYS 63 1HD LYS 63 8.452 -10.249 -35.169 490 HD3 LYS 63 2HD LYS 63 7.105 -9.129 -34.831 491 HE2 LYS 63 1HE LYS 63 8.117 -8.471 -36.935 492 HE3 LYS 63 2HE LYS 63 8.504 -7.243 -35.707 493 HZ1 LYS 63 1HZ LYS 63 10.352 -9.383 -36.592 494 HZ2 LYS 63 2HZ LYS 63 10.694 -8.229 -35.476 495 HZ3 LYS 63 3HZ LYS 63 10.434 -7.803 -37.055 496 H ILE 64 H ILE 64 10.228 -7.337 -30.519 497 HA ILE 64 HA ILE 64 8.303 -5.605 -29.324 498 HB ILE 64 HB ILE 64 10.917 -4.929 -30.780 499 HG12 ILE 64 1HG1 ILE 64 11.125 -6.453 -28.790 500 HG13 ILE 64 2HG1 ILE 64 12.001 -4.925 -28.653 501 HG21 ILE 64 1HG2 ILE 64 10.833 -2.785 -29.364 502 HG22 ILE 64 2HG2 ILE 64 9.662 -2.880 -30.687 503 HG23 ILE 64 3HG2 ILE 64 9.132 -3.179 -29.012 504 HD11 ILE 64 1HD1 ILE 64 9.303 -5.488 -27.307 505 HD12 ILE 64 2HD1 ILE 64 10.885 -5.607 -26.530 506 HD13 ILE 64 3HD1 ILE 64 10.310 -4.034 -27.097 507 H LEU 65 H LEU 65 6.823 -4.250 -30.101 508 HA LEU 65 HA LEU 65 6.961 -3.377 -32.949 509 HB2 LEU 65 1HB LEU 65 4.520 -4.499 -31.522 510 HB3 LEU 65 2HB LEU 65 4.452 -3.599 -33.032 511 HG LEU 65 HG LEU 65 5.775 -6.309 -32.643 512 HD11 LEU 65 1HD1 LEU 65 3.904 -7.134 -33.990 513 HD12 LEU 65 2HD1 LEU 65 3.221 -5.493 -34.097 514 HD13 LEU 65 3HD1 LEU 65 3.303 -6.324 -32.527 515 HD21 LEU 65 1HD2 LEU 65 5.903 -6.330 -35.155 516 HD22 LEU 65 2HD2 LEU 65 6.921 -5.068 -34.434 517 HD23 LEU 65 3HD2 LEU 65 5.375 -4.631 -35.173 518 H VAL 66 H VAL 66 6.570 -1.190 -33.092 519 HA VAL 66 HA VAL 66 5.879 0.224 -30.598 520 HB VAL 66 HB VAL 66 6.515 1.383 -33.367 521 HG11 VAL 66 1HG1 VAL 66 6.434 2.688 -30.591 522 HG12 VAL 66 2HG1 VAL 66 6.942 3.488 -32.088 523 HG13 VAL 66 3HG1 VAL 66 5.263 2.954 -31.912 524 HG21 VAL 66 1HG2 VAL 66 8.346 0.973 -30.945 525 HG22 VAL 66 2HG2 VAL 66 8.466 0.122 -32.517 526 HG23 VAL 66 3HG2 VAL 66 8.764 1.865 -32.424 527 H GLY 67 H GLY 67 3.699 -0.410 -30.314 528 HA2 GLY 67 1HA GLY 67 1.838 -0.058 -32.552 529 HA3 GLY 67 2HA GLY 67 1.449 -0.652 -30.945 530 H MET 68 H MET 68 2.928 1.876 -29.887 531 HA MET 68 HA MET 68 0.795 3.855 -30.522 532 HB2 MET 68 1HB MET 68 1.712 2.896 -27.793 533 HB3 MET 68 2HB MET 68 1.046 4.518 -28.028 534 HG2 MET 68 1HG MET 68 -0.841 3.354 -27.412 535 HG3 MET 68 2HG MET 68 -0.944 3.275 -29.172 536 HE1 MET 68 1HE MET 68 -2.794 1.376 -27.804 537 HE2 MET 68 2HE MET 68 -2.434 1.218 -29.538 538 HE3 MET 68 3HE MET 68 -2.389 -0.217 -28.489 539 H TYR 69 H TYR 69 1.488 5.833 -30.829 540 HA TYR 69 HA TYR 69 4.337 6.497 -30.176 541 HB2 TYR 69 1HB TYR 69 3.947 6.628 -32.574 542 HB3 TYR 69 2HB TYR 69 2.436 7.519 -32.330 543 HD1 TYR 69 HD1 TYR 69 6.160 7.769 -32.070 544 HD2 TYR 69 HD2 TYR 69 2.412 9.907 -32.015 545 HE1 TYR 69 HE1 TYR 69 7.381 9.951 -32.225 546 HE2 TYR 69 HE2 TYR 69 3.643 12.066 -32.172 547 HH TYR 69 HH TYR 69 7.203 12.225 -32.406 548 H ASP 70 H ASP 70 0.982 7.674 -30.373 549 HA ASP 70 HA ASP 70 1.353 9.926 -28.594 550 HB2 ASP 70 1HB ASP 70 -0.501 9.703 -30.278 551 HB3 ASP 70 2HB ASP 70 -1.163 8.371 -29.316 552 H LYS 71 H LYS 71 0.824 9.994 -26.383 553 HA LYS 71 HA LYS 71 0.091 7.679 -24.794 554 HB2 LYS 71 1HB LYS 71 2.326 7.318 -23.753 555 HB3 LYS 71 2HB LYS 71 2.316 6.870 -25.457 556 HG2 LYS 71 1HG LYS 71 3.274 9.158 -25.954 557 HG3 LYS 71 2HG LYS 71 3.538 9.346 -24.221 558 HD2 LYS 71 1HD LYS 71 4.976 7.388 -24.161 559 HD3 LYS 71 2HD LYS 71 4.606 7.035 -25.863 560 HE2 LYS 71 1HE LYS 71 6.012 9.539 -24.844 561 HE3 LYS 71 2HE LYS 71 6.795 8.153 -25.641 562 HZ1 LYS 71 1HZ LYS 71 5.346 8.621 -27.596 563 HZ2 LYS 71 2HZ LYS 71 6.387 9.862 -27.265 564 HZ3 LYS 71 3HZ LYS 71 4.792 9.980 -26.862 565 H LYS 72 H LYS 72 0.636 8.229 -22.455 566 HA LYS 72 HA LYS 72 -0.278 10.848 -21.803 567 HB2 LYS 72 1HB LYS 72 1.349 8.859 -20.182 568 HB3 LYS 72 2HB LYS 72 0.509 10.250 -19.497 569 HG2 LYS 72 1HG LYS 72 -1.642 9.307 -20.055 570 HG3 LYS 72 2HG LYS 72 -0.884 7.981 -20.971 571 HD2 LYS 72 1HD LYS 72 0.230 7.181 -18.947 572 HD3 LYS 72 2HD LYS 72 -0.547 8.469 -18.000 573 HE2 LYS 72 1HE LYS 72 -2.022 6.311 -19.548 574 HE3 LYS 72 2HE LYS 72 -1.694 6.257 -17.804 575 HZ1 LYS 72 1HZ LYS 72 -3.915 7.094 -18.260 576 HZ2 LYS 72 2HZ LYS 72 -3.320 8.334 -19.169 577 HZ3 LYS 72 3HZ LYS 72 -3.017 8.268 -17.545 578 HA PRO 73 HA PRO 73 3.617 12.932 -22.303 579 HB2 PRO 73 1HB PRO 73 3.272 15.195 -20.823 580 HB3 PRO 73 2HB PRO 73 2.419 14.931 -22.365 581 HG2 PRO 73 1HG PRO 73 1.419 14.466 -19.575 582 HG3 PRO 73 2HG PRO 73 0.642 15.363 -20.907 583 HD2 PRO 73 1HD PRO 73 -0.015 12.797 -20.362 584 HD3 PRO 73 2HD PRO 73 0.061 13.397 -22.056 585 H ALA 74 H ALA 74 2.306 12.225 -19.130 586 HA ALA 74 HA ALA 74 3.232 11.656 -17.127 587 HB1 ALA 74 1HB ALA 74 5.801 11.065 -18.661 588 HB2 ALA 74 2HB ALA 74 5.284 10.351 -17.113 589 HB3 ALA 74 3HB ALA 74 4.404 9.967 -18.611 590 H GLY 75 H GLY 75 6.084 12.000 -16.327 591 HA2 GLY 75 1HA GLY 75 7.624 13.738 -15.959 592 HA3 GLY 75 2HA GLY 75 6.458 14.927 -16.551 593 H GLU 76 H GLU 76 4.473 13.308 -14.705 594 HA GLU 76 HA GLU 76 4.675 15.111 -12.462 595 HB2 GLU 76 1HB GLU 76 2.520 14.246 -13.388 596 HB3 GLU 76 2HB GLU 76 2.944 12.625 -12.842 597 HG2 GLU 76 1HG GLU 76 1.407 13.548 -11.271 598 HG3 GLU 76 2HG GLU 76 2.993 13.456 -10.481 599 H PHE 77 H PHE 77 6.687 14.739 -11.486 600 HA PHE 77 HA PHE 77 6.769 12.513 -9.599 601 HB2 PHE 77 1HB PHE 77 7.717 11.654 -11.860 602 HB3 PHE 77 2HB PHE 77 9.061 12.764 -11.577 603 HD1 PHE 77 HD1 PHE 77 7.128 10.084 -9.790 604 HD2 PHE 77 HD2 PHE 77 10.937 11.953 -10.453 605 HE1 PHE 77 HE1 PHE 77 8.229 8.349 -8.364 606 HE2 PHE 77 HE2 PHE 77 12.045 10.222 -9.037 607 HZ PHE 77 HZ PHE 77 10.699 8.403 -7.993 608 H ILE 78 H ILE 78 8.773 12.781 -8.216 609 HA ILE 78 HA ILE 78 9.128 15.588 -7.586 610 HB ILE 78 HB ILE 78 10.655 14.769 -5.814 611 HG12 ILE 78 1HG1 ILE 78 10.131 11.955 -6.865 612 HG13 ILE 78 2HG1 ILE 78 11.596 12.867 -7.226 613 HG21 ILE 78 1HG2 ILE 78 8.147 14.744 -5.505 614 HG22 ILE 78 2HG2 ILE 78 8.148 13.026 -5.959 615 HG23 ILE 78 3HG2 ILE 78 9.002 13.559 -4.493 616 HD11 ILE 78 1HD1 ILE 78 10.688 11.974 -4.477 617 HD12 ILE 78 2HD1 ILE 78 12.055 11.337 -5.407 618 HD13 ILE 78 3HD1 ILE 78 12.101 13.011 -4.780 619 H VAL 79 H VAL 79 11.303 16.565 -7.351 620 HA VAL 79 HA VAL 79 12.779 16.406 -9.799 621 HB VAL 79 HB VAL 79 14.389 17.946 -8.675 622 HG11 VAL 79 1HG1 VAL 79 12.341 18.805 -9.790 623 HG12 VAL 79 2HG1 VAL 79 11.470 18.750 -8.240 624 HG13 VAL 79 3HG1 VAL 79 12.863 19.849 -8.450 625 HG21 VAL 79 1HG2 VAL 79 14.271 17.069 -6.363 626 HG22 VAL 79 2HG2 VAL 79 13.919 18.802 -6.400 627 HG23 VAL 79 3HG2 VAL 79 12.594 17.640 -6.208 628 H THR 80 H THR 80 14.889 15.669 -10.156 629 HA THR 80 HA THR 80 16.135 13.939 -8.115 630 HB THR 80 HB THR 80 16.339 12.343 -10.377 631 HG1 THR 80 HG1 THR 80 13.668 13.341 -10.245 632 HG21 THR 80 1HG2 THR 80 14.093 12.158 -8.322 633 HG22 THR 80 2HG2 THR 80 15.760 11.609 -8.051 634 HG23 THR 80 3HG2 THR 80 14.756 10.832 -9.288 635 H ASP 81 H ASP 81 18.375 13.601 -8.573 636 HA ASP 81 HA ASP 81 19.475 14.957 -10.990 637 HB2 ASP 81 1HB ASP 81 21.135 16.128 -9.722 638 HB3 ASP 81 2HB ASP 81 19.602 16.524 -8.944 639 HXT ASP 81 H02 ASP 81 21.205 11.893 -9.385 Start of MODEL 2 1 H2 GLY 1 2H0 GLY 1 18.576 4.822 -10.750 2 H GLY 1 1H0 GLY 1 18.614 6.373 -11.267 3 HA2 GLY 1 1HA GLY 1 16.906 5.997 -12.918 4 HA3 GLY 1 2HA GLY 1 18.194 4.784 -13.110 5 H SER 2 H SER 2 16.369 4.423 -10.371 6 HA SER 2 HA SER 2 15.245 1.879 -11.222 7 HB2 SER 2 1HB SER 2 14.700 3.501 -8.703 8 HB3 SER 2 2HB SER 2 14.388 1.766 -8.936 9 HG SER 2 HG SER 2 16.655 1.496 -9.218 10 H MET 3 H MET 3 12.977 1.304 -11.016 11 HA MET 3 HA MET 3 10.781 1.500 -11.598 12 HB2 MET 3 1HB MET 3 10.977 4.197 -10.221 13 HB3 MET 3 2HB MET 3 9.494 3.299 -10.574 14 HG2 MET 3 1HG MET 3 10.343 1.436 -9.127 15 HG3 MET 3 2HG MET 3 11.710 2.465 -8.673 16 HE1 MET 3 1HE MET 3 10.521 5.388 -8.290 17 HE2 MET 3 2HE MET 3 10.041 5.317 -6.577 18 HE3 MET 3 3HE MET 3 11.564 4.564 -7.107 19 H LYS 4 H LYS 4 12.135 1.848 -13.802 20 HA LYS 4 HA LYS 4 11.173 4.354 -15.080 21 HB2 LYS 4 1HB LYS 4 13.526 2.739 -15.343 22 HB3 LYS 4 2HB LYS 4 12.620 2.619 -16.854 23 HG2 LYS 4 1HG LYS 4 14.163 4.421 -17.072 24 HG3 LYS 4 2HG LYS 4 12.538 5.120 -16.948 25 HD2 LYS 4 1HD LYS 4 12.933 5.572 -14.520 26 HD3 LYS 4 2HD LYS 4 14.570 4.918 -14.685 27 HE2 LYS 4 1HE LYS 4 13.457 7.319 -16.176 28 HE3 LYS 4 2HE LYS 4 14.558 7.379 -14.782 29 HZ1 LYS 4 1HZ LYS 4 16.186 6.167 -16.107 30 HZ2 LYS 4 2HZ LYS 4 15.773 7.581 -16.853 31 HZ3 LYS 4 3HZ LYS 4 15.169 6.147 -17.407 32 H TYR 5 H TYR 5 10.304 4.079 -17.301 33 HA TYR 5 HA TYR 5 8.830 1.548 -17.735 34 HB2 TYR 5 1HB TYR 5 7.214 2.921 -16.575 35 HB3 TYR 5 2HB TYR 5 7.653 4.336 -17.529 36 HD1 TYR 5 HD1 TYR 5 6.709 0.805 -18.471 37 HD2 TYR 5 HD2 TYR 5 5.906 5.009 -18.906 38 HE1 TYR 5 HE1 TYR 5 4.924 0.308 -20.138 39 HE2 TYR 5 HE2 TYR 5 4.101 4.487 -20.544 40 HH TYR 5 HH TYR 5 3.143 2.847 -21.851 41 H LEU 6 H LEU 6 8.904 1.011 -19.841 42 HA LEU 6 HA LEU 6 10.541 2.790 -21.537 43 HB2 LEU 6 1HB LEU 6 9.651 -0.070 -21.946 44 HB3 LEU 6 2HB LEU 6 10.837 0.796 -22.922 45 HG LEU 6 HG LEU 6 11.150 0.074 -19.985 46 HD11 LEU 6 1HD1 LEU 6 12.795 -1.525 -20.809 47 HD12 LEU 6 2HD1 LEU 6 12.444 -1.046 -22.488 48 HD13 LEU 6 3HD1 LEU 6 11.189 -1.848 -21.500 49 HD21 LEU 6 1HD2 LEU 6 13.508 0.749 -20.278 50 HD22 LEU 6 2HD2 LEU 6 12.392 2.111 -20.478 51 HD23 LEU 6 3HD2 LEU 6 13.123 1.353 -21.913 52 H ASN 7 H ASN 7 7.219 1.929 -21.351 53 HA ASN 7 HA ASN 7 5.442 2.165 -22.774 54 HB2 ASN 7 1HB ASN 7 6.356 4.543 -22.401 55 HB3 ASN 7 2HB ASN 7 6.941 4.435 -24.062 56 HD21 ASN 7 1HD2 ASN 7 3.885 5.534 -25.288 57 HD22 ASN 7 2HD2 ASN 7 5.626 5.519 -25.370 58 H VAL 8 H VAL 8 7.094 0.158 -23.703 59 HA VAL 8 HA VAL 8 6.844 0.490 -26.666 60 HB VAL 8 HB VAL 8 9.253 0.552 -25.812 61 HG11 VAL 8 1HG1 VAL 8 8.860 -1.164 -23.975 62 HG12 VAL 8 2HG1 VAL 8 8.886 -2.409 -25.244 63 HG13 VAL 8 3HG1 VAL 8 10.320 -1.395 -24.953 64 HG21 VAL 8 1HG2 VAL 8 10.129 -0.913 -27.543 65 HG22 VAL 8 2HG2 VAL 8 8.600 -1.813 -27.619 66 HG23 VAL 8 3HG2 VAL 8 8.662 -0.110 -28.136 67 H LEU 9 H LEU 9 6.368 -1.644 -27.733 68 HA LEU 9 HA LEU 9 5.160 -3.604 -25.859 69 HB2 LEU 9 1HB LEU 9 3.125 -3.678 -27.315 70 HB3 LEU 9 2HB LEU 9 3.291 -2.238 -26.327 71 HG LEU 9 HG LEU 9 4.351 -1.970 -29.080 72 HD11 LEU 9 1HD1 LEU 9 2.085 -1.661 -30.031 73 HD12 LEU 9 2HD1 LEU 9 1.377 -2.294 -28.525 74 HD13 LEU 9 3HD1 LEU 9 2.393 -3.339 -29.547 75 HD21 LEU 9 1HD2 LEU 9 2.443 -0.301 -27.371 76 HD22 LEU 9 2HD2 LEU 9 3.256 0.223 -28.863 77 HD23 LEU 9 3HD2 LEU 9 4.206 -0.108 -27.400 78 H ALA 10 H ALA 10 4.486 -5.590 -26.899 79 HA ALA 10 HA ALA 10 6.081 -6.219 -29.324 80 HB1 ALA 10 1HB ALA 10 6.274 -7.775 -26.709 81 HB2 ALA 10 2HB ALA 10 7.202 -8.058 -28.203 82 HB3 ALA 10 3HB ALA 10 7.483 -6.591 -27.247 83 H LYS 11 H LYS 11 5.638 -8.367 -30.142 84 HA LYS 11 HA LYS 11 2.842 -9.277 -29.535 85 HB2 LYS 11 1HB LYS 11 3.198 -8.407 -31.832 86 HB3 LYS 11 2HB LYS 11 4.527 -9.546 -32.065 87 HG2 LYS 11 1HG LYS 11 3.034 -11.434 -31.980 88 HG3 LYS 11 2HG LYS 11 1.686 -10.405 -31.463 89 HD2 LYS 11 1HD LYS 11 1.858 -9.163 -33.624 90 HD3 LYS 11 2HD LYS 11 3.082 -10.339 -34.154 91 HE2 LYS 11 1HE LYS 11 1.463 -12.167 -33.864 92 HE3 LYS 11 2HE LYS 11 0.253 -11.015 -33.266 93 HZ1 LYS 11 1HZ LYS 11 0.281 -9.948 -35.428 94 HZ2 LYS 11 2HZ LYS 11 -0.108 -11.543 -35.579 95 HZ3 LYS 11 3HZ LYS 11 1.399 -11.021 -35.992 96 H ALA 12 H ALA 12 2.601 -11.342 -28.815 97 HA ALA 12 HA ALA 12 5.009 -12.835 -28.147 98 HB1 ALA 12 1HB ALA 12 3.290 -14.582 -27.445 99 HB2 ALA 12 2HB ALA 12 3.185 -13.010 -26.640 100 HB3 ALA 12 3HB ALA 12 2.041 -13.414 -27.938 101 H LEU 13 H LEU 13 5.970 -14.433 -29.188 102 HA LEU 13 HA LEU 13 4.953 -15.144 -31.890 103 HB2 LEU 13 1HB LEU 13 7.539 -15.808 -30.441 104 HB3 LEU 13 2HB LEU 13 7.176 -16.218 -32.115 105 HG LEU 13 HG LEU 13 7.423 -13.382 -31.033 106 HD11 LEU 13 1HD1 LEU 13 9.554 -14.612 -30.931 107 HD12 LEU 13 2HD1 LEU 13 9.599 -13.374 -32.195 108 HD13 LEU 13 3HD1 LEU 13 9.381 -15.083 -32.639 109 HD21 LEU 13 1HD2 LEU 13 7.572 -12.811 -33.482 110 HD22 LEU 13 2HD2 LEU 13 5.990 -13.447 -33.003 111 HD23 LEU 13 3HD2 LEU 13 7.143 -14.493 -33.864 112 H TYR 14 H TYR 14 5.315 -16.385 -28.664 113 HA TYR 14 HA TYR 14 4.316 -19.054 -29.563 114 HB2 TYR 14 1HB TYR 14 6.332 -18.513 -27.355 115 HB3 TYR 14 2HB TYR 14 5.734 -20.096 -27.878 116 HD1 TYR 14 HD1 TYR 14 8.145 -17.436 -28.511 117 HD2 TYR 14 HD2 TYR 14 6.324 -20.915 -30.241 118 HE1 TYR 14 HE1 TYR 14 9.971 -17.538 -30.198 119 HE2 TYR 14 HE2 TYR 14 8.153 -21.010 -31.945 120 HH TYR 14 HH TYR 14 10.831 -18.648 -31.990 121 H ASP 15 H ASP 15 3.139 -20.191 -27.808 122 HA ASP 15 HA ASP 15 1.676 -18.239 -26.101 123 HB2 ASP 15 1HB ASP 15 0.055 -20.147 -25.827 124 HB3 ASP 15 2HB ASP 15 0.191 -19.532 -27.476 125 H ASN 16 H ASN 16 1.132 -18.877 -23.922 126 HA ASN 16 HA ASN 16 2.908 -20.858 -22.640 127 HB2 ASN 16 1HB ASN 16 4.228 -18.697 -22.966 128 HB3 ASN 16 2HB ASN 16 3.075 -17.941 -21.853 129 HD21 ASN 16 1HD2 ASN 16 4.796 -19.033 -19.051 130 HD22 ASN 16 2HD2 ASN 16 3.639 -17.934 -19.795 131 H VAL 17 H VAL 17 2.026 -21.638 -20.795 132 HA VAL 17 HA VAL 17 -0.299 -20.157 -19.615 133 HB VAL 17 HB VAL 17 0.518 -23.099 -19.337 134 HG11 VAL 17 1HG1 VAL 17 -0.534 -22.258 -17.276 135 HG12 VAL 17 2HG1 VAL 17 -1.894 -21.593 -18.220 136 HG13 VAL 17 3HG1 VAL 17 -1.639 -23.352 -18.127 137 HG21 VAL 17 1HG2 VAL 17 -1.601 -23.568 -20.563 138 HG22 VAL 17 2HG2 VAL 17 -1.824 -21.821 -20.816 139 HG23 VAL 17 3HG2 VAL 17 -0.439 -22.666 -21.552 140 H ALA 18 H ALA 18 0.144 -19.207 -17.665 141 HA ALA 18 HA ALA 18 2.829 -19.186 -16.702 142 HB1 ALA 18 1HB ALA 18 0.215 -18.302 -15.406 143 HB2 ALA 18 2HB ALA 18 1.833 -17.918 -14.794 144 HB3 ALA 18 3HB ALA 18 1.322 -17.290 -16.369 145 H GLU 19 H GLU 19 3.880 -20.532 -15.405 146 HA GLU 19 HA GLU 19 2.312 -22.641 -13.964 147 HB2 GLU 19 1HB GLU 19 5.315 -22.423 -14.385 148 HB3 GLU 19 2HB GLU 19 4.410 -23.825 -13.796 149 HG2 GLU 19 1HG GLU 19 3.187 -23.749 -16.059 150 HG3 GLU 19 2HG GLU 19 4.470 -22.635 -16.574 151 H SER 20 H SER 20 3.676 -19.637 -13.561 152 HA SER 20 HA SER 20 3.986 -20.007 -10.614 153 HB2 SER 20 1HB SER 20 5.667 -18.442 -12.598 154 HB3 SER 20 2HB SER 20 5.757 -18.184 -10.836 155 HG SER 20 HG SER 20 6.126 -20.692 -12.116 156 HA PRO 21 HA PRO 21 0.962 -16.911 -10.582 157 HB2 PRO 21 1HB PRO 21 1.366 -15.493 -8.281 158 HB3 PRO 21 2HB PRO 21 0.815 -17.200 -8.277 159 HG2 PRO 21 1HG PRO 21 3.617 -16.129 -7.960 160 HG3 PRO 21 2HG PRO 21 2.731 -17.294 -6.922 161 HD2 PRO 21 1HD PRO 21 4.453 -18.146 -8.810 162 HD3 PRO 21 2HD PRO 21 2.914 -19.025 -8.503 163 H ASP 22 H ASP 22 4.279 -15.772 -10.249 164 HA ASP 22 HA ASP 22 3.618 -12.981 -10.818 165 HB2 ASP 22 1HB ASP 22 6.254 -14.499 -10.700 166 HB3 ASP 22 2HB ASP 22 6.097 -12.737 -10.831 167 H GLU 23 H GLU 23 3.931 -15.799 -12.662 168 HA GLU 23 HA GLU 23 5.146 -14.515 -15.008 169 HB2 GLU 23 1HB GLU 23 5.553 -16.902 -14.240 170 HB3 GLU 23 2HB GLU 23 3.897 -17.260 -14.731 171 HG2 GLU 23 1HG GLU 23 4.477 -16.542 -17.045 172 HG3 GLU 23 2HG GLU 23 6.143 -16.281 -16.505 173 H LEU 24 H LEU 24 4.030 -14.163 -16.973 174 HA LEU 24 HA LEU 24 1.109 -13.783 -16.590 175 HB2 LEU 24 1HB LEU 24 3.182 -12.335 -17.858 176 HB3 LEU 24 2HB LEU 24 2.137 -12.924 -19.153 177 HG LEU 24 HG LEU 24 1.166 -11.346 -16.741 178 HD11 LEU 24 1HD1 LEU 24 1.704 -10.428 -19.587 179 HD12 LEU 24 2HD1 LEU 24 2.693 -10.033 -18.162 180 HD13 LEU 24 3HD1 LEU 24 1.022 -9.445 -18.269 181 HD21 LEU 24 1HD2 LEU 24 -0.619 -12.700 -17.704 182 HD22 LEU 24 2HD2 LEU 24 -0.196 -12.173 -19.344 183 HD23 LEU 24 3HD2 LEU 24 -0.869 -11.014 -18.176 184 H SER 25 H SER 25 -0.409 -14.974 -17.620 185 HA SER 25 HA SER 25 0.438 -17.108 -19.486 186 HB2 SER 25 1HB SER 25 -2.310 -16.246 -18.478 187 HB3 SER 25 2HB SER 25 -2.009 -17.622 -19.560 188 HG SER 25 HG SER 25 -2.179 -18.115 -17.254 189 H PHE 26 H PHE 26 0.517 -16.762 -21.642 190 HA PHE 26 HA PHE 26 -1.210 -14.672 -22.860 191 HB2 PHE 26 1HB PHE 26 0.703 -13.682 -24.063 192 HB3 PHE 26 2HB PHE 26 0.815 -13.432 -22.318 193 HD1 PHE 26 HD1 PHE 26 2.270 -15.274 -25.206 194 HD2 PHE 26 HD2 PHE 26 2.570 -14.410 -21.007 195 HE1 PHE 26 HE1 PHE 26 4.578 -16.216 -25.177 196 HE2 PHE 26 HE2 PHE 26 4.850 -15.380 -20.958 197 HZ PHE 26 HZ PHE 26 5.870 -16.277 -23.052 198 H ARG 27 H ARG 27 -0.950 -14.816 -25.348 199 HA ARG 27 HA ARG 27 -0.301 -17.645 -26.054 200 HB2 ARG 27 1HB ARG 27 -2.714 -16.089 -27.005 201 HB3 ARG 27 2HB ARG 27 -2.265 -17.736 -27.482 202 HG2 ARG 27 1HG ARG 27 -2.424 -18.373 -25.027 203 HG3 ARG 27 2HG ARG 27 -3.149 -16.776 -24.751 204 HD2 ARG 27 1HD ARG 27 -4.841 -17.363 -26.533 205 HD3 ARG 27 2HD ARG 27 -4.176 -19.005 -26.504 206 HE ARG 27 HE ARG 27 -5.159 -19.380 -24.422 207 HH11 ARG 27 1HH1 ARG 27 -5.532 -15.954 -25.231 208 HH12 ARG 27 2HH1 ARG 27 -6.681 -15.681 -23.949 209 HH21 ARG 27 1HH2 ARG 27 -6.627 -18.949 -22.812 210 HH22 ARG 27 2HH2 ARG 27 -7.298 -17.350 -22.619 211 H LYS 28 H LYS 28 0.288 -18.042 -28.222 212 HA LYS 28 HA LYS 28 1.888 -16.030 -29.432 213 HB2 LYS 28 1HB LYS 28 1.892 -17.496 -31.433 214 HB3 LYS 28 2HB LYS 28 2.244 -18.362 -29.950 215 HG2 LYS 28 1HG LYS 28 -0.125 -19.178 -29.901 216 HG3 LYS 28 2HG LYS 28 -0.343 -18.440 -31.505 217 HD2 LYS 28 1HD LYS 28 1.526 -19.823 -32.373 218 HD3 LYS 28 2HD LYS 28 1.735 -20.540 -30.765 219 HE2 LYS 28 1HE LYS 28 0.469 -22.086 -32.110 220 HE3 LYS 28 2HE LYS 28 -0.609 -21.400 -30.877 221 HZ1 LYS 28 1HZ LYS 28 -0.455 -20.523 -33.709 222 HZ2 LYS 28 2HZ LYS 28 -1.456 -19.876 -32.571 223 HZ3 LYS 28 3HZ LYS 28 -1.662 -21.437 -33.051 224 H GLY 29 H GLY 29 1.484 -14.389 -30.749 225 HA2 GLY 29 1HA GLY 29 0.233 -13.299 -32.465 226 HA3 GLY 29 2HA GLY 29 -1.204 -14.212 -32.018 227 H ASP 30 H ASP 30 -0.467 -13.545 -29.056 228 HA ASP 30 HA ASP 30 -2.236 -11.264 -28.905 229 HB2 ASP 30 1HB ASP 30 -1.719 -13.305 -27.265 230 HB3 ASP 30 2HB ASP 30 -0.555 -12.161 -26.577 231 H ILE 31 H ILE 31 -1.716 -9.290 -27.643 232 HA ILE 31 HA ILE 31 1.051 -8.288 -28.269 233 HB ILE 31 HB ILE 31 -1.555 -6.674 -28.250 234 HG12 ILE 31 1HG1 ILE 31 -1.637 -8.249 -30.119 235 HG13 ILE 31 2HG1 ILE 31 -1.474 -6.588 -30.677 236 HG21 ILE 31 1HG2 ILE 31 -0.112 -4.940 -29.437 237 HG22 ILE 31 2HG2 ILE 31 0.353 -5.252 -27.752 238 HG23 ILE 31 3HG2 ILE 31 1.304 -5.956 -29.079 239 HD11 ILE 31 1HD1 ILE 31 0.891 -6.944 -31.180 240 HD12 ILE 31 2HD1 ILE 31 0.783 -8.598 -30.538 241 HD13 ILE 31 3HD1 ILE 31 -0.124 -8.154 -31.997 242 H MET 32 H MET 32 2.132 -7.443 -26.529 243 HA MET 32 HA MET 32 0.496 -6.496 -24.227 244 HB2 MET 32 1HB MET 32 2.047 -7.565 -22.647 245 HB3 MET 32 2HB MET 32 1.122 -8.727 -23.584 246 HG2 MET 32 1HG MET 32 3.988 -7.954 -24.263 247 HG3 MET 32 2HG MET 32 3.573 -9.276 -23.171 248 HE1 MET 32 1HE MET 32 2.512 -11.542 -23.869 249 HE2 MET 32 2HE MET 32 1.074 -10.679 -24.469 250 HE3 MET 32 3HE MET 32 1.866 -11.888 -25.488 251 H THR 33 H THR 33 1.390 -4.899 -22.970 252 HA THR 33 HA THR 33 3.476 -3.310 -24.304 253 HB THR 33 HB THR 33 2.094 -2.813 -21.626 254 HG1 THR 33 HG1 THR 33 0.762 -1.419 -22.959 255 HG21 THR 33 1HG2 THR 33 2.654 -0.439 -22.093 256 HG22 THR 33 2HG2 THR 33 3.479 -0.924 -23.593 257 HG23 THR 33 3HG2 THR 33 4.124 -1.428 -22.012 258 H VAL 34 H VAL 34 5.578 -3.236 -23.696 259 HA VAL 34 HA VAL 34 6.421 -4.994 -21.421 260 HB VAL 34 HB VAL 34 8.002 -3.640 -23.650 261 HG11 VAL 34 1HG1 VAL 34 9.938 -5.019 -22.717 262 HG12 VAL 34 2HG1 VAL 34 9.432 -3.641 -21.716 263 HG13 VAL 34 3HG1 VAL 34 8.937 -5.290 -21.275 264 HG21 VAL 34 1HG2 VAL 34 8.422 -5.878 -24.486 265 HG22 VAL 34 2HG2 VAL 34 7.599 -6.606 -23.091 266 HG23 VAL 34 3HG2 VAL 34 6.669 -5.683 -24.297 267 H LEU 35 H LEU 35 6.769 -4.072 -19.532 268 HA LEU 35 HA LEU 35 6.651 -1.144 -19.364 269 HB2 LEU 35 1HB LEU 35 6.899 -3.238 -17.176 270 HB3 LEU 35 2HB LEU 35 6.510 -1.535 -16.953 271 HG LEU 35 HG LEU 35 4.759 -3.608 -18.334 272 HD11 LEU 35 1HD1 LEU 35 4.906 -3.910 -15.912 273 HD12 LEU 35 2HD1 LEU 35 3.312 -3.304 -16.377 274 HD13 LEU 35 3HD1 LEU 35 4.501 -2.200 -15.654 275 HD21 LEU 35 1HD2 LEU 35 2.999 -1.799 -18.173 276 HD22 LEU 35 2HD2 LEU 35 4.285 -1.498 -19.350 277 HD23 LEU 35 3HD2 LEU 35 4.308 -0.651 -17.782 278 H GLU 36 H GLU 36 8.888 -3.803 -18.480 279 HA GLU 36 HA GLU 36 11.192 -1.997 -18.745 280 HB2 GLU 36 1HB GLU 36 10.315 -1.673 -16.403 281 HB3 GLU 36 2HB GLU 36 10.584 -3.388 -16.106 282 HG2 GLU 36 1HG GLU 36 12.369 -1.909 -15.171 283 HG3 GLU 36 2HG GLU 36 12.984 -3.119 -16.299 284 H ARG 37 H ARG 37 13.268 -3.308 -18.506 285 HA ARG 37 HA ARG 37 12.781 -6.190 -19.254 286 HB2 ARG 37 1HB ARG 37 14.892 -4.281 -20.315 287 HB3 ARG 37 2HB ARG 37 14.747 -5.993 -20.737 288 HG2 ARG 37 1HG ARG 37 12.534 -5.552 -21.748 289 HG3 ARG 37 2HG ARG 37 12.685 -3.850 -21.303 290 HD2 ARG 37 1HD ARG 37 14.795 -3.751 -22.648 291 HD3 ARG 37 2HD ARG 37 14.424 -5.390 -23.228 292 HE ARG 37 HE ARG 37 12.127 -3.813 -23.637 293 HH11 ARG 37 1HH1 ARG 37 15.434 -3.888 -24.846 294 HH12 ARG 37 2HH1 ARG 37 15.001 -3.158 -26.370 295 HH21 ARG 37 1HH2 ARG 37 11.636 -2.888 -25.598 296 HH22 ARG 37 2HH2 ARG 37 12.885 -2.597 -26.783 297 H ASP 38 H ASP 38 14.442 -7.667 -18.665 298 HA ASP 38 HA ASP 38 15.731 -8.673 -17.087 299 HB2 ASP 38 1HB ASP 38 17.478 -7.185 -18.167 300 HB3 ASP 38 2HB ASP 38 17.272 -6.087 -16.790 301 H THR 39 H THR 39 13.373 -7.858 -16.281 302 HA THR 39 HA THR 39 13.327 -6.022 -14.100 303 HB THR 39 HB THR 39 11.385 -6.597 -15.558 304 HG1 THR 39 HG1 THR 39 11.225 -6.885 -12.749 305 HG21 THR 39 1HG2 THR 39 10.106 -8.641 -15.187 306 HG22 THR 39 2HG2 THR 39 11.255 -9.195 -13.957 307 HG23 THR 39 3HG2 THR 39 11.756 -9.079 -15.665 308 H GLN 40 H GLN 40 14.606 -9.145 -14.083 309 HA GLN 40 HA GLN 40 14.121 -9.357 -11.147 310 HB2 GLN 40 1HB GLN 40 12.709 -10.831 -12.861 311 HB3 GLN 40 2HB GLN 40 14.159 -11.834 -12.825 312 HG2 GLN 40 1HG GLN 40 13.949 -11.947 -10.328 313 HG3 GLN 40 2HG GLN 40 12.433 -11.042 -10.450 314 HE21 GLN 40 1HE2 GLN 40 12.152 -14.903 -10.562 315 HE22 GLN 40 2HE2 GLN 40 13.300 -13.916 -9.688 316 H GLY 41 H GLY 41 16.535 -8.937 -13.339 317 HA2 GLY 41 1HA GLY 41 18.825 -9.336 -13.098 318 HA3 GLY 41 2HA GLY 41 18.498 -10.312 -11.639 319 H LEU 42 H LEU 42 16.662 -10.825 -14.502 320 HA LEU 42 HA LEU 42 18.215 -13.267 -15.211 321 HB2 LEU 42 1HB LEU 42 15.196 -12.871 -15.268 322 HB3 LEU 42 2HB LEU 42 16.048 -14.281 -15.886 323 HG LEU 42 HG LEU 42 15.926 -13.459 -12.964 324 HD11 LEU 42 1HD1 LEU 42 14.434 -15.629 -14.498 325 HD12 LEU 42 2HD1 LEU 42 13.730 -14.126 -13.860 326 HD13 LEU 42 3HD1 LEU 42 14.357 -15.353 -12.743 327 HD21 LEU 42 1HD2 LEU 42 16.988 -15.976 -14.317 328 HD22 LEU 42 2HD2 LEU 42 16.777 -15.757 -12.564 329 HD23 LEU 42 3HD2 LEU 42 17.945 -14.755 -13.441 330 H ASP 43 H ASP 43 19.177 -12.642 -17.076 331 HA ASP 43 HA ASP 43 18.248 -10.443 -18.612 332 HB2 ASP 43 1HB ASP 43 20.618 -11.354 -18.546 333 HB3 ASP 43 2HB ASP 43 20.067 -12.666 -19.594 334 H GLY 44 H GLY 44 17.233 -10.332 -20.545 335 HA2 GLY 44 1HA GLY 44 15.950 -11.089 -22.343 336 HA3 GLY 44 2HA GLY 44 16.146 -12.753 -21.781 337 H TRP 45 H TRP 45 15.090 -11.610 -18.975 338 HA TRP 45 HA TRP 45 12.263 -12.148 -19.721 339 HB2 TRP 45 1HB TRP 45 13.733 -11.896 -17.092 340 HB3 TRP 45 2HB TRP 45 11.968 -11.956 -17.184 341 HD1 TRP 45 HD1 TRP 45 15.044 -14.157 -17.979 342 HE1 TRP 45 HE1 TRP 45 14.364 -16.605 -18.035 343 HE3 TRP 45 HE3 TRP 45 10.001 -13.495 -17.481 344 HZ2 TRP 45 HZ2 TRP 45 11.927 -18.106 -17.903 345 HZ3 TRP 45 HZ3 TRP 45 8.518 -15.511 -17.433 346 HH2 TRP 45 HH2 TRP 45 9.490 -17.799 -17.655 347 H TRP 46 H TRP 46 10.668 -10.667 -19.819 348 HA TRP 46 HA TRP 46 11.410 -7.864 -19.071 349 HB2 TRP 46 1HB TRP 46 9.627 -8.859 -21.317 350 HB3 TRP 46 2HB TRP 46 9.948 -7.171 -20.926 351 HD1 TRP 46 HD1 TRP 46 13.262 -8.429 -20.554 352 HE1 TRP 46 HE1 TRP 46 14.681 -8.398 -22.650 353 HE3 TRP 46 HE3 TRP 46 9.479 -7.872 -23.944 354 HZ2 TRP 46 HZ2 TRP 46 14.252 -8.154 -25.460 355 HZ3 TRP 46 HZ3 TRP 46 10.055 -7.766 -26.376 356 HH2 TRP 46 HH2 TRP 46 12.434 -7.903 -27.114 357 H LEU 47 H LEU 47 9.839 -6.643 -18.025 358 HA LEU 47 HA LEU 47 7.630 -8.213 -16.821 359 HB2 LEU 47 1HB LEU 47 8.979 -6.589 -15.463 360 HB3 LEU 47 2HB LEU 47 8.432 -5.289 -16.513 361 HG LEU 47 HG LEU 47 6.076 -5.781 -15.785 362 HD11 LEU 47 1HD1 LEU 47 5.772 -7.089 -13.687 363 HD12 LEU 47 2HD1 LEU 47 7.472 -7.597 -13.769 364 HD13 LEU 47 3HD1 LEU 47 6.323 -8.107 -15.029 365 HD21 LEU 47 1HD2 LEU 47 6.334 -4.690 -13.598 366 HD22 LEU 47 2HD2 LEU 47 7.436 -3.980 -14.794 367 HD23 LEU 47 3HD2 LEU 47 8.068 -5.117 -13.576 368 H CYS 48 H CYS 48 5.740 -8.340 -17.925 369 HA CYS 48 HA CYS 48 5.113 -6.075 -19.784 370 HB2 CYS 48 1HB CYS 48 4.376 -9.002 -20.071 371 HB3 CYS 48 2HB CYS 48 4.003 -7.702 -21.213 372 HG CYS 48 HG CYS 48 6.954 -8.825 -20.248 373 H SER 49 H SER 49 2.772 -5.806 -20.195 374 HA SER 49 HA SER 49 1.098 -6.708 -17.887 375 HB2 SER 49 1HB SER 49 1.649 -4.333 -17.615 376 HB3 SER 49 2HB SER 49 1.032 -3.992 -19.247 377 HG SER 49 HG SER 49 -0.504 -3.583 -17.565 378 H LEU 50 H LEU 50 -0.728 -7.675 -18.393 379 HA LEU 50 HA LEU 50 -2.099 -7.313 -20.963 380 HB2 LEU 50 1HB LEU 50 -0.207 -8.842 -21.558 381 HB3 LEU 50 2HB LEU 50 -0.711 -9.925 -20.275 382 HG LEU 50 HG LEU 50 -2.886 -10.269 -21.513 383 HD11 LEU 50 1HD1 LEU 50 -1.367 -8.856 -23.728 384 HD12 LEU 50 2HD1 LEU 50 -2.844 -8.272 -22.939 385 HD13 LEU 50 3HD1 LEU 50 -2.892 -9.743 -23.929 386 HD21 LEU 50 1HD2 LEU 50 -1.133 -11.926 -21.561 387 HD22 LEU 50 2HD2 LEU 50 -0.285 -11.038 -22.847 388 HD23 LEU 50 3HD2 LEU 50 -1.862 -11.789 -23.177 389 H HIS 51 H HIS 51 -4.219 -8.146 -20.801 390 HA HIS 51 HA HIS 51 -6.116 -8.956 -19.824 391 HB2 HIS 51 1HB HIS 51 -4.514 -11.020 -20.027 392 HB3 HIS 51 2HB HIS 51 -4.462 -10.941 -18.265 393 HD1 HIS 51 HD1 HIS 51 -5.673 -13.434 -19.461 394 HD2 HIS 51 HD2 HIS 51 -7.922 -10.025 -18.646 395 HE1 HIS 51 HE1 HIS 51 -8.081 -14.181 -19.237 396 H GLY 52 H GLY 52 -4.785 -6.768 -18.372 397 HA2 GLY 52 1HA GLY 52 -5.470 -5.582 -16.504 398 HA3 GLY 52 2HA GLY 52 -6.413 -6.980 -15.980 399 H ARG 53 H ARG 53 -3.216 -7.981 -16.569 400 HA ARG 53 HA ARG 53 -2.392 -7.291 -13.782 401 HB2 ARG 53 1HB ARG 53 -1.601 -9.516 -13.358 402 HB3 ARG 53 2HB ARG 53 -3.307 -9.617 -13.780 403 HG2 ARG 53 1HG ARG 53 -2.853 -10.641 -15.869 404 HG3 ARG 53 2HG ARG 53 -1.171 -10.079 -15.882 405 HD2 ARG 53 1HD ARG 53 -1.125 -12.413 -15.404 406 HD3 ARG 53 2HD ARG 53 -0.683 -11.538 -13.929 407 HE ARG 53 HE ARG 53 -3.501 -12.064 -13.969 408 HH11 ARG 53 1HH1 ARG 53 -0.410 -13.712 -13.401 409 HH12 ARG 53 2HH1 ARG 53 -1.138 -14.920 -12.388 410 HH21 ARG 53 1HH2 ARG 53 -4.355 -13.651 -12.665 411 HH22 ARG 53 2HH2 ARG 53 -3.329 -14.889 -11.981 412 H GLN 54 H GLN 54 -0.076 -7.611 -13.439 413 HA GLN 54 HA GLN 54 1.495 -7.218 -15.948 414 HB2 GLN 54 1HB GLN 54 2.214 -6.572 -13.062 415 HB3 GLN 54 2HB GLN 54 3.227 -6.268 -14.486 416 HG2 GLN 54 1HG GLN 54 1.675 -4.605 -15.294 417 HG3 GLN 54 2HG GLN 54 0.506 -5.013 -14.034 418 HE21 GLN 54 1HE2 GLN 54 1.747 -2.500 -11.997 419 HE22 GLN 54 2HE2 GLN 54 0.376 -3.299 -12.725 420 H GLY 55 H GLY 55 3.525 -8.502 -15.965 421 HA2 GLY 55 1HA GLY 55 4.061 -10.435 -13.932 422 HA3 GLY 55 2HA GLY 55 3.127 -11.205 -15.226 423 H ILE 56 H ILE 56 5.730 -11.991 -14.560 424 HA ILE 56 HA ILE 56 7.568 -10.686 -16.432 425 HB ILE 56 HB ILE 56 9.218 -12.352 -15.735 426 HG12 ILE 56 1HG1 ILE 56 7.031 -13.654 -14.065 427 HG13 ILE 56 2HG1 ILE 56 7.617 -14.300 -15.595 428 HG21 ILE 56 1HG2 ILE 56 7.670 -11.440 -13.254 429 HG22 ILE 56 2HG2 ILE 56 9.422 -11.713 -13.403 430 HG23 ILE 56 3HG2 ILE 56 8.662 -10.352 -14.253 431 HD11 ILE 56 1HD1 ILE 56 8.691 -15.519 -13.840 432 HD12 ILE 56 2HD1 ILE 56 9.922 -14.463 -14.566 433 HD13 ILE 56 3HD1 ILE 56 9.179 -14.030 -13.006 434 H VAL 57 H VAL 57 8.267 -11.408 -18.367 435 HA VAL 57 HA VAL 57 6.984 -13.845 -19.522 436 HB VAL 57 HB VAL 57 7.055 -11.034 -20.753 437 HG11 VAL 57 1HG1 VAL 57 6.294 -13.701 -21.957 438 HG12 VAL 57 2HG1 VAL 57 5.772 -12.153 -22.635 439 HG13 VAL 57 3HG1 VAL 57 7.498 -12.534 -22.537 440 HG21 VAL 57 1HG2 VAL 57 5.209 -11.264 -19.183 441 HG22 VAL 57 2HG2 VAL 57 4.565 -11.298 -20.835 442 HG23 VAL 57 3HG2 VAL 57 4.724 -12.814 -19.916 443 HA PRO 58 HA PRO 58 11.251 -13.900 -20.845 444 HB2 PRO 58 1HB PRO 58 11.257 -15.983 -22.617 445 HB3 PRO 58 2HB PRO 58 11.198 -16.224 -20.840 446 HG2 PRO 58 1HG PRO 58 8.943 -16.243 -22.826 447 HG3 PRO 58 2HG PRO 58 9.306 -17.410 -21.520 448 HD2 PRO 58 1HD PRO 58 7.460 -15.434 -21.266 449 HD3 PRO 58 2HD PRO 58 8.445 -16.017 -19.884 450 H GLY 59 H GLY 59 11.849 -12.238 -22.115 451 HA2 GLY 59 1HA GLY 59 10.220 -11.216 -24.217 452 HA3 GLY 59 2HA GLY 59 11.864 -10.723 -23.806 453 H ASN 60 H ASN 60 12.697 -13.656 -24.245 454 HA ASN 60 HA ASN 60 13.357 -13.356 -27.050 455 HB2 ASN 60 1HB ASN 60 14.735 -14.531 -25.246 456 HB3 ASN 60 2HB ASN 60 13.602 -15.885 -25.402 457 HD21 ASN 60 1HD2 ASN 60 15.618 -17.206 -27.905 458 HD22 ASN 60 2HD2 ASN 60 14.776 -17.426 -26.393 459 H ARG 61 H ARG 61 10.483 -14.253 -25.588 460 HA ARG 61 HA ARG 61 9.718 -15.977 -27.923 461 HB2 ARG 61 1HB ARG 61 8.366 -15.626 -25.220 462 HB3 ARG 61 2HB ARG 61 7.741 -16.592 -26.551 463 HG2 ARG 61 1HG ARG 61 9.863 -17.975 -26.420 464 HG3 ARG 61 2HG ARG 61 10.214 -17.121 -24.898 465 HD2 ARG 61 1HD ARG 61 7.858 -17.771 -24.163 466 HD3 ARG 61 2HD ARG 61 7.808 -18.858 -25.557 467 HE ARG 61 HE ARG 61 10.145 -19.515 -24.180 468 HH11 ARG 61 1HH1 ARG 61 6.706 -19.467 -23.407 469 HH12 ARG 61 2HH1 ARG 61 6.847 -20.702 -22.185 470 HH21 ARG 61 1HH2 ARG 61 10.258 -21.142 -22.623 471 HH22 ARG 61 2HH2 ARG 61 8.819 -21.640 -21.773 472 H LEU 62 H LEU 62 9.965 -12.877 -27.232 473 HA LEU 62 HA LEU 62 7.280 -12.158 -28.340 474 HB2 LEU 62 1HB LEU 62 9.111 -10.490 -26.584 475 HB3 LEU 62 2HB LEU 62 7.550 -10.013 -27.215 476 HG LEU 62 HG LEU 62 8.054 -12.075 -25.058 477 HD11 LEU 62 1HD1 LEU 62 8.383 -9.740 -24.348 478 HD12 LEU 62 2HD1 LEU 62 6.900 -10.382 -23.632 479 HD13 LEU 62 3HD1 LEU 62 6.799 -9.287 -25.018 480 HD21 LEU 62 1HD2 LEU 62 5.538 -11.992 -24.822 481 HD22 LEU 62 2HD2 LEU 62 6.128 -12.810 -26.273 482 HD23 LEU 62 3HD2 LEU 62 5.483 -11.154 -26.387 483 H LYS 63 H LYS 63 7.298 -10.416 -29.853 484 HA LYS 63 HA LYS 63 10.023 -9.637 -30.854 485 HB2 LYS 63 1HB LYS 63 8.870 -11.219 -32.406 486 HB3 LYS 63 2HB LYS 63 7.528 -10.074 -32.535 487 HG2 LYS 63 1HG LYS 63 9.102 -8.373 -33.429 488 HG3 LYS 63 2HG LYS 63 10.405 -9.573 -33.357 489 HD2 LYS 63 1HD LYS 63 9.085 -11.039 -34.890 490 HD3 LYS 63 2HD LYS 63 7.870 -9.749 -35.022 491 HE2 LYS 63 1HE LYS 63 10.811 -9.535 -35.798 492 HE3 LYS 63 2HE LYS 63 9.449 -9.702 -36.923 493 HZ1 LYS 63 1HZ LYS 63 9.838 -7.415 -35.066 494 HZ2 LYS 63 2HZ LYS 63 8.621 -7.565 -36.169 495 HZ3 LYS 63 3HZ LYS 63 10.179 -7.388 -36.681 496 H ILE 64 H ILE 64 10.330 -7.516 -30.569 497 HA ILE 64 HA ILE 64 8.319 -5.714 -29.677 498 HB ILE 64 HB ILE 64 10.975 -5.147 -31.093 499 HG12 ILE 64 1HG1 ILE 64 11.154 -6.378 -28.922 500 HG13 ILE 64 2HG1 ILE 64 11.932 -4.802 -28.915 501 HG21 ILE 64 1HG2 ILE 64 9.646 -3.148 -31.340 502 HG22 ILE 64 2HG2 ILE 64 9.067 -3.232 -29.661 503 HG23 ILE 64 3HG2 ILE 64 10.772 -2.843 -30.008 504 HD11 ILE 64 1HD1 ILE 64 9.181 -5.340 -27.690 505 HD12 ILE 64 2HD1 ILE 64 10.700 -5.293 -26.782 506 HD13 ILE 64 3HD1 ILE 64 10.103 -3.828 -27.583 507 H LEU 65 H LEU 65 6.789 -4.609 -30.678 508 HA LEU 65 HA LEU 65 6.959 -4.018 -33.557 509 HB2 LEU 65 1HB LEU 65 6.039 -6.320 -33.506 510 HB3 LEU 65 2HB LEU 65 4.794 -5.797 -32.375 511 HG LEU 65 HG LEU 65 3.851 -4.293 -34.121 512 HD11 LEU 65 1HD1 LEU 65 5.960 -5.568 -35.911 513 HD12 LEU 65 2HD1 LEU 65 5.806 -3.843 -35.503 514 HD13 LEU 65 3HD1 LEU 65 4.568 -4.629 -36.495 515 HD21 LEU 65 1HD2 LEU 65 2.885 -6.090 -35.490 516 HD22 LEU 65 2HD2 LEU 65 2.986 -6.568 -33.779 517 HD23 LEU 65 3HD2 LEU 65 4.169 -7.201 -34.952 518 H VAL 66 H VAL 66 6.620 -1.853 -33.316 519 HA VAL 66 HA VAL 66 4.257 -1.025 -31.682 520 HB VAL 66 HB VAL 66 6.663 0.649 -32.552 521 HG11 VAL 66 1HG1 VAL 66 4.291 1.325 -30.751 522 HG12 VAL 66 2HG1 VAL 66 5.707 2.368 -31.021 523 HG13 VAL 66 3HG1 VAL 66 4.613 2.001 -32.368 524 HG21 VAL 66 1HG2 VAL 66 7.325 -0.953 -30.809 525 HG22 VAL 66 2HG2 VAL 66 7.237 0.681 -30.122 526 HG23 VAL 66 3HG2 VAL 66 5.929 -0.477 -29.815 527 H GLY 67 H GLY 67 2.548 -0.808 -32.972 528 HA2 GLY 67 1HA GLY 67 2.917 0.674 -35.527 529 HA3 GLY 67 2HA GLY 67 2.076 -0.887 -35.538 530 H MET 68 H MET 68 1.482 0.659 -32.624 531 HA MET 68 HA MET 68 -1.156 1.664 -33.602 532 HB2 MET 68 1HB MET 68 -1.159 -0.174 -31.877 533 HB3 MET 68 2HB MET 68 -0.255 0.888 -30.791 534 HG2 MET 68 1HG MET 68 -2.128 2.460 -30.721 535 HG3 MET 68 2HG MET 68 -3.023 1.475 -31.897 536 HE1 MET 68 1HE MET 68 -5.031 0.821 -28.561 537 HE2 MET 68 2HE MET 68 -4.278 2.351 -29.068 538 HE3 MET 68 3HE MET 68 -5.138 1.343 -30.261 539 H TYR 69 H TYR 69 -1.711 3.813 -32.920 540 HA TYR 69 HA TYR 69 0.436 5.670 -32.860 541 HB2 TYR 69 1HB TYR 69 -2.516 5.776 -32.321 542 HB3 TYR 69 2HB TYR 69 -1.520 7.122 -31.761 543 HD1 TYR 69 HD1 TYR 69 -0.539 8.714 -33.280 544 HD2 TYR 69 HD2 TYR 69 -2.659 5.291 -34.806 545 HE1 TYR 69 HE1 TYR 69 -0.595 9.751 -35.548 546 HE2 TYR 69 HE2 TYR 69 -2.697 6.334 -37.073 547 HH TYR 69 HH TYR 69 -2.092 8.140 -38.346 548 H ASP 70 H ASP 70 1.767 6.261 -31.302 549 HA ASP 70 HA ASP 70 1.488 5.367 -28.569 550 HB2 ASP 70 1HB ASP 70 3.658 5.879 -29.791 551 HB3 ASP 70 2HB ASP 70 3.242 7.597 -29.679 552 H LYS 71 H LYS 71 0.401 6.339 -26.953 553 HA LYS 71 HA LYS 71 -0.357 9.194 -27.166 554 HB2 LYS 71 1HB LYS 71 -2.344 6.906 -26.802 555 HB3 LYS 71 2HB LYS 71 -2.711 8.612 -26.502 556 HG2 LYS 71 1HG LYS 71 -2.243 9.118 -28.884 557 HG3 LYS 71 2HG LYS 71 -1.950 7.393 -29.174 558 HD2 LYS 71 1HD LYS 71 -4.248 6.893 -28.404 559 HD3 LYS 71 2HD LYS 71 -4.538 8.634 -28.202 560 HE2 LYS 71 1HE LYS 71 -4.040 8.979 -30.611 561 HE3 LYS 71 2HE LYS 71 -3.797 7.230 -30.797 562 HZ1 LYS 71 1HZ LYS 71 -6.095 6.896 -30.124 563 HZ2 LYS 71 2HZ LYS 71 -6.026 7.882 -31.445 564 HZ3 LYS 71 3HZ LYS 71 -6.324 8.522 -29.951 565 H LYS 72 H LYS 72 -0.550 10.112 -25.146 566 HA LYS 72 HA LYS 72 0.598 8.706 -22.906 567 HB2 LYS 72 1HB LYS 72 -0.961 11.322 -23.111 568 HB3 LYS 72 2HB LYS 72 -0.256 10.720 -21.610 569 HG2 LYS 72 1HG LYS 72 1.592 11.865 -22.150 570 HG3 LYS 72 2HG LYS 72 1.898 10.593 -23.345 571 HD2 LYS 72 1HD LYS 72 2.102 12.618 -24.541 572 HD3 LYS 72 2HD LYS 72 0.500 12.001 -24.985 573 HE2 LYS 72 1HE LYS 72 -0.544 13.528 -23.332 574 HE3 LYS 72 2HE LYS 72 1.063 14.107 -22.847 575 HZ1 LYS 72 1HZ LYS 72 -0.118 14.403 -25.557 576 HZ2 LYS 72 2HZ LYS 72 1.373 14.948 -25.102 577 HZ3 LYS 72 3HZ LYS 72 0.013 15.607 -24.434 578 HA PRO 73 HA PRO 73 -3.096 6.665 -21.681 579 HB2 PRO 73 1HB PRO 73 -2.780 6.320 -18.985 580 HB3 PRO 73 2HB PRO 73 -1.771 5.444 -20.180 581 HG2 PRO 73 1HG PRO 73 -1.143 7.990 -18.694 582 HG3 PRO 73 2HG PRO 73 -0.164 6.492 -18.822 583 HD2 PRO 73 1HD PRO 73 0.313 8.598 -20.429 584 HD3 PRO 73 2HD PRO 73 0.405 6.918 -21.067 585 H ALA 74 H ALA 74 -5.120 6.962 -20.541 586 HA ALA 74 HA ALA 74 -5.834 9.759 -20.199 587 HB1 ALA 74 1HB ALA 74 -7.411 7.197 -19.664 588 HB2 ALA 74 2HB ALA 74 -8.088 8.843 -19.731 589 HB3 ALA 74 3HB ALA 74 -7.392 8.109 -21.196 590 H GLY 75 H GLY 75 -4.747 7.183 -18.153 591 HA2 GLY 75 1HA GLY 75 -4.023 8.383 -15.901 592 HA3 GLY 75 2HA GLY 75 -5.799 8.391 -15.684 593 H GLU 76 H GLU 76 -4.638 6.864 -13.844 594 HA GLU 76 HA GLU 76 -4.363 4.102 -14.903 595 HB2 GLU 76 1HB GLU 76 -3.937 5.283 -12.133 596 HB3 GLU 76 2HB GLU 76 -3.639 3.593 -12.574 597 HG2 GLU 76 1HG GLU 76 -1.882 4.278 -14.136 598 HG3 GLU 76 2HG GLU 76 -2.232 5.985 -13.814 599 H PHE 77 H PHE 77 -6.098 5.838 -12.321 600 HA PHE 77 HA PHE 77 -8.064 5.507 -11.255 601 HB2 PHE 77 1HB PHE 77 -8.977 4.008 -13.729 602 HB3 PHE 77 2HB PHE 77 -9.991 4.811 -12.527 603 HD1 PHE 77 HD1 PHE 77 -9.845 7.369 -12.308 604 HD2 PHE 77 HD2 PHE 77 -8.133 5.182 -15.602 605 HE1 PHE 77 HE1 PHE 77 -9.748 9.470 -13.654 606 HE2 PHE 77 HE2 PHE 77 -8.042 7.276 -16.951 607 HZ PHE 77 HZ PHE 77 -8.830 9.424 -15.976 608 H ILE 78 H ILE 78 -9.922 3.479 -11.075 609 HA ILE 78 HA ILE 78 -8.384 1.026 -10.435 610 HB ILE 78 HB ILE 78 -9.623 0.796 -8.276 611 HG12 ILE 78 1HG1 ILE 78 -10.522 3.666 -8.762 612 HG13 ILE 78 2HG1 ILE 78 -11.561 2.244 -8.873 613 HG21 ILE 78 1HG2 ILE 78 -8.072 3.429 -8.316 614 HG22 ILE 78 2HG2 ILE 78 -8.235 2.284 -6.963 615 HG23 ILE 78 3HG2 ILE 78 -7.302 1.830 -8.403 616 HD11 ILE 78 1HD1 ILE 78 -11.995 3.245 -6.744 617 HD12 ILE 78 2HD1 ILE 78 -11.027 1.793 -6.414 618 HD13 ILE 78 3HD1 ILE 78 -10.264 3.398 -6.374 619 H VAL 79 H VAL 79 -9.834 -0.848 -10.311 620 HA VAL 79 HA VAL 79 -12.263 -0.419 -12.002 621 HB VAL 79 HB VAL 79 -12.013 -2.810 -12.655 622 HG11 VAL 79 1HG1 VAL 79 -11.007 -0.996 -14.025 623 HG12 VAL 79 2HG1 VAL 79 -9.481 -1.170 -13.132 624 HG13 VAL 79 3HG1 VAL 79 -10.083 -2.510 -14.136 625 HG21 VAL 79 1HG2 VAL 79 -9.973 -4.062 -12.116 626 HG22 VAL 79 2HG2 VAL 79 -9.343 -2.712 -11.154 627 HG23 VAL 79 3HG2 VAL 79 -10.782 -3.607 -10.607 628 H THR 80 H THR 80 -11.222 -1.228 -8.879 629 HA THR 80 HA THR 80 -13.972 -1.988 -8.096 630 HB THR 80 HB THR 80 -12.924 -3.713 -6.499 631 HG1 THR 80 HG1 THR 80 -10.748 -2.951 -6.877 632 HG21 THR 80 1HG2 THR 80 -12.620 -4.385 -9.449 633 HG22 THR 80 2HG2 THR 80 -14.152 -4.430 -8.550 634 HG23 THR 80 3HG2 THR 80 -12.827 -5.536 -8.114 635 H ASP 81 H ASP 81 -14.378 -1.201 -5.998 636 HA ASP 81 HA ASP 81 -12.686 0.939 -5.042 637 HB2 ASP 81 1HB ASP 81 -15.166 0.957 -4.773 638 HB3 ASP 81 2HB ASP 81 -15.054 -0.441 -3.693 639 HXT ASP 81 H02 ASP 81 -12.005 -1.996 -2.601 Start of MODEL 3 1 H2 GLY 1 2H0 GLY 1 16.369 12.257 -12.474 2 H GLY 1 1H0 GLY 1 15.543 12.588 -13.841 3 HA2 GLY 1 1HA GLY 1 14.299 11.560 -11.347 4 HA3 GLY 1 2HA GLY 1 13.464 11.811 -12.895 5 H SER 2 H SER 2 12.896 9.536 -12.156 6 HA SER 2 HA SER 2 14.497 7.684 -13.792 7 HB2 SER 2 1HB SER 2 15.532 7.493 -11.535 8 HB3 SER 2 2HB SER 2 13.934 7.141 -10.844 9 HG SER 2 HG SER 2 15.288 5.277 -11.377 10 H MET 3 H MET 3 13.245 5.781 -14.324 11 HA MET 3 HA MET 3 10.444 5.693 -13.451 12 HB2 MET 3 1HB MET 3 9.482 5.937 -15.632 13 HB3 MET 3 2HB MET 3 10.467 7.367 -15.333 14 HG2 MET 3 1HG MET 3 11.391 4.990 -17.000 15 HG3 MET 3 2HG MET 3 10.598 6.416 -17.669 16 HE1 MET 3 1HE MET 3 14.947 5.902 -17.539 17 HE2 MET 3 2HE MET 3 13.892 4.773 -16.656 18 HE3 MET 3 3HE MET 3 13.597 5.103 -18.381 19 H LYS 4 H LYS 4 9.367 3.768 -14.419 20 HA LYS 4 HA LYS 4 11.264 1.702 -15.416 21 HB2 LYS 4 1HB LYS 4 10.205 0.032 -13.923 22 HB3 LYS 4 2HB LYS 4 11.178 1.233 -13.084 23 HG2 LYS 4 1HG LYS 4 8.440 2.146 -13.142 24 HG3 LYS 4 2HG LYS 4 8.496 0.464 -12.588 25 HD2 LYS 4 1HD LYS 4 10.375 1.179 -11.005 26 HD3 LYS 4 2HD LYS 4 9.973 2.855 -11.432 27 HE2 LYS 4 1HE LYS 4 8.799 2.326 -9.402 28 HE3 LYS 4 2HE LYS 4 7.593 2.365 -10.710 29 HZ1 LYS 4 1HZ LYS 4 8.859 -0.087 -9.606 30 HZ2 LYS 4 2HZ LYS 4 7.756 -0.061 -10.827 31 HZ3 LYS 4 3HZ LYS 4 7.312 0.408 -9.308 32 H TYR 5 H TYR 5 9.758 3.153 -17.035 33 HA TYR 5 HA TYR 5 7.809 1.178 -18.009 34 HB2 TYR 5 1HB TYR 5 6.463 2.781 -16.691 35 HB3 TYR 5 2HB TYR 5 7.143 4.117 -17.634 36 HD1 TYR 5 HD1 TYR 5 5.660 0.738 -18.465 37 HD2 TYR 5 HD2 TYR 5 5.627 4.978 -19.203 38 HE1 TYR 5 HE1 TYR 5 3.909 0.429 -20.202 39 HE2 TYR 5 HE2 TYR 5 3.850 4.654 -20.921 40 HH TYR 5 HH TYR 5 2.657 3.124 -22.159 41 H LEU 6 H LEU 6 8.022 0.966 -20.171 42 HA LEU 6 HA LEU 6 9.889 2.872 -21.511 43 HB2 LEU 6 1HB LEU 6 9.212 -0.028 -22.056 44 HB3 LEU 6 2HB LEU 6 10.303 0.943 -23.045 45 HG LEU 6 HG LEU 6 10.772 0.355 -20.106 46 HD11 LEU 6 1HD1 LEU 6 12.398 -1.308 -20.907 47 HD12 LEU 6 2HD1 LEU 6 11.876 -1.009 -22.584 48 HD13 LEU 6 3HD1 LEU 6 10.741 -1.708 -21.401 49 HD21 LEU 6 1HD2 LEU 6 11.926 2.355 -20.861 50 HD22 LEU 6 2HD2 LEU 6 12.556 1.495 -22.288 51 HD23 LEU 6 3HD2 LEU 6 13.094 1.038 -20.653 52 H ASN 7 H ASN 7 6.621 1.951 -21.550 53 HA ASN 7 HA ASN 7 4.899 2.274 -23.015 54 HB2 ASN 7 1HB ASN 7 5.946 4.630 -22.701 55 HB3 ASN 7 2HB ASN 7 6.525 4.430 -24.360 56 HD21 ASN 7 1HD2 ASN 7 3.515 5.519 -25.670 57 HD22 ASN 7 2HD2 ASN 7 5.252 5.368 -25.795 58 H VAL 8 H VAL 8 6.864 0.296 -23.867 59 HA VAL 8 HA VAL 8 6.448 0.460 -26.824 60 HB VAL 8 HB VAL 8 8.880 0.637 -26.077 61 HG11 VAL 8 1HG1 VAL 8 8.641 -0.955 -24.120 62 HG12 VAL 8 2HG1 VAL 8 8.587 -2.288 -25.293 63 HG13 VAL 8 3HG1 VAL 8 10.035 -1.266 -25.172 64 HG21 VAL 8 1HG2 VAL 8 8.241 -1.871 -27.680 65 HG22 VAL 8 2HG2 VAL 8 8.210 -0.210 -28.323 66 HG23 VAL 8 3HG2 VAL 8 9.731 -0.907 -27.736 67 H LEU 9 H LEU 9 6.018 -1.709 -27.790 68 HA LEU 9 HA LEU 9 4.944 -3.653 -25.816 69 HB2 LEU 9 1HB LEU 9 2.903 -3.854 -27.321 70 HB3 LEU 9 2HB LEU 9 2.976 -2.463 -26.255 71 HG LEU 9 HG LEU 9 4.001 -2.017 -29.013 72 HD11 LEU 9 1HD1 LEU 9 1.710 -1.728 -29.890 73 HD12 LEU 9 2HD1 LEU 9 1.055 -2.417 -28.385 74 HD13 LEU 9 3HD1 LEU 9 2.055 -3.419 -29.466 75 HD21 LEU 9 1HD2 LEU 9 2.083 -0.463 -27.212 76 HD22 LEU 9 2HD2 LEU 9 2.890 0.140 -28.679 77 HD23 LEU 9 3HD2 LEU 9 3.843 -0.239 -27.230 78 H ALA 10 H ALA 10 4.446 -5.725 -26.747 79 HA ALA 10 HA ALA 10 5.971 -6.271 -29.244 80 HB1 ALA 10 1HB ALA 10 6.393 -7.736 -26.614 81 HB2 ALA 10 2HB ALA 10 7.245 -8.012 -28.153 82 HB3 ALA 10 3HB ALA 10 7.489 -6.493 -27.266 83 H LYS 11 H LYS 11 5.454 -8.199 -30.264 84 HA LYS 11 HA LYS 11 2.774 -9.315 -29.553 85 HB2 LYS 11 1HB LYS 11 3.170 -8.472 -31.862 86 HB3 LYS 11 2HB LYS 11 4.509 -9.612 -32.047 87 HG2 LYS 11 1HG LYS 11 2.986 -11.505 -31.886 88 HG3 LYS 11 2HG LYS 11 1.630 -10.425 -31.525 89 HD2 LYS 11 1HD LYS 11 1.941 -9.340 -33.741 90 HD3 LYS 11 2HD LYS 11 3.214 -10.526 -34.110 91 HE2 LYS 11 1HE LYS 11 1.589 -12.359 -33.806 92 HE3 LYS 11 2HE LYS 11 0.325 -11.177 -33.411 93 HZ1 LYS 11 1HZ LYS 11 0.187 -11.876 -35.709 94 HZ2 LYS 11 2HZ LYS 11 1.730 -11.379 -36.013 95 HZ3 LYS 11 3HZ LYS 11 0.563 -10.271 -35.642 96 H ALA 12 H ALA 12 2.557 -11.385 -28.833 97 HA ALA 12 HA ALA 12 4.973 -12.862 -28.154 98 HB1 ALA 12 1HB ALA 12 2.011 -13.510 -28.006 99 HB2 ALA 12 2HB ALA 12 3.290 -14.619 -27.462 100 HB3 ALA 12 3HB ALA 12 3.097 -13.042 -26.676 101 H LEU 13 H LEU 13 6.008 -14.360 -29.274 102 HA LEU 13 HA LEU 13 4.982 -15.087 -31.967 103 HB2 LEU 13 1HB LEU 13 7.598 -15.683 -30.544 104 HB3 LEU 13 2HB LEU 13 7.240 -16.094 -32.216 105 HG LEU 13 HG LEU 13 7.369 -13.250 -31.142 106 HD11 LEU 13 1HD1 LEU 13 9.440 -14.873 -32.676 107 HD12 LEU 13 2HD1 LEU 13 9.548 -14.380 -30.969 108 HD13 LEU 13 3HD1 LEU 13 9.569 -13.151 -32.245 109 HD21 LEU 13 1HD2 LEU 13 7.223 -14.394 -33.966 110 HD22 LEU 13 2HD2 LEU 13 7.547 -12.689 -33.582 111 HD23 LEU 13 3HD2 LEU 13 5.988 -13.410 -33.145 112 H TYR 14 H TYR 14 5.499 -16.374 -28.768 113 HA TYR 14 HA TYR 14 4.453 -19.029 -29.654 114 HB2 TYR 14 1HB TYR 14 6.493 -18.559 -27.464 115 HB3 TYR 14 2HB TYR 14 5.918 -20.117 -28.068 116 HD1 TYR 14 HD1 TYR 14 6.644 -20.891 -30.380 117 HD2 TYR 14 HD2 TYR 14 8.229 -17.332 -28.583 118 HE1 TYR 14 HE1 TYR 14 8.541 -20.897 -32.011 119 HE2 TYR 14 HE2 TYR 14 10.125 -17.347 -30.182 120 HH TYR 14 HH TYR 14 11.121 -18.426 -31.934 121 H ASP 15 H ASP 15 3.351 -20.156 -27.803 122 HA ASP 15 HA ASP 15 1.979 -18.149 -26.089 123 HB2 ASP 15 1HB ASP 15 0.349 -20.041 -25.708 124 HB3 ASP 15 2HB ASP 15 0.433 -19.450 -27.368 125 H ASN 16 H ASN 16 1.406 -18.805 -23.883 126 HA ASN 16 HA ASN 16 3.230 -20.761 -22.616 127 HB2 ASN 16 1HB ASN 16 4.379 -18.473 -22.719 128 HB3 ASN 16 2HB ASN 16 3.089 -17.882 -21.664 129 HD21 ASN 16 1HD2 ASN 16 4.782 -18.889 -18.816 130 HD22 ASN 16 2HD2 ASN 16 3.730 -17.747 -19.641 131 H VAL 17 H VAL 17 2.560 -21.346 -20.490 132 HA VAL 17 HA VAL 17 -0.043 -20.191 -19.576 133 HB VAL 17 HB VAL 17 0.849 -23.116 -19.369 134 HG11 VAL 17 1HG1 VAL 17 -1.389 -23.484 -18.345 135 HG12 VAL 17 2HG1 VAL 17 -0.394 -22.386 -17.370 136 HG13 VAL 17 3HG1 VAL 17 -1.694 -21.729 -18.395 137 HG21 VAL 17 1HG2 VAL 17 -1.159 -23.592 -20.784 138 HG22 VAL 17 2HG2 VAL 17 -1.393 -21.838 -20.999 139 HG23 VAL 17 3HG2 VAL 17 0.066 -22.633 -21.638 140 H ALA 18 H ALA 18 0.379 -19.142 -17.716 141 HA ALA 18 HA ALA 18 2.963 -19.528 -16.424 142 HB1 ALA 18 1HB ALA 18 2.086 -17.691 -14.931 143 HB2 ALA 18 2HB ALA 18 2.122 -17.272 -16.656 144 HB3 ALA 18 3HB ALA 18 0.586 -17.709 -15.868 145 H GLU 19 H GLU 19 3.348 -20.272 -14.373 146 HA GLU 19 HA GLU 19 1.006 -21.566 -12.998 147 HB2 GLU 19 1HB GLU 19 2.510 -23.168 -12.032 148 HB3 GLU 19 2HB GLU 19 2.687 -23.189 -13.788 149 HG2 GLU 19 1HG GLU 19 4.779 -21.937 -13.636 150 HG3 GLU 19 2HG GLU 19 4.577 -21.760 -11.884 151 H SER 20 H SER 20 3.585 -19.242 -12.802 152 HA SER 20 HA SER 20 3.250 -19.010 -9.855 153 HB2 SER 20 1HB SER 20 5.173 -17.698 -11.811 154 HB3 SER 20 2HB SER 20 5.154 -17.407 -10.059 155 HG SER 20 HG SER 20 5.487 -19.956 -11.284 156 HA PRO 21 HA PRO 21 0.599 -15.555 -10.462 157 HB2 PRO 21 1HB PRO 21 0.934 -14.053 -8.213 158 HB3 PRO 21 2HB PRO 21 0.156 -15.670 -8.167 159 HG2 PRO 21 1HG PRO 21 3.024 -14.938 -7.590 160 HG3 PRO 21 2HG PRO 21 1.882 -15.889 -6.586 161 HD2 PRO 21 1HD PRO 21 3.684 -17.089 -8.211 162 HD3 PRO 21 2HD PRO 21 2.030 -17.764 -7.994 163 H ASP 22 H ASP 22 4.008 -15.092 -9.971 164 HA ASP 22 HA ASP 22 4.012 -12.247 -10.654 165 HB2 ASP 22 1HB ASP 22 6.253 -14.287 -10.387 166 HB3 ASP 22 2HB ASP 22 6.469 -12.532 -10.514 167 H GLU 23 H GLU 23 3.674 -15.118 -12.372 168 HA GLU 23 HA GLU 23 5.209 -14.233 -14.741 169 HB2 GLU 23 1HB GLU 23 5.489 -16.504 -13.641 170 HB3 GLU 23 2HB GLU 23 3.823 -16.845 -14.095 171 HG2 GLU 23 1HG GLU 23 4.525 -16.412 -16.486 172 HG3 GLU 23 2HG GLU 23 6.181 -16.374 -15.872 173 H LEU 24 H LEU 24 4.155 -14.000 -16.775 174 HA LEU 24 HA LEU 24 1.198 -13.713 -16.541 175 HB2 LEU 24 1HB LEU 24 3.305 -12.298 -17.938 176 HB3 LEU 24 2HB LEU 24 2.070 -12.838 -19.071 177 HG LEU 24 HG LEU 24 1.572 -11.124 -16.615 178 HD11 LEU 24 1HD1 LEU 24 1.215 -9.327 -18.242 179 HD12 LEU 24 2HD1 LEU 24 1.589 -10.441 -19.579 180 HD13 LEU 24 3HD1 LEU 24 2.849 -10.001 -18.399 181 HD21 LEU 24 1HD2 LEU 24 -0.310 -12.042 -18.835 182 HD22 LEU 24 2HD2 LEU 24 -0.681 -10.749 -17.668 183 HD23 LEU 24 3HD2 LEU 24 -0.435 -12.408 -17.097 184 H SER 25 H SER 25 -0.210 -14.940 -17.619 185 HA SER 25 HA SER 25 0.754 -17.012 -19.511 186 HB2 SER 25 1HB SER 25 -2.037 -16.224 -18.552 187 HB3 SER 25 2HB SER 25 -1.702 -17.519 -19.719 188 HG SER 25 HG SER 25 -1.901 -17.977 -17.293 189 H PHE 26 H PHE 26 0.486 -16.778 -21.738 190 HA PHE 26 HA PHE 26 -1.133 -14.614 -22.859 191 HB2 PHE 26 1HB PHE 26 0.775 -13.579 -24.059 192 HB3 PHE 26 2HB PHE 26 0.887 -13.330 -22.317 193 HD1 PHE 26 HD1 PHE 26 2.635 -14.346 -20.994 194 HD2 PHE 26 HD2 PHE 26 2.365 -15.110 -25.216 195 HE1 PHE 26 HE1 PHE 26 4.910 -15.333 -20.948 196 HE2 PHE 26 HE2 PHE 26 4.669 -16.061 -25.194 197 HZ PHE 26 HZ PHE 26 5.944 -16.182 -23.058 198 H ARG 27 H ARG 27 -1.007 -14.859 -25.331 199 HA ARG 27 HA ARG 27 -0.006 -17.580 -26.005 200 HB2 ARG 27 1HB ARG 27 -2.718 -16.470 -26.718 201 HB3 ARG 27 2HB ARG 27 -2.014 -17.934 -27.418 202 HG2 ARG 27 1HG ARG 27 -1.799 -18.886 -25.114 203 HG3 ARG 27 2HG ARG 27 -2.673 -17.480 -24.483 204 HD2 ARG 27 1HD ARG 27 -4.633 -18.072 -25.806 205 HD3 ARG 27 2HD ARG 27 -3.750 -19.433 -26.539 206 HE ARG 27 HE ARG 27 -3.595 -19.717 -23.730 207 HH11 ARG 27 1HH1 ARG 27 -6.105 -19.874 -26.208 208 HH12 ARG 27 2HH1 ARG 27 -7.061 -21.011 -25.297 209 HH21 ARG 27 1HH2 ARG 27 -4.861 -21.171 -22.631 210 HH22 ARG 27 2HH2 ARG 27 -6.369 -21.725 -23.303 211 H LYS 28 H LYS 28 0.452 -17.996 -28.158 212 HA LYS 28 HA LYS 28 1.895 -15.934 -29.448 213 HB2 LYS 28 1HB LYS 28 1.896 -17.442 -31.443 214 HB3 LYS 28 2HB LYS 28 2.404 -18.209 -29.948 215 HG2 LYS 28 1HG LYS 28 0.128 -19.222 -29.716 216 HG3 LYS 28 2HG LYS 28 -0.256 -18.586 -31.330 217 HD2 LYS 28 1HD LYS 28 1.584 -19.874 -32.305 218 HD3 LYS 28 2HD LYS 28 2.105 -20.398 -30.693 219 HE2 LYS 28 1HE LYS 28 0.883 -22.208 -31.709 220 HE3 LYS 28 2HE LYS 28 -0.083 -21.544 -30.377 221 HZ1 LYS 28 1HZ LYS 28 -0.476 -20.953 -33.258 222 HZ2 LYS 28 2HZ LYS 28 -1.367 -20.306 -32.031 223 HZ3 LYS 28 3HZ LYS 28 -1.436 -21.926 -32.335 224 H GLY 29 H GLY 29 1.420 -14.342 -30.763 225 HA2 GLY 29 1HA GLY 29 0.096 -13.354 -32.516 226 HA3 GLY 29 2HA GLY 29 -1.313 -14.260 -31.964 227 H ASP 30 H ASP 30 -0.607 -13.579 -29.084 228 HA ASP 30 HA ASP 30 -2.282 -11.235 -28.947 229 HB2 ASP 30 1HB ASP 30 -1.940 -13.304 -27.337 230 HB3 ASP 30 2HB ASP 30 -0.683 -12.286 -26.618 231 H ILE 31 H ILE 31 -1.744 -9.320 -27.621 232 HA ILE 31 HA ILE 31 1.053 -8.365 -28.185 233 HB ILE 31 HB ILE 31 -1.517 -6.698 -28.147 234 HG12 ILE 31 1HG1 ILE 31 -1.642 -8.239 -30.044 235 HG13 ILE 31 2HG1 ILE 31 -1.440 -6.573 -30.569 236 HG21 ILE 31 1HG2 ILE 31 -0.036 -4.985 -29.303 237 HG22 ILE 31 2HG2 ILE 31 0.414 -5.337 -27.624 238 HG23 ILE 31 3HG2 ILE 31 1.357 -6.039 -28.956 239 HD11 ILE 31 1HD1 ILE 31 -0.128 -8.144 -31.927 240 HD12 ILE 31 2HD1 ILE 31 0.923 -6.983 -31.088 241 HD13 ILE 31 3HD1 ILE 31 0.766 -8.649 -30.483 242 H MET 32 H MET 32 2.130 -7.554 -26.427 243 HA MET 32 HA MET 32 0.500 -6.651 -24.091 244 HB2 MET 32 1HB MET 32 2.153 -7.762 -22.578 245 HB3 MET 32 2HB MET 32 1.124 -8.868 -23.478 246 HG2 MET 32 1HG MET 32 3.341 -8.650 -25.134 247 HG3 MET 32 2HG MET 32 4.048 -8.568 -23.516 248 HE1 MET 32 1HE MET 32 0.772 -10.562 -24.875 249 HE2 MET 32 2HE MET 32 2.025 -10.593 -26.141 250 HE3 MET 32 3HE MET 32 1.583 -12.086 -25.285 251 H THR 33 H THR 33 1.407 -5.009 -22.866 252 HA THR 33 HA THR 33 3.432 -3.432 -24.313 253 HB THR 33 HB THR 33 2.013 -2.815 -21.686 254 HG1 THR 33 HG1 THR 33 0.614 -1.599 -23.068 255 HG21 THR 33 1HG2 THR 33 4.007 -1.404 -22.144 256 HG22 THR 33 2HG2 THR 33 2.501 -0.470 -22.263 257 HG23 THR 33 3HG2 THR 33 3.336 -0.997 -23.740 258 H VAL 34 H VAL 34 5.558 -3.276 -23.732 259 HA VAL 34 HA VAL 34 6.438 -4.954 -21.425 260 HB VAL 34 HB VAL 34 8.028 -3.543 -23.615 261 HG11 VAL 34 1HG1 VAL 34 9.974 -4.865 -22.694 262 HG12 VAL 34 2HG1 VAL 34 9.391 -3.587 -21.609 263 HG13 VAL 34 3HG1 VAL 34 8.958 -5.280 -21.292 264 HG21 VAL 34 1HG2 VAL 34 8.501 -5.788 -24.460 265 HG22 VAL 34 2HG2 VAL 34 7.613 -6.526 -23.109 266 HG23 VAL 34 3HG2 VAL 34 6.741 -5.584 -24.343 267 H LEU 35 H LEU 35 6.873 -4.090 -19.538 268 HA LEU 35 HA LEU 35 6.682 -1.154 -19.272 269 HB2 LEU 35 1HB LEU 35 6.914 -3.283 -17.120 270 HB3 LEU 35 2HB LEU 35 6.417 -1.608 -16.906 271 HG LEU 35 HG LEU 35 4.866 -3.802 -18.344 272 HD11 LEU 35 1HD1 LEU 35 4.370 -2.331 -15.729 273 HD12 LEU 35 2HD1 LEU 35 4.891 -4.018 -15.911 274 HD13 LEU 35 3HD1 LEU 35 3.286 -3.529 -16.474 275 HD21 LEU 35 1HD2 LEU 35 4.384 -1.675 -19.435 276 HD22 LEU 35 2HD2 LEU 35 4.085 -0.902 -17.857 277 HD23 LEU 35 3HD2 LEU 35 3.002 -2.179 -18.452 278 H GLU 36 H GLU 36 8.873 -3.837 -18.323 279 HA GLU 36 HA GLU 36 11.198 -2.078 -18.663 280 HB2 GLU 36 1HB GLU 36 12.097 -2.411 -16.446 281 HB3 GLU 36 2HB GLU 36 10.529 -1.607 -16.325 282 HG2 GLU 36 1HG GLU 36 9.472 -3.725 -15.706 283 HG3 GLU 36 2HG GLU 36 11.023 -4.561 -15.867 284 H ARG 37 H ARG 37 13.241 -3.540 -18.101 285 HA ARG 37 HA ARG 37 12.642 -6.314 -19.063 286 HB2 ARG 37 1HB ARG 37 14.959 -4.544 -19.881 287 HB3 ARG 37 2HB ARG 37 14.670 -6.196 -20.428 288 HG2 ARG 37 1HG ARG 37 12.543 -5.410 -21.515 289 HG3 ARG 37 2HG ARG 37 12.985 -3.749 -21.065 290 HD2 ARG 37 1HD ARG 37 14.596 -5.632 -22.820 291 HD3 ARG 37 2HD ARG 37 13.677 -4.212 -23.365 292 HE ARG 37 HE ARG 37 15.495 -3.370 -21.365 293 HH11 ARG 37 1HH1 ARG 37 15.692 -4.660 -24.638 294 HH12 ARG 37 2HH1 ARG 37 17.223 -3.885 -24.949 295 HH21 ARG 37 1HH2 ARG 37 17.437 -2.419 -21.823 296 HH22 ARG 37 2HH2 ARG 37 18.190 -2.635 -23.378 297 H ASP 38 H ASP 38 14.203 -7.877 -18.523 298 HA ASP 38 HA ASP 38 15.618 -9.004 -17.183 299 HB2 ASP 38 1HB ASP 38 17.070 -6.368 -16.856 300 HB3 ASP 38 2HB ASP 38 17.750 -7.999 -16.712 301 H THR 39 H THR 39 13.267 -7.918 -16.173 302 HA THR 39 HA THR 39 13.527 -6.520 -13.709 303 HB THR 39 HB THR 39 11.514 -6.493 -15.174 304 HG1 THR 39 HG1 THR 39 10.911 -5.946 -13.165 305 HG21 THR 39 1HG2 THR 39 11.099 -9.378 -14.267 306 HG22 THR 39 2HG2 THR 39 11.516 -8.860 -15.920 307 HG23 THR 39 3HG2 THR 39 9.959 -8.417 -15.207 308 H GLN 40 H GLN 40 13.743 -9.930 -14.374 309 HA GLN 40 HA GLN 40 13.168 -10.589 -11.533 310 HB2 GLN 40 1HB GLN 40 12.201 -11.783 -13.663 311 HB3 GLN 40 2HB GLN 40 13.776 -12.563 -13.740 312 HG2 GLN 40 1HG GLN 40 12.296 -14.065 -12.608 313 HG3 GLN 40 2HG GLN 40 13.383 -13.416 -11.379 314 HE21 GLN 40 1HE2 GLN 40 10.157 -13.286 -9.753 315 HE22 GLN 40 2HE2 GLN 40 11.433 -14.409 -10.157 316 H GLY 41 H GLY 41 15.734 -9.478 -13.201 317 HA2 GLY 41 1HA GLY 41 18.012 -9.557 -12.673 318 HA3 GLY 41 2HA GLY 41 17.702 -10.878 -11.521 319 H LEU 42 H LEU 42 16.020 -11.745 -14.132 320 HA LEU 42 HA LEU 42 18.165 -13.493 -15.184 321 HB2 LEU 42 1HB LEU 42 15.162 -13.460 -15.663 322 HB3 LEU 42 2HB LEU 42 16.284 -14.652 -16.308 323 HG LEU 42 HG LEU 42 15.660 -14.262 -13.359 324 HD11 LEU 42 1HD1 LEU 42 14.725 -16.391 -15.331 325 HD12 LEU 42 2HD1 LEU 42 13.725 -15.080 -14.667 326 HD13 LEU 42 3HD1 LEU 42 14.359 -16.340 -13.590 327 HD21 LEU 42 1HD2 LEU 42 16.780 -16.472 -13.106 328 HD22 LEU 42 2HD2 LEU 42 17.891 -15.213 -13.675 329 HD23 LEU 42 3HD2 LEU 42 17.248 -16.415 -14.823 330 H ASP 43 H ASP 43 19.129 -12.964 -17.026 331 HA ASP 43 HA ASP 43 18.524 -10.596 -18.480 332 HB2 ASP 43 1HB ASP 43 20.746 -11.777 -18.390 333 HB3 ASP 43 2HB ASP 43 20.068 -13.053 -19.412 334 H GLY 44 H GLY 44 17.217 -10.191 -20.152 335 HA2 GLY 44 1HA GLY 44 15.988 -10.674 -22.067 336 HA3 GLY 44 2HA GLY 44 16.309 -12.392 -21.852 337 H TRP 45 H TRP 45 15.056 -11.337 -18.909 338 HA TRP 45 HA TRP 45 12.308 -12.188 -19.770 339 HB2 TRP 45 1HB TRP 45 13.742 -12.091 -17.115 340 HB3 TRP 45 2HB TRP 45 11.977 -12.185 -17.209 341 HD1 TRP 45 HD1 TRP 45 15.066 -14.215 -18.390 342 HE1 TRP 45 HE1 TRP 45 14.448 -16.676 -18.563 343 HE3 TRP 45 HE3 TRP 45 10.077 -13.757 -17.365 344 HZ2 TRP 45 HZ2 TRP 45 12.083 -18.265 -18.277 345 HZ3 TRP 45 HZ3 TRP 45 8.660 -15.819 -17.318 346 HH2 TRP 45 HH2 TRP 45 9.670 -18.053 -17.769 347 H TRP 46 H TRP 46 10.730 -10.670 -20.005 348 HA TRP 46 HA TRP 46 11.407 -7.949 -18.977 349 HB2 TRP 46 1HB TRP 46 9.698 -8.741 -21.345 350 HB3 TRP 46 2HB TRP 46 10.129 -7.098 -20.866 351 HD1 TRP 46 HD1 TRP 46 13.332 -8.493 -20.373 352 HE1 TRP 46 HE1 TRP 46 14.850 -8.576 -22.400 353 HE3 TRP 46 HE3 TRP 46 9.739 -7.825 -23.948 354 HZ2 TRP 46 HZ2 TRP 46 14.557 -8.410 -25.233 355 HZ3 TRP 46 HZ3 TRP 46 10.431 -7.824 -26.353 356 HH2 TRP 46 HH2 TRP 46 12.829 -8.123 -26.978 357 H LEU 47 H LEU 47 9.845 -6.724 -17.959 358 HA LEU 47 HA LEU 47 7.574 -8.269 -16.866 359 HB2 LEU 47 1HB LEU 47 8.958 -6.566 -15.531 360 HB3 LEU 47 2HB LEU 47 8.251 -5.325 -16.544 361 HG LEU 47 HG LEU 47 5.983 -6.014 -15.704 362 HD11 LEU 47 1HD1 LEU 47 7.634 -7.657 -13.732 363 HD12 LEU 47 2HD1 LEU 47 6.523 -8.305 -14.958 364 HD13 LEU 47 3HD1 LEU 47 5.887 -7.340 -13.617 365 HD21 LEU 47 1HD2 LEU 47 8.046 -5.155 -13.629 366 HD22 LEU 47 2HD2 LEU 47 6.286 -4.915 -13.511 367 HD23 LEU 47 3HD2 LEU 47 7.208 -4.089 -14.781 368 H CYS 48 H CYS 48 5.731 -8.389 -18.051 369 HA CYS 48 HA CYS 48 5.185 -6.123 -19.931 370 HB2 CYS 48 1HB CYS 48 4.446 -9.049 -20.232 371 HB3 CYS 48 2HB CYS 48 4.106 -7.753 -21.389 372 HG CYS 48 HG CYS 48 7.024 -8.887 -20.339 373 H SER 49 H SER 49 2.830 -5.822 -20.373 374 HA SER 49 HA SER 49 1.179 -6.702 -18.045 375 HB2 SER 49 1HB SER 49 -0.026 -4.573 -18.183 376 HB3 SER 49 2HB SER 49 1.697 -4.326 -17.841 377 HG SER 49 HG SER 49 0.955 -2.902 -19.446 378 H LEU 50 H LEU 50 -0.787 -7.480 -18.415 379 HA LEU 50 HA LEU 50 -2.112 -7.297 -21.024 380 HB2 LEU 50 1HB LEU 50 -0.328 -9.091 -21.292 381 HB3 LEU 50 2HB LEU 50 -1.115 -9.979 -19.996 382 HG LEU 50 HG LEU 50 -3.160 -10.161 -21.412 383 HD11 LEU 50 1HD1 LEU 50 -1.375 -8.921 -23.537 384 HD12 LEU 50 2HD1 LEU 50 -2.881 -8.240 -22.893 385 HD13 LEU 50 3HD1 LEU 50 -2.924 -9.729 -23.855 386 HD21 LEU 50 1HD2 LEU 50 -0.578 -11.197 -22.631 387 HD22 LEU 50 2HD2 LEU 50 -2.207 -11.848 -22.929 388 HD23 LEU 50 3HD2 LEU 50 -1.496 -11.956 -21.306 389 H HIS 51 H HIS 51 -4.311 -7.839 -20.744 390 HA HIS 51 HA HIS 51 -6.289 -8.022 -19.615 391 HB2 HIS 51 1HB HIS 51 -4.885 -9.865 -17.657 392 HB3 HIS 51 2HB HIS 51 -6.608 -9.790 -18.034 393 HD1 HIS 51 HD1 HIS 51 -6.990 -10.273 -20.871 394 HD2 HIS 51 HD2 HIS 51 -3.742 -11.950 -18.869 395 HE1 HIS 51 HE1 HIS 51 -6.202 -12.235 -22.259 396 H GLY 52 H GLY 52 -4.219 -5.984 -18.610 397 HA2 GLY 52 1HA GLY 52 -4.448 -4.265 -17.050 398 HA3 GLY 52 2HA GLY 52 -5.799 -5.134 -16.304 399 H ARG 53 H ARG 53 -3.273 -7.269 -16.660 400 HA ARG 53 HA ARG 53 -2.290 -6.800 -13.864 401 HB2 ARG 53 1HB ARG 53 -2.415 -9.363 -15.514 402 HB3 ARG 53 2HB ARG 53 -1.785 -9.221 -13.868 403 HG2 ARG 53 1HG ARG 53 -4.067 -8.505 -13.124 404 HG3 ARG 53 2HG ARG 53 -4.657 -8.854 -14.766 405 HD2 ARG 53 1HD ARG 53 -3.793 -11.180 -14.534 406 HD3 ARG 53 2HD ARG 53 -3.326 -10.808 -12.862 407 HE ARG 53 HE ARG 53 -6.087 -10.176 -13.275 408 HH11 ARG 53 1HH1 ARG 53 -3.976 -12.978 -12.862 409 HH12 ARG 53 2HH1 ARG 53 -5.262 -13.973 -12.232 410 HH21 ARG 53 1HH2 ARG 53 -7.677 -11.502 -12.463 411 HH22 ARG 53 2HH2 ARG 53 -7.317 -13.144 -12.003 412 H GLN 54 H GLN 54 0.041 -7.654 -13.662 413 HA GLN 54 HA GLN 54 1.506 -7.454 -16.220 414 HB2 GLN 54 1HB GLN 54 3.183 -5.976 -15.280 415 HB3 GLN 54 2HB GLN 54 1.597 -5.207 -15.181 416 HG2 GLN 54 1HG GLN 54 1.500 -6.043 -12.765 417 HG3 GLN 54 2HG GLN 54 3.221 -6.419 -12.940 418 HE21 GLN 54 1HE2 GLN 54 1.914 -2.598 -12.457 419 HE22 GLN 54 2HE2 GLN 54 0.808 -3.939 -12.630 420 H GLY 55 H GLY 55 3.492 -8.621 -16.176 421 HA2 GLY 55 1HA GLY 55 4.343 -10.076 -13.846 422 HA3 GLY 55 2HA GLY 55 3.311 -11.096 -14.873 423 H ILE 56 H ILE 56 5.929 -11.829 -14.515 424 HA ILE 56 HA ILE 56 7.589 -10.614 -16.566 425 HB ILE 56 HB ILE 56 9.322 -12.154 -15.890 426 HG12 ILE 56 1HG1 ILE 56 7.242 -13.600 -14.202 427 HG13 ILE 56 2HG1 ILE 56 7.892 -14.206 -15.723 428 HG21 ILE 56 1HG2 ILE 56 7.836 -11.411 -13.327 429 HG22 ILE 56 2HG2 ILE 56 9.587 -11.450 -13.617 430 HG23 ILE 56 3HG2 ILE 56 8.599 -10.193 -14.374 431 HD11 ILE 56 1HD1 ILE 56 9.036 -15.332 -13.940 432 HD12 ILE 56 2HD1 ILE 56 10.192 -14.190 -14.665 433 HD13 ILE 56 3HD1 ILE 56 9.401 -13.802 -13.116 434 H VAL 57 H VAL 57 8.300 -11.406 -18.447 435 HA VAL 57 HA VAL 57 7.017 -13.864 -19.557 436 HB VAL 57 HB VAL 57 7.090 -11.055 -20.782 437 HG11 VAL 57 1HG1 VAL 57 6.433 -13.714 -22.050 438 HG12 VAL 57 2HG1 VAL 57 5.864 -12.174 -22.712 439 HG13 VAL 57 3HG1 VAL 57 7.603 -12.493 -22.583 440 HG21 VAL 57 1HG2 VAL 57 4.774 -12.869 -20.011 441 HG22 VAL 57 2HG2 VAL 57 5.217 -11.313 -19.272 442 HG23 VAL 57 3HG2 VAL 57 4.608 -11.358 -20.939 443 HA PRO 58 HA PRO 58 11.302 -13.939 -20.831 444 HB2 PRO 58 1HB PRO 58 11.299 -15.996 -22.646 445 HB3 PRO 58 2HB PRO 58 11.255 -16.265 -20.873 446 HG2 PRO 58 1HG PRO 58 8.984 -16.246 -22.838 447 HG3 PRO 58 2HG PRO 58 9.355 -17.438 -21.557 448 HD2 PRO 58 1HD PRO 58 7.513 -15.477 -21.249 449 HD3 PRO 58 2HD PRO 58 8.525 -16.059 -19.888 450 H GLY 59 H GLY 59 11.945 -12.286 -22.096 451 HA2 GLY 59 1HA GLY 59 10.310 -11.167 -24.131 452 HA3 GLY 59 2HA GLY 59 11.982 -10.744 -23.766 453 H ASN 60 H ASN 60 12.753 -13.629 -24.256 454 HA ASN 60 HA ASN 60 13.420 -13.346 -27.037 455 HB2 ASN 60 1HB ASN 60 13.560 -15.709 -25.132 456 HB3 ASN 60 2HB ASN 60 14.184 -15.739 -26.790 457 HD21 ASN 60 1HD2 ASN 60 16.663 -14.561 -24.036 458 HD22 ASN 60 2HD2 ASN 60 15.360 -15.714 -23.888 459 H ARG 61 H ARG 61 10.518 -14.424 -25.495 460 HA ARG 61 HA ARG 61 9.694 -15.957 -27.917 461 HB2 ARG 61 1HB ARG 61 8.246 -15.430 -25.294 462 HB3 ARG 61 2HB ARG 61 7.598 -16.369 -26.635 463 HG2 ARG 61 1HG ARG 61 9.589 -17.933 -26.371 464 HG3 ARG 61 2HG ARG 61 9.924 -17.084 -24.844 465 HD2 ARG 61 1HD ARG 61 7.466 -17.533 -24.240 466 HD3 ARG 61 2HD ARG 61 7.427 -18.640 -25.620 467 HE ARG 61 HE ARG 61 9.626 -19.308 -23.931 468 HH11 ARG 61 1HH1 ARG 61 6.094 -19.533 -23.982 469 HH12 ARG 61 2HH1 ARG 61 6.075 -20.812 -22.799 470 HH21 ARG 61 1HH2 ARG 61 9.497 -20.995 -22.461 471 HH22 ARG 61 2HH2 ARG 61 7.945 -21.638 -21.996 472 H LEU 62 H LEU 62 10.011 -12.790 -27.293 473 HA LEU 62 HA LEU 62 7.332 -12.067 -28.424 474 HB2 LEU 62 1HB LEU 62 9.185 -10.400 -26.699 475 HB3 LEU 62 2HB LEU 62 7.619 -9.920 -27.311 476 HG LEU 62 HG LEU 62 8.103 -12.038 -25.205 477 HD11 LEU 62 1HD1 LEU 62 7.109 -10.353 -23.680 478 HD12 LEU 62 2HD1 LEU 62 6.979 -9.206 -25.022 479 HD13 LEU 62 3HD1 LEU 62 8.576 -9.730 -24.449 480 HD21 LEU 62 1HD2 LEU 62 6.101 -12.605 -26.409 481 HD22 LEU 62 2HD2 LEU 62 5.540 -10.913 -26.396 482 HD23 LEU 62 3HD2 LEU 62 5.612 -11.849 -24.889 483 H LYS 63 H LYS 63 7.240 -10.356 -29.938 484 HA LYS 63 HA LYS 63 9.898 -9.464 -31.016 485 HB2 LYS 63 1HB LYS 63 8.709 -11.044 -32.549 486 HB3 LYS 63 2HB LYS 63 7.359 -9.906 -32.630 487 HG2 LYS 63 1HG LYS 63 8.871 -8.202 -33.596 488 HG3 LYS 63 2HG LYS 63 10.220 -9.350 -33.491 489 HD2 LYS 63 1HD LYS 63 8.997 -10.899 -35.004 490 HD3 LYS 63 2HD LYS 63 7.679 -9.716 -35.125 491 HE2 LYS 63 1HE LYS 63 9.075 -9.474 -37.079 492 HE3 LYS 63 2HE LYS 63 9.319 -8.052 -36.047 493 HZ1 LYS 63 1HZ LYS 63 11.138 -10.396 -36.196 494 HZ2 LYS 63 2HZ LYS 63 11.367 -9.071 -35.240 495 HZ3 LYS 63 3HZ LYS 63 11.416 -8.922 -36.882 496 H ILE 64 H ILE 64 10.173 -7.407 -30.624 497 HA ILE 64 HA ILE 64 8.130 -5.691 -29.600 498 HB ILE 64 HB ILE 64 10.979 -5.199 -30.595 499 HG12 ILE 64 1HG1 ILE 64 9.797 -5.268 -27.786 500 HG13 ILE 64 2HG1 ILE 64 10.602 -6.638 -28.554 501 HG21 ILE 64 1HG2 ILE 64 9.056 -3.254 -29.256 502 HG22 ILE 64 2HG2 ILE 64 10.813 -2.995 -29.347 503 HG23 ILE 64 3HG2 ILE 64 9.864 -3.082 -30.829 504 HD11 ILE 64 1HD1 ILE 64 11.877 -3.990 -27.759 505 HD12 ILE 64 2HD1 ILE 64 12.171 -5.590 -27.059 506 HD13 ILE 64 3HD1 ILE 64 12.700 -5.245 -28.721 507 H LEU 65 H LEU 65 6.872 -4.142 -30.510 508 HA LEU 65 HA LEU 65 6.779 -3.941 -33.457 509 HB2 LEU 65 1HB LEU 65 5.022 -2.903 -31.188 510 HB3 LEU 65 2HB LEU 65 4.877 -2.324 -32.842 511 HG LEU 65 HG LEU 65 4.461 -4.776 -33.511 512 HD11 LEU 65 1HD1 LEU 65 3.915 -4.948 -30.520 513 HD12 LEU 65 2HD1 LEU 65 5.079 -5.914 -31.457 514 HD13 LEU 65 3HD1 LEU 65 3.338 -6.121 -31.726 515 HD21 LEU 65 1HD2 LEU 65 2.056 -4.529 -32.988 516 HD22 LEU 65 2HD2 LEU 65 2.768 -3.008 -33.564 517 HD23 LEU 65 3HD2 LEU 65 2.445 -3.236 -31.833 518 H VAL 66 H VAL 66 7.239 -1.996 -34.395 519 HA VAL 66 HA VAL 66 9.582 -0.816 -33.642 520 HB VAL 66 HB VAL 66 7.442 0.586 -35.307 521 HG11 VAL 66 1HG1 VAL 66 9.400 1.636 -36.442 522 HG12 VAL 66 2HG1 VAL 66 9.312 2.082 -34.730 523 HG13 VAL 66 3HG1 VAL 66 10.489 0.857 -35.272 524 HG21 VAL 66 1HG2 VAL 66 9.542 -1.495 -36.083 525 HG22 VAL 66 2HG2 VAL 66 7.772 -1.646 -36.217 526 HG23 VAL 66 3HG2 VAL 66 8.639 -0.503 -37.250 527 H GLY 67 H GLY 67 10.122 0.160 -31.873 528 HA2 GLY 67 1HA GLY 67 9.360 2.789 -31.187 529 HA3 GLY 67 2HA GLY 67 8.397 1.668 -30.194 530 H MET 68 H MET 68 11.715 1.252 -31.448 531 HA MET 68 HA MET 68 12.534 0.077 -28.958 532 HB2 MET 68 1HB MET 68 13.478 -0.531 -31.179 533 HB3 MET 68 2HB MET 68 14.234 1.063 -31.280 534 HG2 MET 68 1HG MET 68 15.545 0.551 -29.232 535 HG3 MET 68 2HG MET 68 14.828 -1.069 -29.193 536 HE1 MET 68 1HE MET 68 15.506 -3.048 -30.755 537 HE2 MET 68 2HE MET 68 14.834 -2.176 -32.155 538 HE3 MET 68 3HE MET 68 16.468 -2.871 -32.242 539 H TYR 69 H TYR 69 12.826 1.135 -27.169 540 HA TYR 69 HA TYR 69 13.437 2.690 -25.641 541 HB2 TYR 69 1HB TYR 69 15.666 1.966 -26.931 542 HB3 TYR 69 2HB TYR 69 15.698 3.678 -27.340 543 HD1 TYR 69 HD1 TYR 69 17.652 1.963 -25.558 544 HD2 TYR 69 HD2 TYR 69 14.394 4.619 -24.587 545 HE1 TYR 69 HE1 TYR 69 18.676 2.427 -23.328 546 HE2 TYR 69 HE2 TYR 69 15.421 5.050 -22.365 547 HH TYR 69 HH TYR 69 18.483 3.538 -21.338 548 H ASP 70 H ASP 70 11.359 3.584 -27.161 549 HA ASP 70 HA ASP 70 11.716 6.181 -28.296 550 HB2 ASP 70 1HB ASP 70 9.658 4.766 -28.532 551 HB3 ASP 70 2HB ASP 70 9.296 5.073 -26.824 552 H LYS 71 H LYS 71 11.717 8.206 -27.423 553 HA LYS 71 HA LYS 71 11.366 8.542 -24.494 554 HB2 LYS 71 1HB LYS 71 13.908 9.212 -26.029 555 HB3 LYS 71 2HB LYS 71 13.507 9.905 -24.456 556 HG2 LYS 71 1HG LYS 71 13.546 7.658 -23.436 557 HG3 LYS 71 2HG LYS 71 13.913 6.949 -25.015 558 HD2 LYS 71 1HD LYS 71 15.986 7.106 -23.876 559 HD3 LYS 71 2HD LYS 71 15.989 8.397 -25.089 560 HE2 LYS 71 1HE LYS 71 15.330 10.032 -23.334 561 HE3 LYS 71 2HE LYS 71 15.331 8.728 -22.127 562 HZ1 LYS 71 1HZ LYS 71 17.688 8.411 -22.573 563 HZ2 LYS 71 2HZ LYS 71 17.401 9.967 -22.104 564 HZ3 LYS 71 3HZ LYS 71 17.682 9.623 -23.691 565 H LYS 72 H LYS 72 10.987 10.729 -23.921 566 HA LYS 72 HA LYS 72 9.947 12.434 -26.055 567 HB2 LYS 72 1HB LYS 72 10.315 12.672 -23.062 568 HB3 LYS 72 2HB LYS 72 10.139 14.145 -24.014 569 HG2 LYS 72 1HG LYS 72 7.980 13.613 -23.206 570 HG3 LYS 72 2HG LYS 72 7.981 13.244 -24.936 571 HD2 LYS 72 1HD LYS 72 8.292 10.835 -24.419 572 HD3 LYS 72 2HD LYS 72 8.283 11.208 -22.685 573 HE2 LYS 72 1HE LYS 72 5.997 11.777 -24.619 574 HE3 LYS 72 2HE LYS 72 6.086 10.370 -23.542 575 HZ1 LYS 72 1HZ LYS 72 4.751 12.142 -22.581 576 HZ2 LYS 72 2HZ LYS 72 6.012 13.200 -22.647 577 HZ3 LYS 72 3HZ LYS 72 6.088 11.889 -21.651 578 HA PRO 73 HA PRO 73 13.937 14.054 -26.952 579 HB2 PRO 73 1HB PRO 73 13.400 16.396 -28.206 580 HB3 PRO 73 2HB PRO 73 12.903 14.824 -28.910 581 HG2 PRO 73 1HG PRO 73 11.277 16.741 -27.249 582 HG3 PRO 73 2HG PRO 73 10.885 16.029 -28.848 583 HD2 PRO 73 1HD PRO 73 9.947 14.958 -26.541 584 HD3 PRO 73 2HD PRO 73 10.431 13.921 -27.929 585 H ALA 74 H ALA 74 12.022 15.478 -24.563 586 HA ALA 74 HA ALA 74 14.297 16.985 -23.486 587 HB1 ALA 74 1HB ALA 74 12.930 19.034 -23.139 588 HB2 ALA 74 2HB ALA 74 13.104 18.689 -24.873 589 HB3 ALA 74 3HB ALA 74 11.582 18.297 -24.036 590 H GLY 75 H GLY 75 13.613 17.736 -21.197 591 HA2 GLY 75 1HA GLY 75 11.386 16.207 -20.040 592 HA3 GLY 75 2HA GLY 75 13.019 15.755 -19.494 593 H GLU 76 H GLU 76 11.635 16.636 -17.480 594 HA GLU 76 HA GLU 76 11.556 19.531 -17.241 595 HB2 GLU 76 1HB GLU 76 11.276 17.277 -15.218 596 HB3 GLU 76 2HB GLU 76 10.959 18.985 -14.867 597 HG2 GLU 76 1HG GLU 76 9.098 19.027 -16.415 598 HG3 GLU 76 2HG GLU 76 9.506 17.420 -17.032 599 H PHE 77 H PHE 77 12.764 20.684 -15.505 600 HA PHE 77 HA PHE 77 15.608 19.959 -15.631 601 HB2 PHE 77 1HB PHE 77 14.092 22.312 -14.444 602 HB3 PHE 77 2HB PHE 77 15.845 22.110 -14.310 603 HD1 PHE 77 HD1 PHE 77 13.058 22.866 -16.624 604 HD2 PHE 77 HD2 PHE 77 17.316 22.402 -16.221 605 HE1 PHE 77 HE1 PHE 77 13.380 23.961 -18.839 606 HE2 PHE 77 HE2 PHE 77 17.652 23.508 -18.426 607 HZ PHE 77 HZ PHE 77 15.682 24.285 -19.745 608 H ILE 78 H ILE 78 16.844 19.232 -13.958 609 HA ILE 78 HA ILE 78 15.425 18.342 -11.540 610 HB ILE 78 HB ILE 78 17.150 16.919 -12.797 611 HG12 ILE 78 1HG1 ILE 78 17.721 17.394 -9.858 612 HG13 ILE 78 2HG1 ILE 78 16.289 16.563 -10.464 613 HG21 ILE 78 1HG2 ILE 78 19.534 17.301 -12.432 614 HG22 ILE 78 2HG2 ILE 78 18.847 18.779 -13.124 615 HG23 ILE 78 3HG2 ILE 78 19.210 18.701 -11.390 616 HD11 ILE 78 1HD1 ILE 78 19.177 15.648 -10.807 617 HD12 ILE 78 2HD1 ILE 78 17.939 14.919 -9.762 618 HD13 ILE 78 3HD1 ILE 78 17.762 14.843 -11.530 619 H VAL 79 H VAL 79 15.836 19.190 -9.467 620 HA VAL 79 HA VAL 79 16.694 21.988 -9.519 621 HB VAL 79 HB VAL 79 14.611 21.003 -8.340 622 HG11 VAL 79 1HG1 VAL 79 16.631 20.367 -6.145 623 HG12 VAL 79 2HG1 VAL 79 14.866 20.187 -6.063 624 HG13 VAL 79 3HG1 VAL 79 15.809 19.154 -7.157 625 HG21 VAL 79 1HG2 VAL 79 14.649 22.697 -6.584 626 HG22 VAL 79 2HG2 VAL 79 16.416 22.840 -6.716 627 HG23 VAL 79 3HG2 VAL 79 15.378 23.340 -8.070 628 H THR 80 H THR 80 18.327 19.115 -9.143 629 HA THR 80 HA THR 80 19.973 19.571 -6.876 630 HB THR 80 HB THR 80 20.703 18.063 -9.433 631 HG1 THR 80 HG1 THR 80 19.748 16.296 -8.355 632 HG21 THR 80 1HG2 THR 80 21.596 17.747 -6.536 633 HG22 THR 80 2HG2 THR 80 22.598 18.319 -7.895 634 HG23 THR 80 3HG2 THR 80 22.012 16.643 -7.869 635 H ASP 81 H ASP 81 20.412 20.412 -10.324 636 HA ASP 81 HA ASP 81 22.369 22.470 -9.673 637 HB2 ASP 81 1HB ASP 81 24.187 21.544 -11.011 638 HB3 ASP 81 2HB ASP 81 23.781 20.375 -9.756 639 HXT ASP 81 H02 ASP 81 21.741 23.694 -12.740 Start of MODEL 4 1 H2 GLY 1 2H0 GLY 1 10.361 7.606 -25.098 2 H GLY 1 1H0 GLY 1 11.255 7.982 -23.787 3 HA2 GLY 1 1HA GLY 1 9.306 5.741 -23.968 4 HA3 GLY 1 2HA GLY 1 10.302 6.088 -22.542 5 H SER 2 H SER 2 8.075 6.032 -21.585 6 HA SER 2 HA SER 2 7.118 8.859 -21.468 7 HB2 SER 2 1HB SER 2 5.276 6.460 -21.781 8 HB3 SER 2 2HB SER 2 4.770 8.144 -21.523 9 HG SER 2 HG SER 2 6.425 8.195 -23.557 10 H MET 3 H MET 3 6.776 9.533 -19.460 11 HA MET 3 HA MET 3 6.878 9.536 -17.171 12 HB2 MET 3 1HB MET 3 5.149 7.061 -17.482 13 HB3 MET 3 2HB MET 3 5.298 8.051 -16.022 14 HG2 MET 3 1HG MET 3 4.398 9.999 -17.249 15 HG3 MET 3 2HG MET 3 4.201 8.995 -18.694 16 HE1 MET 3 1HE MET 3 2.285 7.320 -19.125 17 HE2 MET 3 2HE MET 3 3.013 6.262 -17.895 18 HE3 MET 3 3HE MET 3 1.272 6.620 -17.844 19 H LYS 4 H LYS 4 9.068 8.293 -18.423 20 HA LYS 4 HA LYS 4 10.986 7.198 -17.939 21 HB2 LYS 4 1HB LYS 4 9.881 6.784 -15.148 22 HB3 LYS 4 2HB LYS 4 11.558 6.591 -15.655 23 HG2 LYS 4 1HG LYS 4 11.670 8.995 -16.214 24 HG3 LYS 4 2HG LYS 4 9.992 9.190 -15.659 25 HD2 LYS 4 1HD LYS 4 10.649 8.345 -13.423 26 HD3 LYS 4 2HD LYS 4 12.333 8.224 -13.981 27 HE2 LYS 4 1HE LYS 4 12.350 10.661 -14.432 28 HE3 LYS 4 2HE LYS 4 10.671 10.773 -13.854 29 HZ1 LYS 4 1HZ LYS 4 11.431 9.974 -11.694 30 HZ2 LYS 4 2HZ LYS 4 12.250 11.345 -12.110 31 HZ3 LYS 4 3HZ LYS 4 12.988 9.873 -12.232 32 H TYR 5 H TYR 5 8.174 5.531 -18.249 33 HA TYR 5 HA TYR 5 9.397 2.874 -17.701 34 HB2 TYR 5 1HB TYR 5 6.637 3.875 -18.411 35 HB3 TYR 5 2HB TYR 5 7.087 2.203 -18.765 36 HD1 TYR 5 HD1 TYR 5 6.459 4.627 -16.022 37 HD2 TYR 5 HD2 TYR 5 7.498 0.574 -17.010 38 HE1 TYR 5 HE1 TYR 5 6.004 3.926 -13.671 39 HE2 TYR 5 HE2 TYR 5 7.043 -0.121 -14.675 40 HH TYR 5 HH TYR 5 5.991 2.194 -12.166 41 H LEU 6 H LEU 6 9.410 1.268 -19.404 42 HA LEU 6 HA LEU 6 10.682 2.171 -21.790 43 HB2 LEU 6 1HB LEU 6 9.406 -0.392 -20.859 44 HB3 LEU 6 2HB LEU 6 9.798 -0.234 -22.551 45 HG LEU 6 HG LEU 6 11.456 -1.513 -21.256 46 HD11 LEU 6 1HD1 LEU 6 12.036 -0.405 -23.379 47 HD12 LEU 6 2HD1 LEU 6 13.421 -0.469 -22.268 48 HD13 LEU 6 3HD1 LEU 6 12.529 1.054 -22.485 49 HD21 LEU 6 1HD2 LEU 6 12.258 1.135 -19.987 50 HD22 LEU 6 2HD2 LEU 6 13.033 -0.449 -19.764 51 HD23 LEU 6 3HD2 LEU 6 11.398 -0.170 -19.144 52 H ASN 7 H ASN 7 7.364 1.063 -21.165 53 HA ASN 7 HA ASN 7 5.404 1.342 -22.279 54 HB2 ASN 7 1HB ASN 7 6.128 3.697 -21.542 55 HB3 ASN 7 2HB ASN 7 6.493 3.988 -23.249 56 HD21 ASN 7 1HD2 ASN 7 3.204 4.915 -23.825 57 HD22 ASN 7 2HD2 ASN 7 4.911 5.177 -24.089 58 H VAL 8 H VAL 8 7.198 -0.182 -23.847 59 HA VAL 8 HA VAL 8 6.289 0.564 -26.597 60 HB VAL 8 HB VAL 8 8.166 -0.874 -27.400 61 HG11 VAL 8 1HG1 VAL 8 8.397 1.589 -27.326 62 HG12 VAL 8 2HG1 VAL 8 9.111 1.464 -25.705 63 HG13 VAL 8 3HG1 VAL 8 9.955 0.767 -27.106 64 HG21 VAL 8 1HG2 VAL 8 10.030 -1.470 -25.918 65 HG22 VAL 8 2HG2 VAL 8 9.169 -0.785 -24.530 66 HG23 VAL 8 3HG2 VAL 8 8.529 -2.226 -25.353 67 H LEU 9 H LEU 9 5.869 -1.577 -27.878 68 HA LEU 9 HA LEU 9 4.883 -3.644 -25.969 69 HB2 LEU 9 1HB LEU 9 2.899 -3.862 -27.607 70 HB3 LEU 9 2HB LEU 9 2.863 -2.654 -26.339 71 HG LEU 9 HG LEU 9 3.830 -1.754 -29.020 72 HD11 LEU 9 1HD1 LEU 9 0.934 -2.408 -28.347 73 HD12 LEU 9 2HD1 LEU 9 1.928 -3.145 -29.625 74 HD13 LEU 9 3HD1 LEU 9 1.464 -1.437 -29.739 75 HD21 LEU 9 1HD2 LEU 9 2.639 0.286 -28.346 76 HD22 LEU 9 2HD2 LEU 9 3.673 -0.239 -27.002 77 HD23 LEU 9 3HD2 LEU 9 1.928 -0.551 -26.944 78 H ALA 10 H ALA 10 4.414 -5.691 -26.863 79 HA ALA 10 HA ALA 10 5.902 -6.281 -29.368 80 HB1 ALA 10 1HB ALA 10 7.483 -6.437 -27.425 81 HB2 ALA 10 2HB ALA 10 6.413 -7.654 -26.693 82 HB3 ALA 10 3HB ALA 10 7.223 -7.994 -28.241 83 H LYS 11 H LYS 11 5.383 -8.271 -30.302 84 HA LYS 11 HA LYS 11 2.748 -9.376 -29.428 85 HB2 LYS 11 1HB LYS 11 3.140 -8.686 -31.836 86 HB3 LYS 11 2HB LYS 11 4.368 -9.954 -31.940 87 HG2 LYS 11 1HG LYS 11 2.566 -11.623 -31.317 88 HG3 LYS 11 2HG LYS 11 1.396 -10.316 -31.413 89 HD2 LYS 11 1HD LYS 11 1.210 -11.319 -33.480 90 HD3 LYS 11 2HD LYS 11 2.307 -9.965 -33.817 91 HE2 LYS 11 1HE LYS 11 4.243 -11.469 -33.671 92 HE3 LYS 11 2HE LYS 11 3.195 -12.811 -33.165 93 HZ1 LYS 11 1HZ LYS 11 3.705 -12.941 -35.517 94 HZ2 LYS 11 2HZ LYS 11 3.073 -11.441 -35.790 95 HZ3 LYS 11 3HZ LYS 11 2.091 -12.676 -35.313 96 H ALA 12 H ALA 12 2.574 -11.452 -28.636 97 HA ALA 12 HA ALA 12 5.033 -12.897 -27.990 98 HB1 ALA 12 1HB ALA 12 3.187 -13.100 -26.464 99 HB2 ALA 12 2HB ALA 12 2.083 -13.571 -27.768 100 HB3 ALA 12 3HB ALA 12 3.378 -14.671 -27.254 101 H LEU 13 H LEU 13 6.027 -14.424 -29.130 102 HA LEU 13 HA LEU 13 4.997 -15.031 -31.836 103 HB2 LEU 13 1HB LEU 13 7.517 -15.820 -30.343 104 HB3 LEU 13 2HB LEU 13 7.175 -16.274 -32.008 105 HG LEU 13 HG LEU 13 7.420 -13.390 -31.077 106 HD11 LEU 13 1HD1 LEU 13 9.686 -13.460 -32.042 107 HD12 LEU 13 2HD1 LEU 13 9.508 -15.201 -32.365 108 HD13 LEU 13 3HD1 LEU 13 9.533 -14.597 -30.693 109 HD21 LEU 13 1HD2 LEU 13 7.401 -14.723 -33.825 110 HD22 LEU 13 2HD2 LEU 13 7.785 -13.012 -33.538 111 HD23 LEU 13 3HD2 LEU 13 6.167 -13.627 -33.156 112 H TYR 14 H TYR 14 5.195 -16.451 -28.666 113 HA TYR 14 HA TYR 14 4.031 -18.987 -29.719 114 HB2 TYR 14 1HB TYR 14 6.083 -18.769 -27.493 115 HB3 TYR 14 2HB TYR 14 5.412 -20.251 -28.189 116 HD1 TYR 14 HD1 TYR 14 6.010 -20.861 -30.606 117 HD2 TYR 14 HD2 TYR 14 7.947 -17.641 -28.514 118 HE1 TYR 14 HE1 TYR 14 7.853 -20.861 -32.290 119 HE2 TYR 14 HE2 TYR 14 9.793 -17.659 -30.195 120 HH TYR 14 HH TYR 14 9.835 -19.927 -32.942 121 H ASP 15 H ASP 15 2.837 -20.179 -28.018 122 HA ASP 15 HA ASP 15 1.530 -18.308 -26.100 123 HB2 ASP 15 1HB ASP 15 -0.202 -20.121 -25.961 124 HB3 ASP 15 2HB ASP 15 -0.048 -19.423 -27.571 125 H ASN 16 H ASN 16 1.146 -19.056 -23.933 126 HA ASN 16 HA ASN 16 2.862 -21.330 -23.110 127 HB2 ASN 16 1HB ASN 16 3.992 -20.152 -21.486 128 HB3 ASN 16 2HB ASN 16 4.006 -19.015 -22.822 129 HD21 ASN 16 1HD2 ASN 16 2.844 -17.665 -19.358 130 HD22 ASN 16 2HD2 ASN 16 3.989 -18.947 -19.668 131 H VAL 17 H VAL 17 2.577 -21.783 -20.735 132 HA VAL 17 HA VAL 17 -0.208 -21.285 -19.779 133 HB VAL 17 HB VAL 17 1.507 -23.817 -19.429 134 HG11 VAL 17 1HG1 VAL 17 -1.260 -23.142 -18.318 135 HG12 VAL 17 2HG1 VAL 17 -0.446 -24.719 -18.183 136 HG13 VAL 17 3HG1 VAL 17 0.245 -23.300 -17.377 137 HG21 VAL 17 1HG2 VAL 17 -0.343 -24.988 -20.619 138 HG22 VAL 17 2HG2 VAL 17 -1.130 -23.420 -20.916 139 HG23 VAL 17 3HG2 VAL 17 0.453 -23.780 -21.644 140 H ALA 18 H ALA 18 -0.058 -20.429 -17.669 141 HA ALA 18 HA ALA 18 2.728 -20.016 -16.678 142 HB1 ALA 18 1HB ALA 18 1.800 -17.957 -15.602 143 HB2 ALA 18 2HB ALA 18 1.658 -17.907 -17.372 144 HB3 ALA 18 3HB ALA 18 0.233 -18.278 -16.370 145 H GLU 19 H GLU 19 3.173 -20.550 -14.587 146 HA GLU 19 HA GLU 19 0.898 -21.798 -13.064 147 HB2 GLU 19 1HB GLU 19 2.495 -23.269 -12.026 148 HB3 GLU 19 2HB GLU 19 2.623 -23.395 -13.782 149 HG2 GLU 19 1HG GLU 19 4.653 -22.006 -13.756 150 HG3 GLU 19 2HG GLU 19 4.511 -21.809 -12.000 151 H SER 20 H SER 20 3.457 -19.409 -12.971 152 HA SER 20 HA SER 20 3.181 -19.114 -10.039 153 HB2 SER 20 1HB SER 20 5.417 -19.006 -11.058 154 HB3 SER 20 2HB SER 20 4.888 -17.653 -12.071 155 HG SER 20 HG SER 20 6.064 -17.117 -10.078 156 HA PRO 21 HA PRO 21 0.465 -15.628 -10.589 157 HB2 PRO 21 1HB PRO 21 0.916 -14.188 -8.328 158 HB3 PRO 21 2HB PRO 21 0.022 -15.741 -8.303 159 HG2 PRO 21 1HG PRO 21 2.928 -15.233 -7.722 160 HG3 PRO 21 2HG PRO 21 1.714 -16.095 -6.720 161 HD2 PRO 21 1HD PRO 21 3.392 -17.439 -8.339 162 HD3 PRO 21 2HD PRO 21 1.678 -17.952 -8.157 163 H ASP 22 H ASP 22 3.922 -15.442 -10.150 164 HA ASP 22 HA ASP 22 4.112 -12.582 -10.785 165 HB2 ASP 22 1HB ASP 22 6.189 -14.811 -10.672 166 HB3 ASP 22 2HB ASP 22 6.562 -13.100 -10.925 167 H GLU 23 H GLU 23 3.689 -15.521 -12.522 168 HA GLU 23 HA GLU 23 5.094 -14.590 -14.938 169 HB2 GLU 23 1HB GLU 23 5.279 -16.921 -14.012 170 HB3 GLU 23 2HB GLU 23 3.564 -17.144 -14.379 171 HG2 GLU 23 1HG GLU 23 4.093 -16.666 -16.773 172 HG3 GLU 23 2HG GLU 23 5.802 -16.607 -16.318 173 H LEU 24 H LEU 24 4.077 -13.888 -16.778 174 HA LEU 24 HA LEU 24 1.177 -13.443 -16.580 175 HB2 LEU 24 1HB LEU 24 3.345 -12.176 -17.862 176 HB3 LEU 24 2HB LEU 24 2.350 -12.832 -19.158 177 HG LEU 24 HG LEU 24 1.383 -10.969 -16.961 178 HD11 LEU 24 1HD1 LEU 24 2.944 -9.948 -18.577 179 HD12 LEU 24 2HD1 LEU 24 1.300 -9.299 -18.740 180 HD13 LEU 24 3HD1 LEU 24 1.903 -10.489 -19.918 181 HD21 LEU 24 1HD2 LEU 24 -0.471 -12.355 -17.701 182 HD22 LEU 24 2HD2 LEU 24 -0.057 -12.078 -19.407 183 HD23 LEU 24 3HD2 LEU 24 -0.650 -10.737 -18.394 184 H SER 25 H SER 25 -0.385 -14.532 -17.651 185 HA SER 25 HA SER 25 0.392 -16.827 -19.357 186 HB2 SER 25 1HB SER 25 -2.266 -16.948 -19.346 187 HB3 SER 25 2HB SER 25 -1.322 -17.521 -17.956 188 HG SER 25 HG SER 25 -3.098 -16.078 -17.434 189 H PHE 26 H PHE 26 0.621 -16.477 -21.483 190 HA PHE 26 HA PHE 26 -1.082 -14.396 -22.790 191 HB2 PHE 26 1HB PHE 26 0.912 -13.689 -24.089 192 HB3 PHE 26 2HB PHE 26 1.039 -13.326 -22.364 193 HD1 PHE 26 HD1 PHE 26 2.285 -15.574 -25.066 194 HD2 PHE 26 HD2 PHE 26 2.726 -14.300 -20.979 195 HE1 PHE 26 HE1 PHE 26 4.468 -16.761 -24.932 196 HE2 PHE 26 HE2 PHE 26 4.895 -15.495 -20.829 197 HZ PHE 26 HZ PHE 26 5.782 -16.722 -22.810 198 H ARG 27 H ARG 27 -0.963 -14.604 -25.215 199 HA ARG 27 HA ARG 27 -0.698 -17.496 -25.948 200 HB2 ARG 27 1HB ARG 27 -2.791 -15.549 -26.969 201 HB3 ARG 27 2HB ARG 27 -2.686 -17.276 -27.325 202 HG2 ARG 27 1HG ARG 27 -3.268 -16.074 -24.585 203 HG3 ARG 27 2HG ARG 27 -4.483 -16.708 -25.698 204 HD2 ARG 27 1HD ARG 27 -3.583 -18.960 -25.513 205 HD3 ARG 27 2HD ARG 27 -2.199 -18.371 -24.579 206 HE ARG 27 HE ARG 27 -3.476 -18.243 -22.674 207 HH11 ARG 27 1HH1 ARG 27 -5.658 -18.832 -25.394 208 HH12 ARG 27 2HH1 ARG 27 -7.019 -19.152 -24.354 209 HH21 ARG 27 1HH2 ARG 27 -5.260 -18.647 -21.418 210 HH22 ARG 27 2HH2 ARG 27 -6.796 -19.039 -22.141 211 H LYS 28 H LYS 28 -0.076 -17.922 -28.084 212 HA LYS 28 HA LYS 28 1.711 -16.101 -29.335 213 HB2 LYS 28 1HB LYS 28 1.464 -17.548 -31.362 214 HB3 LYS 28 2HB LYS 28 1.822 -18.436 -29.889 215 HG2 LYS 28 1HG LYS 28 -0.639 -18.988 -29.699 216 HG3 LYS 28 2HG LYS 28 -0.849 -18.310 -31.323 217 HD2 LYS 28 1HD LYS 28 0.492 -19.988 -32.314 218 HD3 LYS 28 2HD LYS 28 1.259 -20.402 -30.771 219 HE2 LYS 28 1HE LYS 28 -1.386 -20.923 -30.210 220 HE3 LYS 28 2HE LYS 28 -1.284 -21.384 -31.924 221 HZ1 LYS 28 1HZ LYS 28 0.588 -22.825 -31.345 222 HZ2 LYS 28 2HZ LYS 28 -0.715 -23.226 -30.416 223 HZ3 LYS 28 3HZ LYS 28 0.527 -22.352 -29.760 224 H GLY 29 H GLY 29 1.475 -14.440 -30.665 225 HA2 GLY 29 1HA GLY 29 0.411 -13.130 -32.300 226 HA3 GLY 29 2HA GLY 29 -1.088 -14.029 -32.072 227 H ASP 30 H ASP 30 -0.434 -13.443 -28.971 228 HA ASP 30 HA ASP 30 -2.258 -11.185 -28.891 229 HB2 ASP 30 1HB ASP 30 -1.873 -13.237 -27.251 230 HB3 ASP 30 2HB ASP 30 -0.709 -12.137 -26.492 231 H ILE 31 H ILE 31 -1.809 -9.189 -27.690 232 HA ILE 31 HA ILE 31 0.983 -8.221 -28.262 233 HB ILE 31 HB ILE 31 -1.600 -6.579 -28.218 234 HG12 ILE 31 1HG1 ILE 31 -1.732 -8.194 -30.065 235 HG13 ILE 31 2HG1 ILE 31 -1.586 -6.538 -30.638 236 HG21 ILE 31 1HG2 ILE 31 0.339 -5.196 -27.775 237 HG22 ILE 31 2HG2 ILE 31 1.254 -5.920 -29.118 238 HG23 ILE 31 3HG2 ILE 31 -0.160 -4.886 -29.445 239 HD11 ILE 31 1HD1 ILE 31 0.731 -8.486 -30.512 240 HD12 ILE 31 2HD1 ILE 31 -0.264 -8.186 -31.949 241 HD13 ILE 31 3HD1 ILE 31 0.720 -6.876 -31.265 242 H MET 32 H MET 32 2.108 -7.522 -26.510 243 HA MET 32 HA MET 32 0.526 -6.580 -24.146 244 HB2 MET 32 1HB MET 32 2.038 -7.779 -22.666 245 HB3 MET 32 2HB MET 32 1.249 -8.886 -23.785 246 HG2 MET 32 1HG MET 32 3.345 -8.758 -25.223 247 HG3 MET 32 2HG MET 32 4.113 -7.912 -23.866 248 HE1 MET 32 1HE MET 32 1.664 -11.087 -24.250 249 HE2 MET 32 2HE MET 32 2.970 -11.085 -25.456 250 HE3 MET 32 3HE MET 32 2.953 -12.310 -24.167 251 H THR 33 H THR 33 1.454 -5.006 -22.878 252 HA THR 33 HA THR 33 3.503 -3.403 -24.288 253 HB THR 33 HB THR 33 1.996 -2.777 -21.714 254 HG1 THR 33 HG1 THR 33 0.635 -1.589 -23.101 255 HG21 THR 33 1HG2 THR 33 4.028 -1.393 -22.071 256 HG22 THR 33 2HG2 THR 33 2.546 -0.433 -22.275 257 HG23 THR 33 3HG2 THR 33 3.451 -0.983 -23.705 258 H VAL 34 H VAL 34 5.594 -3.365 -23.729 259 HA VAL 34 HA VAL 34 6.473 -4.944 -21.365 260 HB VAL 34 HB VAL 34 8.039 -3.538 -23.589 261 HG11 VAL 34 1HG1 VAL 34 9.414 -3.506 -21.590 262 HG12 VAL 34 2HG1 VAL 34 9.021 -5.205 -21.228 263 HG13 VAL 34 3HG1 VAL 34 10.016 -4.798 -22.645 264 HG21 VAL 34 1HG2 VAL 34 8.550 -5.782 -24.398 265 HG22 VAL 34 2HG2 VAL 34 7.721 -6.523 -23.013 266 HG23 VAL 34 3HG2 VAL 34 6.787 -5.640 -24.247 267 H LEU 35 H LEU 35 6.825 -4.023 -19.494 268 HA LEU 35 HA LEU 35 6.779 -1.059 -19.324 269 HB2 LEU 35 1HB LEU 35 6.601 -3.209 -17.185 270 HB3 LEU 35 2HB LEU 35 6.409 -1.481 -16.917 271 HG LEU 35 HG LEU 35 4.550 -3.214 -18.580 272 HD11 LEU 35 1HD1 LEU 35 4.448 -3.766 -16.201 273 HD12 LEU 35 2HD1 LEU 35 2.983 -2.892 -16.692 274 HD13 LEU 35 3HD1 LEU 35 4.258 -2.044 -15.787 275 HD21 LEU 35 1HD2 LEU 35 4.336 -0.296 -17.721 276 HD22 LEU 35 2HD2 LEU 35 3.029 -1.238 -18.478 277 HD23 LEU 35 3HD2 LEU 35 4.515 -0.905 -19.385 278 H GLU 36 H GLU 36 8.745 -3.893 -18.425 279 HA GLU 36 HA GLU 36 11.102 -2.134 -18.071 280 HB2 GLU 36 1HB GLU 36 9.864 -2.385 -15.858 281 HB3 GLU 36 2HB GLU 36 10.197 -4.114 -15.939 282 HG2 GLU 36 1HG GLU 36 11.772 -2.929 -14.468 283 HG3 GLU 36 2HG GLU 36 12.595 -3.698 -15.832 284 H ARG 37 H ARG 37 13.148 -3.440 -18.012 285 HA ARG 37 HA ARG 37 12.764 -6.225 -19.079 286 HB2 ARG 37 1HB ARG 37 14.798 -4.213 -20.101 287 HB3 ARG 37 2HB ARG 37 14.577 -5.877 -20.664 288 HG2 ARG 37 1HG ARG 37 12.133 -5.080 -21.215 289 HG3 ARG 37 2HG ARG 37 12.845 -3.456 -21.134 290 HD2 ARG 37 1HD ARG 37 13.680 -5.747 -22.928 291 HD3 ARG 37 2HD ARG 37 12.885 -4.247 -23.429 292 HE ARG 37 HE ARG 37 15.235 -3.476 -22.136 293 HH11 ARG 37 1HH1 ARG 37 14.470 -5.437 -24.970 294 HH12 ARG 37 2HH1 ARG 37 15.986 -5.072 -25.750 295 HH21 ARG 37 1HH2 ARG 37 17.147 -3.052 -23.189 296 HH22 ARG 37 2HH2 ARG 37 17.477 -3.742 -24.754 297 H ASP 38 H ASP 38 14.429 -7.682 -18.511 298 HA ASP 38 HA ASP 38 15.756 -8.670 -16.938 299 HB2 ASP 38 1HB ASP 38 17.487 -7.144 -18.014 300 HB3 ASP 38 2HB ASP 38 17.238 -6.042 -16.649 301 H THR 39 H THR 39 13.363 -7.825 -16.220 302 HA THR 39 HA THR 39 13.240 -5.922 -14.106 303 HB THR 39 HB THR 39 11.360 -6.524 -15.636 304 HG1 THR 39 HG1 THR 39 11.081 -6.687 -12.828 305 HG21 THR 39 1HG2 THR 39 11.141 -9.066 -13.957 306 HG22 THR 39 2HG2 THR 39 11.693 -9.011 -15.650 307 HG23 THR 39 3HG2 THR 39 10.034 -8.543 -15.234 308 H GLN 40 H GLN 40 14.461 -9.049 -13.929 309 HA GLN 40 HA GLN 40 13.844 -9.176 -11.010 310 HB2 GLN 40 1HB GLN 40 12.456 -10.653 -12.688 311 HB3 GLN 40 2HB GLN 40 13.903 -11.665 -12.706 312 HG2 GLN 40 1HG GLN 40 13.724 -11.984 -10.274 313 HG3 GLN 40 2HG GLN 40 12.339 -10.881 -10.217 314 HE21 GLN 40 1HE2 GLN 40 10.888 -14.226 -10.196 315 HE22 GLN 40 2HE2 GLN 40 11.831 -13.204 -9.141 316 H GLY 41 H GLY 41 16.303 -8.766 -13.124 317 HA2 GLY 41 1HA GLY 41 18.590 -9.089 -12.786 318 HA3 GLY 41 2HA GLY 41 18.243 -10.117 -11.374 319 H LEU 42 H LEU 42 16.316 -10.895 -14.005 320 HA LEU 42 HA LEU 42 18.090 -13.147 -14.823 321 HB2 LEU 42 1HB LEU 42 15.059 -12.862 -15.004 322 HB3 LEU 42 2HB LEU 42 15.993 -14.240 -15.573 323 HG LEU 42 HG LEU 42 15.717 -13.404 -12.667 324 HD11 LEU 42 1HD1 LEU 42 13.582 -14.161 -13.655 325 HD12 LEU 42 2HD1 LEU 42 14.207 -15.342 -12.489 326 HD13 LEU 42 3HD1 LEU 42 14.371 -15.647 -14.235 327 HD21 LEU 42 1HD2 LEU 42 16.924 -15.893 -13.944 328 HD22 LEU 42 2HD2 LEU 42 16.632 -15.671 -12.204 329 HD23 LEU 42 3HD2 LEU 42 17.797 -14.629 -13.042 330 H ASP 43 H ASP 43 19.103 -12.469 -16.644 331 HA ASP 43 HA ASP 43 18.102 -10.356 -18.267 332 HB2 ASP 43 1HB ASP 43 20.516 -11.074 -18.125 333 HB3 ASP 43 2HB ASP 43 20.094 -12.493 -19.097 334 H GLY 44 H GLY 44 17.191 -10.375 -20.269 335 HA2 GLY 44 1HA GLY 44 16.012 -11.278 -22.072 336 HA3 GLY 44 2HA GLY 44 16.226 -12.900 -21.403 337 H TRP 45 H TRP 45 15.053 -11.613 -18.713 338 HA TRP 45 HA TRP 45 12.252 -12.183 -19.546 339 HB2 TRP 45 1HB TRP 45 13.619 -11.954 -16.860 340 HB3 TRP 45 2HB TRP 45 11.862 -12.069 -17.038 341 HD1 TRP 45 HD1 TRP 45 15.049 -14.157 -17.637 342 HE1 TRP 45 HE1 TRP 45 14.459 -16.626 -17.784 343 HE3 TRP 45 HE3 TRP 45 9.961 -13.665 -17.571 344 HZ2 TRP 45 HZ2 TRP 45 12.072 -18.206 -17.865 345 HZ3 TRP 45 HZ3 TRP 45 8.548 -15.728 -17.673 346 HH2 TRP 45 HH2 TRP 45 9.611 -17.979 -17.820 347 H TRP 46 H TRP 46 10.711 -10.663 -19.753 348 HA TRP 46 HA TRP 46 11.439 -7.898 -18.878 349 HB2 TRP 46 1HB TRP 46 9.744 -8.780 -21.232 350 HB3 TRP 46 2HB TRP 46 10.135 -7.115 -20.798 351 HD1 TRP 46 HD1 TRP 46 13.373 -8.534 -20.311 352 HE1 TRP 46 HE1 TRP 46 14.875 -8.577 -22.354 353 HE3 TRP 46 HE3 TRP 46 9.757 -7.760 -23.835 354 HZ2 TRP 46 HZ2 TRP 46 14.562 -8.305 -25.183 355 HZ3 TRP 46 HZ3 TRP 46 10.423 -7.676 -26.241 356 HH2 TRP 46 HH2 TRP 46 12.814 -7.934 -26.903 357 H LEU 47 H LEU 47 9.842 -6.681 -17.888 358 HA LEU 47 HA LEU 47 7.552 -8.230 -16.817 359 HB2 LEU 47 1HB LEU 47 8.782 -6.614 -15.361 360 HB3 LEU 47 2HB LEU 47 8.372 -5.317 -16.472 361 HG LEU 47 HG LEU 47 5.953 -5.696 -15.958 362 HD11 LEU 47 1HD1 LEU 47 6.013 -8.019 -15.188 363 HD12 LEU 47 2HD1 LEU 47 5.412 -6.984 -13.885 364 HD13 LEU 47 3HD1 LEU 47 7.086 -7.579 -13.841 365 HD21 LEU 47 1HD2 LEU 47 6.068 -4.626 -13.738 366 HD22 LEU 47 2HD2 LEU 47 7.276 -3.944 -14.847 367 HD23 LEU 47 3HD2 LEU 47 7.778 -5.101 -13.593 368 H CYS 48 H CYS 48 5.791 -8.395 -18.054 369 HA CYS 48 HA CYS 48 5.234 -6.144 -19.949 370 HB2 CYS 48 1HB CYS 48 4.544 -9.083 -20.233 371 HB3 CYS 48 2HB CYS 48 4.215 -7.802 -21.412 372 HG CYS 48 HG CYS 48 7.116 -8.897 -20.277 373 H SER 49 H SER 49 2.884 -5.916 -20.431 374 HA SER 49 HA SER 49 1.173 -6.806 -18.151 375 HB2 SER 49 1HB SER 49 0.038 -4.565 -18.321 376 HB3 SER 49 2HB SER 49 1.693 -4.515 -17.679 377 HG SER 49 HG SER 49 2.401 -3.960 -19.803 378 H LEU 50 H LEU 50 -0.713 -7.627 -18.696 379 HA LEU 50 HA LEU 50 -1.922 -7.210 -21.351 380 HB2 LEU 50 1HB LEU 50 -0.148 -8.866 -21.820 381 HB3 LEU 50 2HB LEU 50 -0.707 -9.857 -20.489 382 HG LEU 50 HG LEU 50 -2.834 -10.272 -21.706 383 HD11 LEU 50 1HD1 LEU 50 -2.928 -9.780 -24.113 384 HD12 LEU 50 2HD1 LEU 50 -1.402 -8.883 -23.987 385 HD13 LEU 50 3HD1 LEU 50 -2.854 -8.286 -23.163 386 HD21 LEU 50 1HD2 LEU 50 -0.277 -10.993 -23.164 387 HD22 LEU 50 2HD2 LEU 50 -1.842 -11.825 -23.324 388 HD23 LEU 50 3HD2 LEU 50 -0.980 -11.855 -21.772 389 H HIS 51 H HIS 51 -4.091 -7.720 -21.276 390 HA HIS 51 HA HIS 51 -6.128 -8.263 -20.429 391 HB2 HIS 51 1HB HIS 51 -4.696 -10.526 -20.532 392 HB3 HIS 51 2HB HIS 51 -5.052 -10.522 -18.805 393 HD1 HIS 51 HD1 HIS 51 -6.642 -10.989 -22.177 394 HD2 HIS 51 HD2 HIS 51 -7.802 -10.790 -18.178 395 HE1 HIS 51 HE1 HIS 51 -9.026 -11.831 -22.061 396 H GLY 52 H GLY 52 -4.565 -6.366 -18.783 397 HA2 GLY 52 1HA GLY 52 -5.306 -5.143 -16.942 398 HA3 GLY 52 2HA GLY 52 -6.367 -6.474 -16.485 399 H ARG 53 H ARG 53 -3.277 -7.740 -16.954 400 HA ARG 53 HA ARG 53 -2.427 -7.136 -14.154 401 HB2 ARG 53 1HB ARG 53 -1.888 -9.469 -13.762 402 HB3 ARG 53 2HB ARG 53 -3.607 -9.329 -14.138 403 HG2 ARG 53 1HG ARG 53 -3.235 -10.145 -16.404 404 HG3 ARG 53 2HG ARG 53 -1.484 -10.166 -16.150 405 HD2 ARG 53 1HD ARG 53 -3.461 -11.850 -14.581 406 HD3 ARG 53 2HD ARG 53 -2.543 -12.403 -15.993 407 HE ARG 53 HE ARG 53 -0.908 -11.293 -13.826 408 HH11 ARG 53 1HH1 ARG 53 -2.241 -14.273 -15.206 409 HH12 ARG 53 2HH1 ARG 53 -1.047 -15.262 -14.400 410 HH21 ARG 53 1HH2 ARG 53 0.522 -12.652 -12.807 411 HH22 ARG 53 2HH2 ARG 53 0.483 -14.365 -13.121 412 H GLN 54 H GLN 54 -0.118 -7.680 -13.827 413 HA GLN 54 HA GLN 54 1.385 -7.688 -16.405 414 HB2 GLN 54 1HB GLN 54 3.187 -6.470 -15.254 415 HB3 GLN 54 2HB GLN 54 1.709 -5.523 -15.374 416 HG2 GLN 54 1HG GLN 54 2.143 -7.069 -12.847 417 HG3 GLN 54 2HG GLN 54 3.163 -5.658 -13.151 418 HE21 GLN 54 1HE2 GLN 54 0.700 -3.308 -12.447 419 HE22 GLN 54 2HE2 GLN 54 2.352 -3.636 -12.909 420 H GLY 55 H GLY 55 3.482 -8.758 -16.274 421 HA2 GLY 55 1HA GLY 55 4.171 -10.406 -14.034 422 HA3 GLY 55 2HA GLY 55 3.264 -11.364 -15.218 423 H ILE 56 H ILE 56 5.851 -12.061 -14.680 424 HA ILE 56 HA ILE 56 7.653 -10.744 -16.563 425 HB ILE 56 HB ILE 56 9.326 -12.381 -15.863 426 HG12 ILE 56 1HG1 ILE 56 7.136 -13.776 -14.273 427 HG13 ILE 56 2HG1 ILE 56 7.795 -14.372 -15.792 428 HG21 ILE 56 1HG2 ILE 56 8.687 -10.422 -14.350 429 HG22 ILE 56 2HG2 ILE 56 7.743 -11.572 -13.374 430 HG23 ILE 56 3HG2 ILE 56 9.504 -11.768 -13.533 431 HD11 ILE 56 1HD1 ILE 56 10.066 -14.491 -14.688 432 HD12 ILE 56 2HD1 ILE 56 9.263 -14.102 -13.147 433 HD13 ILE 56 3HD1 ILE 56 8.844 -15.592 -14.015 434 H VAL 57 H VAL 57 8.380 -11.458 -18.494 435 HA VAL 57 HA VAL 57 7.167 -13.918 -19.677 436 HB VAL 57 HB VAL 57 7.175 -11.119 -20.922 437 HG11 VAL 57 1HG1 VAL 57 5.881 -12.233 -22.768 438 HG12 VAL 57 2HG1 VAL 57 7.587 -12.700 -22.670 439 HG13 VAL 57 3HG1 VAL 57 6.327 -13.795 -22.062 440 HG21 VAL 57 1HG2 VAL 57 5.378 -11.289 -19.318 441 HG22 VAL 57 2HG2 VAL 57 4.684 -11.403 -20.946 442 HG23 VAL 57 3HG2 VAL 57 4.886 -12.874 -19.964 443 HA PRO 58 HA PRO 58 11.430 -13.781 -20.962 444 HB2 PRO 58 1HB PRO 58 11.589 -15.869 -22.716 445 HB3 PRO 58 2HB PRO 58 11.481 -16.108 -20.941 446 HG2 PRO 58 1HG PRO 58 9.308 -16.258 -23.011 447 HG3 PRO 58 2HG PRO 58 9.672 -17.380 -21.667 448 HD2 PRO 58 1HD PRO 58 7.728 -15.460 -21.540 449 HD3 PRO 58 2HD PRO 58 8.644 -16.020 -20.102 450 H GLY 59 H GLY 59 12.052 -12.160 -22.255 451 HA2 GLY 59 1HA GLY 59 10.463 -11.161 -24.389 452 HA3 GLY 59 2HA GLY 59 12.107 -10.674 -23.987 453 H ASN 60 H ASN 60 12.870 -13.639 -24.378 454 HA ASN 60 HA ASN 60 13.729 -13.471 -27.109 455 HB2 ASN 60 1HB ASN 60 14.782 -14.897 -25.358 456 HB3 ASN 60 2HB ASN 60 13.342 -15.928 -25.347 457 HD21 ASN 60 1HD2 ASN 60 16.101 -16.245 -28.321 458 HD22 ASN 60 2HD2 ASN 60 16.156 -14.919 -27.186 459 H ARG 61 H ARG 61 10.774 -14.656 -25.575 460 HA ARG 61 HA ARG 61 9.832 -15.889 -28.098 461 HB2 ARG 61 1HB ARG 61 8.590 -15.653 -25.331 462 HB3 ARG 61 2HB ARG 61 7.825 -16.456 -26.705 463 HG2 ARG 61 1HG ARG 61 9.910 -17.927 -26.836 464 HG3 ARG 61 2HG ARG 61 10.338 -17.289 -25.236 465 HD2 ARG 61 1HD ARG 61 8.181 -18.096 -24.346 466 HD3 ARG 61 2HD ARG 61 7.732 -18.692 -25.952 467 HE ARG 61 HE ARG 61 9.655 -20.261 -25.810 468 HH11 ARG 61 1HH1 ARG 61 8.382 -18.996 -22.755 469 HH12 ARG 61 2HH1 ARG 61 9.001 -20.344 -21.844 470 HH21 ARG 61 1HH2 ARG 61 10.411 -21.934 -24.568 471 HH22 ARG 61 2HH2 ARG 61 10.119 -21.971 -22.849 472 H LEU 62 H LEU 62 10.161 -12.792 -27.335 473 HA LEU 62 HA LEU 62 7.427 -12.028 -28.302 474 HB2 LEU 62 1HB LEU 62 9.398 -10.433 -26.632 475 HB3 LEU 62 2HB LEU 62 7.859 -9.850 -27.230 476 HG LEU 62 HG LEU 62 8.234 -12.014 -25.146 477 HD11 LEU 62 1HD1 LEU 62 7.255 -10.313 -23.638 478 HD12 LEU 62 2HD1 LEU 62 7.208 -9.146 -24.974 479 HD13 LEU 62 3HD1 LEU 62 8.767 -9.743 -24.359 480 HD21 LEU 62 1HD2 LEU 62 5.741 -11.721 -24.868 481 HD22 LEU 62 2HD2 LEU 62 6.239 -12.523 -26.359 482 HD23 LEU 62 3HD2 LEU 62 5.735 -10.814 -26.393 483 H LYS 63 H LYS 63 7.269 -10.361 -29.818 484 HA LYS 63 HA LYS 63 9.856 -9.560 -31.104 485 HB2 LYS 63 1HB LYS 63 8.561 -11.205 -32.479 486 HB3 LYS 63 2HB LYS 63 7.199 -10.081 -32.490 487 HG2 LYS 63 1HG LYS 63 8.337 -9.857 -34.581 488 HG3 LYS 63 2HG LYS 63 8.689 -8.399 -33.640 489 HD2 LYS 63 1HD LYS 63 10.885 -9.404 -32.969 490 HD3 LYS 63 2HD LYS 63 10.531 -10.807 -33.993 491 HE2 LYS 63 1HE LYS 63 10.755 -7.917 -34.944 492 HE3 LYS 63 2HE LYS 63 12.027 -9.146 -35.091 493 HZ1 LYS 63 1HZ LYS 63 10.781 -8.925 -37.137 494 HZ2 LYS 63 2HZ LYS 63 9.362 -9.284 -36.376 495 HZ3 LYS 63 3HZ LYS 63 10.543 -10.430 -36.504 496 H ILE 64 H ILE 64 10.183 -7.463 -30.841 497 HA ILE 64 HA ILE 64 8.306 -5.638 -29.763 498 HB ILE 64 HB ILE 64 10.765 -5.031 -31.495 499 HG12 ILE 64 1HG1 ILE 64 11.373 -6.449 -29.583 500 HG13 ILE 64 2HG1 ILE 64 12.023 -4.823 -29.413 501 HG21 ILE 64 1HG2 ILE 64 9.174 -3.275 -29.555 502 HG22 ILE 64 2HG2 ILE 64 10.798 -2.859 -30.154 503 HG23 ILE 64 3HG2 ILE 64 9.444 -3.006 -31.292 504 HD11 ILE 64 1HD1 ILE 64 11.230 -5.601 -27.244 505 HD12 ILE 64 2HD1 ILE 64 10.183 -4.276 -27.776 506 HD13 ILE 64 3HD1 ILE 64 9.624 -5.961 -27.900 507 H LEU 65 H LEU 65 6.885 -4.196 -30.624 508 HA LEU 65 HA LEU 65 6.475 -4.280 -33.587 509 HB2 LEU 65 1HB LEU 65 4.764 -5.132 -31.414 510 HB3 LEU 65 2HB LEU 65 4.043 -3.735 -32.198 511 HG LEU 65 HG LEU 65 4.190 -4.917 -34.392 512 HD11 LEU 65 1HD1 LEU 65 4.524 -7.396 -34.356 513 HD12 LEU 65 2HD1 LEU 65 5.064 -7.271 -32.664 514 HD13 LEU 65 3HD1 LEU 65 6.003 -6.500 -33.957 515 HD21 LEU 65 1HD2 LEU 65 2.139 -4.911 -33.044 516 HD22 LEU 65 2HD2 LEU 65 2.696 -6.355 -32.170 517 HD23 LEU 65 3HD2 LEU 65 2.321 -6.451 -33.906 518 H VAL 66 H VAL 66 4.956 -2.413 -34.169 519 HA VAL 66 HA VAL 66 4.680 -0.185 -34.485 520 HB VAL 66 HB VAL 66 5.023 0.181 -31.474 521 HG11 VAL 66 1HG1 VAL 66 4.941 2.293 -32.760 522 HG12 VAL 66 2HG1 VAL 66 3.464 1.752 -33.594 523 HG13 VAL 66 3HG1 VAL 66 3.441 2.072 -31.844 524 HG21 VAL 66 1HG2 VAL 66 2.582 -0.687 -33.097 525 HG22 VAL 66 2HG2 VAL 66 3.391 -1.592 -31.795 526 HG23 VAL 66 3HG2 VAL 66 2.515 -0.103 -31.420 527 H GLY 67 H GLY 67 6.635 -0.162 -35.702 528 HA2 GLY 67 1HA GLY 67 8.638 1.673 -34.486 529 HA3 GLY 67 2HA GLY 67 9.172 0.193 -35.301 530 H MET 68 H MET 68 6.620 2.598 -36.129 531 HA MET 68 HA MET 68 7.963 2.881 -38.790 532 HB2 MET 68 1HB MET 68 5.654 1.751 -38.653 533 HB3 MET 68 2HB MET 68 5.027 3.339 -38.201 534 HG2 MET 68 1HG MET 68 4.676 3.139 -40.532 535 HG3 MET 68 2HG MET 68 6.069 4.220 -40.352 536 HE1 MET 68 1HE MET 68 7.196 3.945 -42.695 537 HE2 MET 68 2HE MET 68 7.246 2.396 -43.566 538 HE3 MET 68 3HE MET 68 5.680 3.132 -43.155 539 H TYR 69 H TYR 69 8.779 4.851 -39.181 540 HA TYR 69 HA TYR 69 8.255 7.035 -37.316 541 HB2 TYR 69 1HB TYR 69 10.481 6.433 -38.433 542 HB3 TYR 69 2HB TYR 69 9.824 7.124 -39.920 543 HD1 TYR 69 HD1 TYR 69 9.649 9.548 -40.204 544 HD2 TYR 69 HD2 TYR 69 10.911 7.876 -36.438 545 HE1 TYR 69 HE1 TYR 69 10.416 11.802 -39.447 546 HE2 TYR 69 HE2 TYR 69 11.672 10.133 -35.696 547 HH TYR 69 HH TYR 69 11.426 13.014 -37.778 548 H ASP 70 H ASP 70 7.671 6.364 -40.777 549 HA ASP 70 HA ASP 70 6.270 8.844 -41.254 550 HB2 ASP 70 1HB ASP 70 6.421 6.219 -42.776 551 HB3 ASP 70 2HB ASP 70 5.566 7.654 -43.368 552 H LYS 71 H LYS 71 4.111 9.272 -41.231 553 HA LYS 71 HA LYS 71 2.167 7.104 -40.845 554 HB2 LYS 71 1HB LYS 71 1.287 8.034 -38.739 555 HB3 LYS 71 2HB LYS 71 2.950 7.466 -38.562 556 HG2 LYS 71 1HG LYS 71 3.745 9.830 -38.808 557 HG3 LYS 71 2HG LYS 71 2.048 10.354 -38.787 558 HD2 LYS 71 1HD LYS 71 1.763 9.316 -36.568 559 HD3 LYS 71 2HD LYS 71 3.450 8.753 -36.615 560 HE2 LYS 71 1HE LYS 71 4.221 11.104 -36.770 561 HE3 LYS 71 2HE LYS 71 2.533 11.654 -36.665 562 HZ1 LYS 71 1HZ LYS 71 2.396 10.612 -34.484 563 HZ2 LYS 71 2HZ LYS 71 3.629 11.705 -34.511 564 HZ3 LYS 71 3HZ LYS 71 3.958 10.092 -34.587 565 H LYS 72 H LYS 72 -0.062 7.980 -40.853 566 HA LYS 72 HA LYS 72 -0.183 10.307 -42.695 567 HB2 LYS 72 1HB LYS 72 -2.324 8.325 -41.810 568 HB3 LYS 72 2HB LYS 72 -2.541 9.576 -43.029 569 HG2 LYS 72 1HG LYS 72 -0.629 7.205 -43.239 570 HG3 LYS 72 2HG LYS 72 -2.207 7.315 -44.020 571 HD2 LYS 72 1HD LYS 72 0.133 9.209 -44.570 572 HD3 LYS 72 2HD LYS 72 -0.264 7.793 -45.550 573 HE2 LYS 72 1HE LYS 72 -2.121 10.172 -45.100 574 HE3 LYS 72 2HE LYS 72 -1.106 9.922 -46.531 575 HZ1 LYS 72 1HZ LYS 72 -3.365 9.166 -46.910 576 HZ2 LYS 72 2HZ LYS 72 -3.281 8.111 -45.643 577 HZ3 LYS 72 3HZ LYS 72 -2.331 7.882 -46.973 578 HA PRO 73 HA PRO 73 -1.655 12.736 -39.313 579 HB2 PRO 73 1HB PRO 73 -3.204 14.637 -40.490 580 HB3 PRO 73 2HB PRO 73 -1.427 14.594 -40.736 581 HG2 PRO 73 1HG PRO 73 -3.606 13.478 -42.495 582 HG3 PRO 73 2HG PRO 73 -2.246 14.562 -42.936 583 HD2 PRO 73 1HD PRO 73 -2.115 11.886 -43.315 584 HD3 PRO 73 2HD PRO 73 -0.671 12.830 -42.807 585 H ALA 74 H ALA 74 -3.642 13.306 -38.108 586 HA ALA 74 HA ALA 74 -6.157 12.064 -39.016 587 HB1 ALA 74 1HB ALA 74 -4.983 10.242 -37.765 588 HB2 ALA 74 2HB ALA 74 -4.776 11.338 -36.376 589 HB3 ALA 74 3HB ALA 74 -6.406 10.824 -36.873 590 H GLY 75 H GLY 75 -7.933 12.769 -37.503 591 HA2 GLY 75 1HA GLY 75 -7.332 15.499 -36.458 592 HA3 GLY 75 2HA GLY 75 -8.921 14.914 -36.995 593 H GLU 76 H GLU 76 -6.483 14.781 -34.448 594 HA GLU 76 HA GLU 76 -8.453 13.385 -32.670 595 HB2 GLU 76 1HB GLU 76 -5.412 13.347 -32.690 596 HB3 GLU 76 2HB GLU 76 -6.424 12.583 -31.454 597 HG2 GLU 76 1HG GLU 76 -7.369 11.057 -33.100 598 HG3 GLU 76 2HG GLU 76 -6.511 11.877 -34.413 599 H PHE 77 H PHE 77 -8.681 14.185 -30.554 600 HA PHE 77 HA PHE 77 -7.270 16.731 -29.940 601 HB2 PHE 77 1HB PHE 77 -9.808 16.768 -30.896 602 HB3 PHE 77 2HB PHE 77 -10.143 16.522 -29.177 603 HD1 PHE 77 HD1 PHE 77 -9.606 18.288 -27.538 604 HD2 PHE 77 HD2 PHE 77 -8.755 18.801 -31.724 605 HE1 PHE 77 HE1 PHE 77 -9.243 20.722 -27.161 606 HE2 PHE 77 HE2 PHE 77 -8.411 21.240 -31.364 607 HZ PHE 77 HZ PHE 77 -8.645 22.207 -29.079 608 H ILE 78 H ILE 78 -6.895 17.033 -27.731 609 HA ILE 78 HA ILE 78 -7.101 14.549 -26.161 610 HB ILE 78 HB ILE 78 -5.582 15.670 -24.569 611 HG12 ILE 78 1HG1 ILE 78 -5.634 18.075 -26.444 612 HG13 ILE 78 2HG1 ILE 78 -6.539 17.994 -24.931 613 HG21 ILE 78 1HG2 ILE 78 -4.692 14.500 -26.640 614 HG22 ILE 78 2HG2 ILE 78 -4.583 16.089 -27.435 615 HG23 ILE 78 3HG2 ILE 78 -3.603 15.742 -25.992 616 HD11 ILE 78 1HD1 ILE 78 -4.513 19.245 -24.547 617 HD12 ILE 78 2HD1 ILE 78 -4.380 17.695 -23.687 618 HD13 ILE 78 3HD1 ILE 78 -3.513 17.944 -25.224 619 H VAL 79 H VAL 79 -7.719 14.623 -23.914 620 HA VAL 79 HA VAL 79 -9.460 14.802 -22.438 621 HB VAL 79 HB VAL 79 -8.711 17.754 -22.412 622 HG11 VAL 79 1HG1 VAL 79 -9.050 17.473 -19.959 623 HG12 VAL 79 2HG1 VAL 79 -10.524 17.055 -20.852 624 HG13 VAL 79 3HG1 VAL 79 -9.479 15.765 -20.209 625 HG21 VAL 79 1HG2 VAL 79 -6.598 16.564 -22.542 626 HG22 VAL 79 2HG2 VAL 79 -6.844 17.054 -20.860 627 HG23 VAL 79 3HG2 VAL 79 -7.137 15.366 -21.339 628 H THR 80 H THR 80 -11.154 14.308 -23.996 629 HA THR 80 HA THR 80 -13.113 16.543 -24.040 630 HB THR 80 HB THR 80 -12.466 16.392 -26.357 631 HG1 THR 80 HG1 THR 80 -14.401 15.523 -27.259 632 HG21 THR 80 1HG2 THR 80 -12.523 14.238 -27.621 633 HG22 THR 80 2HG2 THR 80 -12.736 13.366 -26.090 634 HG23 THR 80 3HG2 THR 80 -11.238 14.285 -26.401 635 H ASP 81 H ASP 81 -15.050 15.991 -23.250 636 HA ASP 81 HA ASP 81 -15.901 13.225 -22.797 637 HB2 ASP 81 1HB ASP 81 -14.317 13.466 -20.906 638 HB3 ASP 81 2HB ASP 81 -15.089 14.978 -20.422 639 HXT ASP 81 H02 ASP 81 -18.158 16.221 -21.755 Start of MODEL 5 1 H2 GLY 1 2H0 GLY 1 -0.592 12.407 -18.682 2 H GLY 1 1H0 GLY 1 -1.468 11.427 -17.660 3 HA2 GLY 1 1HA GLY 1 -0.124 13.973 -16.872 4 HA3 GLY 1 2HA GLY 1 -1.084 12.957 -15.783 5 H SER 2 H SER 2 0.559 10.971 -17.825 6 HA SER 2 HA SER 2 2.485 10.212 -15.740 7 HB2 SER 2 1HB SER 2 3.048 8.396 -17.367 8 HB3 SER 2 2HB SER 2 1.327 8.432 -16.928 9 HG SER 2 HG SER 2 1.652 8.238 -19.198 10 H MET 3 H MET 3 4.787 10.218 -16.036 11 HA MET 3 HA MET 3 5.666 12.468 -17.696 12 HB2 MET 3 1HB MET 3 6.520 12.130 -15.412 13 HB3 MET 3 2HB MET 3 7.272 10.618 -15.879 14 HG2 MET 3 1HG MET 3 8.729 11.813 -17.442 15 HG3 MET 3 2HG MET 3 7.938 13.347 -17.056 16 HE1 MET 3 1HE MET 3 9.226 14.287 -13.566 17 HE2 MET 3 2HE MET 3 8.430 14.829 -15.049 18 HE3 MET 3 3HE MET 3 7.625 13.648 -13.989 19 H LYS 4 H LYS 4 7.165 9.197 -17.324 20 HA LYS 4 HA LYS 4 6.941 8.628 -20.194 21 HB2 LYS 4 1HB LYS 4 9.552 9.468 -18.888 22 HB3 LYS 4 2HB LYS 4 9.556 8.159 -20.063 23 HG2 LYS 4 1HG LYS 4 9.750 9.678 -21.673 24 HG3 LYS 4 2HG LYS 4 8.084 10.160 -21.325 25 HD2 LYS 4 1HD LYS 4 9.097 11.685 -19.491 26 HD3 LYS 4 2HD LYS 4 10.667 11.370 -20.265 27 HE2 LYS 4 1HE LYS 4 9.869 13.407 -21.229 28 HE3 LYS 4 2HE LYS 4 9.591 12.149 -22.457 29 HZ1 LYS 4 1HZ LYS 4 7.579 13.431 -20.688 30 HZ2 LYS 4 2HZ LYS 4 7.268 12.007 -21.441 31 HZ3 LYS 4 3HZ LYS 4 7.601 13.364 -22.342 32 H TYR 5 H TYR 5 7.457 6.412 -20.575 33 HA TYR 5 HA TYR 5 8.533 4.743 -18.424 34 HB2 TYR 5 1HB TYR 5 5.726 4.918 -18.634 35 HB3 TYR 5 2HB TYR 5 6.150 3.455 -19.537 36 HD1 TYR 5 HD1 TYR 5 6.239 5.134 -16.215 37 HD2 TYR 5 HD2 TYR 5 7.175 1.518 -18.366 38 HE1 TYR 5 HE1 TYR 5 6.562 3.920 -14.055 39 HE2 TYR 5 HE2 TYR 5 7.533 0.338 -16.204 40 HH TYR 5 HH TYR 5 7.591 0.519 -13.923 41 H LEU 6 H LEU 6 8.653 2.396 -19.617 42 HA LEU 6 HA LEU 6 10.084 2.707 -22.037 43 HB2 LEU 6 1HB LEU 6 8.931 0.484 -20.490 44 HB3 LEU 6 2HB LEU 6 8.959 0.183 -22.223 45 HG LEU 6 HG LEU 6 11.405 0.747 -22.231 46 HD11 LEU 6 1HD1 LEU 6 12.627 0.553 -20.077 47 HD12 LEU 6 2HD1 LEU 6 11.078 0.546 -19.210 48 HD13 LEU 6 3HD1 LEU 6 11.584 1.989 -20.118 49 HD21 LEU 6 1HD2 LEU 6 12.073 -1.464 -21.380 50 HD22 LEU 6 2HD2 LEU 6 10.541 -1.568 -22.278 51 HD23 LEU 6 3HD2 LEU 6 10.538 -1.607 -20.502 52 H ASN 7 H ASN 7 6.664 1.820 -21.547 53 HA ASN 7 HA ASN 7 4.868 1.813 -22.952 54 HB2 ASN 7 1HB ASN 7 5.493 4.255 -22.533 55 HB3 ASN 7 2HB ASN 7 6.164 4.273 -24.171 56 HD21 ASN 7 1HD2 ASN 7 3.045 5.115 -25.452 57 HD22 ASN 7 2HD2 ASN 7 4.780 5.332 -25.438 58 H VAL 8 H VAL 8 6.648 -0.014 -23.989 59 HA VAL 8 HA VAL 8 6.275 0.395 -26.920 60 HB VAL 8 HB VAL 8 8.684 0.623 -26.225 61 HG11 VAL 8 1HG1 VAL 8 8.522 -2.343 -25.549 62 HG12 VAL 8 2HG1 VAL 8 9.957 -1.291 -25.459 63 HG13 VAL 8 3HG1 VAL 8 8.607 -1.041 -24.336 64 HG21 VAL 8 1HG2 VAL 8 9.597 -0.825 -27.962 65 HG22 VAL 8 2HG2 VAL 8 8.113 -1.811 -27.964 66 HG23 VAL 8 3HG2 VAL 8 8.070 -0.116 -28.495 67 H LEU 9 H LEU 9 5.703 -1.542 -28.058 68 HA LEU 9 HA LEU 9 4.571 -3.607 -26.216 69 HB2 LEU 9 1HB LEU 9 3.081 -3.820 -28.495 70 HB3 LEU 9 2HB LEU 9 2.568 -3.050 -27.015 71 HG LEU 9 HG LEU 9 3.917 -1.396 -29.136 72 HD11 LEU 9 1HD1 LEU 9 1.011 -2.278 -29.084 73 HD12 LEU 9 2HD1 LEU 9 2.221 -2.702 -30.321 74 HD13 LEU 9 3HD1 LEU 9 1.685 -1.011 -30.129 75 HD21 LEU 9 1HD2 LEU 9 3.381 -0.441 -26.873 76 HD22 LEU 9 2HD2 LEU 9 1.665 -0.818 -27.128 77 HD23 LEU 9 3HD2 LEU 9 2.499 0.372 -28.180 78 H ALA 10 H ALA 10 4.356 -5.707 -26.980 79 HA ALA 10 HA ALA 10 6.069 -6.385 -29.335 80 HB1 ALA 10 1HB ALA 10 7.333 -6.542 -27.112 81 HB2 ALA 10 2HB ALA 10 6.228 -7.860 -26.689 82 HB3 ALA 10 3HB ALA 10 7.303 -8.002 -28.113 83 H LYS 11 H LYS 11 5.561 -8.438 -30.226 84 HA LYS 11 HA LYS 11 2.810 -9.413 -29.518 85 HB2 LYS 11 1HB LYS 11 3.248 -8.624 -31.895 86 HB3 LYS 11 2HB LYS 11 4.481 -9.883 -32.030 87 HG2 LYS 11 1HG LYS 11 2.221 -11.274 -31.168 88 HG3 LYS 11 2HG LYS 11 1.551 -10.068 -32.270 89 HD2 LYS 11 1HD LYS 11 3.898 -11.876 -32.991 90 HD3 LYS 11 2HD LYS 11 2.196 -12.304 -33.290 91 HE2 LYS 11 1HE LYS 11 1.942 -10.189 -34.613 92 HE3 LYS 11 2HE LYS 11 3.682 -9.916 -34.461 93 HZ1 LYS 11 1HZ LYS 11 3.115 -11.078 -36.512 94 HZ2 LYS 11 2HZ LYS 11 2.419 -12.310 -35.673 95 HZ3 LYS 11 3HZ LYS 11 4.039 -12.057 -35.558 96 H ALA 12 H ALA 12 2.612 -11.483 -28.766 97 HA ALA 12 HA ALA 12 5.028 -12.970 -28.149 98 HB1 ALA 12 1HB ALA 12 3.324 -14.738 -27.446 99 HB2 ALA 12 2HB ALA 12 3.191 -13.160 -26.638 100 HB3 ALA 12 3HB ALA 12 2.060 -13.586 -27.935 101 H LEU 13 H LEU 13 6.017 -14.492 -29.282 102 HA LEU 13 HA LEU 13 4.976 -15.134 -31.977 103 HB2 LEU 13 1HB LEU 13 7.581 -15.819 -30.568 104 HB3 LEU 13 2HB LEU 13 7.213 -16.199 -32.256 105 HG LEU 13 HG LEU 13 7.356 -13.374 -31.130 106 HD11 LEU 13 1HD1 LEU 13 9.425 -14.968 -32.705 107 HD12 LEU 13 2HD1 LEU 13 9.541 -14.528 -30.989 108 HD13 LEU 13 3HD1 LEU 13 9.572 -13.259 -32.219 109 HD21 LEU 13 1HD2 LEU 13 7.532 -12.780 -33.545 110 HD22 LEU 13 2HD2 LEU 13 5.975 -13.520 -33.150 111 HD23 LEU 13 3HD2 LEU 13 7.244 -14.469 -33.981 112 H TYR 14 H TYR 14 5.394 -16.511 -28.818 113 HA TYR 14 HA TYR 14 4.356 -19.121 -29.807 114 HB2 TYR 14 1HB TYR 14 6.368 -18.747 -27.570 115 HB3 TYR 14 2HB TYR 14 5.786 -20.273 -28.224 116 HD1 TYR 14 HD1 TYR 14 8.168 -17.528 -28.610 117 HD2 TYR 14 HD2 TYR 14 6.514 -20.967 -30.584 118 HE1 TYR 14 HE1 TYR 14 10.080 -17.511 -30.202 119 HE2 TYR 14 HE2 TYR 14 8.444 -20.943 -32.194 120 HH TYR 14 HH TYR 14 11.062 -18.521 -31.996 121 H ASP 15 H ASP 15 3.147 -20.270 -28.066 122 HA ASP 15 HA ASP 15 1.804 -18.340 -26.232 123 HB2 ASP 15 1HB ASP 15 0.136 -20.249 -26.015 124 HB3 ASP 15 2HB ASP 15 0.242 -19.508 -27.607 125 H ASN 16 H ASN 16 1.312 -19.078 -24.028 126 HA ASN 16 HA ASN 16 3.140 -21.178 -23.007 127 HB2 ASN 16 1HB ASN 16 4.239 -19.822 -21.528 128 HB3 ASN 16 2HB ASN 16 4.035 -18.657 -22.824 129 HD21 ASN 16 1HD2 ASN 16 2.848 -17.585 -19.251 130 HD22 ASN 16 2HD2 ASN 16 4.110 -18.732 -19.635 131 H VAL 17 H VAL 17 2.655 -21.531 -20.599 132 HA VAL 17 HA VAL 17 -0.175 -20.952 -19.892 133 HB VAL 17 HB VAL 17 1.308 -23.604 -19.444 134 HG11 VAL 17 1HG1 VAL 17 -0.767 -24.360 -18.342 135 HG12 VAL 17 2HG1 VAL 17 -0.070 -22.973 -17.490 136 HG13 VAL 17 3HG1 VAL 17 -1.485 -22.748 -18.556 137 HG21 VAL 17 1HG2 VAL 17 -1.138 -22.995 -21.156 138 HG22 VAL 17 2HG2 VAL 17 0.465 -23.511 -21.725 139 HG23 VAL 17 3HG2 VAL 17 -0.526 -24.626 -20.775 140 H ALA 18 H ALA 18 -0.020 -19.829 -17.953 141 HA ALA 18 HA ALA 18 2.659 -19.619 -16.769 142 HB1 ALA 18 1HB ALA 18 1.391 -17.549 -17.177 143 HB2 ALA 18 2HB ALA 18 0.060 -18.148 -16.167 144 HB3 ALA 18 3HB ALA 18 1.637 -17.782 -15.441 145 H GLU 19 H GLU 19 3.225 -20.353 -14.788 146 HA GLU 19 HA GLU 19 1.054 -21.794 -13.265 147 HB2 GLU 19 1HB GLU 19 2.792 -23.325 -12.460 148 HB3 GLU 19 2HB GLU 19 2.571 -23.404 -14.207 149 HG2 GLU 19 1HG GLU 19 4.613 -22.067 -14.538 150 HG3 GLU 19 2HG GLU 19 4.841 -21.934 -12.791 151 H SER 20 H SER 20 3.786 -19.561 -13.118 152 HA SER 20 HA SER 20 3.569 -19.399 -10.175 153 HB2 SER 20 1HB SER 20 5.278 -17.877 -12.181 154 HB3 SER 20 2HB SER 20 5.370 -17.705 -10.415 155 HG SER 20 HG SER 20 5.854 -20.062 -11.938 156 HA PRO 21 HA PRO 21 0.702 -16.058 -10.578 157 HB2 PRO 21 1HB PRO 21 1.059 -14.600 -8.289 158 HB3 PRO 21 2HB PRO 21 0.308 -16.237 -8.273 159 HG2 PRO 21 1HG PRO 21 3.168 -15.473 -7.714 160 HG3 PRO 21 2HG PRO 21 2.065 -16.496 -6.746 161 HD2 PRO 21 1HD PRO 21 3.878 -17.566 -8.453 162 HD3 PRO 21 2HD PRO 21 2.254 -18.303 -8.223 163 H ASP 22 H ASP 22 4.097 -15.536 -10.123 164 HA ASP 22 HA ASP 22 4.162 -12.697 -10.749 165 HB2 ASP 22 1HB ASP 22 6.302 -14.869 -10.821 166 HB3 ASP 22 2HB ASP 22 6.603 -13.131 -10.925 167 H GLU 23 H GLU 23 3.699 -15.548 -12.569 168 HA GLU 23 HA GLU 23 5.054 -14.529 -14.988 169 HB2 GLU 23 1HB GLU 23 5.255 -16.901 -14.088 170 HB3 GLU 23 2HB GLU 23 3.558 -17.120 -14.538 171 HG2 GLU 23 1HG GLU 23 4.168 -16.570 -16.886 172 HG3 GLU 23 2HG GLU 23 5.866 -16.504 -16.368 173 H LEU 24 H LEU 24 3.967 -14.017 -16.887 174 HA LEU 24 HA LEU 24 1.074 -13.510 -16.562 175 HB2 LEU 24 1HB LEU 24 3.269 -12.331 -18.027 176 HB3 LEU 24 2HB LEU 24 1.960 -12.755 -19.138 177 HG LEU 24 HG LEU 24 1.664 -11.001 -16.680 178 HD11 LEU 24 1HD1 LEU 24 1.712 -10.329 -19.637 179 HD12 LEU 24 2HD1 LEU 24 3.003 -9.961 -18.454 180 HD13 LEU 24 3HD1 LEU 24 1.412 -9.190 -18.312 181 HD21 LEU 24 1HD2 LEU 24 -0.297 -11.801 -18.855 182 HD22 LEU 24 2HD2 LEU 24 -0.565 -10.441 -17.749 183 HD23 LEU 24 3HD2 LEU 24 -0.453 -12.082 -17.102 184 H SER 25 H SER 25 -0.488 -14.577 -17.684 185 HA SER 25 HA SER 25 0.329 -16.850 -19.421 186 HB2 SER 25 1HB SER 25 -1.394 -17.277 -17.675 187 HB3 SER 25 2HB SER 25 -2.416 -16.009 -18.402 188 HG SER 25 HG SER 25 -1.476 -18.202 -19.915 189 H PHE 26 H PHE 26 0.364 -16.597 -21.575 190 HA PHE 26 HA PHE 26 -1.437 -14.624 -22.887 191 HB2 PHE 26 1HB PHE 26 0.447 -13.555 -24.049 192 HB3 PHE 26 2HB PHE 26 0.576 -13.315 -22.304 193 HD1 PHE 26 HD1 PHE 26 2.388 -14.261 -21.025 194 HD2 PHE 26 HD2 PHE 26 2.007 -15.161 -25.209 195 HE1 PHE 26 HE1 PHE 26 4.655 -15.274 -21.005 196 HE2 PHE 26 HE2 PHE 26 4.277 -16.150 -25.206 197 HZ PHE 26 HZ PHE 26 5.610 -16.220 -23.110 198 H ARG 27 H ARG 27 -1.121 -14.874 -25.348 199 HA ARG 27 HA ARG 27 -0.136 -17.620 -25.972 200 HB2 ARG 27 1HB ARG 27 -2.834 -16.455 -26.740 201 HB3 ARG 27 2HB ARG 27 -2.115 -17.892 -27.496 202 HG2 ARG 27 1HG ARG 27 -2.021 -19.028 -25.308 203 HG3 ARG 27 2HG ARG 27 -2.742 -17.612 -24.525 204 HD2 ARG 27 1HD ARG 27 -4.777 -17.872 -25.921 205 HD3 ARG 27 2HD ARG 27 -4.035 -19.311 -26.660 206 HE ARG 27 HE ARG 27 -4.426 -20.541 -24.737 207 HH11 ARG 27 1HH1 ARG 27 -5.202 -17.157 -24.056 208 HH12 ARG 27 2HH1 ARG 27 -5.951 -17.550 -22.524 209 HH21 ARG 27 1HH2 ARG 27 -5.413 -20.946 -22.791 210 HH22 ARG 27 2HH2 ARG 27 -6.064 -19.657 -21.825 211 H LYS 28 H LYS 28 0.306 -17.959 -28.243 212 HA LYS 28 HA LYS 28 1.818 -15.859 -29.392 213 HB2 LYS 28 1HB LYS 28 1.836 -17.257 -31.431 214 HB3 LYS 28 2HB LYS 28 2.211 -18.161 -29.970 215 HG2 LYS 28 1HG LYS 28 -0.173 -18.969 -29.934 216 HG3 LYS 28 2HG LYS 28 -0.365 -18.261 -31.542 217 HD2 LYS 28 1HD LYS 28 1.356 -19.698 -32.446 218 HD3 LYS 28 2HD LYS 28 1.832 -20.213 -30.821 219 HE2 LYS 28 1HE LYS 28 -0.656 -21.054 -30.630 220 HE3 LYS 28 2HE LYS 28 -0.613 -21.006 -32.409 221 HZ1 LYS 28 1HZ LYS 28 0.072 -23.159 -31.594 222 HZ2 LYS 28 2HZ LYS 28 1.239 -22.484 -30.625 223 HZ3 LYS 28 3HZ LYS 28 1.394 -22.414 -32.265 224 H GLY 29 H GLY 29 1.443 -14.289 -30.780 225 HA2 GLY 29 1HA GLY 29 0.197 -13.109 -32.419 226 HA3 GLY 29 2HA GLY 29 -1.246 -14.043 -32.016 227 H ASP 30 H ASP 30 -0.643 -13.535 -29.046 228 HA ASP 30 HA ASP 30 -2.314 -11.201 -28.831 229 HB2 ASP 30 1HB ASP 30 -1.949 -13.304 -27.257 230 HB3 ASP 30 2HB ASP 30 -0.728 -12.249 -26.500 231 H ILE 31 H ILE 31 -1.771 -9.265 -27.557 232 HA ILE 31 HA ILE 31 1.043 -8.347 -28.100 233 HB ILE 31 HB ILE 31 -1.500 -6.635 -28.128 234 HG12 ILE 31 1HG1 ILE 31 -1.618 -8.191 -29.997 235 HG13 ILE 31 2HG1 ILE 31 -1.375 -6.546 -30.537 236 HG21 ILE 31 1HG2 ILE 31 1.407 -6.037 -28.889 237 HG22 ILE 31 2HG2 ILE 31 0.038 -4.961 -29.292 238 HG23 ILE 31 3HG2 ILE 31 0.449 -5.286 -27.593 239 HD11 ILE 31 1HD1 ILE 31 -0.075 -8.176 -31.859 240 HD12 ILE 31 2HD1 ILE 31 0.993 -7.032 -31.023 241 HD13 ILE 31 3HD1 ILE 31 0.775 -8.680 -30.390 242 H MET 32 H MET 32 2.137 -7.619 -26.378 243 HA MET 32 HA MET 32 0.537 -6.637 -24.044 244 HB2 MET 32 1HB MET 32 2.174 -7.611 -22.513 245 HB3 MET 32 2HB MET 32 1.305 -8.837 -23.428 246 HG2 MET 32 1HG MET 32 4.085 -7.884 -24.206 247 HG3 MET 32 2HG MET 32 3.802 -9.222 -23.082 248 HE1 MET 32 1HE MET 32 1.474 -10.866 -24.109 249 HE2 MET 32 2HE MET 32 2.184 -11.958 -25.291 250 HE3 MET 32 3HE MET 32 3.039 -11.650 -23.769 251 H THR 33 H THR 33 1.432 -5.005 -22.842 252 HA THR 33 HA THR 33 3.423 -3.382 -24.310 253 HB THR 33 HB THR 33 2.006 -2.789 -21.679 254 HG1 THR 33 HG1 THR 33 0.621 -1.544 -23.033 255 HG21 THR 33 1HG2 THR 33 3.996 -1.365 -22.074 256 HG22 THR 33 2HG2 THR 33 2.506 -0.410 -22.287 257 HG23 THR 33 3HG2 THR 33 3.401 -0.979 -23.713 258 H VAL 34 H VAL 34 5.539 -3.361 -23.778 259 HA VAL 34 HA VAL 34 6.432 -4.920 -21.408 260 HB VAL 34 HB VAL 34 8.023 -3.532 -23.622 261 HG11 VAL 34 1HG1 VAL 34 8.878 -5.383 -21.359 262 HG12 VAL 34 2HG1 VAL 34 9.927 -4.957 -22.724 263 HG13 VAL 34 3HG1 VAL 34 9.372 -3.693 -21.599 264 HG21 VAL 34 1HG2 VAL 34 6.685 -5.491 -24.444 265 HG22 VAL 34 2HG2 VAL 34 8.430 -5.812 -24.494 266 HG23 VAL 34 3HG2 VAL 34 7.450 -6.511 -23.198 267 H LEU 35 H LEU 35 6.961 -3.964 -19.545 268 HA LEU 35 HA LEU 35 6.926 -0.973 -19.498 269 HB2 LEU 35 1HB LEU 35 6.384 -3.030 -17.341 270 HB3 LEU 35 2HB LEU 35 6.353 -1.295 -17.115 271 HG LEU 35 HG LEU 35 4.474 -2.841 -18.937 272 HD11 LEU 35 1HD1 LEU 35 4.090 -3.358 -16.579 273 HD12 LEU 35 2HD1 LEU 35 2.802 -2.295 -17.172 274 HD13 LEU 35 3HD1 LEU 35 4.105 -1.630 -16.165 275 HD21 LEU 35 1HD2 LEU 35 3.184 -0.694 -18.959 276 HD22 LEU 35 2HD2 LEU 35 4.777 -0.541 -19.723 277 HD23 LEU 35 3HD2 LEU 35 4.521 0.090 -18.074 278 H GLU 36 H GLU 36 8.775 -3.829 -18.472 279 HA GLU 36 HA GLU 36 11.130 -2.100 -18.095 280 HB2 GLU 36 1HB GLU 36 9.931 -2.200 -15.869 281 HB3 GLU 36 2HB GLU 36 10.177 -3.950 -15.850 282 HG2 GLU 36 1HG GLU 36 11.836 -2.633 -14.477 283 HG3 GLU 36 2HG GLU 36 12.579 -3.663 -15.703 284 H ARG 37 H ARG 37 13.132 -3.571 -17.823 285 HA ARG 37 HA ARG 37 12.600 -6.280 -19.035 286 HB2 ARG 37 1HB ARG 37 14.873 -4.401 -19.720 287 HB3 ARG 37 2HB ARG 37 14.641 -6.030 -20.336 288 HG2 ARG 37 1HG ARG 37 12.412 -5.259 -21.267 289 HG3 ARG 37 2HG ARG 37 12.936 -3.608 -20.883 290 HD2 ARG 37 1HD ARG 37 14.974 -3.991 -22.261 291 HD3 ARG 37 2HD ARG 37 14.325 -5.580 -22.715 292 HE ARG 37 HE ARG 37 12.426 -3.465 -23.188 293 HH11 ARG 37 1HH1 ARG 37 15.262 -5.025 -24.601 294 HH12 ARG 37 2HH1 ARG 37 14.842 -4.531 -26.219 295 HH21 ARG 37 1HH2 ARG 37 11.954 -2.867 -25.281 296 HH22 ARG 37 2HH2 ARG 37 12.996 -3.331 -26.596 297 H ASP 38 H ASP 38 14.072 -7.908 -18.519 298 HA ASP 38 HA ASP 38 15.300 -9.161 -17.109 299 HB2 ASP 38 1HB ASP 38 16.981 -6.683 -16.798 300 HB3 ASP 38 2HB ASP 38 17.499 -8.355 -16.549 301 H THR 39 H THR 39 13.043 -8.105 -16.070 302 HA THR 39 HA THR 39 13.366 -6.411 -13.834 303 HB THR 39 HB THR 39 11.302 -6.630 -15.226 304 HG1 THR 39 HG1 THR 39 11.260 -6.874 -12.419 305 HG21 THR 39 1HG2 THR 39 11.224 -9.108 -15.406 306 HG22 THR 39 2HG2 THR 39 9.712 -8.447 -14.745 307 HG23 THR 39 3HG2 THR 39 10.877 -9.216 -13.664 308 H GLN 40 H GLN 40 13.861 -9.776 -13.960 309 HA GLN 40 HA GLN 40 13.564 -9.944 -10.986 310 HB2 GLN 40 1HB GLN 40 12.205 -11.449 -12.673 311 HB3 GLN 40 2HB GLN 40 13.710 -12.340 -12.796 312 HG2 GLN 40 1HG GLN 40 13.688 -12.678 -10.324 313 HG3 GLN 40 2HG GLN 40 12.128 -11.844 -10.246 314 HE21 GLN 40 1HE2 GLN 40 11.499 -15.487 -10.320 315 HE22 GLN 40 2HE2 GLN 40 12.339 -14.367 -9.265 316 H GLY 41 H GLY 41 15.809 -9.229 -13.194 317 HA2 GLY 41 1HA GLY 41 18.137 -9.357 -13.060 318 HA3 GLY 41 2HA GLY 41 17.997 -10.516 -11.720 319 H LEU 42 H LEU 42 15.890 -11.734 -13.824 320 HA LEU 42 HA LEU 42 17.796 -13.661 -14.966 321 HB2 LEU 42 1HB LEU 42 14.783 -13.334 -15.278 322 HB3 LEU 42 2HB LEU 42 15.726 -14.620 -16.020 323 HG LEU 42 HG LEU 42 15.349 -14.234 -13.039 324 HD11 LEU 42 1HD1 LEU 42 13.890 -16.208 -13.232 325 HD12 LEU 42 2HD1 LEU 42 14.094 -16.201 -15.002 326 HD13 LEU 42 3HD1 LEU 42 13.271 -14.851 -14.183 327 HD21 LEU 42 1HD2 LEU 42 16.288 -16.525 -12.894 328 HD22 LEU 42 2HD2 LEU 42 17.462 -15.353 -13.504 329 HD23 LEU 42 3HD2 LEU 42 16.657 -16.480 -14.632 330 H ASP 43 H ASP 43 18.733 -13.366 -16.858 331 HA ASP 43 HA ASP 43 18.418 -10.993 -18.369 332 HB2 ASP 43 1HB ASP 43 20.465 -12.362 -18.392 333 HB3 ASP 43 2HB ASP 43 19.588 -13.699 -19.151 334 H GLY 44 H GLY 44 17.147 -10.400 -19.981 335 HA2 GLY 44 1HA GLY 44 15.791 -10.632 -21.833 336 HA3 GLY 44 2HA GLY 44 15.957 -12.384 -21.740 337 H TRP 45 H TRP 45 14.872 -11.441 -18.683 338 HA TRP 45 HA TRP 45 12.104 -12.166 -19.540 339 HB2 TRP 45 1HB TRP 45 13.543 -12.190 -16.885 340 HB3 TRP 45 2HB TRP 45 11.780 -12.340 -16.995 341 HD1 TRP 45 HD1 TRP 45 14.987 -14.165 -18.154 342 HE1 TRP 45 HE1 TRP 45 14.492 -16.615 -18.579 343 HE3 TRP 45 HE3 TRP 45 9.919 -13.981 -17.521 344 HZ2 TRP 45 HZ2 TRP 45 12.185 -18.318 -18.623 345 HZ3 TRP 45 HZ3 TRP 45 8.599 -16.085 -17.741 346 HH2 TRP 45 HH2 TRP 45 9.732 -18.235 -18.310 347 H TRP 46 H TRP 46 10.835 -10.541 -20.071 348 HA TRP 46 HA TRP 46 11.377 -7.896 -18.892 349 HB2 TRP 46 1HB TRP 46 9.617 -8.707 -21.207 350 HB3 TRP 46 2HB TRP 46 10.021 -7.058 -20.723 351 HD1 TRP 46 HD1 TRP 46 13.255 -8.412 -20.294 352 HE1 TRP 46 HE1 TRP 46 14.748 -8.421 -22.332 353 HE3 TRP 46 HE3 TRP 46 9.603 -7.784 -23.799 354 HZ2 TRP 46 HZ2 TRP 46 14.406 -8.225 -25.175 355 HZ3 TRP 46 HZ3 TRP 46 10.247 -7.740 -26.217 356 HH2 TRP 46 HH2 TRP 46 12.643 -7.945 -26.879 357 H LEU 47 H LEU 47 9.868 -6.646 -17.849 358 HA LEU 47 HA LEU 47 7.567 -8.122 -16.703 359 HB2 LEU 47 1HB LEU 47 8.912 -6.456 -15.345 360 HB3 LEU 47 2HB LEU 47 8.389 -5.194 -16.433 361 HG LEU 47 HG LEU 47 6.013 -5.711 -15.762 362 HD11 LEU 47 1HD1 LEU 47 6.288 -7.978 -14.880 363 HD12 LEU 47 2HD1 LEU 47 5.678 -6.908 -13.613 364 HD13 LEU 47 3HD1 LEU 47 7.388 -7.386 -13.608 365 HD21 LEU 47 1HD2 LEU 47 7.287 -3.829 -14.848 366 HD22 LEU 47 2HD2 LEU 47 7.957 -4.877 -13.572 367 HD23 LEU 47 3HD2 LEU 47 6.211 -4.512 -13.610 368 H CYS 48 H CYS 48 5.849 -8.317 -18.014 369 HA CYS 48 HA CYS 48 5.215 -6.031 -19.832 370 HB2 CYS 48 1HB CYS 48 4.484 -8.951 -20.142 371 HB3 CYS 48 2HB CYS 48 4.159 -7.649 -21.291 372 HG CYS 48 HG CYS 48 7.069 -8.786 -20.225 373 H SER 49 H SER 49 2.893 -5.748 -20.214 374 HA SER 49 HA SER 49 1.243 -6.645 -17.887 375 HB2 SER 49 1HB SER 49 1.783 -4.297 -17.622 376 HB3 SER 49 2HB SER 49 1.211 -3.954 -19.262 377 HG SER 49 HG SER 49 -0.335 -3.484 -17.625 378 H LEU 50 H LEU 50 -0.618 -7.576 -18.351 379 HA LEU 50 HA LEU 50 -2.001 -7.176 -20.910 380 HB2 LEU 50 1HB LEU 50 -0.200 -8.819 -21.480 381 HB3 LEU 50 2HB LEU 50 -0.770 -9.875 -20.197 382 HG LEU 50 HG LEU 50 -2.976 -9.247 -21.957 383 HD11 LEU 50 1HD1 LEU 50 -2.175 -10.246 -24.008 384 HD12 LEU 50 2HD1 LEU 50 -0.556 -10.417 -23.308 385 HD13 LEU 50 3HD1 LEU 50 -1.233 -8.797 -23.597 386 HD21 LEU 50 1HD2 LEU 50 -1.426 -11.839 -21.452 387 HD22 LEU 50 2HD2 LEU 50 -3.054 -11.701 -22.168 388 HD23 LEU 50 3HD2 LEU 50 -2.787 -11.238 -20.476 389 H HIS 51 H HIS 51 -4.167 -7.722 -20.649 390 HA HIS 51 HA HIS 51 -6.120 -8.199 -19.566 391 HB2 HIS 51 1HB HIS 51 -4.873 -10.510 -19.770 392 HB3 HIS 51 2HB HIS 51 -4.808 -10.401 -18.001 393 HD1 HIS 51 HD1 HIS 51 -7.421 -9.755 -16.984 394 HD2 HIS 51 HD2 HIS 51 -7.051 -11.819 -20.584 395 HE1 HIS 51 HE1 HIS 51 -9.639 -10.914 -17.399 396 H GLY 52 H GLY 52 -4.197 -6.324 -18.238 397 HA2 GLY 52 1HA GLY 52 -4.487 -4.954 -16.392 398 HA3 GLY 52 2HA GLY 52 -5.680 -6.077 -15.747 399 H ARG 53 H ARG 53 -3.025 -7.952 -16.447 400 HA ARG 53 HA ARG 53 -1.981 -7.620 -13.664 401 HB2 ARG 53 1HB ARG 53 -1.761 -9.978 -15.575 402 HB3 ARG 53 2HB ARG 53 -1.080 -9.893 -13.946 403 HG2 ARG 53 1HG ARG 53 -3.439 -9.606 -13.089 404 HG3 ARG 53 2HG ARG 53 -3.994 -10.031 -14.724 405 HD2 ARG 53 1HD ARG 53 -2.649 -12.132 -14.583 406 HD3 ARG 53 2HD ARG 53 -2.202 -11.697 -12.923 407 HE ARG 53 HE ARG 53 -5.069 -11.718 -13.269 408 HH11 ARG 53 1HH1 ARG 53 -2.294 -13.842 -12.679 409 HH12 ARG 53 2HH1 ARG 53 -3.276 -15.074 -11.939 410 HH21 ARG 53 1HH2 ARG 53 -6.259 -13.386 -12.334 411 HH22 ARG 53 2HH2 ARG 53 -5.461 -14.820 -11.762 412 H GLN 54 H GLN 54 0.308 -7.691 -13.409 413 HA GLN 54 HA GLN 54 1.865 -7.190 -15.919 414 HB2 GLN 54 1HB GLN 54 2.374 -6.188 -13.095 415 HB3 GLN 54 2HB GLN 54 3.442 -5.940 -14.486 416 HG2 GLN 54 1HG GLN 54 1.873 -4.514 -15.558 417 HG3 GLN 54 2HG GLN 54 0.595 -4.947 -14.422 418 HE21 GLN 54 1HE2 GLN 54 1.404 -2.482 -12.125 419 HE22 GLN 54 2HE2 GLN 54 0.298 -3.731 -12.647 420 H GLY 55 H GLY 55 3.664 -8.554 -16.080 421 HA2 GLY 55 1HA GLY 55 4.516 -10.206 -13.872 422 HA3 GLY 55 2HA GLY 55 3.448 -11.104 -14.968 423 H ILE 56 H ILE 56 5.975 -12.011 -14.612 424 HA ILE 56 HA ILE 56 7.801 -10.818 -16.536 425 HB ILE 56 HB ILE 56 9.349 -12.584 -15.960 426 HG12 ILE 56 1HG1 ILE 56 7.094 -13.932 -14.417 427 HG13 ILE 56 2HG1 ILE 56 7.706 -14.489 -15.979 428 HG21 ILE 56 1HG2 ILE 56 9.635 -12.098 -13.629 429 HG22 ILE 56 2HG2 ILE 56 8.794 -10.680 -14.290 430 HG23 ILE 56 3HG2 ILE 56 7.891 -11.900 -13.350 431 HD11 ILE 56 1HD1 ILE 56 9.962 -14.780 -14.877 432 HD12 ILE 56 2HD1 ILE 56 9.159 -14.461 -13.319 433 HD13 ILE 56 3HD1 ILE 56 8.679 -15.856 -14.305 434 H VAL 57 H VAL 57 8.357 -11.466 -18.535 435 HA VAL 57 HA VAL 57 7.003 -13.834 -19.717 436 HB VAL 57 HB VAL 57 7.051 -11.031 -20.931 437 HG11 VAL 57 1HG1 VAL 57 7.413 -12.580 -22.725 438 HG12 VAL 57 2HG1 VAL 57 6.148 -13.659 -22.111 439 HG13 VAL 57 3HG1 VAL 57 5.709 -12.081 -22.784 440 HG21 VAL 57 1HG2 VAL 57 5.276 -11.224 -19.288 441 HG22 VAL 57 2HG2 VAL 57 4.566 -11.229 -20.910 442 HG23 VAL 57 3HG2 VAL 57 4.723 -12.755 -20.005 443 HA PRO 58 HA PRO 58 11.272 -13.915 -21.027 444 HB2 PRO 58 1HB PRO 58 11.260 -15.986 -22.826 445 HB3 PRO 58 2HB PRO 58 11.156 -16.235 -21.043 446 HG2 PRO 58 1HG PRO 58 8.935 -16.188 -23.073 447 HG3 PRO 58 2HG PRO 58 9.249 -17.370 -21.758 448 HD2 PRO 58 1HD PRO 58 7.448 -15.349 -21.523 449 HD3 PRO 58 2HD PRO 58 8.407 -15.951 -20.138 450 H GLY 59 H GLY 59 11.894 -12.210 -22.219 451 HA2 GLY 59 1HA GLY 59 10.412 -11.130 -24.366 452 HA3 GLY 59 2HA GLY 59 12.070 -10.728 -23.930 453 H ASN 60 H ASN 60 12.851 -13.609 -24.384 454 HA ASN 60 HA ASN 60 13.646 -13.410 -27.125 455 HB2 ASN 60 1HB ASN 60 14.676 -14.775 -25.216 456 HB3 ASN 60 2HB ASN 60 13.407 -15.971 -25.511 457 HD21 ASN 60 1HD2 ASN 60 15.968 -17.374 -27.543 458 HD22 ASN 60 2HD2 ASN 60 15.243 -17.405 -25.955 459 H ARG 61 H ARG 61 10.698 -14.534 -25.605 460 HA ARG 61 HA ARG 61 9.831 -15.951 -28.077 461 HB2 ARG 61 1HB ARG 61 8.479 -15.541 -25.383 462 HB3 ARG 61 2HB ARG 61 7.769 -16.413 -26.742 463 HG2 ARG 61 1HG ARG 61 9.834 -17.920 -26.655 464 HG3 ARG 61 2HG ARG 61 10.144 -17.203 -25.062 465 HD2 ARG 61 1HD ARG 61 7.892 -17.908 -24.320 466 HD3 ARG 61 2HD ARG 61 7.572 -18.575 -25.927 467 HE ARG 61 HE ARG 61 9.949 -19.721 -24.753 468 HH11 ARG 61 1HH1 ARG 61 6.412 -19.970 -24.686 469 HH12 ARG 61 2HH1 ARG 61 6.458 -21.617 -24.125 470 HH21 ARG 61 1HH2 ARG 61 9.909 -21.836 -24.032 471 HH22 ARG 61 2HH2 ARG 61 8.379 -22.637 -23.757 472 H LEU 62 H LEU 62 10.114 -12.801 -27.347 473 HA LEU 62 HA LEU 62 7.422 -12.081 -28.448 474 HB2 LEU 62 1HB LEU 62 9.301 -10.434 -26.716 475 HB3 LEU 62 2HB LEU 62 7.737 -9.929 -27.321 476 HG LEU 62 HG LEU 62 8.222 -12.042 -25.229 477 HD11 LEU 62 1HD1 LEU 62 7.147 -10.379 -23.726 478 HD12 LEU 62 2HD1 LEU 62 6.996 -9.254 -25.079 479 HD13 LEU 62 3HD1 LEU 62 8.606 -9.709 -24.475 480 HD21 LEU 62 1HD2 LEU 62 5.661 -11.051 -26.538 481 HD22 LEU 62 2HD2 LEU 62 5.685 -11.889 -24.974 482 HD23 LEU 62 3HD2 LEU 62 6.261 -12.721 -26.424 483 H LYS 63 H LYS 63 7.317 -10.404 -29.969 484 HA LYS 63 HA LYS 63 9.974 -9.528 -31.053 485 HB2 LYS 63 1HB LYS 63 8.777 -11.138 -32.545 486 HB3 LYS 63 2HB LYS 63 7.437 -9.980 -32.675 487 HG2 LYS 63 1HG LYS 63 8.916 -8.344 -33.730 488 HG3 LYS 63 2HG LYS 63 10.324 -9.377 -33.431 489 HD2 LYS 63 1HD LYS 63 9.293 -11.120 -34.892 490 HD3 LYS 63 2HD LYS 63 7.977 -9.992 -35.259 491 HE2 LYS 63 1HE LYS 63 9.599 -8.378 -36.183 492 HE3 LYS 63 2HE LYS 63 10.940 -9.459 -35.743 493 HZ1 LYS 63 1HZ LYS 63 10.070 -11.094 -37.290 494 HZ2 LYS 63 2HZ LYS 63 10.340 -9.677 -38.085 495 HZ3 LYS 63 3HZ LYS 63 8.810 -10.122 -37.695 496 H ILE 64 H ILE 64 10.277 -7.462 -30.699 497 HA ILE 64 HA ILE 64 8.259 -5.669 -29.754 498 HB ILE 64 HB ILE 64 11.012 -5.159 -31.004 499 HG12 ILE 64 1HG1 ILE 64 10.994 -6.474 -28.850 500 HG13 ILE 64 2HG1 ILE 64 11.854 -4.943 -28.765 501 HG21 ILE 64 1HG2 ILE 64 9.105 -3.209 -29.627 502 HG22 ILE 64 2HG2 ILE 64 10.845 -2.878 -29.817 503 HG23 ILE 64 3HG2 ILE 64 9.818 -3.085 -31.246 504 HD11 ILE 64 1HD1 ILE 64 10.475 -5.435 -26.743 505 HD12 ILE 64 2HD1 ILE 64 10.040 -3.892 -27.504 506 HD13 ILE 64 3HD1 ILE 64 9.013 -5.325 -27.728 507 H LEU 65 H LEU 65 6.920 -4.289 -30.765 508 HA LEU 65 HA LEU 65 6.666 -4.462 -33.693 509 HB2 LEU 65 1HB LEU 65 5.242 -2.926 -31.502 510 HB3 LEU 65 2HB LEU 65 5.007 -2.507 -33.176 511 HG LEU 65 HG LEU 65 3.142 -3.791 -32.411 512 HD11 LEU 65 1HD1 LEU 65 3.944 -4.128 -34.747 513 HD12 LEU 65 2HD1 LEU 65 3.048 -5.510 -34.097 514 HD13 LEU 65 3HD1 LEU 65 4.822 -5.584 -34.215 515 HD21 LEU 65 1HD2 LEU 65 5.031 -6.108 -31.792 516 HD22 LEU 65 2HD2 LEU 65 3.255 -6.081 -31.633 517 HD23 LEU 65 3HD2 LEU 65 4.241 -5.059 -30.588 518 H VAL 66 H VAL 66 8.200 -3.480 -34.839 519 HA VAL 66 HA VAL 66 9.640 -1.941 -35.645 520 HB VAL 66 HB VAL 66 8.003 0.226 -34.254 521 HG11 VAL 66 1HG1 VAL 66 8.609 1.551 -36.273 522 HG12 VAL 66 2HG1 VAL 66 10.045 1.011 -35.403 523 HG13 VAL 66 3HG1 VAL 66 9.552 0.186 -36.902 524 HG21 VAL 66 1HG2 VAL 66 6.395 -1.246 -35.363 525 HG22 VAL 66 2HG2 VAL 66 6.574 0.219 -36.334 526 HG23 VAL 66 3HG2 VAL 66 7.381 -1.281 -36.855 527 H GLY 67 H GLY 67 11.224 -2.966 -34.138 528 HA2 GLY 67 1HA GLY 67 12.630 -0.738 -32.831 529 HA3 GLY 67 2HA GLY 67 12.267 -2.137 -31.799 530 H MET 68 H MET 68 14.596 -0.746 -33.739 531 HA MET 68 HA MET 68 16.307 -3.062 -33.724 532 HB2 MET 68 1HB MET 68 14.568 -2.983 -35.918 533 HB3 MET 68 2HB MET 68 16.030 -2.208 -36.536 534 HG2 MET 68 1HG MET 68 17.338 -4.193 -35.717 535 HG3 MET 68 2HG MET 68 15.815 -4.970 -35.283 536 HE1 MET 68 1HE MET 68 14.086 -5.916 -37.000 537 HE2 MET 68 2HE MET 68 13.803 -4.295 -37.692 538 HE3 MET 68 3HE MET 68 14.169 -5.677 -38.758 539 H TYR 69 H TYR 69 18.340 -2.456 -34.991 540 HA TYR 69 HA TYR 69 20.011 -1.122 -35.674 541 HB2 TYR 69 1HB TYR 69 17.710 0.370 -36.502 542 HB3 TYR 69 2HB TYR 69 18.932 1.497 -35.899 543 HD1 TYR 69 HD1 TYR 69 17.953 -0.715 -38.612 544 HD2 TYR 69 HD2 TYR 69 21.288 1.393 -36.903 545 HE1 TYR 69 HE1 TYR 69 19.189 -0.919 -40.760 546 HE2 TYR 69 HE2 TYR 69 22.534 1.164 -39.048 547 HH TYR 69 HH TYR 69 22.481 0.352 -41.211 548 H ASP 70 H ASP 70 21.583 -0.711 -34.389 549 HA ASP 70 HA ASP 70 21.137 1.065 -32.037 550 HB2 ASP 70 1HB ASP 70 23.193 -1.139 -32.317 551 HB3 ASP 70 2HB ASP 70 22.694 -0.308 -30.843 552 H LYS 71 H LYS 71 23.468 0.255 -34.601 553 HA LYS 71 HA LYS 71 25.534 1.107 -35.170 554 HB2 LYS 71 1HB LYS 71 24.040 3.675 -34.519 555 HB3 LYS 71 2HB LYS 71 25.655 3.629 -35.217 556 HG2 LYS 71 1HG LYS 71 24.721 2.258 -37.111 557 HG3 LYS 71 2HG LYS 71 23.099 2.653 -36.492 558 HD2 LYS 71 1HD LYS 71 23.628 5.055 -36.681 559 HD3 LYS 71 2HD LYS 71 25.274 4.666 -37.202 560 HE2 LYS 71 1HE LYS 71 24.364 3.528 -39.218 561 HE3 LYS 71 2HE LYS 71 22.724 4.008 -38.728 562 HZ1 LYS 71 1HZ LYS 71 23.691 5.575 -40.333 563 HZ2 LYS 71 2HZ LYS 71 24.944 5.908 -39.301 564 HZ3 LYS 71 3HZ LYS 71 23.400 6.330 -38.894 565 H LYS 72 H LYS 72 26.230 -0.009 -33.099 566 HA LYS 72 HA LYS 72 27.100 1.462 -30.839 567 HB2 LYS 72 1HB LYS 72 28.557 -0.431 -30.414 568 HB3 LYS 72 2HB LYS 72 27.023 -1.040 -31.069 569 HG2 LYS 72 1HG LYS 72 28.115 -1.221 -33.322 570 HG3 LYS 72 2HG LYS 72 29.639 -0.697 -32.584 571 HD2 LYS 72 1HD LYS 72 29.434 -2.628 -31.003 572 HD3 LYS 72 2HD LYS 72 28.068 -3.203 -31.996 573 HE2 LYS 72 1HE LYS 72 29.549 -3.284 -33.970 574 HE3 LYS 72 2HE LYS 72 30.886 -2.625 -33.024 575 HZ1 LYS 72 1HZ LYS 72 31.068 -5.015 -33.243 576 HZ2 LYS 72 2HZ LYS 72 29.585 -5.240 -32.541 577 HZ3 LYS 72 3HZ LYS 72 30.833 -4.618 -31.664 578 HA PRO 73 HA PRO 73 30.493 3.730 -32.567 579 HB2 PRO 73 1HB PRO 73 32.231 4.009 -30.504 580 HB3 PRO 73 2HB PRO 73 30.611 4.773 -30.472 581 HG2 PRO 73 1HG PRO 73 31.483 2.154 -29.273 582 HG3 PRO 73 2HG PRO 73 30.660 3.530 -28.475 583 HD2 PRO 73 1HD PRO 73 29.271 1.398 -29.394 584 HD3 PRO 73 2HD PRO 73 28.610 3.069 -29.555 585 H ALA 74 H ALA 74 32.931 3.718 -32.876 586 HA ALA 74 HA ALA 74 34.324 1.152 -32.565 587 HB1 ALA 74 1HB ALA 74 33.780 2.366 -35.353 588 HB2 ALA 74 2HB ALA 74 34.812 0.957 -35.000 589 HB3 ALA 74 3HB ALA 74 33.062 0.862 -34.728 590 H GLY 75 H GLY 75 36.660 1.552 -33.504 591 HA2 GLY 75 1HA GLY 75 37.372 4.380 -33.764 592 HA3 GLY 75 2HA GLY 75 38.036 3.561 -32.333 593 H GLU 76 H GLU 76 38.688 4.425 -35.450 594 HA GLU 76 HA GLU 76 40.007 1.966 -36.349 595 HB2 GLU 76 1HB GLU 76 39.932 4.801 -37.462 596 HB3 GLU 76 2HB GLU 76 40.677 3.415 -38.285 597 HG2 GLU 76 1HG GLU 76 37.777 3.312 -37.472 598 HG3 GLU 76 2HG GLU 76 38.268 4.192 -38.920 599 H PHE 77 H PHE 77 40.892 4.655 -34.405 600 HA PHE 77 HA PHE 77 43.761 4.268 -35.095 601 HB2 PHE 77 1HB PHE 77 42.439 6.724 -33.910 602 HB3 PHE 77 2HB PHE 77 44.127 6.564 -34.423 603 HD1 PHE 77 HD1 PHE 77 40.912 7.675 -35.365 604 HD2 PHE 77 HD2 PHE 77 44.446 5.822 -36.971 605 HE1 PHE 77 HE1 PHE 77 40.273 8.457 -37.630 606 HE2 PHE 77 HE2 PHE 77 43.822 6.601 -39.255 607 HZ PHE 77 HZ PHE 77 41.738 7.920 -39.591 608 H ILE 78 H ILE 78 44.772 3.062 -33.704 609 HA ILE 78 HA ILE 78 44.662 3.881 -30.852 610 HB ILE 78 HB ILE 78 45.029 1.509 -30.158 611 HG12 ILE 78 1HG1 ILE 78 44.333 0.738 -33.036 612 HG13 ILE 78 2HG1 ILE 78 45.980 0.770 -32.388 613 HG21 ILE 78 1HG2 ILE 78 42.711 0.763 -30.330 614 HG22 ILE 78 2HG2 ILE 78 42.682 2.537 -30.251 615 HG23 ILE 78 3HG2 ILE 78 42.447 1.718 -31.815 616 HD11 ILE 78 1HD1 ILE 78 45.143 -1.512 -32.358 617 HD12 ILE 78 2HD1 ILE 78 45.343 -0.942 -30.683 618 HD13 ILE 78 3HD1 ILE 78 43.725 -1.015 -31.417 619 H VAL 79 H VAL 79 46.820 3.544 -29.863 620 HA VAL 79 HA VAL 79 49.023 3.048 -31.795 621 HB VAL 79 HB VAL 79 50.254 5.080 -30.900 622 HG11 VAL 79 1HG1 VAL 79 49.064 5.144 -33.091 623 HG12 VAL 79 2HG1 VAL 79 47.621 5.804 -32.293 624 HG13 VAL 79 3HG1 VAL 79 49.151 6.732 -32.315 625 HG21 VAL 79 1HG2 VAL 79 47.515 5.902 -29.789 626 HG22 VAL 79 2HG2 VAL 79 48.908 5.390 -28.809 627 HG23 VAL 79 3HG2 VAL 79 48.995 6.876 -29.778 628 H THR 80 H THR 80 51.035 2.573 -30.689 629 HA THR 80 HA THR 80 50.770 2.070 -27.761 630 HB THR 80 HB THR 80 52.055 -0.112 -28.108 631 HG1 THR 80 HG1 THR 80 52.740 -0.404 -30.089 632 HG21 THR 80 1HG2 THR 80 49.323 -0.006 -29.442 633 HG22 THR 80 2HG2 THR 80 49.601 -0.092 -27.683 634 HG23 THR 80 3HG2 THR 80 50.105 -1.435 -28.737 635 H ASP 81 H ASP 81 53.190 1.484 -30.309 636 HA ASP 81 HA ASP 81 55.121 3.410 -29.212 637 HB2 ASP 81 1HB ASP 81 56.840 1.691 -28.838 638 HB3 ASP 81 2HB ASP 81 55.439 1.275 -27.859 639 HXT ASP 81 H02 ASP 81 55.389 1.800 -32.734 Start of MODEL 6 1 H2 GLY 1 2H0 GLY 1 5.573 15.584 -10.904 2 H GLY 1 1H0 GLY 1 3.991 15.286 -10.607 3 HA2 GLY 1 1HA GLY 1 3.756 13.851 -12.498 4 HA3 GLY 1 2HA GLY 1 4.595 15.335 -13.039 5 H SER 2 H SER 2 6.060 12.964 -11.049 6 HA SER 2 HA SER 2 8.145 12.449 -13.071 7 HB2 SER 2 1HB SER 2 7.807 11.457 -10.221 8 HB3 SER 2 2HB SER 2 9.204 11.102 -11.259 9 HG SER 2 HG SER 2 8.306 13.670 -10.417 10 H MET 3 H MET 3 7.242 11.213 -14.698 11 HA MET 3 HA MET 3 6.498 8.422 -13.918 12 HB2 MET 3 1HB MET 3 4.540 9.766 -14.714 13 HB3 MET 3 2HB MET 3 5.404 10.091 -16.216 14 HG2 MET 3 1HG MET 3 5.426 7.664 -16.715 15 HG3 MET 3 2HG MET 3 4.525 7.362 -15.220 16 HE1 MET 3 1HE MET 3 3.456 6.307 -18.031 17 HE2 MET 3 2HE MET 3 2.552 6.111 -16.506 18 HE3 MET 3 3HE MET 3 1.743 6.784 -17.938 19 H LYS 4 H LYS 4 7.588 6.822 -15.053 20 HA LYS 4 HA LYS 4 8.865 7.332 -17.608 21 HB2 LYS 4 1HB LYS 4 11.199 6.855 -16.795 22 HB3 LYS 4 2HB LYS 4 10.552 8.437 -16.397 23 HG2 LYS 4 1HG LYS 4 9.951 7.391 -14.064 24 HG3 LYS 4 2HG LYS 4 11.070 6.105 -14.536 25 HD2 LYS 4 1HD LYS 4 12.374 7.628 -13.305 26 HD3 LYS 4 2HD LYS 4 12.765 7.980 -15.000 27 HE2 LYS 4 1HE LYS 4 11.149 9.874 -14.964 28 HE3 LYS 4 2HE LYS 4 10.748 9.499 -13.282 29 HZ1 LYS 4 1HZ LYS 4 13.040 9.981 -12.686 30 HZ2 LYS 4 2HZ LYS 4 12.377 11.283 -13.446 31 HZ3 LYS 4 3HZ LYS 4 13.431 10.298 -14.258 32 H TYR 5 H TYR 5 8.493 5.512 -18.662 33 HA TYR 5 HA TYR 5 9.323 2.930 -17.508 34 HB2 TYR 5 1HB TYR 5 6.480 3.711 -18.056 35 HB3 TYR 5 2HB TYR 5 7.007 2.148 -18.701 36 HD1 TYR 5 HD1 TYR 5 5.721 3.786 -15.790 37 HD2 TYR 5 HD2 TYR 5 8.303 0.578 -17.016 38 HE1 TYR 5 HE1 TYR 5 5.478 2.706 -13.546 39 HE2 TYR 5 HE2 TYR 5 8.046 -0.495 -14.809 40 HH TYR 5 HH TYR 5 7.142 -0.355 -12.731 41 H LEU 6 H LEU 6 9.354 1.306 -19.422 42 HA LEU 6 HA LEU 6 10.527 2.625 -21.711 43 HB2 LEU 6 1HB LEU 6 9.486 -0.208 -21.367 44 HB3 LEU 6 2HB LEU 6 10.423 0.355 -22.742 45 HG LEU 6 HG LEU 6 11.450 0.329 -19.887 46 HD11 LEU 6 1HD1 LEU 6 12.693 -1.664 -20.541 47 HD12 LEU 6 2HD1 LEU 6 11.959 -1.615 -22.167 48 HD13 LEU 6 3HD1 LEU 6 10.955 -1.931 -20.734 49 HD21 LEU 6 1HD2 LEU 6 13.667 0.567 -20.964 50 HD22 LEU 6 2HD2 LEU 6 12.624 1.960 -21.300 51 HD23 LEU 6 3HD2 LEU 6 12.879 0.716 -22.555 52 H ASN 7 H ASN 7 7.389 1.100 -21.096 53 HA ASN 7 HA ASN 7 5.400 1.129 -22.208 54 HB2 ASN 7 1HB ASN 7 5.738 3.542 -21.459 55 HB3 ASN 7 2HB ASN 7 6.178 3.901 -23.137 56 HD21 ASN 7 1HD2 ASN 7 2.841 4.457 -23.882 57 HD22 ASN 7 2HD2 ASN 7 4.510 4.961 -23.988 58 H VAL 8 H VAL 8 7.221 -0.255 -23.688 59 HA VAL 8 HA VAL 8 6.540 0.503 -26.506 60 HB VAL 8 HB VAL 8 8.423 -0.994 -27.154 61 HG11 VAL 8 1HG1 VAL 8 9.323 1.208 -25.276 62 HG12 VAL 8 2HG1 VAL 8 10.246 0.533 -26.634 63 HG13 VAL 8 3HG1 VAL 8 8.759 1.453 -26.938 64 HG21 VAL 8 1HG2 VAL 8 10.118 -1.684 -25.473 65 HG22 VAL 8 2HG2 VAL 8 9.054 -1.102 -24.173 66 HG23 VAL 8 3HG2 VAL 8 8.551 -2.462 -25.201 67 H LEU 9 H LEU 9 6.169 -1.723 -27.775 68 HA LEU 9 HA LEU 9 4.915 -3.678 -25.918 69 HB2 LEU 9 1HB LEU 9 2.936 -3.782 -27.459 70 HB3 LEU 9 2HB LEU 9 3.056 -2.346 -26.452 71 HG LEU 9 HG LEU 9 4.267 -1.997 -29.114 72 HD11 LEU 9 1HD1 LEU 9 2.095 -1.800 -30.272 73 HD12 LEU 9 2HD1 LEU 9 1.281 -2.481 -28.844 74 HD13 LEU 9 3HD1 LEU 9 2.429 -3.470 -29.764 75 HD21 LEU 9 1HD2 LEU 9 3.882 -0.220 -27.403 76 HD22 LEU 9 2HD2 LEU 9 2.133 -0.477 -27.550 77 HD23 LEU 9 3HD2 LEU 9 3.067 0.132 -28.942 78 H ALA 10 H ALA 10 4.328 -5.683 -26.900 79 HA ALA 10 HA ALA 10 5.919 -6.323 -29.319 80 HB1 ALA 10 1HB ALA 10 7.088 -8.110 -28.174 81 HB2 ALA 10 2HB ALA 10 7.372 -6.600 -27.285 82 HB3 ALA 10 3HB ALA 10 6.201 -7.785 -26.663 83 H LYS 11 H LYS 11 5.370 -8.204 -30.349 84 HA LYS 11 HA LYS 11 2.688 -9.335 -29.637 85 HB2 LYS 11 1HB LYS 11 3.082 -8.522 -31.973 86 HB3 LYS 11 2HB LYS 11 4.455 -9.625 -32.095 87 HG2 LYS 11 1HG LYS 11 2.263 -11.251 -31.335 88 HG3 LYS 11 2HG LYS 11 1.624 -10.138 -32.554 89 HD2 LYS 11 1HD LYS 11 4.144 -11.812 -32.895 90 HD3 LYS 11 2HD LYS 11 2.538 -12.264 -33.506 91 HE2 LYS 11 1HE LYS 11 2.470 -10.163 -34.843 92 HE3 LYS 11 2HE LYS 11 4.091 -9.749 -34.260 93 HZ1 LYS 11 1HZ LYS 11 3.403 -12.113 -35.890 94 HZ2 LYS 11 2HZ LYS 11 4.903 -11.781 -35.296 95 HZ3 LYS 11 3HZ LYS 11 4.209 -10.778 -36.411 96 H ALA 12 H ALA 12 2.583 -11.380 -28.782 97 HA ALA 12 HA ALA 12 5.078 -12.761 -28.180 98 HB1 ALA 12 1HB ALA 12 3.434 -14.561 -27.398 99 HB2 ALA 12 2HB ALA 12 3.372 -12.999 -26.565 100 HB3 ALA 12 3HB ALA 12 2.145 -13.397 -27.792 101 H LEU 13 H LEU 13 5.969 -14.462 -29.135 102 HA LEU 13 HA LEU 13 4.928 -15.216 -31.822 103 HB2 LEU 13 1HB LEU 13 7.558 -15.799 -30.417 104 HB3 LEU 13 2HB LEU 13 7.166 -16.273 -32.065 105 HG LEU 13 HG LEU 13 7.360 -13.394 -31.091 106 HD11 LEU 13 1HD1 LEU 13 9.509 -13.370 -32.296 107 HD12 LEU 13 2HD1 LEU 13 9.338 -15.101 -32.662 108 HD13 LEU 13 3HD1 LEU 13 9.528 -14.552 -30.979 109 HD21 LEU 13 1HD2 LEU 13 7.090 -14.615 -33.876 110 HD22 LEU 13 2HD2 LEU 13 7.443 -12.904 -33.558 111 HD23 LEU 13 3HD2 LEU 13 5.896 -13.596 -33.038 112 H TYR 14 H TYR 14 5.215 -16.372 -28.584 113 HA TYR 14 HA TYR 14 4.329 -19.100 -29.428 114 HB2 TYR 14 1HB TYR 14 6.173 -18.365 -27.131 115 HB3 TYR 14 2HB TYR 14 5.583 -19.992 -27.489 116 HD1 TYR 14 HD1 TYR 14 7.894 -17.299 -28.548 117 HD2 TYR 14 HD2 TYR 14 6.530 -21.285 -29.359 118 HE1 TYR 14 HE1 TYR 14 9.878 -17.666 -30.009 119 HE2 TYR 14 HE2 TYR 14 8.509 -21.656 -30.847 120 HH TYR 14 HH TYR 14 10.434 -20.745 -31.724 121 H ASP 15 H ASP 15 2.992 -20.138 -27.742 122 HA ASP 15 HA ASP 15 1.513 -18.128 -26.108 123 HB2 ASP 15 1HB ASP 15 -0.171 -20.007 -25.877 124 HB3 ASP 15 2HB ASP 15 -0.004 -19.342 -27.500 125 H ASN 16 H ASN 16 0.999 -18.607 -23.954 126 HA ASN 16 HA ASN 16 2.514 -20.736 -22.578 127 HB2 ASN 16 1HB ASN 16 4.064 -18.731 -22.984 128 HB3 ASN 16 2HB ASN 16 3.007 -17.824 -21.896 129 HD21 ASN 16 1HD2 ASN 16 4.686 -18.957 -19.097 130 HD22 ASN 16 2HD2 ASN 16 3.730 -17.729 -19.907 131 H VAL 17 H VAL 17 1.819 -21.003 -20.371 132 HA VAL 17 HA VAL 17 -0.590 -19.412 -19.623 133 HB VAL 17 HB VAL 17 -1.196 -21.459 -18.297 134 HG11 VAL 17 1HG1 VAL 17 -1.047 -21.873 -21.309 135 HG12 VAL 17 2HG1 VAL 17 -2.180 -22.673 -20.197 136 HG13 VAL 17 3HG1 VAL 17 -2.285 -20.917 -20.461 137 HG21 VAL 17 1HG2 VAL 17 1.063 -22.537 -18.306 138 HG22 VAL 17 2HG2 VAL 17 -0.236 -23.624 -18.820 139 HG23 VAL 17 3HG2 VAL 17 0.841 -22.899 -20.032 140 H ALA 18 H ALA 18 -0.717 -18.903 -17.354 141 HA ALA 18 HA ALA 18 1.954 -18.424 -16.243 142 HB1 ALA 18 1HB ALA 18 -0.859 -17.783 -15.214 143 HB2 ALA 18 2HB ALA 18 0.660 -17.231 -14.473 144 HB3 ALA 18 3HB ALA 18 0.215 -16.665 -16.089 145 H GLU 19 H GLU 19 2.922 -20.140 -15.323 146 HA GLU 19 HA GLU 19 1.277 -22.137 -13.828 147 HB2 GLU 19 1HB GLU 19 4.257 -22.026 -14.449 148 HB3 GLU 19 2HB GLU 19 3.420 -23.373 -13.681 149 HG2 GLU 19 1HG GLU 19 2.784 -22.409 -16.498 150 HG3 GLU 19 2HG GLU 19 3.980 -23.657 -16.143 151 H SER 20 H SER 20 2.850 -19.229 -13.410 152 HA SER 20 HA SER 20 2.960 -19.579 -10.442 153 HB2 SER 20 1HB SER 20 5.287 -19.604 -11.272 154 HB3 SER 20 2HB SER 20 4.967 -18.136 -12.221 155 HG SER 20 HG SER 20 6.014 -17.735 -10.185 156 HA PRO 21 HA PRO 21 0.471 -15.970 -10.960 157 HB2 PRO 21 1HB PRO 21 0.810 -14.600 -8.629 158 HB3 PRO 21 2HB PRO 21 -0.100 -16.144 -8.714 159 HG2 PRO 21 1HG PRO 21 2.782 -15.701 -7.950 160 HG3 PRO 21 2HG PRO 21 1.498 -16.580 -7.048 161 HD2 PRO 21 1HD PRO 21 3.228 -17.905 -8.606 162 HD3 PRO 21 2HD PRO 21 1.490 -18.369 -8.570 163 H ASP 22 H ASP 22 3.889 -15.719 -10.254 164 HA ASP 22 HA ASP 22 4.101 -12.863 -10.789 165 HB2 ASP 22 1HB ASP 22 6.149 -15.117 -10.718 166 HB3 ASP 22 2HB ASP 22 6.549 -13.395 -10.838 167 H GLU 23 H GLU 23 3.728 -15.681 -12.712 168 HA GLU 23 HA GLU 23 5.205 -14.629 -15.036 169 HB2 GLU 23 1HB GLU 23 5.265 -17.039 -14.271 170 HB3 GLU 23 2HB GLU 23 3.556 -17.158 -14.700 171 HG2 GLU 23 1HG GLU 23 4.105 -16.635 -17.031 172 HG3 GLU 23 2HG GLU 23 5.809 -16.455 -16.586 173 H LEU 24 H LEU 24 4.197 -13.955 -16.974 174 HA LEU 24 HA LEU 24 1.279 -13.477 -16.683 175 HB2 LEU 24 1HB LEU 24 3.413 -12.066 -17.920 176 HB3 LEU 24 2HB LEU 24 2.320 -12.588 -19.204 177 HG LEU 24 HG LEU 24 1.536 -10.977 -16.751 178 HD11 LEU 24 1HD1 LEU 24 1.276 -9.138 -18.305 179 HD12 LEU 24 2HD1 LEU 24 1.747 -10.184 -19.669 180 HD13 LEU 24 3HD1 LEU 24 2.922 -9.787 -18.391 181 HD21 LEU 24 1HD2 LEU 24 -0.614 -10.626 -17.970 182 HD22 LEU 24 2HD2 LEU 24 -0.379 -12.291 -17.425 183 HD23 LEU 24 3HD2 LEU 24 -0.123 -11.870 -19.137 184 H SER 25 H SER 25 -0.234 -14.552 -17.748 185 HA SER 25 HA SER 25 0.497 -16.728 -19.596 186 HB2 SER 25 1HB SER 25 -1.984 -17.024 -19.718 187 HB3 SER 25 2HB SER 25 -1.412 -17.011 -18.033 188 HG SER 25 HG SER 25 -2.200 -14.617 -19.304 189 H PHE 26 H PHE 26 0.325 -16.565 -21.848 190 HA PHE 26 HA PHE 26 -1.115 -14.316 -23.057 191 HB2 PHE 26 1HB PHE 26 0.889 -13.533 -24.329 192 HB3 PHE 26 2HB PHE 26 0.974 -13.166 -22.609 193 HD1 PHE 26 HD1 PHE 26 2.367 -15.349 -25.287 194 HD2 PHE 26 HD2 PHE 26 2.640 -14.114 -21.182 195 HE1 PHE 26 HE1 PHE 26 4.602 -16.439 -25.106 196 HE2 PHE 26 HE2 PHE 26 4.837 -15.224 -20.979 197 HZ PHE 26 HZ PHE 26 5.843 -16.384 -22.944 198 H ARG 27 H ARG 27 -0.975 -14.547 -25.530 199 HA ARG 27 HA ARG 27 -0.409 -17.406 -26.184 200 HB2 ARG 27 1HB ARG 27 -2.730 -15.740 -27.146 201 HB3 ARG 27 2HB ARG 27 -2.299 -17.343 -27.757 202 HG2 ARG 27 1HG ARG 27 -2.578 -18.235 -25.421 203 HG3 ARG 27 2HG ARG 27 -3.224 -16.647 -24.946 204 HD2 ARG 27 1HD ARG 27 -4.328 -18.400 -27.161 205 HD3 ARG 27 2HD ARG 27 -4.983 -18.325 -25.519 206 HE ARG 27 HE ARG 27 -5.133 -16.223 -27.608 207 HH11 ARG 27 1HH1 ARG 27 -5.923 -17.152 -24.296 208 HH12 ARG 27 2HH1 ARG 27 -7.065 -15.853 -24.107 209 HH21 ARG 27 1HH2 ARG 27 -6.580 -14.575 -27.280 210 HH22 ARG 27 2HH2 ARG 27 -7.428 -14.421 -25.768 211 H LYS 28 H LYS 28 0.210 -17.866 -28.305 212 HA LYS 28 HA LYS 28 1.893 -15.912 -29.552 213 HB2 LYS 28 1HB LYS 28 1.746 -17.419 -31.580 214 HB3 LYS 28 2HB LYS 28 2.361 -18.145 -30.103 215 HG2 LYS 28 1HG LYS 28 0.122 -19.175 -29.699 216 HG3 LYS 28 2HG LYS 28 -0.379 -18.597 -31.300 217 HD2 LYS 28 1HD LYS 28 1.330 -19.914 -32.384 218 HD3 LYS 28 2HD LYS 28 2.106 -20.278 -30.835 219 HE2 LYS 28 1HE LYS 28 0.894 -22.238 -31.558 220 HE3 LYS 28 2HE LYS 28 0.097 -21.559 -30.130 221 HZ1 LYS 28 1HZ LYS 28 -0.807 -21.223 -32.924 222 HZ2 LYS 28 2HZ LYS 28 -1.540 -20.555 -31.602 223 HZ3 LYS 28 3HZ LYS 28 -1.500 -22.193 -31.783 224 H GLY 29 H GLY 29 1.495 -14.255 -30.812 225 HA2 GLY 29 1HA GLY 29 0.327 -13.056 -32.484 226 HA3 GLY 29 2HA GLY 29 -1.092 -14.081 -32.249 227 H ASP 30 H ASP 30 -0.412 -13.478 -29.157 228 HA ASP 30 HA ASP 30 -2.334 -11.273 -29.010 229 HB2 ASP 30 1HB ASP 30 -1.875 -13.376 -27.415 230 HB3 ASP 30 2HB ASP 30 -0.784 -12.230 -26.619 231 H ILE 31 H ILE 31 -1.861 -9.289 -27.750 232 HA ILE 31 HA ILE 31 0.953 -8.360 -28.291 233 HB ILE 31 HB ILE 31 -1.541 -6.600 -28.360 234 HG12 ILE 31 1HG1 ILE 31 -1.883 -8.247 -30.112 235 HG13 ILE 31 2HG1 ILE 31 -1.536 -6.669 -30.791 236 HG21 ILE 31 1HG2 ILE 31 0.479 -5.324 -28.020 237 HG22 ILE 31 2HG2 ILE 31 1.334 -6.198 -29.314 238 HG23 ILE 31 3HG2 ILE 31 0.000 -5.094 -29.717 239 HD11 ILE 31 1HD1 ILE 31 0.784 -7.381 -31.309 240 HD12 ILE 31 2HD1 ILE 31 0.430 -8.986 -30.626 241 HD13 ILE 31 3HD1 ILE 31 -0.426 -8.420 -32.075 242 H MET 32 H MET 32 2.019 -7.541 -26.552 243 HA MET 32 HA MET 32 0.376 -6.529 -24.272 244 HB2 MET 32 1HB MET 32 1.843 -7.680 -22.684 245 HB3 MET 32 2HB MET 32 0.982 -8.798 -23.727 246 HG2 MET 32 1HG MET 32 3.323 -8.468 -25.122 247 HG3 MET 32 2HG MET 32 3.867 -8.348 -23.442 248 HE1 MET 32 1HE MET 32 0.910 -10.440 -25.224 249 HE2 MET 32 2HE MET 32 2.350 -10.519 -26.264 250 HE3 MET 32 3HE MET 32 1.777 -11.975 -25.415 251 H THR 33 H THR 33 1.394 -5.059 -22.882 252 HA THR 33 HA THR 33 3.407 -3.401 -24.281 253 HB THR 33 HB THR 33 2.011 -2.949 -21.592 254 HG1 THR 33 HG1 THR 33 0.484 -3.025 -23.234 255 HG21 THR 33 1HG2 THR 33 4.023 -1.544 -21.896 256 HG22 THR 33 2HG2 THR 33 2.550 -0.557 -22.028 257 HG23 THR 33 3HG2 THR 33 3.430 -1.035 -23.494 258 H VAL 34 H VAL 34 5.532 -3.271 -23.684 259 HA VAL 34 HA VAL 34 6.406 -4.988 -21.374 260 HB VAL 34 HB VAL 34 7.994 -3.791 -23.695 261 HG11 VAL 34 1HG1 VAL 34 9.914 -5.129 -22.760 262 HG12 VAL 34 2HG1 VAL 34 9.413 -3.777 -21.727 263 HG13 VAL 34 3HG1 VAL 34 8.928 -5.436 -21.311 264 HG21 VAL 34 1HG2 VAL 34 7.526 -6.725 -23.011 265 HG22 VAL 34 2HG2 VAL 34 6.594 -5.832 -24.245 266 HG23 VAL 34 3HG2 VAL 34 8.343 -6.073 -24.451 267 H LEU 35 H LEU 35 6.825 -3.996 -19.544 268 HA LEU 35 HA LEU 35 6.910 -1.030 -19.504 269 HB2 LEU 35 1HB LEU 35 6.800 -3.107 -17.285 270 HB3 LEU 35 2HB LEU 35 6.676 -1.372 -17.055 271 HG LEU 35 HG LEU 35 4.674 -3.049 -18.578 272 HD11 LEU 35 1HD1 LEU 35 4.579 -1.907 -15.766 273 HD12 LEU 35 2HD1 LEU 35 4.714 -3.625 -16.209 274 HD13 LEU 35 3HD1 LEU 35 3.234 -2.726 -16.598 275 HD21 LEU 35 1HD2 LEU 35 4.601 -0.142 -17.670 276 HD22 LEU 35 2HD2 LEU 35 3.236 -1.038 -18.371 277 HD23 LEU 35 3HD2 LEU 35 4.673 -0.728 -19.354 278 H GLU 36 H GLU 36 8.812 -3.875 -18.540 279 HA GLU 36 HA GLU 36 11.242 -2.182 -18.262 280 HB2 GLU 36 1HB GLU 36 9.937 -2.487 -16.049 281 HB3 GLU 36 2HB GLU 36 10.389 -4.191 -16.160 282 HG2 GLU 36 1HG GLU 36 12.778 -3.555 -16.094 283 HG3 GLU 36 2HG GLU 36 12.316 -1.847 -16.014 284 H ARG 37 H ARG 37 13.202 -3.680 -18.053 285 HA ARG 37 HA ARG 37 12.717 -6.377 -19.228 286 HB2 ARG 37 1HB ARG 37 14.836 -4.379 -20.092 287 HB3 ARG 37 2HB ARG 37 14.772 -6.067 -20.604 288 HG2 ARG 37 1HG ARG 37 12.591 -5.642 -21.712 289 HG3 ARG 37 2HG ARG 37 12.691 -3.948 -21.228 290 HD2 ARG 37 1HD ARG 37 14.666 -5.405 -23.006 291 HD3 ARG 37 2HD ARG 37 13.418 -4.256 -23.546 292 HE ARG 37 HE ARG 37 15.065 -3.058 -21.538 293 HH11 ARG 37 1HH1 ARG 37 15.236 -3.971 -24.943 294 HH12 ARG 37 2HH1 ARG 37 16.446 -2.769 -25.293 295 HH21 ARG 37 1HH2 ARG 37 16.605 -1.558 -22.066 296 HH22 ARG 37 2HH2 ARG 37 17.198 -1.424 -23.698 297 H ASP 38 H ASP 38 14.276 -7.881 -18.540 298 HA ASP 38 HA ASP 38 15.678 -8.862 -17.074 299 HB2 ASP 38 1HB ASP 38 17.162 -6.236 -16.976 300 HB3 ASP 38 2HB ASP 38 17.822 -7.875 -16.808 301 H THR 39 H THR 39 13.348 -7.904 -16.116 302 HA THR 39 HA THR 39 13.538 -6.066 -13.955 303 HB THR 39 HB THR 39 11.504 -6.452 -15.348 304 HG1 THR 39 HG1 THR 39 11.073 -5.526 -13.373 305 HG21 THR 39 1HG2 THR 39 11.678 -8.954 -15.513 306 HG22 THR 39 2HG2 THR 39 10.075 -8.400 -14.996 307 HG23 THR 39 3HG2 THR 39 11.200 -9.062 -13.800 308 H GLN 40 H GLN 40 14.284 -9.371 -14.007 309 HA GLN 40 HA GLN 40 14.113 -9.503 -11.016 310 HB2 GLN 40 1HB GLN 40 13.865 -11.553 -13.213 311 HB3 GLN 40 2HB GLN 40 14.260 -12.036 -11.550 312 HG2 GLN 40 1HG GLN 40 12.174 -10.922 -10.771 313 HG3 GLN 40 2HG GLN 40 11.749 -10.612 -12.456 314 HE21 GLN 40 1HE2 GLN 40 10.293 -13.848 -11.050 315 HE22 GLN 40 2HE2 GLN 40 10.455 -12.265 -10.333 316 H GLY 41 H GLY 41 16.207 -8.566 -13.228 317 HA2 GLY 41 1HA GLY 41 18.532 -8.489 -13.161 318 HA3 GLY 41 2HA GLY 41 18.543 -9.684 -11.844 319 H LEU 42 H LEU 42 16.518 -11.037 -13.934 320 HA LEU 42 HA LEU 42 18.563 -12.789 -15.091 321 HB2 LEU 42 1HB LEU 42 15.535 -12.818 -15.278 322 HB3 LEU 42 2HB LEU 42 16.603 -14.065 -15.913 323 HG LEU 42 HG LEU 42 16.288 -13.390 -12.964 324 HD11 LEU 42 1HD1 LEU 42 14.239 -14.345 -13.944 325 HD12 LEU 42 2HD1 LEU 42 15.029 -15.509 -12.865 326 HD13 LEU 42 3HD1 LEU 42 15.178 -15.690 -14.626 327 HD21 LEU 42 1HD2 LEU 42 17.483 -15.563 -12.637 328 HD22 LEU 42 2HD2 LEU 42 18.497 -14.343 -13.434 329 HD23 LEU 42 3HD2 LEU 42 17.761 -15.652 -14.394 330 H ASP 43 H ASP 43 19.458 -12.328 -16.971 331 HA ASP 43 HA ASP 43 18.634 -10.228 -18.686 332 HB2 ASP 43 1HB ASP 43 20.920 -11.346 -18.523 333 HB3 ASP 43 2HB ASP 43 20.258 -12.685 -19.466 334 H GLY 44 H GLY 44 17.130 -10.093 -20.203 335 HA2 GLY 44 1HA GLY 44 15.827 -10.873 -21.987 336 HA3 GLY 44 2HA GLY 44 16.241 -12.531 -21.593 337 H TRP 45 H TRP 45 15.136 -11.181 -18.702 338 HA TRP 45 HA TRP 45 12.382 -12.205 -19.323 339 HB2 TRP 45 1HB TRP 45 13.965 -11.981 -16.770 340 HB3 TRP 45 2HB TRP 45 12.207 -12.215 -16.771 341 HD1 TRP 45 HD1 TRP 45 15.456 -14.026 -17.788 342 HE1 TRP 45 HE1 TRP 45 15.006 -16.504 -18.134 343 HE3 TRP 45 HE3 TRP 45 10.356 -13.880 -17.365 344 HZ2 TRP 45 HZ2 TRP 45 12.716 -18.223 -18.217 345 HZ3 TRP 45 HZ3 TRP 45 9.064 -16.018 -17.578 346 HH2 TRP 45 HH2 TRP 45 10.251 -18.166 -18.001 347 H TRP 46 H TRP 46 10.907 -10.695 -19.805 348 HA TRP 46 HA TRP 46 11.459 -7.947 -18.828 349 HB2 TRP 46 1HB TRP 46 9.823 -8.952 -21.169 350 HB3 TRP 46 2HB TRP 46 10.133 -7.261 -20.773 351 HD1 TRP 46 HD1 TRP 46 13.405 -8.634 -20.148 352 HE1 TRP 46 HE1 TRP 46 14.982 -8.563 -22.129 353 HE3 TRP 46 HE3 TRP 46 9.891 -7.886 -23.778 354 HZ2 TRP 46 HZ2 TRP 46 14.755 -8.218 -24.956 355 HZ3 TRP 46 HZ3 TRP 46 10.637 -7.726 -26.153 356 HH2 TRP 46 HH2 TRP 46 13.056 -7.872 -26.735 357 H LEU 47 H LEU 47 9.905 -6.689 -17.869 358 HA LEU 47 HA LEU 47 7.612 -8.151 -16.721 359 HB2 LEU 47 1HB LEU 47 8.940 -6.513 -15.365 360 HB3 LEU 47 2HB LEU 47 8.467 -5.236 -16.486 361 HG LEU 47 HG LEU 47 6.081 -5.607 -15.850 362 HD11 LEU 47 1HD1 LEU 47 5.618 -6.857 -13.741 363 HD12 LEU 47 2HD1 LEU 47 7.296 -7.448 -13.739 364 HD13 LEU 47 3HD1 LEU 47 6.179 -7.921 -15.042 365 HD21 LEU 47 1HD2 LEU 47 8.015 -4.959 -13.587 366 HD22 LEU 47 2HD2 LEU 47 6.292 -4.511 -13.644 367 HD23 LEU 47 3HD2 LEU 47 7.425 -3.826 -14.835 368 H CYS 48 H CYS 48 5.801 -8.336 -17.898 369 HA CYS 48 HA CYS 48 5.180 -6.124 -19.814 370 HB2 CYS 48 1HB CYS 48 4.444 -9.057 -19.989 371 HB3 CYS 48 2HB CYS 48 4.078 -7.807 -21.193 372 HG CYS 48 HG CYS 48 7.019 -8.875 -20.136 373 H SER 49 H SER 49 2.794 -6.014 -20.329 374 HA SER 49 HA SER 49 1.103 -6.796 -17.999 375 HB2 SER 49 1HB SER 49 1.648 -4.419 -17.721 376 HB3 SER 49 2HB SER 49 1.086 -4.087 -19.378 377 HG SER 49 HG SER 49 -0.492 -3.685 -17.693 378 H LEU 50 H LEU 50 -0.686 -7.787 -18.543 379 HA LEU 50 HA LEU 50 -2.092 -7.339 -21.084 380 HB2 LEU 50 1HB LEU 50 -0.205 -8.878 -21.717 381 HB3 LEU 50 2HB LEU 50 -0.748 -10.008 -20.495 382 HG LEU 50 HG LEU 50 -2.823 -10.399 -21.745 383 HD11 LEU 50 1HD1 LEU 50 -1.632 -8.414 -23.712 384 HD12 LEU 50 2HD1 LEU 50 -3.192 -8.298 -22.877 385 HD13 LEU 50 3HD1 LEU 50 -2.949 -9.529 -24.129 386 HD21 LEU 50 1HD2 LEU 50 -0.879 -11.805 -22.155 387 HD22 LEU 50 2HD2 LEU 50 -0.296 -10.665 -23.389 388 HD23 LEU 50 3HD2 LEU 50 -1.797 -11.568 -23.654 389 H HIS 51 H HIS 51 -4.191 -8.476 -20.962 390 HA HIS 51 HA HIS 51 -6.023 -9.330 -19.874 391 HB2 HIS 51 1HB HIS 51 -4.158 -11.215 -19.727 392 HB3 HIS 51 2HB HIS 51 -4.255 -10.877 -17.998 393 HD1 HIS 51 HD1 HIS 51 -6.152 -12.449 -20.832 394 HD2 HIS 51 HD2 HIS 51 -6.677 -11.621 -16.780 395 HE1 HIS 51 HE1 HIS 51 -8.159 -13.788 -20.057 396 H GLY 52 H GLY 52 -4.604 -6.892 -18.682 397 HA2 GLY 52 1HA GLY 52 -5.289 -5.435 -17.017 398 HA3 GLY 52 2HA GLY 52 -6.367 -6.682 -16.383 399 H ARG 53 H ARG 53 -3.147 -7.800 -16.760 400 HA ARG 53 HA ARG 53 -2.391 -7.028 -13.995 401 HB2 ARG 53 1HB ARG 53 -1.954 -9.344 -13.371 402 HB3 ARG 53 2HB ARG 53 -3.652 -9.122 -13.815 403 HG2 ARG 53 1HG ARG 53 -3.004 -10.019 -16.132 404 HG3 ARG 53 2HG ARG 53 -1.487 -10.559 -15.383 405 HD2 ARG 53 1HD ARG 53 -2.741 -11.883 -13.769 406 HD3 ARG 53 2HD ARG 53 -4.278 -11.220 -14.374 407 HE ARG 53 HE ARG 53 -2.726 -12.590 -16.414 408 HH11 ARG 53 1HH1 ARG 53 -5.105 -13.049 -13.857 409 HH12 ARG 53 2HH1 ARG 53 -5.701 -14.535 -14.542 410 HH21 ARG 53 1HH2 ARG 53 -3.534 -14.520 -17.229 411 HH22 ARG 53 2HH2 ARG 53 -4.844 -15.331 -16.417 412 H GLN 54 H GLN 54 -0.117 -7.633 -13.529 413 HA GLN 54 HA GLN 54 1.502 -7.491 -16.033 414 HB2 GLN 54 1HB GLN 54 2.180 -6.573 -13.209 415 HB3 GLN 54 2HB GLN 54 3.218 -6.415 -14.631 416 HG2 GLN 54 1HG GLN 54 2.356 -4.345 -14.763 417 HG3 GLN 54 2HG GLN 54 0.960 -5.138 -15.494 418 HE21 GLN 54 1HE2 GLN 54 0.590 -3.145 -12.047 419 HE22 GLN 54 2HE2 GLN 54 2.015 -3.109 -13.051 420 H GLY 55 H GLY 55 3.505 -8.687 -16.033 421 HA2 GLY 55 1HA GLY 55 4.225 -10.462 -13.906 422 HA3 GLY 55 2HA GLY 55 3.270 -11.347 -15.115 423 H ILE 56 H ILE 56 5.886 -12.080 -14.657 424 HA ILE 56 HA ILE 56 7.620 -10.679 -16.555 425 HB ILE 56 HB ILE 56 9.334 -12.301 -15.965 426 HG12 ILE 56 1HG1 ILE 56 7.200 -13.802 -14.403 427 HG13 ILE 56 2HG1 ILE 56 7.885 -14.324 -15.940 428 HG21 ILE 56 1HG2 ILE 56 9.575 -11.781 -13.610 429 HG22 ILE 56 2HG2 ILE 56 8.723 -10.415 -14.352 430 HG23 ILE 56 3HG2 ILE 56 7.816 -11.614 -13.403 431 HD11 ILE 56 1HD1 ILE 56 8.977 -15.595 -14.242 432 HD12 ILE 56 2HD1 ILE 56 10.160 -14.385 -14.798 433 HD13 ILE 56 3HD1 ILE 56 9.297 -14.150 -13.262 434 H VAL 57 H VAL 57 8.419 -11.442 -18.489 435 HA VAL 57 HA VAL 57 7.155 -13.872 -19.664 436 HB VAL 57 HB VAL 57 7.217 -11.080 -20.934 437 HG11 VAL 57 1HG1 VAL 57 6.493 -13.794 -22.095 438 HG12 VAL 57 2HG1 VAL 57 5.973 -12.255 -22.816 439 HG13 VAL 57 3HG1 VAL 57 7.703 -12.625 -22.678 440 HG21 VAL 57 1HG2 VAL 57 4.894 -12.852 -20.075 441 HG22 VAL 57 2HG2 VAL 57 5.354 -11.276 -19.388 442 HG23 VAL 57 3HG2 VAL 57 4.734 -11.371 -21.049 443 HA PRO 58 HA PRO 58 11.466 -13.853 -20.853 444 HB2 PRO 58 1HB PRO 58 11.547 -15.960 -22.605 445 HB3 PRO 58 2HB PRO 58 11.474 -16.186 -20.824 446 HG2 PRO 58 1HG PRO 58 9.241 -16.252 -22.842 447 HG3 PRO 58 2HG PRO 58 9.606 -17.417 -21.537 448 HD2 PRO 58 1HD PRO 58 7.719 -15.496 -21.279 449 HD3 PRO 58 2HD PRO 58 8.733 -16.021 -19.901 450 H GLY 59 H GLY 59 12.168 -12.304 -22.181 451 HA2 GLY 59 1HA GLY 59 10.647 -11.185 -24.283 452 HA3 GLY 59 2HA GLY 59 12.365 -10.901 -23.975 453 H ASN 60 H ASN 60 12.884 -13.867 -24.338 454 HA ASN 60 HA ASN 60 13.472 -13.823 -27.146 455 HB2 ASN 60 1HB ASN 60 13.547 -15.920 -24.984 456 HB3 ASN 60 2HB ASN 60 13.752 -16.394 -26.675 457 HD21 ASN 60 1HD2 ASN 60 16.909 -15.078 -24.729 458 HD22 ASN 60 2HD2 ASN 60 15.472 -15.749 -24.007 459 H ARG 61 H ARG 61 10.505 -14.440 -25.512 460 HA ARG 61 HA ARG 61 9.483 -15.989 -27.863 461 HB2 ARG 61 1HB ARG 61 8.250 -15.489 -25.127 462 HB3 ARG 61 2HB ARG 61 7.477 -16.381 -26.438 463 HG2 ARG 61 1HG ARG 61 9.444 -17.988 -26.376 464 HG3 ARG 61 2HG ARG 61 9.945 -17.181 -24.873 465 HD2 ARG 61 1HD ARG 61 7.645 -17.634 -23.946 466 HD3 ARG 61 2HD ARG 61 7.280 -18.560 -25.404 467 HE ARG 61 HE ARG 61 8.886 -19.390 -23.127 468 HH11 ARG 61 1HH1 ARG 61 8.267 -20.044 -26.547 469 HH12 ARG 61 2HH1 ARG 61 8.841 -21.682 -26.427 470 HH21 ARG 61 1HH2 ARG 61 9.575 -21.491 -23.053 471 HH22 ARG 61 2HH2 ARG 61 9.566 -22.484 -24.482 472 H LEU 62 H LEU 62 10.003 -12.887 -27.208 473 HA LEU 62 HA LEU 62 7.323 -11.980 -28.203 474 HB2 LEU 62 1HB LEU 62 9.384 -10.522 -26.512 475 HB3 LEU 62 2HB LEU 62 7.922 -9.807 -27.162 476 HG LEU 62 HG LEU 62 8.006 -11.999 -25.069 477 HD11 LEU 62 1HD1 LEU 62 7.188 -10.183 -23.561 478 HD12 LEU 62 2HD1 LEU 62 7.377 -9.010 -24.881 479 HD13 LEU 62 3HD1 LEU 62 8.799 -9.839 -24.210 480 HD21 LEU 62 1HD2 LEU 62 5.983 -12.224 -26.340 481 HD22 LEU 62 2HD2 LEU 62 5.697 -10.465 -26.329 482 HD23 LEU 62 3HD2 LEU 62 5.565 -11.410 -24.831 483 H LYS 63 H LYS 63 7.272 -10.343 -29.746 484 HA LYS 63 HA LYS 63 9.908 -9.612 -30.954 485 HB2 LYS 63 1HB LYS 63 8.583 -11.260 -32.364 486 HB3 LYS 63 2HB LYS 63 7.303 -10.039 -32.475 487 HG2 LYS 63 1HG LYS 63 8.574 -9.905 -34.487 488 HG3 LYS 63 2HG LYS 63 9.020 -8.487 -33.524 489 HD2 LYS 63 1HD LYS 63 11.068 -9.690 -32.738 490 HD3 LYS 63 2HD LYS 63 10.600 -11.086 -33.736 491 HE2 LYS 63 1HE LYS 63 10.731 -9.668 -35.763 492 HE3 LYS 63 2HE LYS 63 11.206 -8.281 -34.762 493 HZ1 LYS 63 1HZ LYS 63 13.176 -9.542 -34.086 494 HZ2 LYS 63 2HZ LYS 63 13.136 -9.362 -35.732 495 HZ3 LYS 63 3HZ LYS 63 12.744 -10.809 -35.052 496 H ILE 64 H ILE 64 10.223 -7.518 -30.656 497 HA ILE 64 HA ILE 64 8.298 -5.708 -29.627 498 HB ILE 64 HB ILE 64 10.864 -5.130 -31.205 499 HG12 ILE 64 1HG1 ILE 64 11.291 -6.501 -29.203 500 HG13 ILE 64 2HG1 ILE 64 11.973 -4.887 -29.056 501 HG21 ILE 64 1HG2 ILE 64 9.573 -3.094 -31.163 502 HG22 ILE 64 2HG2 ILE 64 9.140 -3.312 -29.457 503 HG23 ILE 64 3HG2 ILE 64 10.818 -2.927 -29.918 504 HD11 ILE 64 1HD1 ILE 64 11.027 -5.531 -26.910 505 HD12 ILE 64 2HD1 ILE 64 10.016 -4.232 -27.575 506 HD13 ILE 64 3HD1 ILE 64 9.462 -5.918 -27.648 507 H LEU 65 H LEU 65 6.871 -4.339 -30.538 508 HA LEU 65 HA LEU 65 6.413 -4.640 -33.475 509 HB2 LEU 65 1HB LEU 65 4.757 -4.756 -31.107 510 HB3 LEU 65 2HB LEU 65 4.220 -3.415 -32.101 511 HG LEU 65 HG LEU 65 4.501 -6.286 -33.046 512 HD11 LEU 65 1HD1 LEU 65 2.058 -4.639 -32.291 513 HD12 LEU 65 2HD1 LEU 65 2.744 -6.002 -31.367 514 HD13 LEU 65 3HD1 LEU 65 2.035 -6.283 -32.973 515 HD21 LEU 65 1HD2 LEU 65 4.730 -4.725 -34.927 516 HD22 LEU 65 2HD2 LEU 65 3.267 -3.854 -34.402 517 HD23 LEU 65 3HD2 LEU 65 3.155 -5.528 -34.985 518 H VAL 66 H VAL 66 4.975 -2.593 -34.117 519 HA VAL 66 HA VAL 66 4.791 -0.407 -34.587 520 HB VAL 66 HB VAL 66 6.440 0.279 -32.113 521 HG11 VAL 66 1HG1 VAL 66 5.229 2.458 -32.310 522 HG12 VAL 66 2HG1 VAL 66 6.271 2.143 -33.712 523 HG13 VAL 66 3HG1 VAL 66 4.509 1.902 -33.835 524 HG21 VAL 66 1HG2 VAL 66 3.429 -0.061 -32.481 525 HG22 VAL 66 2HG2 VAL 66 4.496 -1.041 -31.441 526 HG23 VAL 66 3HG2 VAL 66 4.205 0.662 -31.052 527 H GLY 67 H GLY 67 5.758 -0.542 -36.493 528 HA2 GLY 67 1HA GLY 67 7.675 1.152 -37.280 529 HA3 GLY 67 2HA GLY 67 8.689 -0.135 -36.619 530 H MET 68 H MET 68 7.064 -2.361 -37.479 531 HA MET 68 HA MET 68 7.282 -2.140 -40.445 532 HB2 MET 68 1HB MET 68 8.739 -4.077 -38.626 533 HB3 MET 68 2HB MET 68 8.446 -4.434 -40.334 534 HG2 MET 68 1HG MET 68 9.926 -1.969 -39.362 535 HG3 MET 68 2HG MET 68 10.711 -3.482 -39.855 536 HE1 MET 68 1HE MET 68 12.106 -1.809 -41.591 537 HE2 MET 68 2HE MET 68 11.286 -0.864 -42.857 538 HE3 MET 68 3HE MET 68 11.083 -0.422 -41.143 539 H TYR 69 H TYR 69 5.399 -2.710 -41.224 540 HA TYR 69 HA TYR 69 3.455 -3.865 -41.635 541 HB2 TYR 69 1HB TYR 69 5.091 -6.227 -40.656 542 HB3 TYR 69 2HB TYR 69 3.628 -6.313 -41.640 543 HD1 TYR 69 HD1 TYR 69 3.659 -5.485 -44.023 544 HD2 TYR 69 HD2 TYR 69 7.242 -5.706 -41.650 545 HE1 TYR 69 HE1 TYR 69 5.050 -5.332 -46.090 546 HE2 TYR 69 HE2 TYR 69 8.624 -5.526 -43.717 547 HH TYR 69 HH TYR 69 8.610 -5.309 -46.002 548 H ASP 70 H ASP 70 3.287 -2.561 -39.239 549 HA ASP 70 HA ASP 70 2.888 -4.109 -36.958 550 HB2 ASP 70 1HB ASP 70 1.623 -1.456 -37.715 551 HB3 ASP 70 2HB ASP 70 1.635 -2.138 -36.078 552 H LYS 71 H LYS 71 0.397 -3.201 -39.374 553 HA LYS 71 HA LYS 71 -1.214 -5.449 -38.450 554 HB2 LYS 71 1HB LYS 71 -3.217 -4.257 -37.873 555 HB3 LYS 71 2HB LYS 71 -1.909 -3.647 -36.858 556 HG2 LYS 71 1HG LYS 71 -1.750 -1.611 -38.243 557 HG3 LYS 71 2HG LYS 71 -3.016 -2.234 -39.320 558 HD2 LYS 71 1HD LYS 71 -4.588 -2.325 -37.362 559 HD3 LYS 71 2HD LYS 71 -3.332 -1.569 -36.361 560 HE2 LYS 71 1HE LYS 71 -3.349 0.425 -37.839 561 HE3 LYS 71 2HE LYS 71 -4.581 -0.341 -38.860 562 HZ1 LYS 71 1HZ LYS 71 -6.098 -0.314 -36.953 563 HZ2 LYS 71 2HZ LYS 71 -5.580 1.217 -37.284 564 HZ3 LYS 71 3HZ LYS 71 -4.955 0.388 -35.997 565 H LYS 72 H LYS 72 -3.209 -5.680 -39.747 566 HA LYS 72 HA LYS 72 -2.786 -4.709 -42.549 567 HB2 LYS 72 1HB LYS 72 -4.405 -7.014 -41.367 568 HB3 LYS 72 2HB LYS 72 -4.471 -6.523 -43.066 569 HG2 LYS 72 1HG LYS 72 -2.059 -7.006 -43.310 570 HG3 LYS 72 2HG LYS 72 -2.012 -7.562 -41.623 571 HD2 LYS 72 1HD LYS 72 -3.683 -9.289 -42.133 572 HD3 LYS 72 2HD LYS 72 -3.769 -8.712 -43.815 573 HE2 LYS 72 1HE LYS 72 -1.351 -9.239 -44.101 574 HE3 LYS 72 2HE LYS 72 -1.313 -9.888 -42.446 575 HZ1 LYS 72 1HZ LYS 72 -2.963 -11.528 -43.118 576 HZ2 LYS 72 2HZ LYS 72 -1.636 -11.635 -44.098 577 HZ3 LYS 72 3HZ LYS 72 -3.019 -10.921 -44.645 578 HA PRO 73 HA PRO 73 -6.220 -2.133 -41.770 579 HB2 PRO 73 1HB PRO 73 -7.697 -2.063 -44.069 580 HB3 PRO 73 2HB PRO 73 -6.075 -1.323 -43.951 581 HG2 PRO 73 1HG PRO 73 -6.820 -4.043 -45.006 582 HG3 PRO 73 2HG PRO 73 -5.839 -2.765 -45.789 583 HD2 PRO 73 1HD PRO 73 -4.682 -4.809 -44.475 584 HD3 PRO 73 2HD PRO 73 -4.007 -3.145 -44.358 585 H ALA 74 H ALA 74 -8.334 -2.119 -41.048 586 HA ALA 74 HA ALA 74 -10.234 -4.241 -41.623 587 HB1 ALA 74 1HB ALA 74 -8.953 -4.011 -38.838 588 HB2 ALA 74 2HB ALA 74 -10.409 -4.962 -39.216 589 HB3 ALA 74 3HB ALA 74 -8.841 -5.421 -39.918 590 H GLY 75 H GLY 75 -12.274 -3.599 -40.331 591 HA2 GLY 75 1HA GLY 75 -12.433 -0.666 -40.135 592 HA3 GLY 75 2HA GLY 75 -13.770 -1.827 -39.939 593 H GLU 76 H GLU 76 -13.143 0.372 -38.110 594 HA GLU 76 HA GLU 76 -11.893 -0.981 -35.803 595 HB2 GLU 76 1HB GLU 76 -12.999 1.833 -36.102 596 HB3 GLU 76 2HB GLU 76 -12.098 1.198 -34.710 597 HG2 GLU 76 1HG GLU 76 -10.247 0.615 -36.425 598 HG3 GLU 76 2HG GLU 76 -11.096 1.698 -37.534 599 H PHE 77 H PHE 77 -12.982 -1.532 -33.946 600 HA PHE 77 HA PHE 77 -15.742 -2.284 -34.448 601 HB2 PHE 77 1HB PHE 77 -13.957 -2.705 -32.023 602 HB3 PHE 77 2HB PHE 77 -15.522 -3.476 -32.300 603 HD1 PHE 77 HD1 PHE 77 -11.956 -3.510 -33.133 604 HD2 PHE 77 HD2 PHE 77 -15.813 -5.154 -34.123 605 HE1 PHE 77 HE1 PHE 77 -10.847 -5.350 -34.395 606 HE2 PHE 77 HE2 PHE 77 -14.707 -6.993 -35.389 607 HZ PHE 77 HZ PHE 77 -12.218 -7.095 -35.524 608 H ILE 78 H ILE 78 -17.536 -1.407 -33.700 609 HA ILE 78 HA ILE 78 -17.435 0.962 -31.972 610 HB ILE 78 HB ILE 78 -19.826 -0.614 -33.091 611 HG12 ILE 78 1HG1 ILE 78 -19.785 1.855 -34.345 612 HG13 ILE 78 2HG1 ILE 78 -18.063 1.477 -34.240 613 HG21 ILE 78 1HG2 ILE 78 -21.140 1.449 -32.547 614 HG22 ILE 78 2HG2 ILE 78 -20.460 0.694 -31.094 615 HG23 ILE 78 3HG2 ILE 78 -19.696 2.150 -31.773 616 HD11 ILE 78 1HD1 ILE 78 -19.060 0.717 -36.384 617 HD12 ILE 78 2HD1 ILE 78 -18.454 -0.664 -35.442 618 HD13 ILE 78 3HD1 ILE 78 -20.196 -0.315 -35.500 619 H VAL 79 H VAL 79 -17.750 0.862 -29.786 620 HA VAL 79 HA VAL 79 -18.394 -1.812 -28.615 621 HB VAL 79 HB VAL 79 -17.348 -0.920 -26.513 622 HG11 VAL 79 1HG1 VAL 79 -15.500 -0.820 -28.946 623 HG12 VAL 79 2HG1 VAL 79 -15.014 -1.113 -27.258 624 HG13 VAL 79 3HG1 VAL 79 -16.030 -2.295 -28.106 625 HG21 VAL 79 1HG2 VAL 79 -16.423 1.422 -28.260 626 HG22 VAL 79 2HG2 VAL 79 -17.656 1.529 -26.979 627 HG23 VAL 79 3HG2 VAL 79 -15.982 1.123 -26.562 628 H THR 80 H THR 80 -20.018 -1.904 -27.000 629 HA THR 80 HA THR 80 -21.565 0.523 -26.425 630 HB THR 80 HB THR 80 -22.918 -1.810 -27.881 631 HG1 THR 80 HG1 THR 80 -21.598 0.417 -28.808 632 HG21 THR 80 1HG2 THR 80 -24.788 -0.188 -28.080 633 HG22 THR 80 2HG2 THR 80 -23.871 0.979 -27.108 634 HG23 THR 80 3HG2 THR 80 -24.420 -0.555 -26.387 635 H ASP 81 H ASP 81 -21.207 0.161 -24.273 636 HA ASP 81 HA ASP 81 -22.773 -1.928 -22.978 637 HB2 ASP 81 1HB ASP 81 -20.841 -2.790 -21.619 638 HB3 ASP 81 2HB ASP 81 -20.719 -3.203 -23.338 639 HXT ASP 81 H02 ASP 81 -21.562 1.291 -21.253 Start of MODEL 7 1 H2 GLY 1 2H0 GLY 1 15.297 10.781 -12.219 2 H GLY 1 1H0 GLY 1 15.050 10.464 -10.627 3 HA2 GLY 1 1HA GLY 1 13.496 12.224 -10.337 4 HA3 GLY 1 2HA GLY 1 14.857 12.901 -11.264 5 H SER 2 H SER 2 13.056 10.686 -12.958 6 HA SER 2 HA SER 2 11.062 12.598 -14.031 7 HB2 SER 2 1HB SER 2 13.135 12.971 -15.403 8 HB3 SER 2 2HB SER 2 13.139 11.243 -15.813 9 HG SER 2 HG SER 2 11.240 13.231 -16.515 10 H MET 3 H MET 3 9.202 11.506 -14.323 11 HA MET 3 HA MET 3 9.158 8.634 -13.864 12 HB2 MET 3 1HB MET 3 6.951 10.572 -14.672 13 HB3 MET 3 2HB MET 3 6.706 8.895 -14.178 14 HG2 MET 3 1HG MET 3 7.872 11.096 -12.442 15 HG3 MET 3 2HG MET 3 6.211 10.483 -12.353 16 HE1 MET 3 1HE MET 3 5.477 8.295 -11.239 17 HE2 MET 3 2HE MET 3 6.315 7.342 -12.488 18 HE3 MET 3 3HE MET 3 6.563 6.971 -10.765 19 H LYS 4 H LYS 4 9.524 7.145 -15.397 20 HA LYS 4 HA LYS 4 8.243 7.409 -18.014 21 HB2 LYS 4 1HB LYS 4 10.302 7.218 -19.308 22 HB3 LYS 4 2HB LYS 4 10.312 8.705 -18.359 23 HG2 LYS 4 1HG LYS 4 11.731 7.488 -16.637 24 HG3 LYS 4 2HG LYS 4 11.869 6.152 -17.788 25 HD2 LYS 4 1HD LYS 4 12.698 9.026 -18.344 26 HD3 LYS 4 2HD LYS 4 13.795 7.735 -17.825 27 HE2 LYS 4 1HE LYS 4 13.148 6.425 -19.863 28 HE3 LYS 4 2HE LYS 4 12.193 7.820 -20.409 29 HZ1 LYS 4 1HZ LYS 4 15.107 7.861 -19.872 30 HZ2 LYS 4 2HZ LYS 4 14.216 9.140 -20.400 31 HZ3 LYS 4 3HZ LYS 4 14.413 7.816 -21.372 32 H TYR 5 H TYR 5 8.554 5.450 -19.311 33 HA TYR 5 HA TYR 5 9.648 3.058 -17.960 34 HB2 TYR 5 1HB TYR 5 6.734 3.627 -18.404 35 HB3 TYR 5 2HB TYR 5 7.311 2.053 -18.962 36 HD1 TYR 5 HD1 TYR 5 6.500 4.073 -16.007 37 HD2 TYR 5 HD2 TYR 5 8.371 0.459 -17.360 38 HE1 TYR 5 HE1 TYR 5 6.388 3.134 -13.696 39 HE2 TYR 5 HE2 TYR 5 8.247 -0.484 -15.084 40 HH TYR 5 HH TYR 5 6.868 1.357 -12.346 41 H LEU 6 H LEU 6 9.608 1.257 -19.776 42 HA LEU 6 HA LEU 6 10.602 2.502 -22.212 43 HB2 LEU 6 1HB LEU 6 9.746 -0.373 -21.702 44 HB3 LEU 6 2HB LEU 6 10.679 0.196 -23.081 45 HG LEU 6 HG LEU 6 11.642 0.212 -20.207 46 HD11 LEU 6 1HD1 LEU 6 11.313 -2.037 -21.186 47 HD12 LEU 6 2HD1 LEU 6 13.028 -1.666 -20.925 48 HD13 LEU 6 3HD1 LEU 6 12.340 -1.578 -22.562 49 HD21 LEU 6 1HD2 LEU 6 12.729 1.988 -21.474 50 HD22 LEU 6 2HD2 LEU 6 13.075 0.870 -22.809 51 HD23 LEU 6 3HD2 LEU 6 13.868 0.657 -21.230 52 H ASN 7 H ASN 7 7.648 0.791 -21.281 53 HA ASN 7 HA ASN 7 5.601 0.574 -22.243 54 HB2 ASN 7 1HB ASN 7 5.857 3.044 -21.532 55 HB3 ASN 7 2HB ASN 7 5.918 3.393 -23.263 56 HD21 ASN 7 1HD2 ASN 7 2.468 3.152 -23.646 57 HD22 ASN 7 2HD2 ASN 7 4.025 3.556 -24.329 58 H VAL 8 H VAL 8 7.355 -0.651 -23.951 59 HA VAL 8 HA VAL 8 6.376 0.208 -26.656 60 HB VAL 8 HB VAL 8 8.346 -1.393 -27.387 61 HG11 VAL 8 1HG1 VAL 8 9.845 0.572 -27.551 62 HG12 VAL 8 2HG1 VAL 8 8.170 0.984 -27.972 63 HG13 VAL 8 3HG1 VAL 8 8.826 1.448 -26.381 64 HG21 VAL 8 1HG2 VAL 8 10.288 -1.361 -25.936 65 HG22 VAL 8 2HG2 VAL 8 9.450 -0.344 -24.746 66 HG23 VAL 8 3HG2 VAL 8 8.931 -2.031 -25.007 67 H LEU 9 H LEU 9 4.989 -1.138 -27.622 68 HA LEU 9 HA LEU 9 4.254 -3.516 -26.093 69 HB2 LEU 9 1HB LEU 9 2.849 -3.585 -28.497 70 HB3 LEU 9 2HB LEU 9 2.246 -3.116 -26.928 71 HG LEU 9 HG LEU 9 3.478 -1.138 -28.841 72 HD11 LEU 9 1HD1 LEU 9 0.558 -1.958 -28.531 73 HD12 LEU 9 2HD1 LEU 9 1.577 -2.219 -29.967 74 HD13 LEU 9 3HD1 LEU 9 1.138 -0.568 -29.478 75 HD21 LEU 9 1HD2 LEU 9 2.187 0.516 -27.511 76 HD22 LEU 9 2HD2 LEU 9 3.249 -0.419 -26.442 77 HD23 LEU 9 3HD2 LEU 9 1.518 -0.795 -26.507 78 H ALA 10 H ALA 10 4.057 -5.586 -26.938 79 HA ALA 10 HA ALA 10 5.832 -6.135 -29.242 80 HB1 ALA 10 1HB ALA 10 7.107 -6.407 -27.065 81 HB2 ALA 10 2HB ALA 10 5.912 -7.615 -26.559 82 HB3 ALA 10 3HB ALA 10 6.945 -7.922 -27.970 83 H LYS 11 H LYS 11 5.471 -8.327 -30.069 84 HA LYS 11 HA LYS 11 2.699 -9.314 -29.470 85 HB2 LYS 11 1HB LYS 11 3.056 -8.405 -31.773 86 HB3 LYS 11 2HB LYS 11 4.325 -9.616 -32.027 87 HG2 LYS 11 1HG LYS 11 1.708 -10.684 -31.108 88 HG3 LYS 11 2HG LYS 11 1.679 -9.928 -32.701 89 HD2 LYS 11 1HD LYS 11 3.796 -11.957 -32.013 90 HD3 LYS 11 2HD LYS 11 2.173 -12.474 -32.480 91 HE2 LYS 11 1HE LYS 11 2.403 -11.119 -34.573 92 HE3 LYS 11 2HE LYS 11 4.089 -10.793 -34.119 93 HZ1 LYS 11 1HZ LYS 11 3.914 -12.706 -35.597 94 HZ2 LYS 11 2HZ LYS 11 2.909 -13.482 -34.549 95 HZ3 LYS 11 3HZ LYS 11 4.479 -13.187 -34.127 96 H ALA 12 H ALA 12 2.505 -11.369 -28.770 97 HA ALA 12 HA ALA 12 4.938 -12.829 -28.093 98 HB1 ALA 12 1HB ALA 12 1.990 -13.501 -27.915 99 HB2 ALA 12 2HB ALA 12 3.286 -14.590 -27.365 100 HB3 ALA 12 3HB ALA 12 3.078 -13.003 -26.597 101 H LEU 13 H LEU 13 6.041 -14.158 -29.295 102 HA LEU 13 HA LEU 13 5.086 -14.855 -31.986 103 HB2 LEU 13 1HB LEU 13 7.617 -15.571 -30.466 104 HB3 LEU 13 2HB LEU 13 7.349 -15.861 -32.182 105 HG LEU 13 HG LEU 13 7.474 -13.109 -30.883 106 HD11 LEU 13 1HD1 LEU 13 9.623 -14.327 -30.752 107 HD12 LEU 13 2HD1 LEU 13 9.702 -12.965 -31.876 108 HD13 LEU 13 3HD1 LEU 13 9.555 -14.619 -32.504 109 HD21 LEU 13 1HD2 LEU 13 7.778 -12.390 -33.297 110 HD22 LEU 13 2HD2 LEU 13 6.165 -13.010 -32.899 111 HD23 LEU 13 3HD2 LEU 13 7.329 -14.039 -33.785 112 H TYR 14 H TYR 14 5.462 -16.353 -28.843 113 HA TYR 14 HA TYR 14 4.341 -18.897 -29.922 114 HB2 TYR 14 1HB TYR 14 6.406 -18.705 -27.708 115 HB3 TYR 14 2HB TYR 14 5.815 -20.166 -28.510 116 HD1 TYR 14 HD1 TYR 14 8.173 -17.377 -28.641 117 HD2 TYR 14 HD2 TYR 14 6.548 -20.639 -30.905 118 HE1 TYR 14 HE1 TYR 14 10.070 -17.196 -30.241 119 HE2 TYR 14 HE2 TYR 14 8.446 -20.456 -32.518 120 HH TYR 14 HH TYR 14 10.405 -19.378 -33.047 121 H ASP 15 H ASP 15 3.271 -20.150 -28.087 122 HA ASP 15 HA ASP 15 2.013 -18.211 -26.222 123 HB2 ASP 15 1HB ASP 15 0.274 -19.929 -25.919 124 HB3 ASP 15 2HB ASP 15 0.435 -19.436 -27.603 125 H ASN 16 H ASN 16 1.419 -19.112 -24.026 126 HA ASN 16 HA ASN 16 3.410 -21.041 -22.980 127 HB2 ASN 16 1HB ASN 16 4.331 -18.646 -22.909 128 HB3 ASN 16 2HB ASN 16 3.004 -18.264 -21.803 129 HD21 ASN 16 1HD2 ASN 16 5.012 -19.178 -19.122 130 HD22 ASN 16 2HD2 ASN 16 3.914 -18.030 -19.877 131 H VAL 17 H VAL 17 2.875 -21.693 -20.783 132 HA VAL 17 HA VAL 17 0.150 -20.902 -19.840 133 HB VAL 17 HB VAL 17 1.408 -23.698 -19.677 134 HG11 VAL 17 1HG1 VAL 17 -1.268 -22.652 -18.638 135 HG12 VAL 17 2HG1 VAL 17 -0.737 -24.346 -18.600 136 HG13 VAL 17 3HG1 VAL 17 0.129 -23.131 -17.644 137 HG21 VAL 17 1HG2 VAL 17 -1.027 -22.709 -21.240 138 HG22 VAL 17 2HG2 VAL 17 0.511 -23.301 -21.921 139 HG23 VAL 17 3HG2 VAL 17 -0.557 -24.423 -21.048 140 H ALA 18 H ALA 18 0.527 -19.819 -17.960 141 HA ALA 18 HA ALA 18 3.199 -19.778 -16.861 142 HB1 ALA 18 1HB ALA 18 2.158 -18.220 -15.197 143 HB2 ALA 18 2HB ALA 18 1.840 -17.743 -16.880 144 HB3 ALA 18 3HB ALA 18 0.575 -18.547 -15.914 145 H GLU 19 H GLU 19 3.935 -20.596 -14.949 146 HA GLU 19 HA GLU 19 2.019 -22.312 -13.406 147 HB2 GLU 19 1HB GLU 19 3.867 -23.802 -12.832 148 HB3 GLU 19 2HB GLU 19 3.585 -23.751 -14.566 149 HG2 GLU 19 1HG GLU 19 5.743 -23.355 -14.885 150 HG3 GLU 19 2HG GLU 19 5.575 -21.800 -14.073 151 H SER 20 H SER 20 4.723 -20.014 -13.330 152 HA SER 20 HA SER 20 4.673 -19.854 -10.404 153 HB2 SER 20 1HB SER 20 6.742 -19.353 -11.613 154 HB3 SER 20 2HB SER 20 5.912 -18.096 -12.543 155 HG SER 20 HG SER 20 7.182 -17.352 -10.717 156 HA PRO 21 HA PRO 21 1.330 -16.953 -10.483 157 HB2 PRO 21 1HB PRO 21 1.642 -15.611 -8.146 158 HB3 PRO 21 2HB PRO 21 1.142 -17.334 -8.196 159 HG2 PRO 21 1HG PRO 21 3.895 -16.181 -7.792 160 HG3 PRO 21 2HG PRO 21 3.014 -17.371 -6.782 161 HD2 PRO 21 1HD PRO 21 4.799 -18.155 -8.637 162 HD3 PRO 21 2HD PRO 21 3.287 -19.082 -8.366 163 H ASP 22 H ASP 22 4.647 -15.979 -10.385 164 HA ASP 22 HA ASP 22 4.109 -13.098 -10.754 165 HB2 ASP 22 1HB ASP 22 6.121 -14.138 -9.523 166 HB3 ASP 22 2HB ASP 22 6.702 -14.647 -11.116 167 H GLU 23 H GLU 23 4.245 -15.961 -12.629 168 HA GLU 23 HA GLU 23 5.324 -14.714 -15.045 169 HB2 GLU 23 1HB GLU 23 5.764 -17.053 -14.284 170 HB3 GLU 23 2HB GLU 23 4.070 -17.433 -14.608 171 HG2 GLU 23 1HG GLU 23 4.427 -16.865 -16.988 172 HG3 GLU 23 2HG GLU 23 6.132 -16.524 -16.625 173 H LEU 24 H LEU 24 4.193 -14.049 -16.819 174 HA LEU 24 HA LEU 24 1.298 -13.703 -16.438 175 HB2 LEU 24 1HB LEU 24 3.381 -12.357 -17.822 176 HB3 LEU 24 2HB LEU 24 2.273 -12.943 -19.057 177 HG LEU 24 HG LEU 24 1.521 -11.170 -16.707 178 HD11 LEU 24 1HD1 LEU 24 1.263 -9.434 -18.417 179 HD12 LEU 24 2HD1 LEU 24 1.780 -10.575 -19.681 180 HD13 LEU 24 3HD1 LEU 24 2.919 -10.062 -18.411 181 HD21 LEU 24 1HD2 LEU 24 -0.628 -10.868 -17.967 182 HD22 LEU 24 2HD2 LEU 24 -0.405 -12.492 -17.296 183 HD23 LEU 24 3HD2 LEU 24 -0.140 -12.207 -19.027 184 H SER 25 H SER 25 -0.287 -14.838 -17.397 185 HA SER 25 HA SER 25 0.388 -17.044 -19.231 186 HB2 SER 25 1HB SER 25 -2.293 -15.998 -18.214 187 HB3 SER 25 2HB SER 25 -2.057 -17.466 -19.186 188 HG SER 25 HG SER 25 -2.181 -17.902 -16.924 189 H PHE 26 H PHE 26 0.736 -16.550 -21.330 190 HA PHE 26 HA PHE 26 -1.109 -14.628 -22.672 191 HB2 PHE 26 1HB PHE 26 0.760 -13.591 -23.852 192 HB3 PHE 26 2HB PHE 26 0.955 -13.369 -22.105 193 HD1 PHE 26 HD1 PHE 26 2.293 -15.024 -25.127 194 HD2 PHE 26 HD2 PHE 26 2.724 -14.538 -20.885 195 HE1 PHE 26 HE1 PHE 26 4.567 -16.060 -25.241 196 HE2 PHE 26 HE2 PHE 26 4.964 -15.601 -20.966 197 HZ PHE 26 HZ PHE 26 5.901 -16.361 -23.154 198 H ARG 27 H ARG 27 -1.056 -14.957 -25.075 199 HA ARG 27 HA ARG 27 0.122 -17.588 -25.791 200 HB2 ARG 27 1HB ARG 27 -2.690 -16.742 -26.535 201 HB3 ARG 27 2HB ARG 27 -1.861 -18.203 -27.089 202 HG2 ARG 27 1HG ARG 27 -1.586 -18.609 -24.450 203 HG3 ARG 27 2HG ARG 27 -3.022 -17.571 -24.392 204 HD2 ARG 27 1HD ARG 27 -4.005 -19.643 -24.539 205 HD3 ARG 27 2HD ARG 27 -3.885 -19.256 -26.265 206 HE ARG 27 HE ARG 27 -1.504 -20.571 -25.660 207 HH11 ARG 27 1HH1 ARG 27 -4.905 -21.449 -25.310 208 HH12 ARG 27 2HH1 ARG 27 -4.570 -23.153 -25.453 209 HH21 ARG 27 1HH2 ARG 27 -1.144 -22.748 -25.885 210 HH22 ARG 27 2HH2 ARG 27 -2.491 -23.868 -25.776 211 H LYS 28 H LYS 28 0.220 -17.970 -28.150 212 HA LYS 28 HA LYS 28 1.724 -15.889 -29.334 213 HB2 LYS 28 1HB LYS 28 1.684 -17.296 -31.367 214 HB3 LYS 28 2HB LYS 28 2.060 -18.218 -29.914 215 HG2 LYS 28 1HG LYS 28 -0.386 -18.937 -29.849 216 HG3 LYS 28 2HG LYS 28 -0.532 -18.242 -31.474 217 HD2 LYS 28 1HD LYS 28 1.264 -19.741 -32.261 218 HD3 LYS 28 2HD LYS 28 1.445 -20.389 -30.614 219 HE2 LYS 28 1HE LYS 28 -0.950 -21.137 -30.697 220 HE3 LYS 28 2HE LYS 28 -1.015 -20.619 -32.396 221 HZ1 LYS 28 1HZ LYS 28 0.805 -22.675 -31.280 222 HZ2 LYS 28 2HZ LYS 28 0.794 -22.181 -32.854 223 HZ3 LYS 28 3HZ LYS 28 -0.517 -22.966 -32.228 224 H GLY 29 H GLY 29 1.335 -14.334 -30.742 225 HA2 GLY 29 1HA GLY 29 0.068 -13.175 -32.390 226 HA3 GLY 29 2HA GLY 29 -1.369 -14.096 -31.934 227 H ASP 30 H ASP 30 -0.695 -13.546 -29.001 228 HA ASP 30 HA ASP 30 -2.402 -11.256 -28.758 229 HB2 ASP 30 1HB ASP 30 -2.002 -13.340 -27.221 230 HB3 ASP 30 2HB ASP 30 -0.706 -12.358 -26.525 231 H ILE 31 H ILE 31 -1.917 -9.293 -27.534 232 HA ILE 31 HA ILE 31 0.842 -8.275 -28.154 233 HB ILE 31 HB ILE 31 -1.775 -6.675 -28.088 234 HG12 ILE 31 1HG1 ILE 31 -1.861 -8.233 -29.971 235 HG13 ILE 31 2HG1 ILE 31 -1.699 -6.569 -30.519 236 HG21 ILE 31 1HG2 ILE 31 0.136 -5.252 -27.600 237 HG22 ILE 31 2HG2 ILE 31 1.072 -5.923 -28.952 238 HG23 ILE 31 3HG2 ILE 31 -0.369 -4.913 -29.260 239 HD11 ILE 31 1HD1 ILE 31 0.663 -6.928 -31.048 240 HD12 ILE 31 2HD1 ILE 31 0.567 -8.584 -30.409 241 HD13 ILE 31 3HD1 ILE 31 -0.351 -8.143 -31.857 242 H MET 32 H MET 32 1.966 -7.511 -26.454 243 HA MET 32 HA MET 32 0.475 -6.579 -24.046 244 HB2 MET 32 1HB MET 32 2.113 -7.754 -22.604 245 HB3 MET 32 2HB MET 32 1.071 -8.844 -23.503 246 HG2 MET 32 1HG MET 32 3.928 -8.179 -24.307 247 HG3 MET 32 2HG MET 32 3.471 -9.558 -23.310 248 HE1 MET 32 1HE MET 32 0.682 -10.494 -24.840 249 HE2 MET 32 2HE MET 32 1.377 -11.761 -25.867 250 HE3 MET 32 3HE MET 32 1.927 -11.587 -24.187 251 H THR 33 H THR 33 1.512 -5.006 -22.824 252 HA THR 33 HA THR 33 3.561 -3.546 -24.377 253 HB THR 33 HB THR 33 2.169 -2.722 -21.811 254 HG1 THR 33 HG1 THR 33 0.783 -1.609 -23.190 255 HG21 THR 33 1HG2 THR 33 4.236 -1.444 -22.261 256 HG22 THR 33 2HG2 THR 33 2.810 -0.430 -22.567 257 HG23 THR 33 3HG2 THR 33 3.696 -1.142 -23.929 258 H VAL 34 H VAL 34 5.700 -3.700 -23.979 259 HA VAL 34 HA VAL 34 6.583 -5.070 -21.510 260 HB VAL 34 HB VAL 34 8.172 -3.888 -23.847 261 HG11 VAL 34 1HG1 VAL 34 9.108 -5.444 -21.399 262 HG12 VAL 34 2HG1 VAL 34 10.104 -5.190 -22.854 263 HG13 VAL 34 3HG1 VAL 34 9.582 -3.801 -21.885 264 HG21 VAL 34 1HG2 VAL 34 7.751 -6.811 -23.097 265 HG22 VAL 34 2HG2 VAL 34 6.792 -5.964 -24.339 266 HG23 VAL 34 3HG2 VAL 34 8.539 -6.171 -24.549 267 H LEU 35 H LEU 35 6.965 -4.025 -19.704 268 HA LEU 35 HA LEU 35 6.990 -1.072 -19.726 269 HB2 LEU 35 1HB LEU 35 7.001 -3.104 -17.466 270 HB3 LEU 35 2HB LEU 35 6.857 -1.363 -17.256 271 HG LEU 35 HG LEU 35 4.847 -3.087 -18.738 272 HD11 LEU 35 1HD1 LEU 35 4.900 -3.671 -16.374 273 HD12 LEU 35 2HD1 LEU 35 3.425 -2.759 -16.739 274 HD13 LEU 35 3HD1 LEU 35 4.783 -1.955 -15.924 275 HD21 LEU 35 1HD2 LEU 35 4.786 -0.776 -19.518 276 HD22 LEU 35 2HD2 LEU 35 4.755 -0.179 -17.838 277 HD23 LEU 35 3HD2 LEU 35 3.376 -1.086 -18.497 278 H GLU 36 H GLU 36 9.025 -3.812 -18.652 279 HA GLU 36 HA GLU 36 11.446 -2.189 -18.992 280 HB2 GLU 36 1HB GLU 36 12.276 -2.506 -16.763 281 HB3 GLU 36 2HB GLU 36 10.752 -1.622 -16.700 282 HG2 GLU 36 1HG GLU 36 9.570 -3.643 -16.037 283 HG3 GLU 36 2HG GLU 36 11.068 -4.582 -16.154 284 H ARG 37 H ARG 37 13.406 -3.647 -18.334 285 HA ARG 37 HA ARG 37 12.855 -6.499 -19.042 286 HB2 ARG 37 1HB ARG 37 15.053 -4.723 -20.178 287 HB3 ARG 37 2HB ARG 37 14.895 -6.463 -20.441 288 HG2 ARG 37 1HG ARG 37 12.675 -6.027 -21.525 289 HG3 ARG 37 2HG ARG 37 13.002 -4.296 -21.417 290 HD2 ARG 37 1HD ARG 37 15.028 -6.137 -22.681 291 HD3 ARG 37 2HD ARG 37 13.603 -5.642 -23.604 292 HE ARG 37 HE ARG 37 15.833 -3.927 -22.698 293 HH11 ARG 37 1HH1 ARG 37 12.714 -4.110 -24.352 294 HH12 ARG 37 2HH1 ARG 37 12.894 -2.533 -25.068 295 HH21 ARG 37 1HH2 ARG 37 15.994 -1.928 -23.650 296 HH22 ARG 37 2HH2 ARG 37 14.729 -1.331 -24.692 297 H ASP 38 H ASP 38 14.532 -7.900 -18.182 298 HA ASP 38 HA ASP 38 15.843 -8.652 -16.480 299 HB2 ASP 38 1HB ASP 38 17.482 -7.035 -17.580 300 HB3 ASP 38 2HB ASP 38 17.085 -5.896 -16.289 301 H THR 39 H THR 39 13.324 -7.889 -15.949 302 HA THR 39 HA THR 39 13.014 -6.018 -13.813 303 HB THR 39 HB THR 39 11.231 -6.606 -15.426 304 HG1 THR 39 HG1 THR 39 10.579 -5.833 -13.375 305 HG21 THR 39 1HG2 THR 39 11.096 -9.301 -14.020 306 HG22 THR 39 2HG2 THR 39 11.723 -9.039 -15.667 307 HG23 THR 39 3HG2 THR 39 10.019 -8.713 -15.302 308 H GLN 40 H GLN 40 14.011 -9.335 -13.749 309 HA GLN 40 HA GLN 40 13.396 -9.449 -10.816 310 HB2 GLN 40 1HB GLN 40 12.372 -11.106 -12.713 311 HB3 GLN 40 2HB GLN 40 13.873 -11.960 -12.347 312 HG2 GLN 40 1HG GLN 40 13.204 -11.829 -9.883 313 HG3 GLN 40 2HG GLN 40 11.625 -11.245 -10.435 314 HE21 GLN 40 1HE2 GLN 40 10.437 -14.451 -11.063 315 HE22 GLN 40 2HE2 GLN 40 10.098 -12.755 -10.804 316 H GLY 41 H GLY 41 15.921 -8.711 -12.695 317 HA2 GLY 41 1HA GLY 41 18.199 -8.807 -12.174 318 HA3 GLY 41 2HA GLY 41 17.865 -9.992 -10.883 319 H LEU 42 H LEU 42 16.209 -10.782 -13.668 320 HA LEU 42 HA LEU 42 18.335 -12.654 -14.605 321 HB2 LEU 42 1HB LEU 42 15.307 -12.905 -14.800 322 HB3 LEU 42 2HB LEU 42 16.468 -14.050 -15.451 323 HG LEU 42 HG LEU 42 16.013 -13.473 -12.507 324 HD11 LEU 42 1HD1 LEU 42 15.204 -15.856 -14.212 325 HD12 LEU 42 2HD1 LEU 42 14.105 -14.598 -13.594 326 HD13 LEU 42 3HD1 LEU 42 14.942 -15.677 -12.463 327 HD21 LEU 42 1HD2 LEU 42 17.747 -15.561 -13.894 328 HD22 LEU 42 2HD2 LEU 42 17.385 -15.520 -12.153 329 HD23 LEU 42 3HD2 LEU 42 18.307 -14.201 -12.887 330 H ASP 43 H ASP 43 19.218 -11.677 -16.368 331 HA ASP 43 HA ASP 43 17.771 -9.823 -18.005 332 HB2 ASP 43 1HB ASP 43 20.299 -9.981 -17.836 333 HB3 ASP 43 2HB ASP 43 20.204 -11.446 -18.826 334 H GLY 44 H GLY 44 16.947 -10.126 -20.068 335 HA2 GLY 44 1HA GLY 44 16.113 -11.467 -21.858 336 HA3 GLY 44 2HA GLY 44 16.440 -12.925 -20.915 337 H TRP 45 H TRP 45 15.068 -11.563 -18.490 338 HA TRP 45 HA TRP 45 12.303 -12.281 -19.364 339 HB2 TRP 45 1HB TRP 45 13.598 -11.871 -16.655 340 HB3 TRP 45 2HB TRP 45 11.841 -11.996 -16.869 341 HD1 TRP 45 HD1 TRP 45 15.018 -14.122 -17.110 342 HE1 TRP 45 HE1 TRP 45 14.412 -16.592 -17.181 343 HE3 TRP 45 HE3 TRP 45 9.956 -13.586 -17.548 344 HZ2 TRP 45 HZ2 TRP 45 12.028 -18.156 -17.419 345 HZ3 TRP 45 HZ3 TRP 45 8.532 -15.640 -17.679 346 HH2 TRP 45 HH2 TRP 45 9.569 -17.904 -17.618 347 H TRP 46 H TRP 46 10.711 -10.810 -19.644 348 HA TRP 46 HA TRP 46 11.432 -7.969 -19.049 349 HB2 TRP 46 1HB TRP 46 9.746 -9.117 -21.297 350 HB3 TRP 46 2HB TRP 46 10.078 -7.410 -21.029 351 HD1 TRP 46 HD1 TRP 46 13.339 -8.943 -20.455 352 HE1 TRP 46 HE1 TRP 46 14.842 -8.986 -22.496 353 HE3 TRP 46 HE3 TRP 46 9.760 -7.957 -23.963 354 HZ2 TRP 46 HZ2 TRP 46 14.545 -8.605 -25.318 355 HZ3 TRP 46 HZ3 TRP 46 10.437 -7.822 -26.369 356 HH2 TRP 46 HH2 TRP 46 12.818 -8.134 -27.026 357 H LEU 47 H LEU 47 9.878 -6.722 -18.037 358 HA LEU 47 HA LEU 47 7.567 -8.200 -16.910 359 HB2 LEU 47 1HB LEU 47 8.864 -6.553 -15.535 360 HB3 LEU 47 2HB LEU 47 8.395 -5.290 -16.659 361 HG LEU 47 HG LEU 47 5.998 -5.714 -16.036 362 HD11 LEU 47 1HD1 LEU 47 7.263 -7.439 -13.864 363 HD12 LEU 47 2HD1 LEU 47 6.191 -8.002 -15.165 364 HD13 LEU 47 3HD1 LEU 47 5.562 -6.921 -13.916 365 HD21 LEU 47 1HD2 LEU 47 7.317 -3.876 -15.062 366 HD22 LEU 47 2HD2 LEU 47 7.904 -4.962 -13.783 367 HD23 LEU 47 3HD2 LEU 47 6.172 -4.541 -13.878 368 H CYS 48 H CYS 48 5.689 -8.279 -17.991 369 HA CYS 48 HA CYS 48 5.169 -6.087 -19.964 370 HB2 CYS 48 1HB CYS 48 4.371 -9.007 -20.172 371 HB3 CYS 48 2HB CYS 48 4.059 -7.733 -21.367 372 HG CYS 48 HG CYS 48 6.968 -8.857 -20.292 373 H SER 49 H SER 49 2.943 -5.542 -20.288 374 HA SER 49 HA SER 49 1.159 -6.488 -18.081 375 HB2 SER 49 1HB SER 49 -0.007 -4.316 -18.280 376 HB3 SER 49 2HB SER 49 1.684 -4.136 -17.767 377 HG SER 49 HG SER 49 1.251 -2.653 -19.376 378 H LEU 50 H LEU 50 -0.673 -7.419 -18.659 379 HA LEU 50 HA LEU 50 -1.655 -7.273 -21.449 380 HB2 LEU 50 1HB LEU 50 0.230 -8.956 -21.265 381 HB3 LEU 50 2HB LEU 50 -0.733 -9.844 -20.122 382 HG LEU 50 HG LEU 50 -0.471 -10.465 -22.710 383 HD11 LEU 50 1HD1 LEU 50 -1.357 -11.932 -21.052 384 HD12 LEU 50 2HD1 LEU 50 -2.514 -11.853 -22.400 385 HD13 LEU 50 3HD1 LEU 50 -2.834 -10.951 -20.896 386 HD21 LEU 50 1HD2 LEU 50 -2.345 -9.919 -24.033 387 HD22 LEU 50 2HD2 LEU 50 -1.746 -8.380 -23.392 388 HD23 LEU 50 3HD2 LEU 50 -3.195 -9.152 -22.694 389 H HIS 51 H HIS 51 -3.855 -7.470 -21.430 390 HA HIS 51 HA HIS 51 -5.986 -7.568 -20.615 391 HB2 HIS 51 1HB HIS 51 -4.905 -10.095 -19.343 392 HB3 HIS 51 2HB HIS 51 -6.615 -9.651 -19.390 393 HD1 HIS 51 HD1 HIS 51 -4.891 -12.059 -21.008 394 HD2 HIS 51 HD2 HIS 51 -6.851 -8.687 -22.478 395 HE1 HIS 51 HE1 HIS 51 -5.439 -12.521 -23.434 396 H GLY 52 H GLY 52 -4.297 -5.836 -19.062 397 HA2 GLY 52 1HA GLY 52 -4.760 -4.488 -17.230 398 HA3 GLY 52 2HA GLY 52 -6.075 -5.575 -16.780 399 H ARG 53 H ARG 53 -3.323 -7.438 -17.172 400 HA ARG 53 HA ARG 53 -2.613 -7.201 -14.261 401 HB2 ARG 53 1HB ARG 53 -2.487 -9.656 -16.063 402 HB3 ARG 53 2HB ARG 53 -2.074 -9.580 -14.344 403 HG2 ARG 53 1HG ARG 53 -4.523 -8.903 -13.944 404 HG3 ARG 53 2HG ARG 53 -4.813 -9.370 -15.633 405 HD2 ARG 53 1HD ARG 53 -5.333 -11.291 -14.321 406 HD3 ARG 53 2HD ARG 53 -3.751 -11.608 -15.069 407 HE ARG 53 HE ARG 53 -3.695 -10.389 -12.387 408 HH11 ARG 53 1HH1 ARG 53 -3.480 -13.409 -14.194 409 HH12 ARG 53 2HH1 ARG 53 -2.683 -14.240 -12.887 410 HH21 ARG 53 1HH2 ARG 53 -2.683 -11.524 -10.765 411 HH22 ARG 53 2HH2 ARG 53 -2.240 -13.193 -10.987 412 H GLN 54 H GLN 54 -0.264 -7.978 -13.936 413 HA GLN 54 HA GLN 54 1.348 -7.674 -16.396 414 HB2 GLN 54 1HB GLN 54 2.967 -6.245 -15.343 415 HB3 GLN 54 2HB GLN 54 1.388 -5.466 -15.218 416 HG2 GLN 54 1HG GLN 54 1.214 -6.180 -12.872 417 HG3 GLN 54 2HG GLN 54 2.766 -7.012 -12.998 418 HE21 GLN 54 1HE2 GLN 54 4.456 -4.181 -11.950 419 HE22 GLN 54 2HE2 GLN 54 4.237 -5.918 -11.891 420 H GLY 55 H GLY 55 3.438 -8.719 -16.183 421 HA2 GLY 55 1HA GLY 55 4.169 -10.245 -13.883 422 HA3 GLY 55 2HA GLY 55 3.232 -11.274 -14.994 423 H ILE 56 H ILE 56 5.802 -12.016 -14.592 424 HA ILE 56 HA ILE 56 7.532 -10.684 -16.541 425 HB ILE 56 HB ILE 56 9.257 -12.257 -15.868 426 HG12 ILE 56 1HG1 ILE 56 7.143 -13.683 -14.209 427 HG13 ILE 56 2HG1 ILE 56 7.782 -14.286 -15.733 428 HG21 ILE 56 1HG2 ILE 56 9.461 -11.619 -13.540 429 HG22 ILE 56 2HG2 ILE 56 8.609 -10.301 -14.366 430 HG23 ILE 56 3HG2 ILE 56 7.704 -11.453 -13.357 431 HD11 ILE 56 1HD1 ILE 56 8.897 -15.462 -13.985 432 HD12 ILE 56 2HD1 ILE 56 10.077 -14.316 -14.650 433 HD13 ILE 56 3HD1 ILE 56 9.265 -13.958 -13.112 434 H VAL 57 H VAL 57 8.286 -11.451 -18.440 435 HA VAL 57 HA VAL 57 7.020 -13.906 -19.584 436 HB VAL 57 HB VAL 57 7.154 -11.117 -20.863 437 HG11 VAL 57 1HG1 VAL 57 5.919 -12.233 -22.766 438 HG12 VAL 57 2HG1 VAL 57 7.626 -12.678 -22.603 439 HG13 VAL 57 3HG1 VAL 57 6.358 -13.789 -22.044 440 HG21 VAL 57 1HG2 VAL 57 4.674 -11.325 -20.986 441 HG22 VAL 57 2HG2 VAL 57 4.772 -12.846 -20.064 442 HG23 VAL 57 3HG2 VAL 57 5.277 -11.308 -19.317 443 HA PRO 58 HA PRO 58 11.319 -14.049 -20.733 444 HB2 PRO 58 1HB PRO 58 11.369 -16.154 -22.491 445 HB3 PRO 58 2HB PRO 58 11.215 -16.383 -20.717 446 HG2 PRO 58 1HG PRO 58 9.061 -16.354 -22.815 447 HG3 PRO 58 2HG PRO 58 9.327 -17.525 -21.488 448 HD2 PRO 58 1HD PRO 58 7.523 -15.508 -21.337 449 HD3 PRO 58 2HD PRO 58 8.430 -16.101 -19.903 450 H GLY 59 H GLY 59 12.089 -12.472 -22.016 451 HA2 GLY 59 1HA GLY 59 10.579 -11.295 -24.090 452 HA3 GLY 59 2HA GLY 59 12.292 -11.012 -23.745 453 H ASN 60 H ASN 60 12.789 -13.970 -24.259 454 HA ASN 60 HA ASN 60 13.554 -13.793 -26.999 455 HB2 ASN 60 1HB ASN 60 14.555 -15.363 -25.378 456 HB3 ASN 60 2HB ASN 60 13.019 -16.236 -25.262 457 HD21 ASN 60 1HD2 ASN 60 15.458 -16.764 -28.485 458 HD22 ASN 60 2HD2 ASN 60 15.703 -15.427 -27.397 459 H ARG 61 H ARG 61 10.511 -14.741 -25.469 460 HA ARG 61 HA ARG 61 9.507 -15.891 -27.996 461 HB2 ARG 61 1HB ARG 61 8.108 -15.456 -25.328 462 HB3 ARG 61 2HB ARG 61 7.465 -16.360 -26.702 463 HG2 ARG 61 1HG ARG 61 9.500 -17.903 -26.466 464 HG3 ARG 61 2HG ARG 61 9.778 -17.106 -24.902 465 HD2 ARG 61 1HD ARG 61 7.262 -17.640 -24.458 466 HD3 ARG 61 2HD ARG 61 7.426 -18.793 -25.789 467 HE ARG 61 HE ARG 61 9.537 -19.183 -23.893 468 HH11 ARG 61 1HH1 ARG 61 6.072 -19.796 -24.268 469 HH12 ARG 61 2HH1 ARG 61 6.070 -21.022 -23.025 470 HH21 ARG 61 1HH2 ARG 61 9.440 -20.819 -22.359 471 HH22 ARG 61 2HH2 ARG 61 7.926 -21.610 -22.016 472 H LEU 62 H LEU 62 10.045 -12.806 -27.258 473 HA LEU 62 HA LEU 62 7.383 -11.864 -28.266 474 HB2 LEU 62 1HB LEU 62 9.373 -10.457 -26.460 475 HB3 LEU 62 2HB LEU 62 7.899 -9.751 -27.089 476 HG LEU 62 HG LEU 62 8.046 -12.042 -25.108 477 HD11 LEU 62 1HD1 LEU 62 7.325 -9.093 -24.823 478 HD12 LEU 62 2HD1 LEU 62 8.739 -9.924 -24.141 479 HD13 LEU 62 3HD1 LEU 62 7.120 -10.319 -23.557 480 HD21 LEU 62 1HD2 LEU 62 5.569 -11.535 -24.877 481 HD22 LEU 62 2HD2 LEU 62 6.047 -12.318 -26.391 482 HD23 LEU 62 3HD2 LEU 62 5.703 -10.572 -26.361 483 H LYS 63 H LYS 63 7.327 -10.186 -29.739 484 HA LYS 63 HA LYS 63 9.983 -9.239 -30.782 485 HB2 LYS 63 1HB LYS 63 8.857 -10.669 -32.469 486 HB3 LYS 63 2HB LYS 63 7.418 -9.639 -32.364 487 HG2 LYS 63 1HG LYS 63 8.838 -7.697 -33.092 488 HG3 LYS 63 2HG LYS 63 10.172 -8.828 -33.360 489 HD2 LYS 63 1HD LYS 63 8.821 -10.014 -35.040 490 HD3 LYS 63 2HD LYS 63 7.456 -8.911 -34.717 491 HE2 LYS 63 1HE LYS 63 8.887 -6.978 -35.353 492 HE3 LYS 63 2HE LYS 63 10.204 -8.097 -35.750 493 HZ1 LYS 63 1HZ LYS 63 8.981 -7.444 -37.720 494 HZ2 LYS 63 2HZ LYS 63 7.563 -8.015 -37.094 495 HZ3 LYS 63 3HZ LYS 63 8.792 -9.056 -37.469 496 H ILE 64 H ILE 64 10.254 -7.190 -30.221 497 HA ILE 64 HA ILE 64 8.167 -5.438 -29.306 498 HB ILE 64 HB ILE 64 10.975 -4.828 -30.396 499 HG12 ILE 64 1HG1 ILE 64 10.913 -6.235 -28.324 500 HG13 ILE 64 2HG1 ILE 64 11.718 -4.686 -28.116 501 HG21 ILE 64 1HG2 ILE 64 9.715 -2.782 -30.591 502 HG22 ILE 64 2HG2 ILE 64 8.965 -2.995 -28.994 503 HG23 ILE 64 3HG2 ILE 64 10.706 -2.625 -29.126 504 HD11 ILE 64 1HD1 ILE 64 9.817 -3.778 -26.865 505 HD12 ILE 64 2HD1 ILE 64 8.849 -5.224 -27.205 506 HD13 ILE 64 3HD1 ILE 64 10.277 -5.340 -26.160 507 H LEU 65 H LEU 65 6.860 -4.060 -30.414 508 HA LEU 65 HA LEU 65 6.817 -4.344 -33.344 509 HB2 LEU 65 1HB LEU 65 5.008 -2.833 -31.426 510 HB3 LEU 65 2HB LEU 65 4.715 -3.043 -33.152 511 HG LEU 65 HG LEU 65 4.844 -5.307 -31.122 512 HD11 LEU 65 1HD1 LEU 65 2.435 -4.010 -32.450 513 HD12 LEU 65 2HD1 LEU 65 2.929 -3.828 -30.750 514 HD13 LEU 65 3HD1 LEU 65 2.419 -5.411 -31.347 515 HD21 LEU 65 1HD2 LEU 65 5.415 -6.156 -33.311 516 HD22 LEU 65 2HD2 LEU 65 4.080 -5.250 -34.066 517 HD23 LEU 65 3HD2 LEU 65 3.739 -6.610 -32.975 518 H VAL 66 H VAL 66 7.962 -3.046 -34.565 519 HA VAL 66 HA VAL 66 8.909 -0.455 -33.490 520 HB VAL 66 HB VAL 66 9.711 -1.976 -36.028 521 HG11 VAL 66 1HG1 VAL 66 10.935 0.485 -34.706 522 HG12 VAL 66 2HG1 VAL 66 11.653 -0.409 -36.061 523 HG13 VAL 66 3HG1 VAL 66 10.112 0.428 -36.281 524 HG21 VAL 66 1HG2 VAL 66 10.400 -3.216 -34.009 525 HG22 VAL 66 2HG2 VAL 66 11.821 -2.478 -34.778 526 HG23 VAL 66 3HG2 VAL 66 11.121 -1.739 -33.320 527 H GLY 67 H GLY 67 8.020 1.430 -34.150 528 HA2 GLY 67 1HA GLY 67 6.804 1.691 -36.789 529 HA3 GLY 67 2HA GLY 67 5.631 1.661 -35.462 530 H MET 68 H MET 68 8.921 3.093 -35.558 531 HA MET 68 HA MET 68 7.688 5.790 -35.154 532 HB2 MET 68 1HB MET 68 9.964 4.579 -33.519 533 HB3 MET 68 2HB MET 68 9.401 6.255 -33.430 534 HG2 MET 68 1HG MET 68 8.308 5.385 -31.622 535 HG3 MET 68 2HG MET 68 7.079 5.131 -32.879 536 HE1 MET 68 1HE MET 68 6.401 1.856 -30.949 537 HE2 MET 68 2HE MET 68 6.701 3.466 -30.247 538 HE3 MET 68 3HE MET 68 5.724 3.304 -31.730 539 H TYR 69 H TYR 69 9.376 7.523 -35.477 540 HA TYR 69 HA TYR 69 10.749 7.148 -37.964 541 HB2 TYR 69 1HB TYR 69 11.015 9.283 -35.808 542 HB3 TYR 69 2HB TYR 69 11.766 9.376 -37.405 543 HD1 TYR 69 HD1 TYR 69 10.365 9.661 -39.457 544 HD2 TYR 69 HD2 TYR 69 8.650 9.806 -35.505 545 HE1 TYR 69 HE1 TYR 69 8.319 10.763 -40.372 546 HE2 TYR 69 HE2 TYR 69 6.621 10.906 -36.433 547 HH TYR 69 HH TYR 69 5.571 11.706 -38.303 548 H ASP 70 H ASP 70 12.971 7.006 -38.419 549 HA ASP 70 HA ASP 70 14.624 5.648 -36.490 550 HB2 ASP 70 1HB ASP 70 15.081 6.872 -39.215 551 HB3 ASP 70 2HB ASP 70 16.448 6.320 -38.231 552 H LYS 71 H LYS 71 16.451 6.343 -35.440 553 HA LYS 71 HA LYS 71 16.237 9.001 -34.339 554 HB2 LYS 71 1HB LYS 71 18.120 8.394 -32.966 555 HB3 LYS 71 2HB LYS 71 17.021 7.012 -33.054 556 HG2 LYS 71 1HG LYS 71 18.491 5.877 -34.631 557 HG3 LYS 71 2HG LYS 71 19.511 7.318 -34.761 558 HD2 LYS 71 1HD LYS 71 19.965 7.125 -32.288 559 HD3 LYS 71 2HD LYS 71 19.151 5.546 -32.338 560 HE2 LYS 71 1HE LYS 71 21.562 5.223 -32.548 561 HE3 LYS 71 2HE LYS 71 20.775 4.807 -34.084 562 HZ1 LYS 71 1HZ LYS 71 22.042 7.436 -33.533 563 HZ2 LYS 71 2HZ LYS 71 21.417 6.938 -34.974 564 HZ3 LYS 71 3HZ LYS 71 22.764 6.207 -34.368 565 H LYS 72 H LYS 72 17.972 10.533 -34.163 566 HA LYS 72 HA LYS 72 19.438 10.990 -36.705 567 HB2 LYS 72 1HB LYS 72 18.534 12.577 -34.355 568 HB3 LYS 72 2HB LYS 72 20.163 12.967 -34.895 569 HG2 LYS 72 1HG LYS 72 18.651 14.468 -35.994 570 HG3 LYS 72 2HG LYS 72 19.273 13.344 -37.211 571 HD2 LYS 72 1HD LYS 72 17.185 12.019 -37.050 572 HD3 LYS 72 2HD LYS 72 16.568 13.146 -35.825 573 HE2 LYS 72 1HE LYS 72 16.699 14.998 -37.467 574 HE3 LYS 72 2HE LYS 72 17.326 13.869 -38.686 575 HZ1 LYS 72 1HZ LYS 72 14.668 13.667 -37.384 576 HZ2 LYS 72 2HZ LYS 72 15.251 12.624 -38.518 577 HZ3 LYS 72 3HZ LYS 72 14.941 14.191 -38.928 578 HA PRO 73 HA PRO 73 23.192 9.547 -34.698 579 HB2 PRO 73 1HB PRO 73 25.137 11.376 -35.248 580 HB3 PRO 73 2HB PRO 73 24.487 10.303 -36.522 581 HG2 PRO 73 1HG PRO 73 23.712 13.129 -35.845 582 HG3 PRO 73 2HG PRO 73 24.174 12.438 -37.435 583 HD2 PRO 73 1HD PRO 73 21.590 12.749 -36.732 584 HD3 PRO 73 2HD PRO 73 22.125 11.317 -37.665 585 H ALA 74 H ALA 74 24.814 10.287 -32.926 586 HA ALA 74 HA ALA 74 23.806 12.614 -31.380 587 HB1 ALA 74 1HB ALA 74 23.949 11.287 -29.291 588 HB2 ALA 74 2HB ALA 74 22.747 10.579 -30.387 589 HB3 ALA 74 3HB ALA 74 24.356 9.831 -30.221 590 H GLY 75 H GLY 75 25.473 13.783 -30.533 591 HA2 GLY 75 1HA GLY 75 27.686 14.280 -29.926 592 HA3 GLY 75 2HA GLY 75 28.193 12.650 -30.432 593 H GLU 76 H GLU 76 29.664 14.891 -31.208 594 HA GLU 76 HA GLU 76 29.385 14.732 -34.125 595 HB2 GLU 76 1HB GLU 76 29.508 17.319 -34.233 596 HB3 GLU 76 2HB GLU 76 27.944 16.538 -33.996 597 HG2 GLU 76 1HG GLU 76 28.056 17.027 -31.562 598 HG3 GLU 76 2HG GLU 76 29.622 17.817 -31.802 599 H PHE 77 H PHE 77 31.053 16.470 -31.434 600 HA PHE 77 HA PHE 77 33.624 15.834 -32.812 601 HB2 PHE 77 1HB PHE 77 32.873 18.463 -31.470 602 HB3 PHE 77 2HB PHE 77 34.464 18.050 -32.124 603 HD1 PHE 77 HD1 PHE 77 31.242 19.464 -32.865 604 HD2 PHE 77 HD2 PHE 77 34.617 17.473 -34.642 605 HE1 PHE 77 HE1 PHE 77 30.561 20.307 -35.105 606 HE2 PHE 77 HE2 PHE 77 33.945 18.315 -36.878 607 HZ PHE 77 HZ PHE 77 31.911 19.743 -37.116 608 H ILE 78 H ILE 78 35.490 16.007 -31.330 609 HA ILE 78 HA ILE 78 34.859 14.643 -28.815 610 HB ILE 78 HB ILE 78 36.727 13.946 -30.397 611 HG12 ILE 78 1HG1 ILE 78 37.789 14.619 -27.639 612 HG13 ILE 78 2HG1 ILE 78 36.534 13.400 -27.905 613 HG21 ILE 78 1HG2 ILE 78 38.855 15.177 -30.398 614 HG22 ILE 78 2HG2 ILE 78 37.556 16.260 -30.945 615 HG23 ILE 78 3HG2 ILE 78 38.185 16.401 -29.294 616 HD11 ILE 78 1HD1 ILE 78 38.722 12.348 -27.732 617 HD12 ILE 78 2HD1 ILE 78 38.080 12.126 -29.378 618 HD13 ILE 78 3HD1 ILE 78 39.353 13.334 -29.064 619 H VAL 79 H VAL 79 35.699 15.384 -26.751 620 HA VAL 79 HA VAL 79 35.956 18.358 -26.587 621 HB VAL 79 HB VAL 79 34.643 16.451 -24.574 622 HG11 VAL 79 1HG1 VAL 79 35.683 18.359 -23.457 623 HG12 VAL 79 2HG1 VAL 79 34.889 19.491 -24.583 624 HG13 VAL 79 3HG1 VAL 79 33.920 18.542 -23.424 625 HG21 VAL 79 1HG2 VAL 79 33.192 16.708 -26.532 626 HG22 VAL 79 2HG2 VAL 79 32.525 17.649 -25.183 627 HG23 VAL 79 3HG2 VAL 79 33.394 18.476 -26.491 628 H THR 80 H THR 80 37.715 19.063 -25.503 629 HA THR 80 HA THR 80 39.761 19.063 -24.527 630 HB THR 80 HB THR 80 38.859 16.763 -22.756 631 HG1 THR 80 HG1 THR 80 37.678 18.242 -21.615 632 HG21 THR 80 1HG2 THR 80 41.159 17.668 -22.402 633 HG22 THR 80 2HG2 THR 80 40.089 18.061 -21.044 634 HG23 THR 80 3HG2 THR 80 40.476 19.311 -22.249 635 H ASP 81 H ASP 81 40.361 18.138 -26.741 636 HA ASP 81 HA ASP 81 42.272 15.913 -26.214 637 HB2 ASP 81 1HB ASP 81 40.459 14.882 -27.529 638 HB3 ASP 81 2HB ASP 81 40.566 16.175 -28.728 639 HXT ASP 81 H02 ASP 81 43.177 18.610 -28.846 Start of MODEL 8 1 H2 GLY 1 2H0 GLY 1 11.556 0.519 -12.174 2 H GLY 1 1H0 GLY 1 12.109 1.922 -12.795 3 HA2 GLY 1 1HA GLY 1 10.611 1.558 -10.271 4 HA3 GLY 1 2HA GLY 1 11.445 3.077 -10.669 5 H SER 2 H SER 2 9.009 3.438 -10.097 6 HA SER 2 HA SER 2 7.120 3.060 -12.242 7 HB2 SER 2 1HB SER 2 6.892 4.996 -9.927 8 HB3 SER 2 2HB SER 2 5.584 4.176 -10.808 9 HG SER 2 HG SER 2 6.366 2.200 -9.964 10 H MET 3 H MET 3 9.627 4.814 -12.778 11 HA MET 3 HA MET 3 8.121 7.170 -13.844 12 HB2 MET 3 1HB MET 3 9.574 7.805 -11.918 13 HB3 MET 3 2HB MET 3 10.968 7.127 -12.771 14 HG2 MET 3 1HG MET 3 10.621 8.777 -14.603 15 HG3 MET 3 2HG MET 3 9.272 9.478 -13.690 16 HE1 MET 3 1HE MET 3 10.332 11.939 -13.683 17 HE2 MET 3 2HE MET 3 12.034 12.256 -13.273 18 HE3 MET 3 3HE MET 3 11.634 11.304 -14.721 19 H LYS 4 H LYS 4 8.305 7.452 -15.946 20 HA LYS 4 HA LYS 4 8.918 7.163 -18.132 21 HB2 LYS 4 1HB LYS 4 10.895 8.405 -17.082 22 HB3 LYS 4 2HB LYS 4 11.739 6.861 -17.100 23 HG2 LYS 4 1HG LYS 4 11.159 6.842 -19.664 24 HG3 LYS 4 2HG LYS 4 10.811 8.563 -19.432 25 HD2 LYS 4 1HD LYS 4 13.077 8.468 -20.133 26 HD3 LYS 4 2HD LYS 4 13.147 8.731 -18.378 27 HE2 LYS 4 1HE LYS 4 13.464 6.259 -18.057 28 HE3 LYS 4 2HE LYS 4 13.455 6.053 -19.818 29 HZ1 LYS 4 1HZ LYS 4 15.423 7.446 -19.931 30 HZ2 LYS 4 2HZ LYS 4 15.696 6.162 -18.931 31 HZ3 LYS 4 3HZ LYS 4 15.424 7.660 -18.294 32 H TYR 5 H TYR 5 7.807 4.929 -17.483 33 HA TYR 5 HA TYR 5 9.389 2.540 -17.804 34 HB2 TYR 5 1HB TYR 5 6.470 3.250 -18.241 35 HB3 TYR 5 2HB TYR 5 7.110 1.675 -18.719 36 HD1 TYR 5 HD1 TYR 5 8.570 0.450 -16.861 37 HD2 TYR 5 HD2 TYR 5 5.540 3.394 -16.060 38 HE1 TYR 5 HE1 TYR 5 8.294 -0.480 -14.612 39 HE2 TYR 5 HE2 TYR 5 5.276 2.469 -13.756 40 HH TYR 5 HH TYR 5 7.214 -0.316 -12.605 41 H LEU 6 H LEU 6 9.417 1.184 -19.737 42 HA LEU 6 HA LEU 6 10.274 2.650 -22.051 43 HB2 LEU 6 1HB LEU 6 9.355 -0.238 -21.805 44 HB3 LEU 6 2HB LEU 6 10.269 0.433 -23.154 45 HG LEU 6 HG LEU 6 11.295 0.264 -20.300 46 HD11 LEU 6 1HD1 LEU 6 12.605 -1.645 -21.080 47 HD12 LEU 6 2HD1 LEU 6 11.821 -1.545 -22.677 48 HD13 LEU 6 3HD1 LEU 6 10.863 -1.952 -21.230 49 HD21 LEU 6 1HD2 LEU 6 12.419 2.003 -21.582 50 HD22 LEU 6 2HD2 LEU 6 12.704 0.869 -22.925 51 HD23 LEU 6 3HD2 LEU 6 13.504 0.620 -21.354 52 H ASN 7 H ASN 7 7.278 0.963 -21.209 53 HA ASN 7 HA ASN 7 5.198 0.913 -22.136 54 HB2 ASN 7 1HB ASN 7 5.502 3.343 -21.388 55 HB3 ASN 7 2HB ASN 7 5.730 3.731 -23.099 56 HD21 ASN 7 1HD2 ASN 7 2.303 4.125 -23.431 57 HD22 ASN 7 2HD2 ASN 7 3.919 4.727 -23.704 58 H VAL 8 H VAL 8 7.152 -0.208 -23.787 59 HA VAL 8 HA VAL 8 6.243 0.505 -26.547 60 HB VAL 8 HB VAL 8 8.102 -0.985 -27.299 61 HG11 VAL 8 1HG1 VAL 8 9.071 1.181 -25.389 62 HG12 VAL 8 2HG1 VAL 8 9.957 0.518 -26.778 63 HG13 VAL 8 3HG1 VAL 8 8.474 1.460 -27.038 64 HG21 VAL 8 1HG2 VAL 8 8.814 -1.147 -24.333 65 HG22 VAL 8 2HG2 VAL 8 8.267 -2.485 -25.370 66 HG23 VAL 8 3HG2 VAL 8 9.836 -1.715 -25.669 67 H LEU 9 H LEU 9 5.868 -1.686 -27.856 68 HA LEU 9 HA LEU 9 4.646 -3.677 -26.009 69 HB2 LEU 9 1HB LEU 9 2.802 -3.841 -27.838 70 HB3 LEU 9 2HB LEU 9 2.676 -2.666 -26.541 71 HG LEU 9 HG LEU 9 3.921 -1.718 -29.090 72 HD11 LEU 9 1HD1 LEU 9 2.022 -3.072 -29.877 73 HD12 LEU 9 2HD1 LEU 9 1.700 -1.338 -30.082 74 HD13 LEU 9 3HD1 LEU 9 0.940 -2.227 -28.743 75 HD21 LEU 9 1HD2 LEU 9 2.763 0.341 -28.472 76 HD22 LEU 9 2HD2 LEU 9 3.585 -0.282 -27.026 77 HD23 LEU 9 3HD2 LEU 9 1.836 -0.508 -27.208 78 H ALA 10 H ALA 10 4.319 -5.731 -26.847 79 HA ALA 10 HA ALA 10 5.968 -6.329 -29.260 80 HB1 ALA 10 1HB ALA 10 7.226 -6.597 -27.045 81 HB2 ALA 10 2HB ALA 10 6.090 -7.905 -26.671 82 HB3 ALA 10 3HB ALA 10 7.159 -8.027 -28.090 83 H LYS 11 H LYS 11 5.424 -8.193 -30.368 84 HA LYS 11 HA LYS 11 2.744 -9.342 -29.696 85 HB2 LYS 11 1HB LYS 11 3.173 -8.579 -32.042 86 HB3 LYS 11 2HB LYS 11 4.507 -9.738 -32.153 87 HG2 LYS 11 1HG LYS 11 2.961 -11.614 -31.880 88 HG3 LYS 11 2HG LYS 11 1.623 -10.510 -31.559 89 HD2 LYS 11 1HD LYS 11 1.332 -11.214 -33.780 90 HD3 LYS 11 2HD LYS 11 1.986 -9.570 -33.896 91 HE2 LYS 11 1HE LYS 11 4.236 -10.491 -34.332 92 HE3 LYS 11 2HE LYS 11 3.604 -12.144 -34.143 93 HZ1 LYS 11 1HZ LYS 11 2.145 -11.728 -36.039 94 HZ2 LYS 11 2HZ LYS 11 3.722 -11.519 -36.473 95 HZ3 LYS 11 3HZ LYS 11 2.751 -10.206 -36.225 96 H ALA 12 H ALA 12 2.592 -11.350 -28.833 97 HA ALA 12 HA ALA 12 5.054 -12.754 -28.143 98 HB1 ALA 12 1HB ALA 12 3.338 -14.531 -27.403 99 HB2 ALA 12 2HB ALA 12 3.344 -12.976 -26.553 100 HB3 ALA 12 3HB ALA 12 2.111 -13.304 -27.791 101 H LEU 13 H LEU 13 5.967 -14.443 -29.090 102 HA LEU 13 HA LEU 13 4.966 -15.181 -31.792 103 HB2 LEU 13 1HB LEU 13 7.573 -15.809 -30.368 104 HB3 LEU 13 2HB LEU 13 7.217 -16.141 -32.060 105 HG LEU 13 HG LEU 13 7.389 -13.362 -30.823 106 HD11 LEU 13 1HD1 LEU 13 9.554 -13.206 -31.973 107 HD12 LEU 13 2HD1 LEU 13 9.390 -14.891 -32.527 108 HD13 LEU 13 3HD1 LEU 13 9.551 -14.527 -30.793 109 HD21 LEU 13 1HD2 LEU 13 7.163 -14.276 -33.723 110 HD22 LEU 13 2HD2 LEU 13 7.500 -12.609 -33.198 111 HD23 LEU 13 3HD2 LEU 13 5.947 -13.363 -32.793 112 H TYR 14 H TYR 14 5.190 -16.340 -28.550 113 HA TYR 14 HA TYR 14 4.259 -19.043 -29.412 114 HB2 TYR 14 1HB TYR 14 6.233 -18.443 -27.188 115 HB3 TYR 14 2HB TYR 14 5.609 -20.037 -27.625 116 HD1 TYR 14 HD1 TYR 14 7.973 -17.358 -28.520 117 HD2 TYR 14 HD2 TYR 14 6.365 -21.152 -29.734 118 HE1 TYR 14 HE1 TYR 14 9.848 -17.625 -30.133 119 HE2 TYR 14 HE2 TYR 14 8.242 -21.413 -31.361 120 HH TYR 14 HH TYR 14 10.133 -20.469 -32.259 121 H ASP 15 H ASP 15 3.016 -20.129 -27.700 122 HA ASP 15 HA ASP 15 1.597 -18.178 -25.956 123 HB2 ASP 15 1HB ASP 15 -0.084 -20.047 -25.761 124 HB3 ASP 15 2HB ASP 15 0.074 -19.350 -27.374 125 H ASN 16 H ASN 16 1.055 -18.802 -23.802 126 HA ASN 16 HA ASN 16 2.678 -20.918 -22.532 127 HB2 ASN 16 1HB ASN 16 4.136 -18.853 -22.810 128 HB3 ASN 16 2HB ASN 16 2.985 -17.990 -21.780 129 HD21 ASN 16 1HD2 ASN 16 4.723 -18.949 -18.950 130 HD22 ASN 16 2HD2 ASN 16 3.865 -17.719 -19.865 131 H VAL 17 H VAL 17 2.138 -21.116 -20.203 132 HA VAL 17 HA VAL 17 -0.400 -19.735 -19.438 133 HB VAL 17 HB VAL 17 -0.814 -22.181 -19.989 134 HG11 VAL 17 1HG1 VAL 17 1.409 -23.071 -19.292 135 HG12 VAL 17 2HG1 VAL 17 0.995 -22.748 -17.592 136 HG13 VAL 17 3HG1 VAL 17 0.066 -23.938 -18.525 137 HG21 VAL 17 1HG2 VAL 17 -2.096 -22.688 -17.984 138 HG22 VAL 17 2HG2 VAL 17 -1.139 -21.540 -17.026 139 HG23 VAL 17 3HG2 VAL 17 -2.209 -20.947 -18.326 140 H ALA 18 H ALA 18 -0.400 -19.137 -17.180 141 HA ALA 18 HA ALA 18 2.332 -18.688 -16.205 142 HB1 ALA 18 1HB ALA 18 1.191 -17.288 -14.503 143 HB2 ALA 18 2HB ALA 18 0.708 -16.831 -16.147 144 HB3 ALA 18 3HB ALA 18 -0.385 -17.807 -15.134 145 H GLU 19 H GLU 19 3.288 -20.232 -15.042 146 HA GLU 19 HA GLU 19 1.618 -22.124 -13.433 147 HB2 GLU 19 1HB GLU 19 4.594 -21.981 -14.062 148 HB3 GLU 19 2HB GLU 19 3.856 -23.220 -13.041 149 HG2 GLU 19 1HG GLU 19 3.034 -22.769 -15.925 150 HG3 GLU 19 2HG GLU 19 4.339 -23.861 -15.448 151 H SER 20 H SER 20 3.123 -19.153 -13.180 152 HA SER 20 HA SER 20 3.286 -19.362 -10.200 153 HB2 SER 20 1HB SER 20 5.564 -19.246 -11.146 154 HB3 SER 20 2HB SER 20 5.093 -17.831 -12.102 155 HG SER 20 HG SER 20 6.219 -17.316 -10.147 156 HA PRO 21 HA PRO 21 0.573 -15.892 -10.704 157 HB2 PRO 21 1HB PRO 21 0.856 -14.556 -8.358 158 HB3 PRO 21 2HB PRO 21 0.039 -16.148 -8.451 159 HG2 PRO 21 1HG PRO 21 2.893 -15.546 -7.713 160 HG3 PRO 21 2HG PRO 21 1.676 -16.507 -6.809 161 HD2 PRO 21 1HD PRO 21 3.472 -17.702 -8.411 162 HD3 PRO 21 2HD PRO 21 1.775 -18.284 -8.335 163 H ASP 22 H ASP 22 3.966 -15.629 -10.227 164 HA ASP 22 HA ASP 22 4.130 -12.722 -10.619 165 HB2 ASP 22 1HB ASP 22 5.671 -14.307 -9.228 166 HB3 ASP 22 2HB ASP 22 6.376 -14.754 -10.789 167 H GLU 23 H GLU 23 3.769 -15.532 -12.526 168 HA GLU 23 HA GLU 23 5.222 -14.468 -14.866 169 HB2 GLU 23 1HB GLU 23 5.343 -16.873 -14.041 170 HB3 GLU 23 2HB GLU 23 3.655 -17.043 -14.539 171 HG2 GLU 23 1HG GLU 23 4.307 -16.496 -16.857 172 HG3 GLU 23 2HG GLU 23 5.989 -16.335 -16.320 173 H LEU 24 H LEU 24 4.166 -14.007 -16.840 174 HA LEU 24 HA LEU 24 1.265 -13.433 -16.513 175 HB2 LEU 24 1HB LEU 24 3.419 -12.110 -17.767 176 HB3 LEU 24 2HB LEU 24 2.387 -12.696 -19.071 177 HG LEU 24 HG LEU 24 1.512 -10.928 -16.762 178 HD11 LEU 24 1HD1 LEU 24 1.904 -10.375 -19.720 179 HD12 LEU 24 2HD1 LEU 24 2.998 -9.878 -18.399 180 HD13 LEU 24 3HD1 LEU 24 1.355 -9.218 -18.484 181 HD21 LEU 24 1HD2 LEU 24 -0.582 -10.634 -18.104 182 HD22 LEU 24 2HD2 LEU 24 -0.396 -12.259 -17.433 183 HD23 LEU 24 3HD2 LEU 24 -0.055 -11.971 -19.156 184 H SER 25 H SER 25 -0.305 -14.462 -17.644 185 HA SER 25 HA SER 25 0.464 -16.696 -19.418 186 HB2 SER 25 1HB SER 25 -2.165 -16.778 -19.544 187 HB3 SER 25 2HB SER 25 -1.334 -17.324 -18.072 188 HG SER 25 HG SER 25 -3.030 -15.915 -17.550 189 H PHE 26 H PHE 26 0.852 -16.262 -21.499 190 HA PHE 26 HA PHE 26 -0.738 -14.148 -22.872 191 HB2 PHE 26 1HB PHE 26 1.320 -13.445 -24.054 192 HB3 PHE 26 2HB PHE 26 1.416 -13.127 -22.320 193 HD1 PHE 26 HD1 PHE 26 2.983 -14.316 -20.900 194 HD2 PHE 26 HD2 PHE 26 2.707 -15.229 -25.093 195 HE1 PHE 26 HE1 PHE 26 5.101 -15.606 -20.747 196 HE2 PHE 26 HE2 PHE 26 4.846 -16.500 -24.962 197 HZ PHE 26 HZ PHE 26 6.047 -16.695 -22.783 198 H ARG 27 H ARG 27 -0.626 -14.481 -25.296 199 HA ARG 27 HA ARG 27 -0.114 -17.351 -25.920 200 HB2 ARG 27 1HB ARG 27 -2.533 -15.735 -26.673 201 HB3 ARG 27 2HB ARG 27 -2.166 -17.339 -27.305 202 HG2 ARG 27 1HG ARG 27 -2.364 -18.336 -25.103 203 HG3 ARG 27 2HG ARG 27 -2.569 -16.742 -24.352 204 HD2 ARG 27 1HD ARG 27 -4.436 -17.929 -26.409 205 HD3 ARG 27 2HD ARG 27 -4.711 -17.950 -24.656 206 HE ARG 27 HE ARG 27 -4.895 -15.633 -26.470 207 HH11 ARG 27 1HH1 ARG 27 -4.812 -16.661 -23.085 208 HH12 ARG 27 2HH1 ARG 27 -5.412 -15.117 -22.525 209 HH21 ARG 27 1HH2 ARG 27 -5.609 -13.700 -25.657 210 HH22 ARG 27 2HH2 ARG 27 -5.859 -13.499 -23.942 211 H LYS 28 H LYS 28 0.317 -17.826 -28.093 212 HA LYS 28 HA LYS 28 1.911 -15.893 -29.445 213 HB2 LYS 28 1HB LYS 28 1.773 -17.429 -31.411 214 HB3 LYS 28 2HB LYS 28 2.280 -18.195 -29.917 215 HG2 LYS 28 1HG LYS 28 -0.010 -19.107 -29.607 216 HG3 LYS 28 2HG LYS 28 -0.448 -18.444 -31.195 217 HD2 LYS 28 1HD LYS 28 1.229 -19.821 -32.286 218 HD3 LYS 28 2HD LYS 28 1.900 -20.320 -30.723 219 HE2 LYS 28 1HE LYS 28 0.562 -22.132 -31.585 220 HE3 LYS 28 2HE LYS 28 -0.247 -21.446 -30.168 221 HZ1 LYS 28 1HZ LYS 28 -0.951 -20.899 -32.998 222 HZ2 LYS 28 2HZ LYS 28 -1.693 -20.217 -31.692 223 HZ3 LYS 28 3HZ LYS 28 -1.811 -21.842 -31.952 224 H GLY 29 H GLY 29 1.530 -14.331 -30.831 225 HA2 GLY 29 1HA GLY 29 0.330 -13.208 -32.535 226 HA3 GLY 29 2HA GLY 29 -1.116 -14.147 -32.157 227 H ASP 30 H ASP 30 -0.489 -13.474 -29.164 228 HA ASP 30 HA ASP 30 -2.277 -11.191 -29.097 229 HB2 ASP 30 1HB ASP 30 -1.846 -13.259 -27.445 230 HB3 ASP 30 2HB ASP 30 -0.757 -12.096 -26.675 231 H ILE 31 H ILE 31 -1.804 -9.199 -27.879 232 HA ILE 31 HA ILE 31 1.016 -8.277 -28.369 233 HB ILE 31 HB ILE 31 -1.538 -6.591 -28.476 234 HG12 ILE 31 1HG1 ILE 31 -1.603 -8.190 -30.323 235 HG13 ILE 31 2HG1 ILE 31 -1.367 -6.543 -30.895 236 HG21 ILE 31 1HG2 ILE 31 -0.008 -4.918 -29.623 237 HG22 ILE 31 2HG2 ILE 31 0.393 -5.229 -27.921 238 HG23 ILE 31 3HG2 ILE 31 1.369 -5.972 -29.211 239 HD11 ILE 31 1HD1 ILE 31 0.811 -8.636 -30.664 240 HD12 ILE 31 2HD1 ILE 31 -0.020 -8.159 -32.155 241 HD13 ILE 31 3HD1 ILE 31 1.014 -6.988 -31.305 242 H MET 32 H MET 32 2.053 -7.516 -26.579 243 HA MET 32 HA MET 32 0.359 -6.536 -24.312 244 HB2 MET 32 1HB MET 32 1.867 -7.685 -22.725 245 HB3 MET 32 2HB MET 32 0.944 -8.792 -23.734 246 HG2 MET 32 1HG MET 32 3.295 -8.485 -25.175 247 HG3 MET 32 2HG MET 32 3.843 -8.451 -23.491 248 HE1 MET 32 1HE MET 32 0.804 -10.317 -25.332 249 HE2 MET 32 2HE MET 32 2.216 -10.513 -26.395 250 HE3 MET 32 3HE MET 32 1.532 -11.921 -25.552 251 H THR 33 H THR 33 1.274 -5.015 -22.963 252 HA THR 33 HA THR 33 3.318 -3.339 -24.227 253 HB THR 33 HB THR 33 2.003 -3.075 -21.477 254 HG1 THR 33 HG1 THR 33 0.582 -1.644 -22.637 255 HG21 THR 33 1HG2 THR 33 3.975 -1.619 -21.773 256 HG22 THR 33 2HG2 THR 33 2.483 -0.657 -21.788 257 HG23 THR 33 3HG2 THR 33 3.313 -1.022 -23.316 258 H VAL 34 H VAL 34 5.445 -3.196 -23.615 259 HA VAL 34 HA VAL 34 6.355 -4.970 -21.358 260 HB VAL 34 HB VAL 34 7.921 -3.813 -23.718 261 HG11 VAL 34 1HG1 VAL 34 9.826 -5.195 -22.800 262 HG12 VAL 34 2HG1 VAL 34 9.374 -3.817 -21.775 263 HG13 VAL 34 3HG1 VAL 34 8.854 -5.456 -21.332 264 HG21 VAL 34 1HG2 VAL 34 8.210 -6.108 -24.451 265 HG22 VAL 34 2HG2 VAL 34 7.387 -6.726 -23.008 266 HG23 VAL 34 3HG2 VAL 34 6.473 -5.813 -24.236 267 H LEU 35 H LEU 35 6.808 -3.945 -19.542 268 HA LEU 35 HA LEU 35 6.837 -0.993 -19.534 269 HB2 LEU 35 1HB LEU 35 6.924 -3.089 -17.337 270 HB3 LEU 35 2HB LEU 35 6.898 -1.361 -17.045 271 HG LEU 35 HG LEU 35 4.692 -2.894 -18.432 272 HD11 LEU 35 1HD1 LEU 35 4.900 -3.561 -16.087 273 HD12 LEU 35 2HD1 LEU 35 3.445 -2.573 -16.322 274 HD13 LEU 35 3HD1 LEU 35 4.897 -1.854 -15.585 275 HD21 LEU 35 1HD2 LEU 35 4.709 -0.550 -19.122 276 HD22 LEU 35 2HD2 LEU 35 4.836 -0.022 -17.426 277 HD23 LEU 35 3HD2 LEU 35 3.359 -0.825 -18.009 278 H GLU 36 H GLU 36 8.955 -3.698 -18.569 279 HA GLU 36 HA GLU 36 11.347 -2.023 -18.904 280 HB2 GLU 36 1HB GLU 36 12.179 -2.477 -16.632 281 HB3 GLU 36 2HB GLU 36 10.730 -1.467 -16.618 282 HG2 GLU 36 1HG GLU 36 9.366 -3.421 -16.044 283 HG3 GLU 36 2HG GLU 36 10.823 -4.431 -16.030 284 H ARG 37 H ARG 37 13.327 -3.551 -18.314 285 HA ARG 37 HA ARG 37 12.645 -6.310 -19.251 286 HB2 ARG 37 1HB ARG 37 14.953 -4.542 -20.132 287 HB3 ARG 37 2HB ARG 37 14.750 -6.242 -20.560 288 HG2 ARG 37 1HG ARG 37 12.614 -5.656 -21.702 289 HG3 ARG 37 2HG ARG 37 12.962 -3.947 -21.379 290 HD2 ARG 37 1HD ARG 37 15.108 -4.169 -22.567 291 HD3 ARG 37 2HD ARG 37 14.737 -5.870 -22.910 292 HE ARG 37 HE ARG 37 12.587 -4.287 -23.855 293 HH11 ARG 37 1HH1 ARG 37 15.973 -4.892 -24.635 294 HH12 ARG 37 2HH1 ARG 37 15.761 -4.487 -26.317 295 HH21 ARG 37 1HH2 ARG 37 12.383 -3.785 -26.017 296 HH22 ARG 37 2HH2 ARG 37 13.762 -3.857 -27.079 297 H ASP 38 H ASP 38 14.088 -7.919 -18.643 298 HA ASP 38 HA ASP 38 15.446 -9.074 -17.264 299 HB2 ASP 38 1HB ASP 38 17.111 -6.548 -17.181 300 HB3 ASP 38 2HB ASP 38 17.669 -8.219 -17.004 301 H THR 39 H THR 39 13.235 -7.840 -16.175 302 HA THR 39 HA THR 39 13.750 -6.195 -13.907 303 HB THR 39 HB THR 39 11.611 -6.333 -15.272 304 HG1 THR 39 HG1 THR 39 11.473 -5.296 -13.309 305 HG21 THR 39 1HG2 THR 39 9.959 -8.062 -14.745 306 HG22 THR 39 2HG2 THR 39 11.069 -8.839 -13.616 307 HG23 THR 39 3HG2 THR 39 11.429 -8.832 -15.364 308 H GLN 40 H GLN 40 13.805 -9.641 -14.255 309 HA GLN 40 HA GLN 40 13.474 -10.041 -11.333 310 HB2 GLN 40 1HB GLN 40 12.361 -11.411 -13.290 311 HB3 GLN 40 2HB GLN 40 13.923 -12.219 -13.370 312 HG2 GLN 40 1HG GLN 40 12.669 -13.613 -11.976 313 HG3 GLN 40 2HG GLN 40 13.591 -12.652 -10.818 314 HE21 GLN 40 1HE2 GLN 40 9.710 -12.848 -10.331 315 HE22 GLN 40 2HE2 GLN 40 10.789 -14.039 -11.036 316 H GLY 41 H GLY 41 15.918 -9.162 -13.336 317 HA2 GLY 41 1HA GLY 41 18.230 -9.240 -12.999 318 HA3 GLY 41 2HA GLY 41 18.001 -10.393 -11.663 319 H LEU 42 H LEU 42 16.094 -11.615 -13.942 320 HA LEU 42 HA LEU 42 18.111 -13.534 -14.908 321 HB2 LEU 42 1HB LEU 42 15.100 -13.369 -15.309 322 HB3 LEU 42 2HB LEU 42 16.126 -14.678 -15.880 323 HG LEU 42 HG LEU 42 15.641 -14.003 -12.962 324 HD11 LEU 42 1HD1 LEU 42 13.607 -14.805 -14.126 325 HD12 LEU 42 2HD1 LEU 42 14.217 -16.014 -12.976 326 HD13 LEU 42 3HD1 LEU 42 14.507 -16.220 -14.720 327 HD21 LEU 42 1HD2 LEU 42 17.049 -16.360 -14.282 328 HD22 LEU 42 2HD2 LEU 42 16.637 -16.250 -12.554 329 HD23 LEU 42 3HD2 LEU 42 17.794 -15.106 -13.259 330 H ASP 43 H ASP 43 19.007 -13.342 -16.850 331 HA ASP 43 HA ASP 43 18.624 -11.046 -18.472 332 HB2 ASP 43 1HB ASP 43 20.684 -12.473 -18.396 333 HB3 ASP 43 2HB ASP 43 19.793 -13.753 -19.234 334 H GLY 44 H GLY 44 17.257 -10.561 -20.054 335 HA2 GLY 44 1HA GLY 44 15.864 -10.935 -21.857 336 HA3 GLY 44 2HA GLY 44 16.041 -12.675 -21.644 337 H TRP 45 H TRP 45 15.013 -11.502 -18.634 338 HA TRP 45 HA TRP 45 12.220 -12.257 -19.394 339 HB2 TRP 45 1HB TRP 45 13.718 -12.175 -16.786 340 HB3 TRP 45 2HB TRP 45 11.949 -12.270 -16.844 341 HD1 TRP 45 HD1 TRP 45 15.048 -14.311 -17.937 342 HE1 TRP 45 HE1 TRP 45 14.414 -16.756 -18.227 343 HE3 TRP 45 HE3 TRP 45 10.003 -13.816 -17.274 344 HZ2 TRP 45 HZ2 TRP 45 12.019 -18.319 -18.165 345 HZ3 TRP 45 HZ3 TRP 45 8.564 -15.857 -17.390 346 HH2 TRP 45 HH2 TRP 45 9.575 -18.090 -17.831 347 H TRP 46 H TRP 46 10.892 -10.669 -19.952 348 HA TRP 46 HA TRP 46 11.474 -7.960 -18.883 349 HB2 TRP 46 1HB TRP 46 9.770 -8.861 -21.221 350 HB3 TRP 46 2HB TRP 46 10.178 -7.194 -20.809 351 HD1 TRP 46 HD1 TRP 46 13.379 -8.691 -20.251 352 HE1 TRP 46 HE1 TRP 46 14.925 -8.740 -22.254 353 HE3 TRP 46 HE3 TRP 46 9.843 -7.848 -23.846 354 HZ2 TRP 46 HZ2 TRP 46 14.671 -8.442 -25.091 355 HZ3 TRP 46 HZ3 TRP 46 10.567 -7.780 -26.243 356 HH2 TRP 46 HH2 TRP 46 12.967 -8.056 -26.848 357 H LEU 47 H LEU 47 9.893 -6.664 -17.936 358 HA LEU 47 HA LEU 47 7.610 -8.150 -16.794 359 HB2 LEU 47 1HB LEU 47 8.923 -6.418 -15.485 360 HB3 LEU 47 2HB LEU 47 8.321 -5.205 -16.594 361 HG LEU 47 HG LEU 47 5.996 -5.716 -15.862 362 HD11 LEU 47 1HD1 LEU 47 6.276 -8.020 -15.069 363 HD12 LEU 47 2HD1 LEU 47 5.677 -6.997 -13.756 364 HD13 LEU 47 3HD1 LEU 47 7.389 -7.475 -13.794 365 HD21 LEU 47 1HD2 LEU 47 7.296 -3.869 -14.867 366 HD22 LEU 47 2HD2 LEU 47 7.947 -4.981 -13.640 367 HD23 LEU 47 3HD2 LEU 47 6.207 -4.603 -13.674 368 H CYS 48 H CYS 48 5.786 -8.349 -17.937 369 HA CYS 48 HA CYS 48 5.155 -6.179 -19.899 370 HB2 CYS 48 1HB CYS 48 4.446 -9.121 -20.060 371 HB3 CYS 48 2HB CYS 48 4.097 -7.881 -21.275 372 HG CYS 48 HG CYS 48 7.025 -8.938 -20.170 373 H SER 49 H SER 49 2.759 -6.054 -20.366 374 HA SER 49 HA SER 49 1.122 -6.982 -18.061 375 HB2 SER 49 1HB SER 49 1.647 -4.630 -17.623 376 HB3 SER 49 2HB SER 49 1.030 -4.185 -19.234 377 HG SER 49 HG SER 49 -0.492 -5.510 -17.218 378 H LEU 50 H LEU 50 -0.709 -7.893 -18.581 379 HA LEU 50 HA LEU 50 -2.125 -7.419 -21.107 380 HB2 LEU 50 1HB LEU 50 -0.212 -8.955 -21.731 381 HB3 LEU 50 2HB LEU 50 -0.807 -10.106 -20.552 382 HG LEU 50 HG LEU 50 -2.905 -10.336 -21.879 383 HD11 LEU 50 1HD1 LEU 50 -2.892 -9.543 -24.233 384 HD12 LEU 50 2HD1 LEU 50 -1.431 -8.597 -23.874 385 HD13 LEU 50 3HD1 LEU 50 -2.959 -8.212 -23.062 386 HD21 LEU 50 1HD2 LEU 50 -1.871 -11.659 -23.675 387 HD22 LEU 50 2HD2 LEU 50 -1.054 -11.908 -22.113 388 HD23 LEU 50 3HD2 LEU 50 -0.310 -10.868 -23.349 389 H HIS 51 H HIS 51 -4.239 -8.478 -20.974 390 HA HIS 51 HA HIS 51 -6.122 -9.184 -19.892 391 HB2 HIS 51 1HB HIS 51 -4.214 -10.937 -18.292 392 HB3 HIS 51 2HB HIS 51 -5.967 -11.112 -18.364 393 HD1 HIS 51 HD1 HIS 51 -2.960 -12.384 -19.959 394 HD2 HIS 51 HD2 HIS 51 -6.898 -11.617 -21.117 395 HE1 HIS 51 HE1 HIS 51 -3.372 -13.694 -22.070 396 H GLY 52 H GLY 52 -4.585 -6.856 -18.659 397 HA2 GLY 52 1HA GLY 52 -5.102 -5.431 -16.901 398 HA3 GLY 52 2HA GLY 52 -6.301 -6.607 -16.332 399 H ARG 53 H ARG 53 -3.213 -7.944 -16.877 400 HA ARG 53 HA ARG 53 -2.477 -7.729 -13.979 401 HB2 ARG 53 1HB ARG 53 -2.165 -10.122 -15.846 402 HB3 ARG 53 2HB ARG 53 -1.602 -10.031 -14.173 403 HG2 ARG 53 1HG ARG 53 -3.984 -9.755 -13.448 404 HG3 ARG 53 2HG ARG 53 -4.473 -10.046 -15.133 405 HD2 ARG 53 1HD ARG 53 -3.232 -12.209 -15.070 406 HD3 ARG 53 2HD ARG 53 -2.891 -11.923 -13.351 407 HE ARG 53 HE ARG 53 -5.705 -11.720 -13.851 408 HH11 ARG 53 1HH1 ARG 53 -3.160 -14.154 -13.537 409 HH12 ARG 53 2HH1 ARG 53 -4.280 -15.398 -13.051 410 HH21 ARG 53 1HH2 ARG 53 -7.075 -13.364 -13.223 411 HH22 ARG 53 2HH2 ARG 53 -6.453 -14.951 -12.868 412 H GLN 54 H GLN 54 -0.077 -8.215 -13.748 413 HA GLN 54 HA GLN 54 1.443 -7.722 -16.231 414 HB2 GLN 54 1HB GLN 54 2.916 -6.121 -15.161 415 HB3 GLN 54 2HB GLN 54 1.255 -5.519 -15.098 416 HG2 GLN 54 1HG GLN 54 1.096 -6.323 -12.743 417 HG3 GLN 54 2HG GLN 54 2.800 -6.794 -12.822 418 HE21 GLN 54 1HE2 GLN 54 3.001 -3.568 -11.255 419 HE22 GLN 54 2HE2 GLN 54 2.689 -5.251 -10.902 420 H GLY 55 H GLY 55 3.530 -8.714 -16.121 421 HA2 GLY 55 1HA GLY 55 4.422 -10.153 -13.815 422 HA3 GLY 55 2HA GLY 55 3.446 -11.227 -14.836 423 H ILE 56 H ILE 56 5.998 -11.940 -14.495 424 HA ILE 56 HA ILE 56 7.721 -10.688 -16.484 425 HB ILE 56 HB ILE 56 9.424 -12.279 -15.799 426 HG12 ILE 56 1HG1 ILE 56 7.292 -13.678 -14.140 427 HG13 ILE 56 2HG1 ILE 56 7.936 -14.293 -15.657 428 HG21 ILE 56 1HG2 ILE 56 8.785 -10.304 -14.291 429 HG22 ILE 56 2HG2 ILE 56 7.903 -11.464 -13.270 430 HG23 ILE 56 3HG2 ILE 56 9.659 -11.618 -13.482 431 HD11 ILE 56 1HD1 ILE 56 10.229 -14.337 -14.574 432 HD12 ILE 56 2HD1 ILE 56 9.424 -13.951 -13.032 433 HD13 ILE 56 3HD1 ILE 56 9.036 -15.459 -13.884 434 H VAL 57 H VAL 57 8.439 -11.453 -18.404 435 HA VAL 57 HA VAL 57 7.183 -13.917 -19.535 436 HB VAL 57 HB VAL 57 7.206 -11.117 -20.780 437 HG11 VAL 57 1HG1 VAL 57 6.476 -13.788 -21.993 438 HG12 VAL 57 2HG1 VAL 57 5.942 -12.242 -22.670 439 HG13 VAL 57 3HG1 VAL 57 7.673 -12.610 -22.566 440 HG21 VAL 57 1HG2 VAL 57 5.373 -11.345 -19.222 441 HG22 VAL 57 2HG2 VAL 57 4.718 -11.431 -20.868 442 HG23 VAL 57 3HG2 VAL 57 4.918 -12.920 -19.911 443 HA PRO 58 HA PRO 58 11.435 -13.926 -20.899 444 HB2 PRO 58 1HB PRO 58 11.465 -16.026 -22.651 445 HB3 PRO 58 2HB PRO 58 11.407 -16.255 -20.874 446 HG2 PRO 58 1HG PRO 58 9.161 -16.308 -22.859 447 HG3 PRO 58 2HG PRO 58 9.535 -17.467 -21.550 448 HD2 PRO 58 1HD PRO 58 7.667 -15.507 -21.307 449 HD3 PRO 58 2HD PRO 58 8.651 -16.072 -19.920 450 H GLY 59 H GLY 59 12.054 -12.316 -22.195 451 HA2 GLY 59 1HA GLY 59 10.437 -11.229 -24.241 452 HA3 GLY 59 2HA GLY 59 12.122 -10.829 -23.913 453 H ASN 60 H ASN 60 12.832 -13.764 -24.449 454 HA ASN 60 HA ASN 60 13.444 -13.479 -27.242 455 HB2 ASN 60 1HB ASN 60 14.659 -14.938 -25.571 456 HB3 ASN 60 2HB ASN 60 13.289 -16.060 -25.643 457 HD21 ASN 60 1HD2 ASN 60 14.795 -17.730 -28.283 458 HD22 ASN 60 2HD2 ASN 60 13.980 -17.789 -26.741 459 H ARG 61 H ARG 61 10.591 -14.572 -25.547 460 HA ARG 61 HA ARG 61 9.529 -15.927 -27.968 461 HB2 ARG 61 1HB ARG 61 8.347 -15.512 -25.193 462 HB3 ARG 61 2HB ARG 61 7.565 -16.391 -26.510 463 HG2 ARG 61 1HG ARG 61 9.593 -17.920 -26.555 464 HG3 ARG 61 2HG ARG 61 10.094 -17.158 -25.033 465 HD2 ARG 61 1HD ARG 61 7.896 -17.794 -24.031 466 HD3 ARG 61 2HD ARG 61 7.459 -18.601 -25.538 467 HE ARG 61 HE ARG 61 9.249 -19.576 -23.462 468 HH11 ARG 61 1HH1 ARG 61 8.367 -19.964 -26.870 469 HH12 ARG 61 2HH1 ARG 61 8.992 -21.588 -26.933 470 HH21 ARG 61 1HH2 ARG 61 10.017 -21.648 -23.633 471 HH22 ARG 61 2HH2 ARG 61 9.906 -22.519 -25.139 472 H LEU 62 H LEU 62 9.994 -12.819 -27.338 473 HA LEU 62 HA LEU 62 7.291 -11.978 -28.331 474 HB2 LEU 62 1HB LEU 62 9.224 -10.453 -26.553 475 HB3 LEU 62 2HB LEU 62 7.698 -9.862 -27.157 476 HG LEU 62 HG LEU 62 8.037 -12.056 -25.104 477 HD11 LEU 62 1HD1 LEU 62 7.118 -9.149 -24.881 478 HD12 LEU 62 2HD1 LEU 62 8.664 -9.808 -24.297 479 HD13 LEU 62 3HD1 LEU 62 7.144 -10.329 -23.558 480 HD21 LEU 62 1HD2 LEU 62 5.558 -11.678 -24.784 481 HD22 LEU 62 2HD2 LEU 62 6.004 -12.477 -26.295 482 HD23 LEU 62 3HD2 LEU 62 5.562 -10.751 -26.297 483 H LYS 63 H LYS 63 7.298 -10.203 -29.824 484 HA LYS 63 HA LYS 63 10.023 -9.306 -30.700 485 HB2 LYS 63 1HB LYS 63 9.022 -10.907 -32.341 486 HB3 LYS 63 2HB LYS 63 7.680 -9.778 -32.582 487 HG2 LYS 63 1HG LYS 63 9.221 -8.078 -33.431 488 HG3 LYS 63 2HG LYS 63 10.612 -9.115 -33.051 489 HD2 LYS 63 1HD LYS 63 9.740 -10.819 -34.651 490 HD3 LYS 63 2HD LYS 63 8.434 -9.696 -35.095 491 HE2 LYS 63 1HE LYS 63 10.103 -8.036 -35.843 492 HE3 LYS 63 2HE LYS 63 11.420 -9.113 -35.334 493 HZ1 LYS 63 1HZ LYS 63 11.025 -9.269 -37.711 494 HZ2 LYS 63 2HZ LYS 63 9.454 -9.716 -37.477 495 HZ3 LYS 63 3HZ LYS 63 10.677 -10.715 -36.998 496 H ILE 64 H ILE 64 10.235 -7.233 -30.276 497 HA ILE 64 HA ILE 64 8.045 -5.540 -29.495 498 HB ILE 64 HB ILE 64 10.912 -4.815 -30.297 499 HG12 ILE 64 1HG1 ILE 64 10.598 -6.427 -28.319 500 HG13 ILE 64 2HG1 ILE 64 11.562 -4.984 -28.051 501 HG21 ILE 64 1HG2 ILE 64 10.491 -2.727 -28.893 502 HG22 ILE 64 2HG2 ILE 64 9.557 -2.795 -30.397 503 HG23 ILE 64 3HG2 ILE 64 8.763 -3.166 -28.859 504 HD11 ILE 64 1HD1 ILE 64 9.891 -3.946 -26.708 505 HD12 ILE 64 2HD1 ILE 64 8.622 -5.052 -27.267 506 HD13 ILE 64 3HD1 ILE 64 9.903 -5.637 -26.190 507 H LEU 65 H LEU 65 6.824 -4.132 -30.659 508 HA LEU 65 HA LEU 65 6.973 -4.244 -33.567 509 HB2 LEU 65 1HB LEU 65 5.237 -2.746 -31.575 510 HB3 LEU 65 2HB LEU 65 5.197 -2.388 -33.294 511 HG LEU 65 HG LEU 65 4.583 -4.827 -33.692 512 HD11 LEU 65 1HD1 LEU 65 5.156 -5.821 -31.541 513 HD12 LEU 65 2HD1 LEU 65 3.408 -5.958 -31.800 514 HD13 LEU 65 3HD1 LEU 65 4.043 -4.718 -30.694 515 HD21 LEU 65 1HD2 LEU 65 2.701 -3.012 -32.140 516 HD22 LEU 65 2HD2 LEU 65 2.206 -4.382 -33.162 517 HD23 LEU 65 3HD2 LEU 65 3.006 -2.974 -33.890 518 H VAL 66 H VAL 66 8.241 -3.053 -34.718 519 HA VAL 66 HA VAL 66 9.748 -1.466 -35.396 520 HB VAL 66 HB VAL 66 8.084 0.674 -34.029 521 HG11 VAL 66 1HG1 VAL 66 9.368 0.455 -36.807 522 HG12 VAL 66 2HG1 VAL 66 8.519 1.878 -36.160 523 HG13 VAL 66 3HG1 VAL 66 10.045 1.351 -35.427 524 HG21 VAL 66 1HG2 VAL 66 6.501 0.543 -36.000 525 HG22 VAL 66 2HG2 VAL 66 7.234 -1.021 -36.429 526 HG23 VAL 66 3HG2 VAL 66 6.371 -0.824 -34.882 527 H GLY 67 H GLY 67 10.693 -2.735 -33.170 528 HA2 GLY 67 1HA GLY 67 11.396 -0.939 -31.056 529 HA3 GLY 67 2HA GLY 67 12.072 -2.538 -31.348 530 H MET 68 H MET 68 12.536 -0.553 -34.078 531 HA MET 68 HA MET 68 15.080 0.584 -33.103 532 HB2 MET 68 1HB MET 68 15.562 -1.779 -33.821 533 HB3 MET 68 2HB MET 68 14.946 -1.382 -35.425 534 HG2 MET 68 1HG MET 68 16.738 0.341 -35.648 535 HG3 MET 68 2HG MET 68 17.366 -0.161 -34.062 536 HE1 MET 68 1HE MET 68 17.336 -0.760 -37.861 537 HE2 MET 68 2HE MET 68 17.630 -2.506 -38.048 538 HE3 MET 68 3HE MET 68 16.060 -1.926 -37.442 539 H TYR 69 H TYR 69 14.506 2.682 -33.660 540 HA TYR 69 HA TYR 69 14.386 3.264 -36.518 541 HB2 TYR 69 1HB TYR 69 11.998 2.730 -35.867 542 HB3 TYR 69 2HB TYR 69 12.038 4.140 -34.801 543 HD1 TYR 69 HD1 TYR 69 12.196 2.995 -38.340 544 HD2 TYR 69 HD2 TYR 69 11.944 6.399 -35.731 545 HE1 TYR 69 HE1 TYR 69 11.672 4.462 -40.292 546 HE2 TYR 69 HE2 TYR 69 11.427 7.861 -37.684 547 HH TYR 69 HH TYR 69 11.187 7.978 -39.960 548 H ASP 70 H ASP 70 15.892 4.817 -36.649 549 HA ASP 70 HA ASP 70 16.458 6.611 -34.438 550 HB2 ASP 70 1HB ASP 70 17.436 6.472 -37.302 551 HB3 ASP 70 2HB ASP 70 18.057 7.610 -36.093 552 H LYS 71 H LYS 71 16.352 8.905 -34.468 553 HA LYS 71 HA LYS 71 14.444 10.101 -36.423 554 HB2 LYS 71 1HB LYS 71 14.066 9.973 -33.423 555 HB3 LYS 71 2HB LYS 71 13.252 11.181 -34.424 556 HG2 LYS 71 1HG LYS 71 12.116 9.452 -35.707 557 HG3 LYS 71 2HG LYS 71 12.990 8.181 -34.848 558 HD2 LYS 71 1HD LYS 71 11.176 10.146 -33.428 559 HD3 LYS 71 2HD LYS 71 10.595 8.614 -34.105 560 HE2 LYS 71 1HE LYS 71 12.815 8.861 -32.027 561 HE3 LYS 71 2HE LYS 71 11.128 8.460 -31.669 562 HZ1 LYS 71 1HZ LYS 71 12.473 6.469 -31.818 563 HZ2 LYS 71 2HZ LYS 71 12.968 6.829 -33.348 564 HZ3 LYS 71 3HZ LYS 71 11.384 6.471 -33.053 565 H LYS 72 H LYS 72 16.770 10.708 -33.764 566 HA LYS 72 HA LYS 72 17.152 13.440 -34.911 567 HB2 LYS 72 1HB LYS 72 17.264 12.528 -32.012 568 HB3 LYS 72 2HB LYS 72 17.894 14.081 -32.566 569 HG2 LYS 72 1HG LYS 72 14.988 13.208 -32.830 570 HG3 LYS 72 2HG LYS 72 15.632 14.248 -31.548 571 HD2 LYS 72 1HD LYS 72 16.390 15.874 -33.295 572 HD3 LYS 72 2HD LYS 72 15.601 14.869 -34.531 573 HE2 LYS 72 1HE LYS 72 13.432 15.163 -33.380 574 HE3 LYS 72 2HE LYS 72 14.221 16.189 -32.161 575 HZ1 LYS 72 1HZ LYS 72 14.098 16.778 -35.069 576 HZ2 LYS 72 2HZ LYS 72 14.813 17.735 -33.929 577 HZ3 LYS 72 3HZ LYS 72 13.178 17.509 -33.910 578 HA PRO 73 HA PRO 73 21.376 12.074 -35.165 579 HB2 PRO 73 1HB PRO 73 22.766 14.406 -35.205 580 HB3 PRO 73 2HB PRO 73 21.707 13.941 -36.579 581 HG2 PRO 73 1HG PRO 73 21.105 15.759 -34.256 582 HG3 PRO 73 2HG PRO 73 20.899 16.071 -36.008 583 HD2 PRO 73 1HD PRO 73 18.846 15.240 -34.430 584 HD3 PRO 73 2HD PRO 73 19.000 14.713 -36.143 585 H ALA 74 H ALA 74 23.471 12.293 -33.845 586 HA ALA 74 HA ALA 74 22.901 12.268 -31.014 587 HB1 ALA 74 1HB ALA 74 25.348 11.982 -30.784 588 HB2 ALA 74 2HB ALA 74 24.715 10.895 -32.041 589 HB3 ALA 74 3HB ALA 74 25.571 12.391 -32.500 590 H GLY 75 H GLY 75 23.527 13.809 -29.425 591 HA2 GLY 75 1HA GLY 75 24.925 16.220 -30.028 592 HA3 GLY 75 2HA GLY 75 23.169 16.513 -30.054 593 H GLU 76 H GLU 76 24.268 17.884 -28.126 594 HA GLU 76 HA GLU 76 24.627 16.382 -25.658 595 HB2 GLU 76 1HB GLU 76 24.194 19.347 -26.182 596 HB3 GLU 76 2HB GLU 76 24.657 18.637 -24.627 597 HG2 GLU 76 1HG GLU 76 26.731 17.755 -25.706 598 HG3 GLU 76 2HG GLU 76 26.289 18.623 -27.186 599 H PHE 77 H PHE 77 23.234 16.865 -23.727 600 HA PHE 77 HA PHE 77 20.370 17.144 -24.526 601 HB2 PHE 77 1HB PHE 77 21.581 15.457 -22.308 602 HB3 PHE 77 2HB PHE 77 19.853 15.663 -22.620 603 HD1 PHE 77 HD1 PHE 77 18.847 14.763 -24.742 604 HD2 PHE 77 HD2 PHE 77 22.909 13.920 -23.610 605 HE1 PHE 77 HE1 PHE 77 18.905 12.878 -26.372 606 HE2 PHE 77 HE2 PHE 77 22.978 12.035 -25.235 607 HZ PHE 77 HZ PHE 77 20.974 11.508 -26.620 608 H ILE 78 H ILE 78 19.373 18.814 -23.657 609 HA ILE 78 HA ILE 78 20.869 20.581 -21.910 610 HB ILE 78 HB ILE 78 18.957 22.121 -22.202 611 HG12 ILE 78 1HG1 ILE 78 17.646 19.852 -23.761 612 HG13 ILE 78 2HG1 ILE 78 17.161 20.378 -22.147 613 HG21 ILE 78 1HG2 ILE 78 19.665 20.809 -24.877 614 HG22 ILE 78 2HG2 ILE 78 19.233 22.511 -24.588 615 HG23 ILE 78 3HG2 ILE 78 20.768 21.871 -23.972 616 HD11 ILE 78 1HD1 ILE 78 16.934 21.955 -24.738 617 HD12 ILE 78 2HD1 ILE 78 15.622 21.342 -23.708 618 HD13 ILE 78 3HD1 ILE 78 16.660 22.662 -23.129 619 H VAL 79 H VAL 79 19.940 21.591 -20.015 620 HA VAL 79 HA VAL 79 18.353 19.677 -18.349 621 HB VAL 79 HB VAL 79 19.623 20.602 -16.393 622 HG11 VAL 79 1HG1 VAL 79 21.429 19.437 -18.561 623 HG12 VAL 79 2HG1 VAL 79 21.712 19.397 -16.805 624 HG13 VAL 79 3HG1 VAL 79 20.346 18.502 -17.505 625 HG21 VAL 79 1HG2 VAL 79 20.264 22.804 -17.426 626 HG22 VAL 79 2HG2 VAL 79 21.652 21.946 -16.734 627 HG23 VAL 79 3HG2 VAL 79 21.407 21.950 -18.493 628 H THR 80 H THR 80 17.670 22.054 -20.148 629 HA THR 80 HA THR 80 16.384 23.783 -18.080 630 HB THR 80 HB THR 80 16.399 25.540 -19.901 631 HG1 THR 80 HG1 THR 80 16.677 24.001 -21.626 632 HG21 THR 80 1HG2 THR 80 19.171 24.453 -19.243 633 HG22 THR 80 2HG2 THR 80 18.188 25.444 -18.136 634 HG23 THR 80 3HG2 THR 80 18.750 26.121 -19.682 635 H ASP 81 H ASP 81 14.243 23.688 -17.997 636 HA ASP 81 HA ASP 81 12.745 22.277 -20.063 637 HB2 ASP 81 1HB ASP 81 11.976 23.586 -17.429 638 HB3 ASP 81 2HB ASP 81 10.743 23.077 -18.586 639 HXT ASP 81 H02 ASP 81 11.966 22.991 -21.478 Start of MODEL 9 1 H2 GLY 1 2H0 GLY 1 11.840 15.327 -20.384 2 H GLY 1 1H0 GLY 1 13.446 15.539 -20.077 3 HA2 GLY 1 1HA GLY 1 14.060 13.378 -20.950 4 HA3 GLY 1 2HA GLY 1 12.803 13.200 -19.700 5 H SER 2 H SER 2 10.573 13.817 -21.075 6 HA SER 2 HA SER 2 8.890 12.919 -22.295 7 HB2 SER 2 1HB SER 2 11.051 12.280 -24.317 8 HB3 SER 2 2HB SER 2 9.306 12.388 -24.634 9 HG SER 2 HG SER 2 10.664 14.290 -25.095 10 H MET 3 H MET 3 11.073 10.844 -20.954 11 HA MET 3 HA MET 3 9.381 8.486 -21.593 12 HB2 MET 3 1HB MET 3 11.267 8.470 -23.192 13 HB3 MET 3 2HB MET 3 12.414 8.641 -21.858 14 HG2 MET 3 1HG MET 3 11.804 6.408 -21.020 15 HG3 MET 3 2HG MET 3 10.636 6.227 -22.356 16 HE1 MET 3 1HE MET 3 13.218 4.410 -21.511 17 HE2 MET 3 2HE MET 3 12.144 3.900 -22.832 18 HE3 MET 3 3HE MET 3 13.900 3.971 -23.097 19 H LYS 4 H LYS 4 8.866 7.530 -19.701 20 HA LYS 4 HA LYS 4 10.627 8.065 -17.320 21 HB2 LYS 4 1HB LYS 4 8.331 9.022 -17.200 22 HB3 LYS 4 2HB LYS 4 7.658 7.401 -17.386 23 HG2 LYS 4 1HG LYS 4 9.594 7.796 -15.165 24 HG3 LYS 4 2HG LYS 4 8.029 8.612 -15.006 25 HD2 LYS 4 1HD LYS 4 6.828 6.491 -15.238 26 HD3 LYS 4 2HD LYS 4 8.348 5.622 -15.570 27 HE2 LYS 4 1HE LYS 4 9.177 6.291 -13.304 28 HE3 LYS 4 2HE LYS 4 7.592 6.996 -12.960 29 HZ1 LYS 4 1HZ LYS 4 7.771 4.735 -12.119 30 HZ2 LYS 4 2HZ LYS 4 8.070 4.157 -13.645 31 HZ3 LYS 4 3HZ LYS 4 6.600 4.814 -13.286 32 H TYR 5 H TYR 5 8.935 5.657 -19.248 33 HA TYR 5 HA TYR 5 10.613 3.533 -18.136 34 HB2 TYR 5 1HB TYR 5 8.781 2.015 -17.713 35 HB3 TYR 5 2HB TYR 5 8.539 3.450 -16.729 36 HD1 TYR 5 HD1 TYR 5 7.045 1.220 -19.087 37 HD2 TYR 5 HD2 TYR 5 6.850 5.277 -17.639 38 HE1 TYR 5 HE1 TYR 5 4.731 1.433 -19.972 39 HE2 TYR 5 HE2 TYR 5 4.573 5.489 -18.560 40 HH TYR 5 HH TYR 5 2.878 4.484 -19.726 41 H LEU 6 H LEU 6 10.028 1.541 -19.742 42 HA LEU 6 HA LEU 6 10.763 2.522 -22.265 43 HB2 LEU 6 1HB LEU 6 9.502 -0.097 -21.484 44 HB3 LEU 6 2HB LEU 6 10.233 0.237 -23.062 45 HG LEU 6 HG LEU 6 11.800 0.467 -20.471 46 HD11 LEU 6 1HD1 LEU 6 11.499 -1.939 -22.280 47 HD12 LEU 6 2HD1 LEU 6 10.821 -1.764 -20.630 48 HD13 LEU 6 3HD1 LEU 6 12.576 -1.782 -20.864 49 HD21 LEU 6 1HD2 LEU 6 13.743 0.148 -21.942 50 HD22 LEU 6 2HD2 LEU 6 12.787 1.520 -22.502 51 HD23 LEU 6 3HD2 LEU 6 12.668 -0.016 -23.366 52 H ASN 7 H ASN 7 7.523 1.376 -21.314 53 HA ASN 7 HA ASN 7 5.522 1.420 -22.404 54 HB2 ASN 7 1HB ASN 7 5.983 3.851 -21.823 55 HB3 ASN 7 2HB ASN 7 6.419 4.092 -23.526 56 HD21 ASN 7 1HD2 ASN 7 3.060 4.875 -24.056 57 HD22 ASN 7 2HD2 ASN 7 4.728 5.404 -24.093 58 H VAL 8 H VAL 8 7.353 -0.097 -23.875 59 HA VAL 8 HA VAL 8 6.559 0.522 -26.697 60 HB VAL 8 HB VAL 8 8.399 -1.028 -27.365 61 HG11 VAL 8 1HG1 VAL 8 8.856 1.395 -27.180 62 HG12 VAL 8 2HG1 VAL 8 9.423 1.163 -25.508 63 HG13 VAL 8 3HG1 VAL 8 10.302 0.415 -26.873 64 HG21 VAL 8 1HG2 VAL 8 10.128 -1.706 -25.648 65 HG22 VAL 8 2HG2 VAL 8 9.029 -1.132 -24.376 66 HG23 VAL 8 3HG2 VAL 8 8.553 -2.491 -25.445 67 H LEU 9 H LEU 9 6.057 -1.641 -27.883 68 HA LEU 9 HA LEU 9 4.833 -3.575 -25.982 69 HB2 LEU 9 1HB LEU 9 2.966 -3.772 -27.735 70 HB3 LEU 9 2HB LEU 9 2.933 -2.407 -26.631 71 HG LEU 9 HG LEU 9 4.287 -1.890 -29.228 72 HD11 LEU 9 1HD1 LEU 9 2.448 -3.325 -29.972 73 HD12 LEU 9 2HD1 LEU 9 2.150 -1.633 -30.431 74 HD13 LEU 9 3HD1 LEU 9 1.295 -2.329 -29.052 75 HD21 LEU 9 1HD2 LEU 9 3.090 0.227 -29.008 76 HD22 LEU 9 2HD2 LEU 9 3.879 -0.167 -27.470 77 HD23 LEU 9 3HD2 LEU 9 2.125 -0.420 -27.651 78 H ALA 10 H ALA 10 4.425 -5.669 -26.819 79 HA ALA 10 HA ALA 10 6.077 -6.335 -29.194 80 HB1 ALA 10 1HB ALA 10 7.490 -6.417 -27.128 81 HB2 ALA 10 2HB ALA 10 6.426 -7.688 -26.488 82 HB3 ALA 10 3HB ALA 10 7.385 -7.951 -27.990 83 H LYS 11 H LYS 11 5.516 -8.204 -30.245 84 HA LYS 11 HA LYS 11 2.870 -9.362 -29.563 85 HB2 LYS 11 1HB LYS 11 3.344 -8.690 -31.902 86 HB3 LYS 11 2HB LYS 11 4.765 -9.738 -31.916 87 HG2 LYS 11 1HG LYS 11 3.262 -11.709 -31.539 88 HG3 LYS 11 2HG LYS 11 1.873 -10.612 -31.717 89 HD2 LYS 11 1HD LYS 11 2.564 -10.086 -33.982 90 HD3 LYS 11 2HD LYS 11 4.029 -11.069 -33.792 91 HE2 LYS 11 1HE LYS 11 2.627 -13.089 -33.410 92 HE3 LYS 11 2HE LYS 11 1.158 -12.095 -33.600 93 HZ1 LYS 11 1HZ LYS 11 3.194 -12.600 -35.697 94 HZ2 LYS 11 2HZ LYS 11 1.869 -11.636 -35.884 95 HZ3 LYS 11 3HZ LYS 11 1.669 -13.255 -35.636 96 H ALA 12 H ALA 12 2.570 -11.344 -28.757 97 HA ALA 12 HA ALA 12 4.902 -12.945 -27.989 98 HB1 ALA 12 1HB ALA 12 1.868 -13.354 -27.832 99 HB2 ALA 12 2HB ALA 12 3.051 -14.603 -27.322 100 HB3 ALA 12 3HB ALA 12 3.018 -13.026 -26.518 101 H LEU 13 H LEU 13 5.929 -14.302 -29.272 102 HA LEU 13 HA LEU 13 4.808 -14.928 -31.926 103 HB2 LEU 13 1HB LEU 13 7.385 -15.714 -30.543 104 HB3 LEU 13 2HB LEU 13 7.026 -16.018 -32.230 105 HG LEU 13 HG LEU 13 7.260 -13.252 -31.017 106 HD11 LEU 13 1HD1 LEU 13 9.474 -13.175 -32.097 107 HD12 LEU 13 2HD1 LEU 13 9.260 -14.858 -32.643 108 HD13 LEU 13 3HD1 LEU 13 9.402 -14.482 -30.909 109 HD21 LEU 13 1HD2 LEU 13 7.482 -12.600 -33.422 110 HD22 LEU 13 2HD2 LEU 13 5.881 -13.228 -33.017 111 HD23 LEU 13 3HD2 LEU 13 7.061 -14.258 -33.884 112 H TYR 14 H TYR 14 5.194 -16.417 -28.809 113 HA TYR 14 HA TYR 14 4.154 -18.995 -29.871 114 HB2 TYR 14 1HB TYR 14 6.203 -18.668 -27.651 115 HB3 TYR 14 2HB TYR 14 5.616 -20.179 -28.328 116 HD1 TYR 14 HD1 TYR 14 6.199 -20.712 -30.801 117 HD2 TYR 14 HD2 TYR 14 8.040 -17.507 -28.583 118 HE1 TYR 14 HE1 TYR 14 8.084 -20.622 -32.461 119 HE2 TYR 14 HE2 TYR 14 9.907 -17.421 -30.258 120 HH TYR 14 HH TYR 14 10.061 -19.628 -33.035 121 H ASP 15 H ASP 15 3.089 -20.267 -28.071 122 HA ASP 15 HA ASP 15 1.682 -18.384 -26.269 123 HB2 ASP 15 1HB ASP 15 0.108 -20.289 -25.970 124 HB3 ASP 15 2HB ASP 15 0.199 -19.728 -27.635 125 H ASN 16 H ASN 16 1.314 -19.036 -24.037 126 HA ASN 16 HA ASN 16 3.293 -20.969 -22.941 127 HB2 ASN 16 1HB ASN 16 4.298 -18.621 -23.106 128 HB3 ASN 16 2HB ASN 16 3.059 -18.098 -21.966 129 HD21 ASN 16 1HD2 ASN 16 5.080 -18.945 -19.279 130 HD22 ASN 16 2HD2 ASN 16 3.854 -17.899 -19.983 131 H VAL 17 H VAL 17 2.428 -22.071 -21.275 132 HA VAL 17 HA VAL 17 0.044 -20.910 -19.882 133 HB VAL 17 HB VAL 17 1.089 -23.799 -19.887 134 HG11 VAL 17 1HG1 VAL 17 -1.343 -22.561 -18.480 135 HG12 VAL 17 2HG1 VAL 17 -0.935 -24.288 -18.520 136 HG13 VAL 17 3HG1 VAL 17 0.142 -23.150 -17.700 137 HG21 VAL 17 1HG2 VAL 17 -1.091 -24.322 -21.018 138 HG22 VAL 17 2HG2 VAL 17 -1.446 -22.573 -21.113 139 HG23 VAL 17 3HG2 VAL 17 -0.062 -23.268 -21.998 140 H ALA 18 H ALA 18 0.629 -19.960 -18.013 141 HA ALA 18 HA ALA 18 3.415 -19.858 -17.292 142 HB1 ALA 18 1HB ALA 18 2.494 -18.463 -15.376 143 HB2 ALA 18 2HB ALA 18 2.082 -17.860 -16.994 144 HB3 ALA 18 3HB ALA 18 0.884 -18.741 -16.025 145 H GLU 19 H GLU 19 4.448 -20.787 -15.579 146 HA GLU 19 HA GLU 19 2.856 -22.835 -14.070 147 HB2 GLU 19 1HB GLU 19 5.859 -22.751 -14.549 148 HB3 GLU 19 2HB GLU 19 4.950 -23.995 -13.679 149 HG2 GLU 19 1HG GLU 19 3.590 -24.201 -15.896 150 HG3 GLU 19 2HG GLU 19 4.995 -23.408 -16.614 151 H SER 20 H SER 20 4.900 -19.995 -13.873 152 HA SER 20 HA SER 20 4.956 -20.161 -10.908 153 HB2 SER 20 1HB SER 20 7.040 -19.517 -12.084 154 HB3 SER 20 2HB SER 20 6.172 -18.165 -12.836 155 HG SER 20 HG SER 20 7.335 -17.481 -10.987 156 HA PRO 21 HA PRO 21 1.494 -17.400 -10.975 157 HB2 PRO 21 1HB PRO 21 1.577 -16.202 -8.537 158 HB3 PRO 21 2HB PRO 21 1.186 -17.942 -8.742 159 HG2 PRO 21 1HG PRO 21 3.818 -16.667 -8.047 160 HG3 PRO 21 2HG PRO 21 2.940 -17.971 -7.196 161 HD2 PRO 21 1HD PRO 21 4.916 -18.483 -8.996 162 HD3 PRO 21 2HD PRO 21 3.489 -19.567 -8.863 163 H ASP 22 H ASP 22 4.746 -16.304 -10.530 164 HA ASP 22 HA ASP 22 4.208 -13.447 -10.753 165 HB2 ASP 22 1HB ASP 22 6.739 -15.077 -11.196 166 HB3 ASP 22 2HB ASP 22 6.659 -13.323 -11.051 167 H GLU 23 H GLU 23 4.254 -16.102 -12.906 168 HA GLU 23 HA GLU 23 5.377 -14.637 -15.199 169 HB2 GLU 23 1HB GLU 23 5.970 -16.977 -14.518 170 HB3 GLU 23 2HB GLU 23 4.325 -17.461 -14.930 171 HG2 GLU 23 1HG GLU 23 4.722 -16.755 -17.258 172 HG3 GLU 23 2HG GLU 23 6.387 -16.354 -16.820 173 H LEU 24 H LEU 24 4.238 -14.125 -17.062 174 HA LEU 24 HA LEU 24 1.297 -14.086 -16.740 175 HB2 LEU 24 1HB LEU 24 3.287 -12.512 -18.160 176 HB3 LEU 24 2HB LEU 24 1.981 -12.996 -19.252 177 HG LEU 24 HG LEU 24 1.532 -11.620 -16.588 178 HD11 LEU 24 1HD1 LEU 24 1.057 -9.603 -17.914 179 HD12 LEU 24 2HD1 LEU 24 1.544 -10.449 -19.406 180 HD13 LEU 24 3HD1 LEU 24 2.736 -10.125 -18.111 181 HD21 LEU 24 1HD2 LEU 24 -0.339 -12.212 -18.919 182 HD22 LEU 24 2HD2 LEU 24 -0.743 -11.150 -17.564 183 HD23 LEU 24 3HD2 LEU 24 -0.438 -12.874 -17.278 184 H SER 25 H SER 25 -0.107 -15.359 -17.798 185 HA SER 25 HA SER 25 0.973 -17.436 -19.616 186 HB2 SER 25 1HB SER 25 -1.662 -17.944 -19.460 187 HB3 SER 25 2HB SER 25 -0.524 -18.426 -18.182 188 HG SER 25 HG SER 25 -2.128 -17.335 -17.161 189 H PHE 26 H PHE 26 1.551 -16.019 -21.345 190 HA PHE 26 HA PHE 26 -0.673 -14.574 -22.712 191 HB2 PHE 26 1HB PHE 26 1.181 -13.791 -24.193 192 HB3 PHE 26 2HB PHE 26 1.409 -13.353 -22.504 193 HD1 PHE 26 HD1 PHE 26 3.157 -14.366 -21.161 194 HD2 PHE 26 HD2 PHE 26 2.651 -15.487 -25.291 195 HE1 PHE 26 HE1 PHE 26 5.380 -15.443 -21.125 196 HE2 PHE 26 HE2 PHE 26 4.908 -16.539 -25.275 197 HZ PHE 26 HZ PHE 26 6.299 -16.513 -23.186 198 H ARG 27 H ARG 27 -0.900 -14.892 -25.107 199 HA ARG 27 HA ARG 27 -0.167 -17.664 -25.888 200 HB2 ARG 27 1HB ARG 27 -2.835 -16.307 -26.298 201 HB3 ARG 27 2HB ARG 27 -2.334 -17.758 -27.169 202 HG2 ARG 27 1HG ARG 27 -1.963 -18.879 -24.951 203 HG3 ARG 27 2HG ARG 27 -2.689 -17.472 -24.153 204 HD2 ARG 27 1HD ARG 27 -4.781 -17.838 -25.370 205 HD3 ARG 27 2HD ARG 27 -4.047 -19.187 -26.263 206 HE ARG 27 HE ARG 27 -4.950 -19.176 -23.458 207 HH11 ARG 27 1HH1 ARG 27 -3.137 -20.972 -25.915 208 HH12 ARG 27 2HH1 ARG 27 -3.274 -22.467 -25.038 209 HH21 ARG 27 1HH2 ARG 27 -5.089 -21.139 -22.422 210 HH22 ARG 27 2HH2 ARG 27 -4.363 -22.557 -23.117 211 H LYS 28 H LYS 28 -0.019 -18.063 -28.129 212 HA LYS 28 HA LYS 28 1.611 -16.147 -29.434 213 HB2 LYS 28 1HB LYS 28 1.442 -17.664 -31.373 214 HB3 LYS 28 2HB LYS 28 1.733 -18.550 -29.898 215 HG2 LYS 28 1HG LYS 28 -0.817 -18.945 -29.802 216 HG3 LYS 28 2HG LYS 28 -0.827 -18.457 -31.496 217 HD2 LYS 28 1HD LYS 28 0.853 -20.699 -30.356 218 HD3 LYS 28 2HD LYS 28 -0.721 -20.911 -31.124 219 HE2 LYS 28 1HE LYS 28 0.214 -19.906 -33.220 220 HE3 LYS 28 2HE LYS 28 1.813 -19.857 -32.433 221 HZ1 LYS 28 1HZ LYS 28 0.188 -22.279 -32.930 222 HZ2 LYS 28 2HZ LYS 28 1.614 -22.262 -32.101 223 HZ3 LYS 28 3HZ LYS 28 1.560 -21.863 -33.720 224 H GLY 29 H GLY 29 1.240 -14.495 -30.751 225 HA2 GLY 29 1HA GLY 29 -0.005 -13.344 -32.418 226 HA3 GLY 29 2HA GLY 29 -1.448 -14.205 -31.956 227 H ASP 30 H ASP 30 -0.679 -13.547 -29.017 228 HA ASP 30 HA ASP 30 -2.277 -11.137 -28.861 229 HB2 ASP 30 1HB ASP 30 -2.036 -13.203 -27.253 230 HB3 ASP 30 2HB ASP 30 -0.658 -12.305 -26.598 231 H ILE 31 H ILE 31 -1.521 -9.168 -27.672 232 HA ILE 31 HA ILE 31 1.411 -8.641 -28.020 233 HB ILE 31 HB ILE 31 -0.898 -6.827 -28.935 234 HG12 ILE 31 1HG1 ILE 31 0.908 -6.931 -30.990 235 HG13 ILE 31 2HG1 ILE 31 1.125 -8.544 -30.308 236 HG21 ILE 31 1HG2 ILE 31 0.854 -5.446 -27.817 237 HG22 ILE 31 2HG2 ILE 31 2.119 -6.234 -28.792 238 HG23 ILE 31 3HG2 ILE 31 0.904 -5.198 -29.575 239 HD11 ILE 31 1HD1 ILE 31 -1.257 -8.995 -30.615 240 HD12 ILE 31 2HD1 ILE 31 -1.469 -7.382 -31.323 241 HD13 ILE 31 3HD1 ILE 31 -0.446 -8.589 -32.142 242 H MET 32 H MET 32 2.308 -7.621 -26.345 243 HA MET 32 HA MET 32 0.490 -6.471 -24.273 244 HB2 MET 32 1HB MET 32 2.045 -7.495 -22.578 245 HB3 MET 32 2HB MET 32 1.019 -8.634 -23.426 246 HG2 MET 32 1HG MET 32 3.368 -8.551 -24.971 247 HG3 MET 32 2HG MET 32 3.930 -8.504 -23.303 248 HE1 MET 32 1HE MET 32 0.662 -10.253 -24.976 249 HE2 MET 32 2HE MET 32 2.004 -10.485 -26.100 250 HE3 MET 32 3HE MET 32 1.313 -11.885 -25.249 251 H THR 33 H THR 33 1.370 -4.794 -23.030 252 HA THR 33 HA THR 33 3.507 -3.299 -24.368 253 HB THR 33 HB THR 33 2.107 -2.582 -21.769 254 HG1 THR 33 HG1 THR 33 0.793 -1.296 -23.245 255 HG21 THR 33 1HG2 THR 33 2.676 -0.266 -22.410 256 HG22 THR 33 2HG2 THR 33 3.497 -0.882 -23.863 257 HG23 THR 33 3HG2 THR 33 4.132 -1.271 -22.250 258 H VAL 34 H VAL 34 5.600 -3.331 -23.820 259 HA VAL 34 HA VAL 34 6.416 -4.921 -21.452 260 HB VAL 34 HB VAL 34 8.029 -3.760 -23.741 261 HG11 VAL 34 1HG1 VAL 34 9.920 -5.148 -22.794 262 HG12 VAL 34 2HG1 VAL 34 9.454 -3.760 -21.786 263 HG13 VAL 34 3HG1 VAL 34 8.921 -5.391 -21.348 264 HG21 VAL 34 1HG2 VAL 34 7.498 -6.687 -23.071 265 HG22 VAL 34 2HG2 VAL 34 6.601 -5.773 -24.308 266 HG23 VAL 34 3HG2 VAL 34 8.346 -6.049 -24.503 267 H LEU 35 H LEU 35 6.873 -3.964 -19.640 268 HA LEU 35 HA LEU 35 6.930 -1.005 -19.607 269 HB2 LEU 35 1HB LEU 35 6.757 -2.973 -17.303 270 HB3 LEU 35 2HB LEU 35 6.479 -1.236 -17.228 271 HG LEU 35 HG LEU 35 4.766 -3.248 -18.741 272 HD11 LEU 35 1HD1 LEU 35 4.349 -1.848 -16.058 273 HD12 LEU 35 2HD1 LEU 35 4.622 -3.589 -16.329 274 HD13 LEU 35 3HD1 LEU 35 3.132 -2.832 -16.915 275 HD21 LEU 35 1HD2 LEU 35 4.284 -0.296 -18.139 276 HD22 LEU 35 2HD2 LEU 35 3.120 -1.404 -18.897 277 HD23 LEU 35 3HD2 LEU 35 4.621 -1.009 -19.730 278 H GLU 36 H GLU 36 8.800 -3.829 -18.574 279 HA GLU 36 HA GLU 36 11.220 -2.156 -18.142 280 HB2 GLU 36 1HB GLU 36 9.748 -2.527 -16.002 281 HB3 GLU 36 2HB GLU 36 10.319 -4.194 -16.086 282 HG2 GLU 36 1HG GLU 36 11.715 -2.999 -14.575 283 HG3 GLU 36 2HG GLU 36 12.659 -3.349 -16.016 284 H ARG 37 H ARG 37 13.188 -3.584 -18.076 285 HA ARG 37 HA ARG 37 12.715 -6.360 -19.087 286 HB2 ARG 37 1HB ARG 37 14.553 -4.293 -20.343 287 HB3 ARG 37 2HB ARG 37 14.585 -6.033 -20.716 288 HG2 ARG 37 1HG ARG 37 12.153 -5.839 -21.359 289 HG3 ARG 37 2HG ARG 37 12.274 -4.109 -21.160 290 HD2 ARG 37 1HD ARG 37 13.995 -5.698 -23.077 291 HD3 ARG 37 2HD ARG 37 12.442 -4.946 -23.532 292 HE ARG 37 HE ARG 37 14.248 -3.039 -22.292 293 HH11 ARG 37 1HH1 ARG 37 13.557 -4.655 -25.361 294 HH12 ARG 37 2HH1 ARG 37 14.268 -3.366 -26.307 295 HH21 ARG 37 1HH2 ARG 37 15.138 -1.460 -23.545 296 HH22 ARG 37 2HH2 ARG 37 15.149 -1.572 -25.285 297 H ASP 38 H ASP 38 14.351 -7.805 -18.505 298 HA ASP 38 HA ASP 38 15.732 -8.753 -16.969 299 HB2 ASP 38 1HB ASP 38 17.340 -7.022 -18.050 300 HB3 ASP 38 2HB ASP 38 17.196 -6.155 -16.517 301 H THR 39 H THR 39 13.281 -7.812 -16.311 302 HA THR 39 HA THR 39 13.192 -5.947 -14.170 303 HB THR 39 HB THR 39 11.274 -6.441 -15.718 304 HG1 THR 39 HG1 THR 39 10.900 -6.837 -12.924 305 HG21 THR 39 1HG2 THR 39 11.518 -8.901 -15.870 306 HG22 THR 39 2HG2 THR 39 9.884 -8.415 -15.365 307 HG23 THR 39 3HG2 THR 39 11.028 -9.048 -14.164 308 H GLN 40 H GLN 40 14.091 -9.240 -14.045 309 HA GLN 40 HA GLN 40 13.536 -9.239 -11.107 310 HB2 GLN 40 1HB GLN 40 12.020 -10.678 -12.632 311 HB3 GLN 40 2HB GLN 40 13.413 -11.734 -12.833 312 HG2 GLN 40 1HG GLN 40 13.388 -12.331 -10.511 313 HG3 GLN 40 2HG GLN 40 12.350 -10.965 -10.094 314 HE21 GLN 40 1HE2 GLN 40 10.723 -14.492 -10.913 315 HE22 GLN 40 2HE2 GLN 40 12.426 -14.233 -10.616 316 H GLY 41 H GLY 41 15.989 -8.735 -13.062 317 HA2 GLY 41 1HA GLY 41 18.264 -9.104 -12.762 318 HA3 GLY 41 2HA GLY 41 17.872 -10.104 -11.323 319 H LEU 42 H LEU 42 16.251 -10.694 -14.289 320 HA LEU 42 HA LEU 42 17.898 -13.118 -14.844 321 HB2 LEU 42 1HB LEU 42 14.910 -12.729 -15.129 322 HB3 LEU 42 2HB LEU 42 15.798 -14.115 -15.743 323 HG LEU 42 HG LEU 42 15.478 -13.397 -12.821 324 HD11 LEU 42 1HD1 LEU 42 13.952 -15.353 -12.797 325 HD12 LEU 42 2HD1 LEU 42 14.120 -15.512 -14.560 326 HD13 LEU 42 3HD1 LEU 42 13.349 -14.071 -13.846 327 HD21 LEU 42 1HD2 LEU 42 16.667 -15.844 -14.196 328 HD22 LEU 42 2HD2 LEU 42 16.322 -15.703 -12.441 329 HD23 LEU 42 3HD2 LEU 42 17.545 -14.660 -13.209 330 H ASP 43 H ASP 43 18.987 -12.680 -16.654 331 HA ASP 43 HA ASP 43 18.393 -10.555 -18.419 332 HB2 ASP 43 1HB ASP 43 20.619 -11.589 -18.318 333 HB3 ASP 43 2HB ASP 43 19.946 -13.111 -18.910 334 H GLY 44 H GLY 44 17.353 -10.409 -20.300 335 HA2 GLY 44 1HA GLY 44 16.026 -11.077 -22.089 336 HA3 GLY 44 2HA GLY 44 16.231 -12.755 -21.577 337 H TRP 45 H TRP 45 15.069 -11.565 -18.772 338 HA TRP 45 HA TRP 45 12.276 -12.188 -19.629 339 HB2 TRP 45 1HB TRP 45 13.664 -12.033 -16.954 340 HB3 TRP 45 2HB TRP 45 11.911 -12.187 -17.113 341 HD1 TRP 45 HD1 TRP 45 15.135 -14.130 -18.094 342 HE1 TRP 45 HE1 TRP 45 14.632 -16.609 -18.294 343 HE3 TRP 45 HE3 TRP 45 10.076 -13.894 -17.349 344 HZ2 TRP 45 HZ2 TRP 45 12.322 -18.299 -18.156 345 HZ3 TRP 45 HZ3 TRP 45 8.750 -16.024 -17.352 346 HH2 TRP 45 HH2 TRP 45 9.889 -18.197 -17.785 347 H TRP 46 H TRP 46 10.669 -10.732 -19.705 348 HA TRP 46 HA TRP 46 11.392 -7.934 -18.977 349 HB2 TRP 46 1HB TRP 46 9.662 -8.992 -21.226 350 HB3 TRP 46 2HB TRP 46 10.001 -7.288 -20.893 351 HD1 TRP 46 HD1 TRP 46 13.279 -8.714 -20.391 352 HE1 TRP 46 HE1 TRP 46 14.779 -8.703 -22.423 353 HE3 TRP 46 HE3 TRP 46 9.657 -7.850 -23.871 354 HZ2 TRP 46 HZ2 TRP 46 14.440 -8.447 -25.248 355 HZ3 TRP 46 HZ3 TRP 46 10.325 -7.762 -26.281 356 HH2 TRP 46 HH2 TRP 46 12.707 -8.066 -26.952 357 H LEU 47 H LEU 47 9.728 -6.596 -18.148 358 HA LEU 47 HA LEU 47 7.497 -8.095 -16.853 359 HB2 LEU 47 1HB LEU 47 8.872 -6.380 -15.607 360 HB3 LEU 47 2HB LEU 47 8.276 -5.160 -16.708 361 HG LEU 47 HG LEU 47 5.955 -5.633 -15.933 362 HD11 LEU 47 1HD1 LEU 47 7.384 -7.339 -13.838 363 HD12 LEU 47 2HD1 LEU 47 6.222 -7.923 -15.046 364 HD13 LEU 47 3HD1 LEU 47 5.677 -6.839 -13.751 365 HD21 LEU 47 1HD2 LEU 47 6.255 -4.424 -13.794 366 HD22 LEU 47 2HD2 LEU 47 7.335 -3.770 -15.053 367 HD23 LEU 47 3HD2 LEU 47 7.977 -4.840 -13.801 368 H CYS 48 H CYS 48 5.601 -8.238 -17.933 369 HA CYS 48 HA CYS 48 5.025 -6.062 -19.937 370 HB2 CYS 48 1HB CYS 48 4.295 -9.005 -20.041 371 HB3 CYS 48 2HB CYS 48 3.849 -7.796 -21.250 372 HG CYS 48 HG CYS 48 6.815 -8.807 -20.269 373 H SER 49 H SER 49 2.813 -5.505 -20.225 374 HA SER 49 HA SER 49 1.037 -6.331 -17.964 375 HB2 SER 49 1HB SER 49 -0.188 -4.219 -18.486 376 HB3 SER 49 2HB SER 49 1.478 -3.949 -17.928 377 HG SER 49 HG SER 49 0.830 -4.191 -20.679 378 H LEU 50 H LEU 50 -0.647 -7.556 -18.444 379 HA LEU 50 HA LEU 50 -2.009 -7.350 -21.067 380 HB2 LEU 50 1HB LEU 50 -0.115 -9.001 -21.365 381 HB3 LEU 50 2HB LEU 50 -0.821 -9.964 -20.063 382 HG LEU 50 HG LEU 50 -2.849 -10.307 -21.465 383 HD11 LEU 50 1HD1 LEU 50 -1.235 -8.839 -23.592 384 HD12 LEU 50 2HD1 LEU 50 -2.783 -8.324 -22.892 385 HD13 LEU 50 3HD1 LEU 50 -2.704 -9.781 -23.901 386 HD21 LEU 50 1HD2 LEU 50 -0.221 -11.084 -22.779 387 HD22 LEU 50 2HD2 LEU 50 -1.798 -11.866 -23.023 388 HD23 LEU 50 3HD2 LEU 50 -1.013 -11.936 -21.431 389 H HIS 51 H HIS 51 -4.161 -8.050 -20.874 390 HA HIS 51 HA HIS 51 -6.144 -8.413 -19.786 391 HB2 HIS 51 1HB HIS 51 -4.754 -10.667 -19.491 392 HB3 HIS 51 2HB HIS 51 -4.841 -10.238 -17.779 393 HD1 HIS 51 HD1 HIS 51 -6.494 -12.413 -19.939 394 HD2 HIS 51 HD2 HIS 51 -7.895 -9.403 -17.408 395 HE1 HIS 51 HE1 HIS 51 -8.936 -12.934 -19.438 396 H GLY 52 H GLY 52 -4.321 -6.262 -18.704 397 HA2 GLY 52 1HA GLY 52 -4.698 -4.631 -17.106 398 HA3 GLY 52 2HA GLY 52 -5.978 -5.647 -16.394 399 H ARG 53 H ARG 53 -3.077 -7.396 -16.721 400 HA ARG 53 HA ARG 53 -2.220 -6.675 -13.951 401 HB2 ARG 53 1HB ARG 53 -2.447 -9.461 -15.167 402 HB3 ARG 53 2HB ARG 53 -1.691 -9.072 -13.628 403 HG2 ARG 53 1HG ARG 53 -3.934 -8.135 -12.896 404 HG3 ARG 53 2HG ARG 53 -4.622 -8.848 -14.376 405 HD2 ARG 53 1HD ARG 53 -4.938 -10.395 -12.561 406 HD3 ARG 53 2HD ARG 53 -3.683 -11.070 -13.651 407 HE ARG 53 HE ARG 53 -2.310 -9.627 -11.693 408 HH11 ARG 53 1HH1 ARG 53 -4.516 -12.369 -11.634 409 HH12 ARG 53 2HH1 ARG 53 -3.787 -13.039 -10.203 410 HH21 ARG 53 1HH2 ARG 53 -1.425 -10.560 -9.874 411 HH22 ARG 53 2HH2 ARG 53 -2.056 -12.035 -9.236 412 H GLN 54 H GLN 54 0.013 -7.373 -13.502 413 HA GLN 54 HA GLN 54 1.667 -7.291 -15.980 414 HB2 GLN 54 1HB GLN 54 2.342 -6.245 -13.211 415 HB3 GLN 54 2HB GLN 54 3.433 -6.274 -14.600 416 HG2 GLN 54 1HG GLN 54 2.708 -4.089 -14.583 417 HG3 GLN 54 2HG GLN 54 1.676 -4.836 -15.797 418 HE21 GLN 54 1HE2 GLN 54 0.069 -3.552 -12.231 419 HE22 GLN 54 2HE2 GLN 54 1.769 -3.928 -12.347 420 H GLY 55 H GLY 55 3.486 -8.656 -16.043 421 HA2 GLY 55 1HA GLY 55 4.213 -10.305 -13.788 422 HA3 GLY 55 2HA GLY 55 3.241 -11.221 -14.966 423 H ILE 56 H ILE 56 5.787 -12.094 -14.622 424 HA ILE 56 HA ILE 56 7.514 -10.666 -16.512 425 HB ILE 56 HB ILE 56 9.303 -12.150 -15.831 426 HG12 ILE 56 1HG1 ILE 56 7.248 -13.700 -14.223 427 HG13 ILE 56 2HG1 ILE 56 7.959 -14.263 -15.726 428 HG21 ILE 56 1HG2 ILE 56 8.536 -10.238 -14.315 429 HG22 ILE 56 2HG2 ILE 56 7.767 -11.481 -13.301 430 HG23 ILE 56 3HG2 ILE 56 9.522 -11.494 -13.544 431 HD11 ILE 56 1HD1 ILE 56 10.231 -14.143 -14.611 432 HD12 ILE 56 2HD1 ILE 56 9.376 -13.861 -13.078 433 HD13 ILE 56 3HD1 ILE 56 9.120 -15.389 -13.976 434 H VAL 57 H VAL 57 8.346 -11.462 -18.390 435 HA VAL 57 HA VAL 57 7.086 -13.900 -19.551 436 HB VAL 57 HB VAL 57 7.178 -11.081 -20.755 437 HG11 VAL 57 1HG1 VAL 57 6.647 -13.737 -22.094 438 HG12 VAL 57 2HG1 VAL 57 6.027 -12.205 -22.753 439 HG13 VAL 57 3HG1 VAL 57 7.771 -12.446 -22.574 440 HG21 VAL 57 1HG2 VAL 57 4.839 -12.953 -20.154 441 HG22 VAL 57 2HG2 VAL 57 5.220 -11.433 -19.327 442 HG23 VAL 57 3HG2 VAL 57 4.700 -11.398 -21.018 443 HA PRO 58 HA PRO 58 11.389 -14.077 -20.805 444 HB2 PRO 58 1HB PRO 58 11.348 -16.187 -22.536 445 HB3 PRO 58 2HB PRO 58 11.257 -16.419 -20.760 446 HG2 PRO 58 1HG PRO 58 9.014 -16.379 -22.769 447 HG3 PRO 58 2HG PRO 58 9.347 -17.564 -21.475 448 HD2 PRO 58 1HD PRO 58 7.560 -15.522 -21.220 449 HD3 PRO 58 2HD PRO 58 8.533 -16.115 -19.844 450 H GLY 59 H GLY 59 12.003 -12.418 -22.075 451 HA2 GLY 59 1HA GLY 59 10.337 -11.360 -24.104 452 HA3 GLY 59 2HA GLY 59 12.000 -10.892 -23.765 453 H ASN 60 H ASN 60 12.745 -13.863 -24.381 454 HA ASN 60 HA ASN 60 13.362 -13.399 -27.161 455 HB2 ASN 60 1HB ASN 60 14.668 -14.853 -25.513 456 HB3 ASN 60 2HB ASN 60 13.393 -16.091 -25.730 457 HD21 ASN 60 1HD2 ASN 60 15.321 -17.374 -28.336 458 HD22 ASN 60 2HD2 ASN 60 14.589 -17.627 -26.781 459 H ARG 61 H ARG 61 10.542 -14.609 -25.519 460 HA ARG 61 HA ARG 61 9.581 -15.950 -27.998 461 HB2 ARG 61 1HB ARG 61 8.229 -15.489 -25.307 462 HB3 ARG 61 2HB ARG 61 7.534 -16.394 -26.663 463 HG2 ARG 61 1HG ARG 61 9.611 -17.907 -26.450 464 HG3 ARG 61 2HG ARG 61 9.842 -17.131 -24.879 465 HD2 ARG 61 1HD ARG 61 7.379 -17.701 -24.438 466 HD3 ARG 61 2HD ARG 61 7.498 -18.751 -25.862 467 HE ARG 61 HE ARG 61 9.600 -19.336 -24.009 468 HH11 ARG 61 1HH1 ARG 61 6.132 -19.829 -24.458 469 HH12 ARG 61 2HH1 ARG 61 6.096 -21.191 -23.366 470 HH21 ARG 61 1HH2 ARG 61 9.465 -21.132 -22.662 471 HH22 ARG 61 2HH2 ARG 61 7.944 -21.923 -22.407 472 H LEU 62 H LEU 62 9.998 -12.832 -27.195 473 HA LEU 62 HA LEU 62 7.350 -11.951 -28.259 474 HB2 LEU 62 1HB LEU 62 9.299 -10.472 -26.463 475 HB3 LEU 62 2HB LEU 62 7.816 -9.825 -27.104 476 HG LEU 62 HG LEU 62 7.974 -12.050 -25.072 477 HD11 LEU 62 1HD1 LEU 62 7.038 -10.260 -23.567 478 HD12 LEU 62 2HD1 LEU 62 7.265 -9.077 -24.875 479 HD13 LEU 62 3HD1 LEU 62 8.668 -9.905 -24.155 480 HD21 LEU 62 1HD2 LEU 62 5.976 -12.349 -26.363 481 HD22 LEU 62 2HD2 LEU 62 5.616 -10.601 -26.356 482 HD23 LEU 62 3HD2 LEU 62 5.502 -11.551 -24.867 483 H LYS 63 H LYS 63 7.329 -10.263 -29.754 484 HA LYS 63 HA LYS 63 9.988 -9.471 -30.895 485 HB2 LYS 63 1HB LYS 63 8.669 -10.956 -32.392 486 HB3 LYS 63 2HB LYS 63 7.338 -9.795 -32.340 487 HG2 LYS 63 1HG LYS 63 8.451 -9.455 -34.391 488 HG3 LYS 63 2HG LYS 63 8.925 -8.085 -33.355 489 HD2 LYS 63 1HD LYS 63 11.072 -9.168 -32.846 490 HD3 LYS 63 2HD LYS 63 10.584 -10.604 -33.791 491 HE2 LYS 63 1HE LYS 63 10.346 -9.113 -35.823 492 HE3 LYS 63 2HE LYS 63 11.016 -7.776 -34.854 493 HZ1 LYS 63 1HZ LYS 63 13.026 -9.139 -34.551 494 HZ2 LYS 63 2HZ LYS 63 12.731 -8.893 -36.144 495 HZ3 LYS 63 3HZ LYS 63 12.381 -10.352 -35.454 496 H ILE 64 H ILE 64 10.363 -7.395 -30.439 497 HA ILE 64 HA ILE 64 8.451 -5.531 -29.444 498 HB ILE 64 HB ILE 64 11.143 -5.052 -30.814 499 HG12 ILE 64 1HG1 ILE 64 11.252 -6.388 -28.714 500 HG13 ILE 64 2HG1 ILE 64 12.122 -4.862 -28.650 501 HG21 ILE 64 1HG2 ILE 64 9.977 -2.969 -30.992 502 HG22 ILE 64 2HG2 ILE 64 9.322 -3.110 -29.349 503 HG23 ILE 64 3HG2 ILE 64 11.057 -2.797 -29.584 504 HD11 ILE 64 1HD1 ILE 64 9.372 -5.345 -27.402 505 HD12 ILE 64 2HD1 ILE 64 10.911 -5.370 -26.522 506 HD13 ILE 64 3HD1 ILE 64 10.344 -3.864 -27.271 507 H LEU 65 H LEU 65 7.099 -4.167 -30.408 508 HA LEU 65 HA LEU 65 6.803 -4.408 -33.370 509 HB2 LEU 65 1HB LEU 65 5.017 -4.307 -31.105 510 HB3 LEU 65 2HB LEU 65 4.685 -2.920 -32.123 511 HG LEU 65 HG LEU 65 4.315 -4.397 -34.065 512 HD11 LEU 65 1HD1 LEU 65 4.829 -6.657 -32.083 513 HD12 LEU 65 2HD1 LEU 65 5.778 -6.286 -33.548 514 HD13 LEU 65 3HD1 LEU 65 4.104 -6.866 -33.693 515 HD21 LEU 65 1HD2 LEU 65 2.216 -5.416 -33.290 516 HD22 LEU 65 2HD2 LEU 65 2.422 -3.809 -32.575 517 HD23 LEU 65 3HD2 LEU 65 2.748 -5.241 -31.599 518 H VAL 66 H VAL 66 5.501 -2.060 -33.939 519 HA VAL 66 HA VAL 66 7.733 -0.296 -34.249 520 HB VAL 66 HB VAL 66 6.023 1.325 -35.183 521 HG11 VAL 66 1HG1 VAL 66 7.022 -0.511 -36.581 522 HG12 VAL 66 2HG1 VAL 66 5.635 -1.555 -36.158 523 HG13 VAL 66 3HG1 VAL 66 5.365 -0.064 -37.093 524 HG21 VAL 66 1HG2 VAL 66 4.132 0.803 -33.669 525 HG22 VAL 66 2HG2 VAL 66 3.638 0.636 -35.350 526 HG23 VAL 66 3HG2 VAL 66 3.979 -0.811 -34.370 527 H GLY 67 H GLY 67 8.226 1.746 -33.351 528 HA2 GLY 67 1HA GLY 67 6.997 3.434 -31.715 529 HA3 GLY 67 2HA GLY 67 7.154 2.069 -30.621 530 H MET 68 H MET 68 8.726 4.816 -31.972 531 HA MET 68 HA MET 68 11.099 4.268 -30.290 532 HB2 MET 68 1HB MET 68 11.198 5.269 -33.174 533 HB3 MET 68 2HB MET 68 12.553 5.339 -32.043 534 HG2 MET 68 1HG MET 68 13.106 3.427 -33.135 535 HG3 MET 68 2HG MET 68 12.073 2.712 -31.881 536 HE1 MET 68 1HE MET 68 12.844 1.251 -34.616 537 HE2 MET 68 2HE MET 68 11.790 0.516 -33.381 538 HE3 MET 68 3HE MET 68 11.278 0.538 -35.081 539 H TYR 69 H TYR 69 12.035 6.338 -29.537 540 HA TYR 69 HA TYR 69 10.085 8.555 -29.578 541 HB2 TYR 69 1HB TYR 69 11.298 8.046 -27.506 542 HB3 TYR 69 2HB TYR 69 12.847 8.261 -28.314 543 HD1 TYR 69 HD1 TYR 69 9.619 10.164 -27.729 544 HD2 TYR 69 HD2 TYR 69 13.919 10.345 -28.115 545 HE1 TYR 69 HE1 TYR 69 9.573 12.612 -27.206 546 HE2 TYR 69 HE2 TYR 69 13.838 12.793 -27.587 547 HH TYR 69 HH TYR 69 12.528 14.598 -27.119 548 H ASP 70 H ASP 70 10.147 10.134 -31.057 549 HA ASP 70 HA ASP 70 12.635 10.834 -32.463 550 HB2 ASP 70 1HB ASP 70 11.523 8.851 -33.687 551 HB3 ASP 70 2HB ASP 70 10.158 9.937 -34.014 552 H LYS 71 H LYS 71 12.222 12.774 -33.778 553 HA LYS 71 HA LYS 71 11.437 14.924 -34.079 554 HB2 LYS 71 1HB LYS 71 8.700 13.762 -33.457 555 HB3 LYS 71 2HB LYS 71 9.031 15.249 -34.336 556 HG2 LYS 71 1HG LYS 71 10.170 13.951 -36.111 557 HG3 LYS 71 2HG LYS 71 9.754 12.451 -35.243 558 HD2 LYS 71 1HD LYS 71 7.359 13.014 -35.431 559 HD3 LYS 71 2HD LYS 71 7.787 14.473 -36.368 560 HE2 LYS 71 1HE LYS 71 8.877 13.048 -38.085 561 HE3 LYS 71 2HE LYS 71 8.465 11.600 -37.137 562 HZ1 LYS 71 1HZ LYS 71 6.832 11.946 -38.865 563 HZ2 LYS 71 2HZ LYS 71 6.514 13.489 -38.329 564 HZ3 LYS 71 3HZ LYS 71 6.123 12.169 -37.417 565 H LYS 72 H LYS 72 9.462 16.435 -33.050 566 HA LYS 72 HA LYS 72 10.668 17.366 -30.605 567 HB2 LYS 72 1HB LYS 72 8.863 19.043 -30.691 568 HB3 LYS 72 2HB LYS 72 9.622 18.837 -32.280 569 HG2 LYS 72 1HG LYS 72 7.692 17.243 -32.877 570 HG3 LYS 72 2HG LYS 72 6.902 17.799 -31.395 571 HD2 LYS 72 1HD LYS 72 7.032 20.126 -32.204 572 HD3 LYS 72 2HD LYS 72 7.837 19.560 -33.678 573 HE2 LYS 72 1HE LYS 72 5.824 18.162 -34.192 574 HE3 LYS 72 2HE LYS 72 5.012 18.822 -32.752 575 HZ1 LYS 72 1HZ LYS 72 4.383 20.002 -34.775 576 HZ2 LYS 72 2HZ LYS 72 5.953 20.418 -35.079 577 HZ3 LYS 72 3HZ LYS 72 5.181 21.008 -33.750 578 HA PRO 73 HA PRO 73 8.445 14.965 -27.721 579 HB2 PRO 73 1HB PRO 73 8.032 16.636 -25.607 580 HB3 PRO 73 2HB PRO 73 9.669 16.042 -26.059 581 HG2 PRO 73 1HG PRO 73 8.332 18.618 -26.804 582 HG3 PRO 73 2HG PRO 73 9.934 18.344 -26.047 583 HD2 PRO 73 1HD PRO 73 9.719 18.759 -28.676 584 HD3 PRO 73 2HD PRO 73 10.849 17.520 -28.049 585 H ALA 74 H ALA 74 6.450 14.803 -26.386 586 HA ALA 74 HA ALA 74 4.179 15.275 -28.004 587 HB1 ALA 74 1HB ALA 74 4.312 13.418 -26.378 588 HB2 ALA 74 2HB ALA 74 4.358 14.595 -25.027 589 HB3 ALA 74 3HB ALA 74 2.902 14.444 -26.039 590 H GLY 75 H GLY 75 2.436 16.654 -27.817 591 HA2 GLY 75 1HA GLY 75 3.078 19.249 -26.585 592 HA3 GLY 75 2HA GLY 75 1.796 18.901 -27.757 593 H GLU 76 H GLU 76 2.618 17.730 -24.425 594 HA GLU 76 HA GLU 76 -0.273 17.898 -23.806 595 HB2 GLU 76 1HB GLU 76 0.381 16.926 -21.617 596 HB3 GLU 76 2HB GLU 76 0.806 15.928 -23.016 597 HG2 GLU 76 1HG GLU 76 3.163 16.670 -22.872 598 HG3 GLU 76 2HG GLU 76 2.767 17.640 -21.442 599 H PHE 77 H PHE 77 -1.160 19.718 -23.122 600 HA PHE 77 HA PHE 77 0.294 21.431 -21.200 601 HB2 PHE 77 1HB PHE 77 0.114 23.442 -22.487 602 HB3 PHE 77 2HB PHE 77 0.924 22.244 -23.502 603 HD1 PHE 77 HD1 PHE 77 -0.321 21.201 -25.410 604 HD2 PHE 77 HD2 PHE 77 -2.028 24.375 -23.082 605 HE1 PHE 77 HE1 PHE 77 -2.006 21.579 -27.202 606 HE2 PHE 77 HE2 PHE 77 -3.724 24.783 -24.848 607 HZ PHE 77 HZ PHE 77 -3.702 23.352 -26.935 608 H ILE 78 H ILE 78 -2.519 19.942 -22.092 609 HA ILE 78 HA ILE 78 -4.314 22.112 -21.176 610 HB ILE 78 HB ILE 78 -5.016 19.364 -22.319 611 HG12 ILE 78 1HG1 ILE 78 -5.137 22.078 -23.680 612 HG13 ILE 78 2HG1 ILE 78 -3.808 20.926 -23.908 613 HG21 ILE 78 1HG2 ILE 78 -7.310 20.300 -22.548 614 HG22 ILE 78 2HG2 ILE 78 -6.798 20.307 -20.850 615 HG23 ILE 78 3HG2 ILE 78 -6.778 21.818 -21.791 616 HD11 ILE 78 1HD1 ILE 78 -5.431 19.238 -24.790 617 HD12 ILE 78 2HD1 ILE 78 -6.691 20.505 -24.719 618 HD13 ILE 78 3HD1 ILE 78 -5.280 20.711 -25.772 619 H VAL 79 H VAL 79 -4.941 22.163 -19.112 620 HA VAL 79 HA VAL 79 -4.365 19.824 -17.396 621 HB VAL 79 HB VAL 79 -4.895 21.369 -15.518 622 HG11 VAL 79 1HG1 VAL 79 -2.895 22.809 -15.775 623 HG12 VAL 79 2HG1 VAL 79 -2.584 21.151 -16.341 624 HG13 VAL 79 3HG1 VAL 79 -2.869 22.451 -17.519 625 HG21 VAL 79 1HG2 VAL 79 -5.172 23.532 -17.652 626 HG22 VAL 79 2HG2 VAL 79 -6.521 22.855 -16.734 627 HG23 VAL 79 3HG2 VAL 79 -5.241 23.769 -15.902 628 H THR 80 H THR 80 -6.005 18.866 -16.074 629 HA THR 80 HA THR 80 -8.768 19.661 -16.466 630 HB THR 80 HB THR 80 -8.716 18.394 -18.472 631 HG1 THR 80 HG1 THR 80 -9.613 16.540 -16.518 632 HG21 THR 80 1HG2 THR 80 -6.569 17.146 -18.113 633 HG22 THR 80 2HG2 THR 80 -7.891 16.109 -18.700 634 HG23 THR 80 3HG2 THR 80 -7.435 16.066 -16.990 635 H ASP 81 H ASP 81 -6.631 16.977 -15.313 636 HA ASP 81 HA ASP 81 -7.660 17.345 -12.592 637 HB2 ASP 81 1HB ASP 81 -8.466 15.130 -12.250 638 HB3 ASP 81 2HB ASP 81 -9.245 15.623 -13.746 639 HXT ASP 81 H02 ASP 81 -4.875 15.597 -11.631 Start of MODEL 10 1 H2 GLY 1 2H0 GLY 1 2.749 12.500 -8.651 2 H GLY 1 1H0 GLY 1 3.735 12.952 -7.407 3 HA2 GLY 1 1HA GLY 1 5.625 13.019 -9.067 4 HA3 GLY 1 2HA GLY 1 5.012 11.402 -8.649 5 H SER 2 H SER 2 6.533 12.205 -10.935 6 HA SER 2 HA SER 2 4.666 11.200 -13.023 7 HB2 SER 2 1HB SER 2 6.450 13.652 -13.370 8 HB3 SER 2 2HB SER 2 5.501 12.861 -14.653 9 HG SER 2 HG SER 2 3.925 13.392 -12.537 10 H MET 3 H MET 3 5.709 9.864 -14.488 11 HA MET 3 HA MET 3 8.636 9.744 -14.574 12 HB2 MET 3 1HB MET 3 7.859 8.308 -12.579 13 HB3 MET 3 2HB MET 3 7.034 7.285 -13.756 14 HG2 MET 3 1HG MET 3 9.173 6.757 -14.831 15 HG3 MET 3 2HG MET 3 10.021 7.856 -13.737 16 HE1 MET 3 1HE MET 3 7.219 4.954 -13.293 17 HE2 MET 3 2HE MET 3 8.531 4.321 -14.307 18 HE3 MET 3 3HE MET 3 8.279 3.669 -12.673 19 H LYS 4 H LYS 4 9.277 8.335 -16.428 20 HA LYS 4 HA LYS 4 7.023 7.877 -18.330 21 HB2 LYS 4 1HB LYS 4 8.518 9.752 -18.976 22 HB3 LYS 4 2HB LYS 4 9.910 8.673 -18.932 23 HG2 LYS 4 1HG LYS 4 7.768 7.631 -20.625 24 HG3 LYS 4 2HG LYS 4 8.258 9.257 -21.124 25 HD2 LYS 4 1HD LYS 4 10.291 7.061 -20.606 26 HD3 LYS 4 2HD LYS 4 9.515 7.230 -22.192 27 HE2 LYS 4 1HE LYS 4 11.111 9.429 -20.804 28 HE3 LYS 4 2HE LYS 4 11.759 8.318 -22.029 29 HZ1 LYS 4 1HZ LYS 4 9.590 10.291 -22.423 30 HZ2 LYS 4 2HZ LYS 4 9.994 9.154 -23.537 31 HZ3 LYS 4 3HZ LYS 4 11.087 10.329 -23.087 32 H TYR 5 H TYR 5 6.805 5.815 -18.965 33 HA TYR 5 HA TYR 5 8.853 3.823 -18.137 34 HB2 TYR 5 1HB TYR 5 5.930 3.826 -18.790 35 HB3 TYR 5 2HB TYR 5 6.849 2.403 -19.307 36 HD1 TYR 5 HD1 TYR 5 8.274 1.165 -17.537 37 HD2 TYR 5 HD2 TYR 5 5.212 4.015 -16.507 38 HE1 TYR 5 HE1 TYR 5 8.148 0.215 -15.219 39 HE2 TYR 5 HE2 TYR 5 5.098 3.045 -14.204 40 HH TYR 5 HH TYR 5 5.951 1.539 -12.737 41 H LEU 6 H LEU 6 9.125 1.957 -19.848 42 HA LEU 6 HA LEU 6 10.316 3.017 -22.207 43 HB2 LEU 6 1HB LEU 6 9.165 0.245 -21.698 44 HB3 LEU 6 2HB LEU 6 10.225 0.655 -23.030 45 HG LEU 6 HG LEU 6 11.036 0.693 -20.119 46 HD11 LEU 6 1HD1 LEU 6 11.534 -1.352 -22.314 47 HD12 LEU 6 2HD1 LEU 6 10.466 -1.566 -20.914 48 HD13 LEU 6 3HD1 LEU 6 12.207 -1.386 -20.670 49 HD21 LEU 6 1HD2 LEU 6 12.402 2.211 -21.455 50 HD22 LEU 6 2HD2 LEU 6 12.700 0.927 -22.654 51 HD23 LEU 6 3HD2 LEU 6 13.337 0.773 -21.010 52 H ASN 7 H ASN 7 7.158 1.547 -21.553 53 HA ASN 7 HA ASN 7 5.199 1.435 -22.681 54 HB2 ASN 7 1HB ASN 7 5.483 3.926 -22.155 55 HB3 ASN 7 2HB ASN 7 5.882 4.143 -23.862 56 HD21 ASN 7 1HD2 ASN 7 2.509 4.394 -24.678 57 HD22 ASN 7 2HD2 ASN 7 4.148 4.935 -24.886 58 H VAL 8 H VAL 8 7.071 -0.039 -24.006 59 HA VAL 8 HA VAL 8 6.393 0.473 -26.860 60 HB VAL 8 HB VAL 8 8.262 -1.054 -27.420 61 HG11 VAL 8 1HG1 VAL 8 8.616 1.433 -27.327 62 HG12 VAL 8 2HG1 VAL 8 9.203 1.246 -25.659 63 HG13 VAL 8 3HG1 VAL 8 10.094 0.498 -27.015 64 HG21 VAL 8 1HG2 VAL 8 8.889 -0.988 -24.415 65 HG22 VAL 8 2HG2 VAL 8 8.339 -2.404 -25.352 66 HG23 VAL 8 3HG2 VAL 8 9.939 -1.700 -25.670 67 H LEU 9 H LEU 9 5.910 -1.629 -28.025 68 HA LEU 9 HA LEU 9 4.692 -3.613 -26.163 69 HB2 LEU 9 1HB LEU 9 2.762 -3.778 -27.744 70 HB3 LEU 9 2HB LEU 9 2.826 -2.332 -26.744 71 HG LEU 9 HG LEU 9 3.961 -2.100 -29.485 72 HD11 LEU 9 1HD1 LEU 9 1.923 -3.402 -29.905 73 HD12 LEU 9 2HD1 LEU 9 1.692 -1.731 -30.435 74 HD13 LEU 9 3HD1 LEU 9 0.979 -2.278 -28.906 75 HD21 LEU 9 1HD2 LEU 9 2.108 -0.324 -27.831 76 HD22 LEU 9 2HD2 LEU 9 2.954 0.143 -29.326 77 HD23 LEU 9 3HD2 LEU 9 3.876 -0.205 -27.844 78 H ALA 10 H ALA 10 4.417 -5.654 -26.854 79 HA ALA 10 HA ALA 10 5.969 -6.352 -29.314 80 HB1 ALA 10 1HB ALA 10 7.195 -8.020 -28.130 81 HB2 ALA 10 2HB ALA 10 7.384 -6.528 -27.198 82 HB3 ALA 10 3HB ALA 10 6.247 -7.773 -26.648 83 H LYS 11 H LYS 11 5.487 -8.450 -30.132 84 HA LYS 11 HA LYS 11 2.779 -9.454 -29.354 85 HB2 LYS 11 1HB LYS 11 3.005 -8.583 -31.657 86 HB3 LYS 11 2HB LYS 11 4.311 -9.731 -31.973 87 HG2 LYS 11 1HG LYS 11 2.741 -11.615 -31.570 88 HG3 LYS 11 2HG LYS 11 1.447 -10.455 -31.265 89 HD2 LYS 11 1HD LYS 11 1.104 -11.116 -33.457 90 HD3 LYS 11 2HD LYS 11 1.963 -9.566 -33.631 91 HE2 LYS 11 1HE LYS 11 4.100 -10.797 -33.966 92 HE3 LYS 11 2HE LYS 11 3.242 -12.341 -33.753 93 HZ1 LYS 11 1HZ LYS 11 3.512 -11.798 -36.084 94 HZ2 LYS 11 2HZ LYS 11 2.726 -10.358 -35.876 95 HZ3 LYS 11 3HZ LYS 11 1.907 -11.788 -35.693 96 H ALA 12 H ALA 12 2.600 -11.521 -28.638 97 HA ALA 12 HA ALA 12 5.042 -12.991 -28.060 98 HB1 ALA 12 1HB ALA 12 3.413 -14.783 -27.347 99 HB2 ALA 12 2HB ALA 12 3.115 -13.203 -26.614 100 HB3 ALA 12 3HB ALA 12 2.077 -13.741 -27.942 101 H LEU 13 H LEU 13 6.078 -14.442 -29.266 102 HA LEU 13 HA LEU 13 5.049 -15.032 -31.989 103 HB2 LEU 13 1HB LEU 13 7.649 -15.628 -30.588 104 HB3 LEU 13 2HB LEU 13 7.289 -16.137 -32.241 105 HG LEU 13 HG LEU 13 7.406 -13.226 -31.335 106 HD11 LEU 13 1HD1 LEU 13 9.618 -13.188 -32.380 107 HD12 LEU 13 2HD1 LEU 13 9.517 -14.952 -32.674 108 HD13 LEU 13 3HD1 LEU 13 9.569 -14.303 -31.004 109 HD21 LEU 13 1HD2 LEU 13 7.695 -12.922 -33.836 110 HD22 LEU 13 2HD2 LEU 13 6.092 -13.528 -33.347 111 HD23 LEU 13 3HD2 LEU 13 7.280 -14.644 -34.028 112 H TYR 14 H TYR 14 5.486 -16.473 -28.858 113 HA TYR 14 HA TYR 14 4.468 -19.085 -29.919 114 HB2 TYR 14 1HB TYR 14 6.318 -18.692 -27.533 115 HB3 TYR 14 2HB TYR 14 5.796 -20.233 -28.235 116 HD1 TYR 14 HD1 TYR 14 6.965 -21.159 -30.175 117 HD2 TYR 14 HD2 TYR 14 7.978 -17.253 -28.698 118 HE1 TYR 14 HE1 TYR 14 9.039 -21.153 -31.572 119 HE2 TYR 14 HE2 TYR 14 10.044 -17.246 -30.079 120 HH TYR 14 HH TYR 14 11.351 -18.411 -31.539 121 H ASP 15 H ASP 15 3.149 -20.249 -28.330 122 HA ASP 15 HA ASP 15 1.685 -18.418 -26.502 123 HB2 ASP 15 1HB ASP 15 0.188 -20.471 -26.254 124 HB3 ASP 15 2HB ASP 15 0.250 -19.769 -27.875 125 H ASN 16 H ASN 16 1.313 -19.207 -24.246 126 HA ASN 16 HA ASN 16 3.316 -21.177 -23.351 127 HB2 ASN 16 1HB ASN 16 4.454 -19.793 -21.908 128 HB3 ASN 16 2HB ASN 16 4.169 -18.662 -23.218 129 HD21 ASN 16 1HD2 ASN 16 3.153 -17.499 -19.631 130 HD22 ASN 16 2HD2 ASN 16 4.433 -18.627 -20.065 131 H VAL 17 H VAL 17 2.987 -21.658 -21.011 132 HA VAL 17 HA VAL 17 0.183 -21.177 -20.121 133 HB VAL 17 HB VAL 17 1.827 -23.734 -19.743 134 HG11 VAL 17 1HG1 VAL 17 -1.003 -23.031 -18.814 135 HG12 VAL 17 2HG1 VAL 17 -0.229 -24.625 -18.642 136 HG13 VAL 17 3HG1 VAL 17 0.428 -23.224 -17.764 137 HG21 VAL 17 1HG2 VAL 17 0.030 -24.842 -21.074 138 HG22 VAL 17 2HG2 VAL 17 -0.682 -23.254 -21.407 139 HG23 VAL 17 3HG2 VAL 17 0.947 -23.648 -22.017 140 H ALA 18 H ALA 18 0.386 -19.958 -18.274 141 HA ALA 18 HA ALA 18 3.041 -19.444 -17.219 142 HB1 ALA 18 1HB ALA 18 1.425 -17.613 -17.265 143 HB2 ALA 18 2HB ALA 18 0.272 -18.573 -16.284 144 HB3 ALA 18 3HB ALA 18 1.786 -18.006 -15.571 145 H GLU 19 H GLU 19 4.046 -20.634 -15.760 146 HA GLU 19 HA GLU 19 2.399 -22.536 -14.142 147 HB2 GLU 19 1HB GLU 19 4.419 -23.853 -13.888 148 HB3 GLU 19 2HB GLU 19 4.061 -23.545 -15.605 149 HG2 GLU 19 1HG GLU 19 5.781 -21.715 -15.597 150 HG3 GLU 19 2HG GLU 19 6.207 -22.184 -13.946 151 H SER 20 H SER 20 4.407 -19.729 -13.906 152 HA SER 20 HA SER 20 4.560 -20.036 -10.940 153 HB2 SER 20 1HB SER 20 5.840 -18.004 -12.794 154 HB3 SER 20 2HB SER 20 6.084 -18.095 -11.046 155 HG SER 20 HG SER 20 6.633 -20.204 -12.875 156 HA PRO 21 HA PRO 21 1.171 -17.237 -10.751 157 HB2 PRO 21 1HB PRO 21 1.531 -15.865 -8.405 158 HB3 PRO 21 2HB PRO 21 1.048 -17.593 -8.455 159 HG2 PRO 21 1HG PRO 21 3.782 -16.409 -8.069 160 HG3 PRO 21 2HG PRO 21 2.953 -17.659 -7.119 161 HD2 PRO 21 1HD PRO 21 4.745 -18.318 -9.035 162 HD3 PRO 21 2HD PRO 21 3.267 -19.315 -8.755 163 H ASP 22 H ASP 22 4.435 -16.023 -10.493 164 HA ASP 22 HA ASP 22 3.731 -13.233 -10.903 165 HB2 ASP 22 1HB ASP 22 6.400 -14.673 -11.056 166 HB3 ASP 22 2HB ASP 22 6.172 -12.920 -10.944 167 H GLU 23 H GLU 23 3.943 -15.946 -12.951 168 HA GLU 23 HA GLU 23 5.160 -14.527 -15.220 169 HB2 GLU 23 1HB GLU 23 5.616 -16.941 -14.618 170 HB3 GLU 23 2HB GLU 23 3.950 -17.312 -15.108 171 HG2 GLU 23 1HG GLU 23 4.479 -16.407 -17.382 172 HG3 GLU 23 2HG GLU 23 6.159 -16.177 -16.844 173 H LEU 24 H LEU 24 4.053 -13.864 -17.069 174 HA LEU 24 HA LEU 24 1.130 -13.642 -16.713 175 HB2 LEU 24 1HB LEU 24 3.218 -12.311 -18.258 176 HB3 LEU 24 2HB LEU 24 1.803 -12.690 -19.241 177 HG LEU 24 HG LEU 24 1.757 -11.115 -16.645 178 HD11 LEU 24 1HD1 LEU 24 1.448 -9.172 -18.096 179 HD12 LEU 24 2HD1 LEU 24 1.645 -10.198 -19.534 180 HD13 LEU 24 3HD1 LEU 24 2.999 -9.967 -18.391 181 HD21 LEU 24 1HD2 LEU 24 -0.536 -10.443 -17.466 182 HD22 LEU 24 2HD2 LEU 24 -0.409 -12.163 -17.027 183 HD23 LEU 24 3HD2 LEU 24 -0.389 -11.696 -18.741 184 H SER 25 H SER 25 -0.392 -14.698 -17.815 185 HA SER 25 HA SER 25 0.431 -16.962 -19.550 186 HB2 SER 25 1HB SER 25 -1.282 -17.347 -17.758 187 HB3 SER 25 2HB SER 25 -2.320 -16.124 -18.497 188 HG SER 25 HG SER 25 -1.818 -17.709 -20.444 189 H PHE 26 H PHE 26 0.567 -16.612 -21.684 190 HA PHE 26 HA PHE 26 -1.380 -14.747 -22.994 191 HB2 PHE 26 1HB PHE 26 0.471 -13.735 -24.279 192 HB3 PHE 26 2HB PHE 26 0.588 -13.388 -22.553 193 HD1 PHE 26 HD1 PHE 26 2.455 -14.150 -21.224 194 HD2 PHE 26 HD2 PHE 26 2.041 -15.394 -25.333 195 HE1 PHE 26 HE1 PHE 26 4.757 -15.063 -21.189 196 HE2 PHE 26 HE2 PHE 26 4.364 -16.283 -25.297 197 HZ PHE 26 HZ PHE 26 5.731 -16.108 -23.221 198 H ARG 27 H ARG 27 -1.067 -14.974 -25.494 199 HA ARG 27 HA ARG 27 -0.324 -17.816 -26.122 200 HB2 ARG 27 1HB ARG 27 -2.845 -16.351 -27.029 201 HB3 ARG 27 2HB ARG 27 -2.341 -17.976 -27.527 202 HG2 ARG 27 1HG ARG 27 -2.406 -18.643 -25.064 203 HG3 ARG 27 2HG ARG 27 -3.182 -17.081 -24.753 204 HD2 ARG 27 1HD ARG 27 -4.929 -17.689 -26.404 205 HD3 ARG 27 2HD ARG 27 -4.186 -19.302 -26.531 206 HE ARG 27 HE ARG 27 -4.599 -18.849 -23.802 207 HH11 ARG 27 1HH1 ARG 27 -6.708 -19.072 -26.646 208 HH12 ARG 27 2HH1 ARG 27 -8.050 -19.647 -25.715 209 HH21 ARG 27 1HH2 ARG 27 -6.354 -19.572 -22.696 210 HH22 ARG 27 2HH2 ARG 27 -7.849 -19.950 -23.524 211 H LYS 28 H LYS 28 0.143 -18.137 -28.454 212 HA LYS 28 HA LYS 28 1.821 -16.042 -29.444 213 HB2 LYS 28 1HB LYS 28 1.986 -17.344 -31.494 214 HB3 LYS 28 2HB LYS 28 2.160 -18.363 -30.076 215 HG2 LYS 28 1HG LYS 28 -0.252 -19.039 -30.374 216 HG3 LYS 28 2HG LYS 28 -0.204 -18.217 -31.940 217 HD2 LYS 28 1HD LYS 28 1.718 -19.628 -32.605 218 HD3 LYS 28 2HD LYS 28 1.658 -20.440 -31.041 219 HE2 LYS 28 1HE LYS 28 0.543 -21.889 -32.553 220 HE3 LYS 28 2HE LYS 28 -0.734 -21.128 -31.589 221 HZ1 LYS 28 1HZ LYS 28 0.119 -20.281 -34.317 222 HZ2 LYS 28 2HZ LYS 28 -1.035 -19.523 -33.406 223 HZ3 LYS 28 3HZ LYS 28 -1.285 -21.068 -33.944 224 H GLY 29 H GLY 29 1.474 -14.296 -30.622 225 HA2 GLY 29 1HA GLY 29 0.279 -13.049 -32.281 226 HA3 GLY 29 2HA GLY 29 -1.184 -13.963 -31.920 227 H ASP 30 H ASP 30 -0.477 -13.564 -28.908 228 HA ASP 30 HA ASP 30 -2.190 -11.334 -28.528 229 HB2 ASP 30 1HB ASP 30 -1.557 -13.401 -27.000 230 HB3 ASP 30 2HB ASP 30 -0.309 -12.307 -26.375 231 H ILE 31 H ILE 31 -1.763 -9.288 -27.596 232 HA ILE 31 HA ILE 31 0.950 -8.203 -28.247 233 HB ILE 31 HB ILE 31 -1.730 -6.711 -28.211 234 HG12 ILE 31 1HG1 ILE 31 -1.740 -8.347 -30.057 235 HG13 ILE 31 2HG1 ILE 31 -1.654 -6.694 -30.646 236 HG21 ILE 31 1HG2 ILE 31 1.103 -5.905 -29.070 237 HG22 ILE 31 2HG2 ILE 31 -0.358 -4.967 -29.494 238 HG23 ILE 31 3HG2 ILE 31 0.100 -5.189 -27.809 239 HD11 ILE 31 1HD1 ILE 31 0.645 -6.923 -31.256 240 HD12 ILE 31 2HD1 ILE 31 0.766 -8.483 -30.416 241 HD13 ILE 31 3HD1 ILE 31 -0.225 -8.349 -31.889 242 H MET 32 H MET 32 2.044 -7.335 -26.533 243 HA MET 32 HA MET 32 0.445 -6.430 -24.179 244 HB2 MET 32 1HB MET 32 1.971 -7.620 -22.656 245 HB3 MET 32 2HB MET 32 1.117 -8.735 -23.723 246 HG2 MET 32 1HG MET 32 3.241 -8.581 -25.224 247 HG3 MET 32 2HG MET 32 4.031 -7.994 -23.755 248 HE1 MET 32 1HE MET 32 2.353 -12.210 -24.608 249 HE2 MET 32 2HE MET 32 1.208 -10.849 -24.535 250 HE3 MET 32 3HE MET 32 2.521 -10.866 -25.756 251 H THR 33 H THR 33 1.361 -4.832 -22.956 252 HA THR 33 HA THR 33 3.432 -3.258 -24.336 253 HB THR 33 HB THR 33 1.981 -2.719 -21.704 254 HG1 THR 33 HG1 THR 33 0.751 -1.294 -23.166 255 HG21 THR 33 1HG2 THR 33 3.434 -0.840 -23.591 256 HG22 THR 33 2HG2 THR 33 4.037 -1.372 -22.001 257 HG23 THR 33 3HG2 THR 33 2.564 -0.368 -22.112 258 H VAL 34 H VAL 34 5.537 -3.202 -23.769 259 HA VAL 34 HA VAL 34 6.375 -4.875 -21.413 260 HB VAL 34 HB VAL 34 8.023 -3.672 -23.692 261 HG11 VAL 34 1HG1 VAL 34 9.402 -3.730 -21.678 262 HG12 VAL 34 2HG1 VAL 34 8.880 -5.372 -21.311 263 HG13 VAL 34 3HG1 VAL 34 9.905 -5.070 -22.733 264 HG21 VAL 34 1HG2 VAL 34 6.553 -5.670 -24.295 265 HG22 VAL 34 2HG2 VAL 34 8.290 -5.948 -24.498 266 HG23 VAL 34 3HG2 VAL 34 7.460 -6.616 -23.070 267 H LEU 35 H LEU 35 6.944 -3.919 -19.602 268 HA LEU 35 HA LEU 35 7.103 -0.948 -19.590 269 HB2 LEU 35 1HB LEU 35 6.652 -2.950 -17.360 270 HB3 LEU 35 2HB LEU 35 6.747 -1.212 -17.147 271 HG LEU 35 HG LEU 35 4.628 -2.610 -18.789 272 HD11 LEU 35 1HD1 LEU 35 3.139 -2.129 -16.879 273 HD12 LEU 35 2HD1 LEU 35 4.536 -1.498 -15.974 274 HD13 LEU 35 3HD1 LEU 35 4.475 -3.217 -16.432 275 HD21 LEU 35 1HD2 LEU 35 4.956 -0.294 -19.528 276 HD22 LEU 35 2HD2 LEU 35 4.895 0.275 -17.826 277 HD23 LEU 35 3HD2 LEU 35 3.441 -0.420 -18.594 278 H GLU 36 H GLU 36 8.847 -3.861 -18.565 279 HA GLU 36 HA GLU 36 11.275 -2.232 -18.154 280 HB2 GLU 36 1HB GLU 36 9.914 -2.435 -15.982 281 HB3 GLU 36 2HB GLU 36 10.224 -4.165 -16.061 282 HG2 GLU 36 1HG GLU 36 11.749 -2.948 -14.538 283 HG3 GLU 36 2HG GLU 36 12.592 -3.827 -15.822 284 H ARG 37 H ARG 37 13.222 -3.654 -17.930 285 HA ARG 37 HA ARG 37 12.724 -6.370 -19.150 286 HB2 ARG 37 1HB ARG 37 15.006 -4.459 -19.777 287 HB3 ARG 37 2HB ARG 37 14.881 -6.124 -20.331 288 HG2 ARG 37 1HG ARG 37 12.680 -5.455 -21.437 289 HG3 ARG 37 2HG ARG 37 13.171 -3.774 -21.122 290 HD2 ARG 37 1HD ARG 37 14.712 -5.876 -22.699 291 HD3 ARG 37 2HD ARG 37 13.887 -4.470 -23.380 292 HE ARG 37 HE ARG 37 16.440 -4.530 -21.885 293 HH11 ARG 37 1HH1 ARG 37 13.959 -2.477 -23.320 294 HH12 ARG 37 2HH1 ARG 37 14.990 -1.074 -23.332 295 HH21 ARG 37 1HH2 ARG 37 17.680 -2.724 -21.926 296 HH22 ARG 37 2HH2 ARG 37 17.054 -1.200 -22.517 297 H ASP 38 H ASP 38 14.157 -7.972 -18.502 298 HA ASP 38 HA ASP 38 15.357 -9.163 -16.970 299 HB2 ASP 38 1HB ASP 38 17.055 -6.656 -16.769 300 HB3 ASP 38 2HB ASP 38 17.561 -8.344 -16.559 301 H THR 39 H THR 39 13.097 -7.923 -16.109 302 HA THR 39 HA THR 39 13.364 -6.185 -13.883 303 HB THR 39 HB THR 39 11.337 -6.445 -15.396 304 HG1 THR 39 HG1 THR 39 11.266 -6.397 -12.598 305 HG21 THR 39 1HG2 THR 39 10.741 -8.895 -13.693 306 HG22 THR 39 2HG2 THR 39 11.258 -8.958 -15.390 307 HG23 THR 39 3HG2 THR 39 9.716 -8.197 -14.945 308 H GLN 40 H GLN 40 13.805 -9.552 -14.013 309 HA GLN 40 HA GLN 40 13.261 -9.833 -11.080 310 HB2 GLN 40 1HB GLN 40 12.528 -11.412 -13.376 311 HB3 GLN 40 2HB GLN 40 13.622 -12.367 -12.359 312 HG2 GLN 40 1HG GLN 40 11.115 -11.002 -11.330 313 HG3 GLN 40 2HG GLN 40 11.196 -12.684 -11.857 314 HE21 GLN 40 1HE2 GLN 40 12.647 -13.866 -8.914 315 HE22 GLN 40 2HE2 GLN 40 12.090 -14.210 -10.542 316 H GLY 41 H GLY 41 15.678 -8.989 -13.032 317 HA2 GLY 41 1HA GLY 41 17.964 -9.113 -12.724 318 HA3 GLY 41 2HA GLY 41 17.729 -10.305 -11.432 319 H LEU 42 H LEU 42 15.887 -11.751 -13.467 320 HA LEU 42 HA LEU 42 17.955 -13.474 -14.582 321 HB2 LEU 42 1HB LEU 42 14.947 -13.406 -14.968 322 HB3 LEU 42 2HB LEU 42 16.003 -14.685 -15.554 323 HG LEU 42 HG LEU 42 15.590 -13.977 -12.617 324 HD11 LEU 42 1HD1 LEU 42 14.186 -15.995 -12.544 325 HD12 LEU 42 2HD1 LEU 42 14.410 -16.228 -14.290 326 HD13 LEU 42 3HD1 LEU 42 13.520 -14.795 -13.690 327 HD21 LEU 42 1HD2 LEU 42 16.648 -16.179 -12.207 328 HD22 LEU 42 2HD2 LEU 42 17.758 -15.080 -13.038 329 HD23 LEU 42 3HD2 LEU 42 16.949 -16.378 -13.950 330 H ASP 43 H ASP 43 18.847 -13.250 -16.543 331 HA ASP 43 HA ASP 43 18.350 -10.957 -18.157 332 HB2 ASP 43 1HB ASP 43 20.501 -12.214 -18.122 333 HB3 ASP 43 2HB ASP 43 19.691 -13.583 -18.900 334 H GLY 44 H GLY 44 17.069 -10.545 -19.815 335 HA2 GLY 44 1HA GLY 44 15.753 -10.973 -21.666 336 HA3 GLY 44 2HA GLY 44 15.954 -12.709 -21.402 337 H TRP 45 H TRP 45 14.885 -11.540 -18.455 338 HA TRP 45 HA TRP 45 12.092 -12.276 -19.224 339 HB2 TRP 45 1HB TRP 45 13.536 -12.165 -16.585 340 HB3 TRP 45 2HB TRP 45 11.764 -12.385 -16.718 341 HD1 TRP 45 HD1 TRP 45 15.076 -14.151 -17.609 342 HE1 TRP 45 HE1 TRP 45 14.672 -16.618 -18.042 343 HE3 TRP 45 HE3 TRP 45 9.963 -14.072 -17.414 344 HZ2 TRP 45 HZ2 TRP 45 12.408 -18.348 -18.339 345 HZ3 TRP 45 HZ3 TRP 45 8.701 -16.218 -17.795 346 HH2 TRP 45 HH2 TRP 45 9.949 -18.323 -18.239 347 H TRP 46 H TRP 46 10.941 -10.652 -19.933 348 HA TRP 46 HA TRP 46 11.456 -7.958 -18.839 349 HB2 TRP 46 1HB TRP 46 9.712 -8.914 -21.138 350 HB3 TRP 46 2HB TRP 46 10.048 -7.231 -20.729 351 HD1 TRP 46 HD1 TRP 46 13.299 -8.787 -20.291 352 HE1 TRP 46 HE1 TRP 46 14.809 -8.652 -22.341 353 HE3 TRP 46 HE3 TRP 46 9.686 -7.570 -23.710 354 HZ2 TRP 46 HZ2 TRP 46 14.479 -8.059 -25.134 355 HZ3 TRP 46 HZ3 TRP 46 10.344 -7.233 -26.091 356 HH2 TRP 46 HH2 TRP 46 12.735 -7.471 -26.789 357 H LEU 47 H LEU 47 9.837 -6.615 -17.952 358 HA LEU 47 HA LEU 47 7.528 -8.074 -16.777 359 HB2 LEU 47 1HB LEU 47 8.880 -6.313 -15.505 360 HB3 LEU 47 2HB LEU 47 8.235 -5.126 -16.616 361 HG LEU 47 HG LEU 47 5.912 -5.823 -15.869 362 HD11 LEU 47 1HD1 LEU 47 6.513 -8.058 -14.918 363 HD12 LEU 47 2HD1 LEU 47 5.735 -7.035 -13.704 364 HD13 LEU 47 3HD1 LEU 47 7.488 -7.258 -13.673 365 HD21 LEU 47 1HD2 LEU 47 7.027 -3.796 -15.037 366 HD22 LEU 47 2HD2 LEU 47 7.798 -4.733 -13.732 367 HD23 LEU 47 3HD2 LEU 47 6.030 -4.548 -13.763 368 H CYS 48 H CYS 48 5.754 -8.278 -18.015 369 HA CYS 48 HA CYS 48 5.176 -6.029 -19.930 370 HB2 CYS 48 1HB CYS 48 4.353 -8.952 -20.109 371 HB3 CYS 48 2HB CYS 48 3.967 -7.704 -21.279 372 HG CYS 48 HG CYS 48 6.878 -8.877 -20.345 373 H SER 49 H SER 49 2.853 -5.646 -20.231 374 HA SER 49 HA SER 49 1.253 -6.397 -17.830 375 HB2 SER 49 1HB SER 49 1.894 -4.042 -17.683 376 HB3 SER 49 2HB SER 49 1.233 -3.778 -19.329 377 HG SER 49 HG SER 49 -0.816 -4.235 -18.535 378 H LEU 50 H LEU 50 -0.513 -7.493 -18.234 379 HA LEU 50 HA LEU 50 -1.987 -7.143 -20.761 380 HB2 LEU 50 1HB LEU 50 -0.132 -8.725 -21.334 381 HB3 LEU 50 2HB LEU 50 -0.613 -9.749 -19.990 382 HG LEU 50 HG LEU 50 -2.797 -10.176 -21.132 383 HD11 LEU 50 1HD1 LEU 50 -2.903 -9.697 -23.563 384 HD12 LEU 50 2HD1 LEU 50 -1.418 -8.750 -23.435 385 HD13 LEU 50 3HD1 LEU 50 -2.913 -8.215 -22.593 386 HD21 LEU 50 1HD2 LEU 50 -0.266 -10.873 -22.634 387 HD22 LEU 50 2HD2 LEU 50 -1.821 -11.716 -22.773 388 HD23 LEU 50 3HD2 LEU 50 -0.933 -11.745 -21.231 389 H HIS 51 H HIS 51 -4.110 -7.717 -20.489 390 HA HIS 51 HA HIS 51 -6.048 -8.176 -19.393 391 HB2 HIS 51 1HB HIS 51 -4.945 -10.494 -19.773 392 HB3 HIS 51 2HB HIS 51 -4.697 -10.503 -18.020 393 HD1 HIS 51 HD1 HIS 51 -6.823 -10.720 -16.507 394 HD2 HIS 51 HD2 HIS 51 -7.615 -10.718 -20.595 395 HE1 HIS 51 HE1 HIS 51 -9.225 -11.459 -16.781 396 H GLY 52 H GLY 52 -4.462 -6.235 -18.057 397 HA2 GLY 52 1HA GLY 52 -4.814 -4.981 -16.145 398 HA3 GLY 52 2HA GLY 52 -5.867 -6.258 -15.521 399 H ARG 53 H ARG 53 -2.969 -7.720 -16.331 400 HA ARG 53 HA ARG 53 -1.895 -7.330 -13.538 401 HB2 ARG 53 1HB ARG 53 -1.898 -9.784 -15.362 402 HB3 ARG 53 2HB ARG 53 -0.953 -9.651 -13.890 403 HG2 ARG 53 1HG ARG 53 -3.065 -9.360 -12.616 404 HG3 ARG 53 2HG ARG 53 -3.947 -9.738 -14.108 405 HD2 ARG 53 1HD ARG 53 -2.713 -11.872 -14.289 406 HD3 ARG 53 2HD ARG 53 -1.843 -11.491 -12.791 407 HE ARG 53 HE ARG 53 -4.663 -11.402 -12.319 408 HH11 ARG 53 1HH1 ARG 53 -2.063 -13.732 -12.856 409 HH12 ARG 53 2HH1 ARG 53 -2.888 -15.000 -11.984 410 HH21 ARG 53 1HH2 ARG 53 -5.645 -13.071 -11.186 411 HH22 ARG 53 2HH2 ARG 53 -4.880 -14.627 -11.053 412 H GLN 54 H GLN 54 0.365 -7.332 -13.352 413 HA GLN 54 HA GLN 54 1.858 -7.164 -15.913 414 HB2 GLN 54 1HB GLN 54 2.624 -6.129 -13.170 415 HB3 GLN 54 2HB GLN 54 3.615 -6.023 -14.634 416 HG2 GLN 54 1HG GLN 54 2.761 -3.989 -14.873 417 HG3 GLN 54 2HG GLN 54 1.272 -4.796 -15.409 418 HE21 GLN 54 1HE2 GLN 54 1.241 -2.510 -12.135 419 HE22 GLN 54 2HE2 GLN 54 2.513 -2.532 -13.318 420 H GLY 55 H GLY 55 3.715 -8.510 -16.024 421 HA2 GLY 55 1HA GLY 55 4.467 -10.183 -13.815 422 HA3 GLY 55 2HA GLY 55 3.422 -11.076 -14.940 423 H ILE 56 H ILE 56 5.908 -12.018 -14.571 424 HA ILE 56 HA ILE 56 7.782 -10.802 -16.457 425 HB ILE 56 HB ILE 56 9.334 -12.554 -15.831 426 HG12 ILE 56 1HG1 ILE 56 7.049 -13.858 -14.304 427 HG13 ILE 56 2HG1 ILE 56 7.692 -14.458 -15.832 428 HG21 ILE 56 1HG2 ILE 56 9.611 -12.017 -13.488 429 HG22 ILE 56 2HG2 ILE 56 8.782 -10.626 -14.202 430 HG23 ILE 56 3HG2 ILE 56 7.860 -11.804 -13.254 431 HD11 ILE 56 1HD1 ILE 56 9.118 -14.364 -13.136 432 HD12 ILE 56 2HD1 ILE 56 8.643 -15.784 -14.098 433 HD13 ILE 56 3HD1 ILE 56 9.939 -14.725 -14.671 434 H VAL 57 H VAL 57 8.386 -11.501 -18.415 435 HA VAL 57 HA VAL 57 6.978 -13.839 -19.633 436 HB VAL 57 HB VAL 57 7.148 -10.999 -20.752 437 HG11 VAL 57 1HG1 VAL 57 6.310 -13.576 -22.083 438 HG12 VAL 57 2HG1 VAL 57 5.867 -11.978 -22.699 439 HG13 VAL 57 3HG1 VAL 57 7.579 -12.446 -22.599 440 HG21 VAL 57 1HG2 VAL 57 4.771 -12.749 -20.020 441 HG22 VAL 57 2HG2 VAL 57 5.275 -11.229 -19.231 442 HG23 VAL 57 3HG2 VAL 57 4.640 -11.215 -20.902 443 HA PRO 58 HA PRO 58 11.247 -14.042 -20.919 444 HB2 PRO 58 1HB PRO 58 11.178 -16.076 -22.758 445 HB3 PRO 58 2HB PRO 58 11.082 -16.370 -20.995 446 HG2 PRO 58 1HG PRO 58 8.849 -16.215 -23.018 447 HG3 PRO 58 2HG PRO 58 9.144 -17.435 -21.743 448 HD2 PRO 58 1HD PRO 58 7.383 -15.382 -21.452 449 HD3 PRO 58 2HD PRO 58 8.320 -16.046 -20.066 450 H GLY 59 H GLY 59 11.907 -12.332 -22.094 451 HA2 GLY 59 1HA GLY 59 10.464 -11.195 -24.244 452 HA3 GLY 59 2HA GLY 59 12.150 -10.862 -23.801 453 H ASN 60 H ASN 60 12.820 -13.773 -24.286 454 HA ASN 60 HA ASN 60 13.645 -13.552 -27.012 455 HB2 ASN 60 1HB ASN 60 14.714 -15.031 -25.354 456 HB3 ASN 60 2HB ASN 60 13.264 -16.035 -25.264 457 HD21 ASN 60 1HD2 ASN 60 15.640 -16.221 -28.619 458 HD22 ASN 60 2HD2 ASN 60 15.650 -14.777 -27.629 459 H ARG 61 H ARG 61 10.656 -14.635 -25.531 460 HA ARG 61 HA ARG 61 9.731 -15.915 -28.042 461 HB2 ARG 61 1HB ARG 61 8.392 -15.561 -25.348 462 HB3 ARG 61 2HB ARG 61 7.696 -16.421 -26.717 463 HG2 ARG 61 1HG ARG 61 9.745 -17.937 -26.649 464 HG3 ARG 61 2HG ARG 61 10.104 -17.225 -25.065 465 HD2 ARG 61 1HD ARG 61 7.819 -17.885 -24.265 466 HD3 ARG 61 2HD ARG 61 7.508 -18.633 -25.854 467 HE ARG 61 HE ARG 61 9.890 -19.676 -24.605 468 HH11 ARG 61 1HH1 ARG 61 6.337 -20.055 -24.669 469 HH12 ARG 61 2HH1 ARG 61 6.427 -21.650 -24.005 470 HH21 ARG 61 1HH2 ARG 61 9.879 -21.720 -23.754 471 HH22 ARG 61 2HH2 ARG 61 8.384 -22.563 -23.478 472 H LEU 62 H LEU 62 10.079 -12.789 -27.296 473 HA LEU 62 HA LEU 62 7.371 -12.028 -28.325 474 HB2 LEU 62 1HB LEU 62 9.328 -10.408 -26.675 475 HB3 LEU 62 2HB LEU 62 7.790 -9.844 -27.289 476 HG LEU 62 HG LEU 62 8.163 -11.946 -25.141 477 HD11 LEU 62 1HD1 LEU 62 7.249 -10.223 -23.654 478 HD12 LEU 62 2HD1 LEU 62 7.076 -9.101 -25.025 479 HD13 LEU 62 3HD1 LEU 62 8.694 -9.608 -24.467 480 HD21 LEU 62 1HD2 LEU 62 5.657 -11.655 -24.891 481 HD22 LEU 62 2HD2 LEU 62 6.168 -12.474 -26.372 482 HD23 LEU 62 3HD2 LEU 62 5.674 -10.756 -26.419 483 H LYS 63 H LYS 63 7.205 -10.450 -29.926 484 HA LYS 63 HA LYS 63 9.795 -9.521 -31.151 485 HB2 LYS 63 1HB LYS 63 8.659 -11.163 -32.604 486 HB3 LYS 63 2HB LYS 63 7.181 -10.190 -32.580 487 HG2 LYS 63 1HG LYS 63 8.407 -8.357 -33.696 488 HG3 LYS 63 2HG LYS 63 9.885 -9.326 -33.678 489 HD2 LYS 63 1HD LYS 63 8.763 -10.996 -35.117 490 HD3 LYS 63 2HD LYS 63 7.313 -9.965 -35.175 491 HE2 LYS 63 1HE LYS 63 8.632 -8.163 -36.184 492 HE3 LYS 63 2HE LYS 63 10.101 -9.126 -36.055 493 HZ1 LYS 63 1HZ LYS 63 7.773 -9.843 -37.724 494 HZ2 LYS 63 2HZ LYS 63 9.180 -10.691 -37.626 495 HZ3 LYS 63 3HZ LYS 63 9.170 -9.188 -38.277 496 H ILE 64 H ILE 64 10.018 -7.402 -30.880 497 HA ILE 64 HA ILE 64 7.998 -5.617 -29.960 498 HB ILE 64 HB ILE 64 10.544 -5.064 -31.532 499 HG12 ILE 64 1HG1 ILE 64 10.922 -6.272 -29.375 500 HG13 ILE 64 2HG1 ILE 64 11.621 -4.663 -29.415 501 HG21 ILE 64 1HG2 ILE 64 9.182 -3.069 -31.678 502 HG22 ILE 64 2HG2 ILE 64 8.732 -3.169 -29.965 503 HG23 ILE 64 3HG2 ILE 64 10.392 -2.763 -30.415 504 HD11 ILE 64 1HD1 ILE 64 9.901 -3.751 -27.940 505 HD12 ILE 64 2HD1 ILE 64 8.977 -5.250 -28.012 506 HD13 ILE 64 3HD1 ILE 64 10.550 -5.232 -27.225 507 H LEU 65 H LEU 65 6.524 -4.337 -31.017 508 HA LEU 65 HA LEU 65 5.884 -4.965 -33.798 509 HB2 LEU 65 1HB LEU 65 4.729 -3.146 -31.663 510 HB3 LEU 65 2HB LEU 65 4.246 -2.933 -33.344 511 HG LEU 65 HG LEU 65 2.543 -4.104 -32.226 512 HD11 LEU 65 1HD1 LEU 65 3.087 -4.742 -34.569 513 HD12 LEU 65 2HD1 LEU 65 2.277 -6.022 -33.653 514 HD13 LEU 65 3HD1 LEU 65 4.023 -6.119 -33.941 515 HD21 LEU 65 1HD2 LEU 65 3.808 -5.081 -30.399 516 HD22 LEU 65 2HD2 LEU 65 4.579 -6.216 -31.525 517 HD23 LEU 65 3HD2 LEU 65 2.835 -6.300 -31.233 518 H VAL 66 H VAL 66 8.109 -4.290 -34.516 519 HA VAL 66 HA VAL 66 8.746 -1.490 -34.720 520 HB VAL 66 HB VAL 66 9.528 -3.799 -36.577 521 HG11 VAL 66 1HG1 VAL 66 10.766 -1.016 -36.228 522 HG12 VAL 66 2HG1 VAL 66 11.470 -2.320 -37.205 523 HG13 VAL 66 3HG1 VAL 66 9.902 -1.620 -37.664 524 HG21 VAL 66 1HG2 VAL 66 11.668 -3.829 -35.274 525 HG22 VAL 66 2HG2 VAL 66 10.980 -2.634 -34.157 526 HG23 VAL 66 3HG2 VAL 66 10.273 -4.260 -34.268 527 H GLY 67 H GLY 67 7.802 0.033 -35.920 528 HA2 GLY 67 1HA GLY 67 6.451 1.052 -37.468 529 HA3 GLY 67 2HA GLY 67 6.773 -0.330 -38.545 530 H MET 68 H MET 68 5.326 -0.907 -35.408 531 HA MET 68 HA MET 68 3.409 -2.038 -34.913 532 HB2 MET 68 1HB MET 68 2.145 -0.079 -36.847 533 HB3 MET 68 2HB MET 68 1.279 -1.080 -35.676 534 HG2 MET 68 1HG MET 68 2.635 -0.001 -33.859 535 HG3 MET 68 2HG MET 68 3.276 1.103 -35.070 536 HE1 MET 68 1HE MET 68 -0.354 -0.420 -34.147 537 HE2 MET 68 2HE MET 68 0.372 0.228 -32.658 538 HE3 MET 68 3HE MET 68 -1.056 1.024 -33.385 539 H TYR 69 H TYR 69 5.012 -3.224 -36.899 540 HA TYR 69 HA TYR 69 5.028 -4.957 -38.353 541 HB2 TYR 69 1HB TYR 69 3.194 -5.780 -36.707 542 HB3 TYR 69 2HB TYR 69 2.059 -5.399 -37.999 543 HD1 TYR 69 HD1 TYR 69 4.826 -7.615 -36.952 544 HD2 TYR 69 HD2 TYR 69 2.003 -6.756 -40.075 545 HE1 TYR 69 HE1 TYR 69 5.335 -9.814 -38.037 546 HE2 TYR 69 HE2 TYR 69 2.520 -8.956 -41.151 547 HH TYR 69 HH TYR 69 3.770 -10.860 -41.052 548 H ASP 70 H ASP 70 5.250 -2.760 -39.580 549 HA ASP 70 HA ASP 70 3.384 -1.997 -41.560 550 HB2 ASP 70 1HB ASP 70 5.500 -0.786 -40.992 551 HB3 ASP 70 2HB ASP 70 6.440 -2.104 -41.711 552 H LYS 71 H LYS 71 2.518 -3.132 -43.128 553 HA LYS 71 HA LYS 71 3.894 -5.597 -44.066 554 HB2 LYS 71 1HB LYS 71 1.917 -6.091 -42.656 555 HB3 LYS 71 2HB LYS 71 0.920 -5.051 -43.690 556 HG2 LYS 71 1HG LYS 71 1.355 -6.572 -45.600 557 HG3 LYS 71 2HG LYS 71 2.299 -7.626 -44.552 558 HD2 LYS 71 1HD LYS 71 0.343 -8.147 -43.231 559 HD3 LYS 71 2HD LYS 71 -0.610 -6.897 -44.060 560 HE2 LYS 71 1HE LYS 71 -1.177 -9.109 -44.963 561 HE3 LYS 71 2HE LYS 71 -0.361 -8.098 -46.187 562 HZ1 LYS 71 1HZ LYS 71 0.509 -10.361 -46.157 563 HZ2 LYS 71 2HZ LYS 71 1.005 -10.174 -44.601 564 HZ3 LYS 71 3HZ LYS 71 1.685 -9.271 -45.779 565 H LYS 72 H LYS 72 4.601 -5.313 -46.027 566 HA LYS 72 HA LYS 72 3.461 -3.434 -47.929 567 HB2 LYS 72 1HB LYS 72 5.436 -5.735 -48.225 568 HB3 LYS 72 2HB LYS 72 5.008 -4.617 -49.545 569 HG2 LYS 72 1HG LYS 72 5.915 -2.728 -48.341 570 HG3 LYS 72 2HG LYS 72 6.152 -3.697 -46.878 571 HD2 LYS 72 1HD LYS 72 7.842 -5.066 -48.015 572 HD3 LYS 72 2HD LYS 72 7.576 -4.154 -49.533 573 HE2 LYS 72 1HE LYS 72 9.568 -3.303 -48.344 574 HE3 LYS 72 2HE LYS 72 8.291 -2.080 -48.413 575 HZ1 LYS 72 1HZ LYS 72 9.361 -2.241 -46.208 576 HZ2 LYS 72 2HZ LYS 72 8.851 -3.791 -46.060 577 HZ3 LYS 72 3HZ LYS 72 7.739 -2.570 -46.125 578 HA PRO 73 HA PRO 73 0.240 -6.087 -49.160 579 HB2 PRO 73 1HB PRO 73 -0.207 -5.475 -51.796 580 HB3 PRO 73 2HB PRO 73 -0.639 -4.359 -50.456 581 HG2 PRO 73 1HG PRO 73 1.818 -4.380 -52.210 582 HG3 PRO 73 2HG PRO 73 0.774 -3.000 -51.761 583 HD2 PRO 73 1HD PRO 73 3.103 -3.452 -50.495 584 HD3 PRO 73 2HD PRO 73 1.652 -2.854 -49.598 585 H ALA 74 H ALA 74 3.157 -6.155 -51.176 586 HA ALA 74 HA ALA 74 2.440 -8.578 -52.589 587 HB1 ALA 74 1HB ALA 74 5.166 -7.258 -52.160 588 HB2 ALA 74 2HB ALA 74 4.770 -8.505 -53.364 589 HB3 ALA 74 3HB ALA 74 4.040 -6.886 -53.491 590 H GLY 75 H GLY 75 3.002 -10.698 -52.097 591 HA2 GLY 75 1HA GLY 75 4.890 -11.438 -50.068 592 HA3 GLY 75 2HA GLY 75 3.239 -11.428 -49.389 593 H GLU 76 H GLU 76 4.321 -13.820 -49.361 594 HA GLU 76 HA GLU 76 2.891 -15.325 -51.468 595 HB2 GLU 76 1HB GLU 76 5.401 -14.944 -52.056 596 HB3 GLU 76 2HB GLU 76 5.760 -15.994 -50.664 597 HG2 GLU 76 1HG GLU 76 4.461 -17.812 -51.748 598 HG3 GLU 76 2HG GLU 76 4.082 -16.745 -53.105 599 H PHE 77 H PHE 77 3.037 -17.736 -50.595 600 HA PHE 77 HA PHE 77 2.486 -19.219 -48.979 601 HB2 PHE 77 1HB PHE 77 4.815 -18.970 -48.340 602 HB3 PHE 77 2HB PHE 77 4.432 -17.597 -47.303 603 HD1 PHE 77 HD1 PHE 77 4.407 -18.067 -45.025 604 HD2 PHE 77 HD2 PHE 77 3.101 -21.122 -47.779 605 HE1 PHE 77 HE1 PHE 77 3.985 -19.600 -43.133 606 HE2 PHE 77 HE2 PHE 77 2.658 -22.631 -45.871 607 HZ PHE 77 HZ PHE 77 3.099 -21.871 -43.539 608 H ILE 78 H ILE 78 0.314 -18.623 -48.937 609 HA ILE 78 HA ILE 78 -0.493 -17.243 -46.449 610 HB ILE 78 HB ILE 78 -2.469 -16.307 -47.615 611 HG12 ILE 78 1HG1 ILE 78 -1.178 -17.456 -50.144 612 HG13 ILE 78 2HG1 ILE 78 -2.656 -18.054 -49.382 613 HG21 ILE 78 1HG2 ILE 78 -1.323 -14.504 -48.787 614 HG22 ILE 78 2HG2 ILE 78 -0.253 -15.024 -47.469 615 HG23 ILE 78 3HG2 ILE 78 0.088 -15.519 -49.137 616 HD11 ILE 78 1HD1 ILE 78 -3.334 -16.735 -51.260 617 HD12 ILE 78 2HD1 ILE 78 -3.689 -15.762 -49.819 618 HD13 ILE 78 3HD1 ILE 78 -2.261 -15.385 -50.808 619 H VAL 79 H VAL 79 -2.582 -17.962 -45.651 620 HA VAL 79 HA VAL 79 -3.399 -20.632 -46.666 621 HB VAL 79 HB VAL 79 -3.362 -19.768 -43.716 622 HG11 VAL 79 1HG1 VAL 79 -4.066 -22.450 -45.048 623 HG12 VAL 79 2HG1 VAL 79 -3.982 -22.140 -43.287 624 HG13 VAL 79 3HG1 VAL 79 -5.220 -21.322 -44.274 625 HG21 VAL 79 1HG2 VAL 79 -1.566 -21.751 -45.229 626 HG22 VAL 79 2HG2 VAL 79 -1.068 -20.228 -44.476 627 HG23 VAL 79 3HG2 VAL 79 -1.607 -21.552 -43.447 628 H THR 80 H THR 80 -4.851 -19.440 -47.973 629 HA THR 80 HA THR 80 -6.977 -17.971 -46.489 630 HB THR 80 HB THR 80 -5.933 -17.352 -49.305 631 HG1 THR 80 HG1 THR 80 -5.293 -15.380 -47.976 632 HG21 THR 80 1HG2 THR 80 -8.275 -16.674 -48.873 633 HG22 THR 80 2HG2 THR 80 -7.228 -15.264 -49.036 634 HG23 THR 80 3HG2 THR 80 -7.774 -15.802 -47.419 635 H ASP 81 H ASP 81 -6.222 -19.689 -49.534 636 HA ASP 81 HA ASP 81 -8.946 -20.902 -49.483 637 HB2 ASP 81 1HB ASP 81 -8.725 -18.779 -50.983 638 HB3 ASP 81 2HB ASP 81 -7.719 -19.770 -52.053 639 HXT ASP 81 H02 ASP 81 -6.117 -22.730 -51.424 Start of MODEL 11 1 H2 GLY 1 2H0 GLY 1 3.488 12.136 -22.496 2 H GLY 1 1H0 GLY 1 3.477 11.007 -21.309 3 HA2 GLY 1 1HA GLY 1 4.044 13.910 -20.966 4 HA3 GLY 1 2HA GLY 1 3.998 12.737 -19.627 5 H SER 2 H SER 2 6.128 13.717 -19.264 6 HA SER 2 HA SER 2 8.313 13.253 -21.029 7 HB2 SER 2 1HB SER 2 8.343 13.399 -17.985 8 HB3 SER 2 2HB SER 2 9.716 13.697 -19.076 9 HG SER 2 HG SER 2 8.866 15.675 -18.596 10 H MET 3 H MET 3 9.476 11.495 -21.494 11 HA MET 3 HA MET 3 8.528 8.925 -20.768 12 HB2 MET 3 1HB MET 3 9.708 9.532 -22.877 13 HB3 MET 3 2HB MET 3 11.204 9.706 -21.962 14 HG2 MET 3 1HG MET 3 11.145 7.327 -21.364 15 HG3 MET 3 2HG MET 3 9.610 7.127 -22.239 16 HE1 MET 3 1HE MET 3 9.745 8.509 -24.955 17 HE2 MET 3 2HE MET 3 10.592 7.314 -25.961 18 HE3 MET 3 3HE MET 3 9.384 6.776 -24.773 19 H LYS 4 H LYS 4 9.261 7.349 -19.431 20 HA LYS 4 HA LYS 4 11.721 7.661 -17.891 21 HB2 LYS 4 1HB LYS 4 10.097 8.952 -16.538 22 HB3 LYS 4 2HB LYS 4 9.050 7.542 -16.433 23 HG2 LYS 4 1HG LYS 4 10.716 6.282 -15.209 24 HG3 LYS 4 2HG LYS 4 11.909 7.564 -15.420 25 HD2 LYS 4 1HD LYS 4 9.297 7.910 -13.895 26 HD3 LYS 4 2HD LYS 4 10.844 7.488 -13.140 27 HE2 LYS 4 1HE LYS 4 10.261 10.044 -14.709 28 HE3 LYS 4 2HE LYS 4 10.412 9.911 -12.949 29 HZ1 LYS 4 1HZ LYS 4 12.718 9.215 -13.272 30 HZ2 LYS 4 2HZ LYS 4 12.461 10.699 -13.949 31 HZ3 LYS 4 3HZ LYS 4 12.573 9.369 -14.915 32 H TYR 5 H TYR 5 8.639 5.923 -18.303 33 HA TYR 5 HA TYR 5 10.011 3.331 -17.806 34 HB2 TYR 5 1HB TYR 5 7.221 4.336 -17.830 35 HB3 TYR 5 2HB TYR 5 7.437 2.759 -18.598 36 HD1 TYR 5 HD1 TYR 5 8.668 4.498 -15.462 37 HD2 TYR 5 HD2 TYR 5 7.179 0.880 -17.256 38 HE1 TYR 5 HE1 TYR 5 8.769 3.358 -13.259 39 HE2 TYR 5 HE2 TYR 5 7.278 -0.247 -15.034 40 HH TYR 5 HH TYR 5 8.483 1.369 -12.114 41 H LEU 6 H LEU 6 9.809 1.668 -19.490 42 HA LEU 6 HA LEU 6 10.765 2.701 -21.973 43 HB2 LEU 6 1HB LEU 6 9.655 -0.062 -21.359 44 HB3 LEU 6 2HB LEU 6 10.680 0.360 -22.724 45 HG LEU 6 HG LEU 6 11.518 0.532 -19.814 46 HD11 LEU 6 1HD1 LEU 6 12.187 -1.546 -21.913 47 HD12 LEU 6 2HD1 LEU 6 11.061 -1.765 -20.553 48 HD13 LEU 6 3HD1 LEU 6 12.781 -1.487 -20.230 49 HD21 LEU 6 1HD2 LEU 6 12.826 2.070 -21.189 50 HD22 LEU 6 2HD2 LEU 6 13.137 0.787 -22.393 51 HD23 LEU 6 3HD2 LEU 6 13.822 0.673 -20.745 52 H ASN 7 H ASN 7 7.638 1.217 -21.105 53 HA ASN 7 HA ASN 7 5.617 1.164 -22.173 54 HB2 ASN 7 1HB ASN 7 5.982 3.600 -21.497 55 HB3 ASN 7 2HB ASN 7 6.311 3.926 -23.202 56 HD21 ASN 7 1HD2 ASN 7 2.927 4.345 -23.829 57 HD22 ASN 7 2HD2 ASN 7 4.592 4.809 -24.124 58 H VAL 8 H VAL 8 7.376 -0.243 -23.714 59 HA VAL 8 HA VAL 8 6.588 0.490 -26.502 60 HB VAL 8 HB VAL 8 8.402 -1.025 -27.234 61 HG11 VAL 8 1HG1 VAL 8 9.441 1.127 -25.353 62 HG12 VAL 8 2HG1 VAL 8 10.277 0.443 -26.764 63 HG13 VAL 8 3HG1 VAL 8 8.812 1.424 -26.986 64 HG21 VAL 8 1HG2 VAL 8 10.128 -1.807 -25.634 65 HG22 VAL 8 2HG2 VAL 8 9.155 -1.187 -24.284 66 HG23 VAL 8 3HG2 VAL 8 8.539 -2.518 -25.295 67 H LEU 9 H LEU 9 6.172 -1.712 -27.761 68 HA LEU 9 HA LEU 9 4.850 -3.625 -25.899 69 HB2 LEU 9 1HB LEU 9 2.891 -3.687 -27.464 70 HB3 LEU 9 2HB LEU 9 3.031 -2.226 -26.494 71 HG LEU 9 HG LEU 9 4.201 -2.126 -29.239 72 HD11 LEU 9 1HD1 LEU 9 2.101 -3.351 -29.603 73 HD12 LEU 9 2HD1 LEU 9 1.991 -1.704 -30.242 74 HD13 LEU 9 3HD1 LEU 9 1.210 -2.115 -28.702 75 HD21 LEU 9 1HD2 LEU 9 3.361 0.167 -29.123 76 HD22 LEU 9 2HD2 LEU 9 4.159 -0.193 -27.586 77 HD23 LEU 9 3HD2 LEU 9 2.392 -0.213 -27.676 78 H ALA 10 H ALA 10 4.310 -5.662 -26.888 79 HA ALA 10 HA ALA 10 5.909 -6.272 -29.310 80 HB1 ALA 10 1HB ALA 10 7.365 -6.444 -27.246 81 HB2 ALA 10 2HB ALA 10 6.282 -7.735 -26.679 82 HB3 ALA 10 3HB ALA 10 7.210 -7.942 -28.182 83 H LYS 11 H LYS 11 5.396 -8.191 -30.340 84 HA LYS 11 HA LYS 11 2.762 -9.359 -29.568 85 HB2 LYS 11 1HB LYS 11 3.133 -8.592 -31.922 86 HB3 LYS 11 2HB LYS 11 4.477 -9.728 -32.068 87 HG2 LYS 11 1HG LYS 11 2.884 -11.595 -31.618 88 HG3 LYS 11 2HG LYS 11 1.552 -10.426 -31.601 89 HD2 LYS 11 1HD LYS 11 2.070 -9.811 -33.935 90 HD3 LYS 11 2HD LYS 11 3.416 -10.983 -33.935 91 HE2 LYS 11 1HE LYS 11 1.793 -12.783 -33.338 92 HE3 LYS 11 2HE LYS 11 0.474 -11.609 -33.475 93 HZ1 LYS 11 1HZ LYS 11 0.698 -12.907 -35.484 94 HZ2 LYS 11 2HZ LYS 11 2.272 -12.446 -35.675 95 HZ3 LYS 11 3HZ LYS 11 1.059 -11.336 -35.810 96 H ALA 12 H ALA 12 2.549 -11.397 -28.811 97 HA ALA 12 HA ALA 12 4.947 -12.890 -28.080 98 HB1 ALA 12 1HB ALA 12 2.955 -12.953 -26.658 99 HB2 ALA 12 2HB ALA 12 1.992 -13.602 -27.997 100 HB3 ALA 12 3HB ALA 12 3.292 -14.576 -27.280 101 H LEU 13 H LEU 13 5.946 -14.455 -29.140 102 HA LEU 13 HA LEU 13 4.869 -15.246 -31.808 103 HB2 LEU 13 1HB LEU 13 7.558 -15.753 -30.494 104 HB3 LEU 13 2HB LEU 13 7.132 -16.127 -32.157 105 HG LEU 13 HG LEU 13 7.237 -13.318 -30.982 106 HD11 LEU 13 1HD1 LEU 13 9.356 -13.081 -32.200 107 HD12 LEU 13 2HD1 LEU 13 9.271 -14.787 -32.703 108 HD13 LEU 13 3HD1 LEU 13 9.461 -14.366 -30.980 109 HD21 LEU 13 1HD2 LEU 13 6.960 -14.327 -33.855 110 HD22 LEU 13 2HD2 LEU 13 7.252 -12.640 -33.387 111 HD23 LEU 13 3HD2 LEU 13 5.742 -13.431 -32.912 112 H TYR 14 H TYR 14 5.387 -16.390 -28.583 113 HA TYR 14 HA TYR 14 4.532 -19.155 -29.353 114 HB2 TYR 14 1HB TYR 14 6.416 -18.305 -27.123 115 HB3 TYR 14 2HB TYR 14 5.840 -19.949 -27.413 116 HD1 TYR 14 HD1 TYR 14 6.838 -21.352 -29.141 117 HD2 TYR 14 HD2 TYR 14 8.016 -17.227 -28.762 118 HE1 TYR 14 HE1 TYR 14 8.767 -21.747 -30.670 119 HE2 TYR 14 HE2 TYR 14 9.928 -17.635 -30.295 120 HH TYR 14 HH TYR 14 10.571 -20.838 -31.739 121 H ASP 15 H ASP 15 3.303 -20.209 -27.578 122 HA ASP 15 HA ASP 15 1.761 -18.210 -25.995 123 HB2 ASP 15 1HB ASP 15 0.139 -20.130 -25.709 124 HB3 ASP 15 2HB ASP 15 0.287 -19.533 -27.356 125 H ASN 16 H ASN 16 1.112 -18.915 -23.784 126 HA ASN 16 HA ASN 16 2.969 -20.813 -22.495 127 HB2 ASN 16 1HB ASN 16 4.046 -18.494 -22.665 128 HB3 ASN 16 2HB ASN 16 2.756 -17.924 -21.597 129 HD21 ASN 16 1HD2 ASN 16 4.677 -18.757 -18.847 130 HD22 ASN 16 2HD2 ASN 16 3.625 -17.624 -19.678 131 H VAL 17 H VAL 17 2.386 -21.224 -20.252 132 HA VAL 17 HA VAL 17 -0.378 -20.316 -19.506 133 HB VAL 17 HB VAL 17 0.950 -23.022 -18.919 134 HG11 VAL 17 1HG1 VAL 17 -1.221 -23.622 -17.876 135 HG12 VAL 17 2HG1 VAL 17 -0.463 -22.260 -17.049 136 HG13 VAL 17 3HG1 VAL 17 -1.821 -21.968 -18.161 137 HG21 VAL 17 1HG2 VAL 17 -0.889 -23.992 -20.286 138 HG22 VAL 17 2HG2 VAL 17 -1.429 -22.344 -20.707 139 HG23 VAL 17 3HG2 VAL 17 0.166 -22.937 -21.243 140 H ALA 18 H ALA 18 -0.347 -19.334 -17.470 141 HA ALA 18 HA ALA 18 2.280 -18.823 -16.337 142 HB1 ALA 18 1HB ALA 18 -0.508 -18.178 -15.295 143 HB2 ALA 18 2HB ALA 18 1.008 -17.546 -14.633 144 HB3 ALA 18 3HB ALA 18 0.509 -17.089 -16.275 145 H GLU 19 H GLU 19 3.344 -20.260 -15.420 146 HA GLU 19 HA GLU 19 2.139 -22.459 -13.922 147 HB2 GLU 19 1HB GLU 19 4.191 -22.768 -15.194 148 HB3 GLU 19 2HB GLU 19 4.967 -21.422 -14.347 149 HG2 GLU 19 1HG GLU 19 4.972 -22.606 -12.304 150 HG3 GLU 19 2HG GLU 19 3.982 -23.904 -12.984 151 H SER 20 H SER 20 3.667 -19.340 -13.353 152 HA SER 20 HA SER 20 3.095 -19.615 -10.424 153 HB2 SER 20 1HB SER 20 5.264 -18.071 -11.907 154 HB3 SER 20 2HB SER 20 4.980 -17.972 -10.155 155 HG SER 20 HG SER 20 5.429 -20.445 -11.483 156 HA PRO 21 HA PRO 21 0.438 -16.213 -11.054 157 HB2 PRO 21 1HB PRO 21 0.523 -14.805 -8.725 158 HB3 PRO 21 2HB PRO 21 -0.220 -16.440 -8.824 159 HG2 PRO 21 1HG PRO 21 2.567 -15.670 -7.951 160 HG3 PRO 21 2HG PRO 21 1.362 -16.689 -7.096 161 HD2 PRO 21 1HD PRO 21 3.314 -17.793 -8.587 162 HD3 PRO 21 2HD PRO 21 1.655 -18.478 -8.599 163 H ASP 22 H ASP 22 3.778 -15.610 -10.330 164 HA ASP 22 HA ASP 22 3.652 -12.739 -10.856 165 HB2 ASP 22 1HB ASP 22 5.967 -14.689 -10.636 166 HB3 ASP 22 2HB ASP 22 6.116 -12.922 -10.699 167 H GLU 23 H GLU 23 3.587 -15.552 -12.748 168 HA GLU 23 HA GLU 23 5.056 -14.371 -15.037 169 HB2 GLU 23 1HB GLU 23 5.289 -16.800 -14.267 170 HB3 GLU 23 2HB GLU 23 3.625 -17.032 -14.810 171 HG2 GLU 23 1HG GLU 23 4.262 -16.354 -17.074 172 HG3 GLU 23 2HG GLU 23 5.929 -16.107 -16.521 173 H LEU 24 H LEU 24 3.974 -13.820 -16.983 174 HA LEU 24 HA LEU 24 1.078 -13.361 -16.604 175 HB2 LEU 24 1HB LEU 24 3.177 -12.059 -18.025 176 HB3 LEU 24 2HB LEU 24 2.021 -12.634 -19.227 177 HG LEU 24 HG LEU 24 1.321 -10.923 -16.817 178 HD11 LEU 24 1HD1 LEU 24 1.550 -10.184 -19.746 179 HD12 LEU 24 2HD1 LEU 24 2.713 -9.759 -18.468 180 HD13 LEU 24 3HD1 LEU 24 1.058 -9.113 -18.405 181 HD21 LEU 24 1HD2 LEU 24 -0.355 -11.837 -19.182 182 HD22 LEU 24 2HD2 LEU 24 -0.837 -10.553 -18.044 183 HD23 LEU 24 3HD2 LEU 24 -0.621 -12.209 -17.460 184 H SER 25 H SER 25 -0.512 -14.482 -17.594 185 HA SER 25 HA SER 25 0.248 -16.767 -19.324 186 HB2 SER 25 1HB SER 25 -1.557 -17.060 -17.636 187 HB3 SER 25 2HB SER 25 -2.483 -15.764 -18.415 188 HG SER 25 HG SER 25 -1.639 -18.145 -19.735 189 H PHE 26 H PHE 26 0.339 -16.522 -21.491 190 HA PHE 26 HA PHE 26 -1.341 -14.502 -22.835 191 HB2 PHE 26 1HB PHE 26 0.589 -13.545 -24.039 192 HB3 PHE 26 2HB PHE 26 0.730 -13.242 -22.303 193 HD1 PHE 26 HD1 PHE 26 2.110 -15.198 -25.146 194 HD2 PHE 26 HD2 PHE 26 2.503 -14.205 -20.981 195 HE1 PHE 26 HE1 PHE 26 4.384 -16.199 -25.117 196 HE2 PHE 26 HE2 PHE 26 4.753 -15.239 -20.935 197 HZ PHE 26 HZ PHE 26 5.711 -16.236 -23.012 198 H ARG 27 H ARG 27 -1.165 -14.875 -25.273 199 HA ARG 27 HA ARG 27 -0.175 -17.626 -25.820 200 HB2 ARG 27 1HB ARG 27 -2.884 -16.514 -26.511 201 HB3 ARG 27 2HB ARG 27 -2.176 -17.886 -27.368 202 HG2 ARG 27 1HG ARG 27 -1.966 -19.120 -25.252 203 HG3 ARG 27 2HG ARG 27 -2.706 -17.780 -24.365 204 HD2 ARG 27 1HD ARG 27 -4.099 -19.248 -26.633 205 HD3 ARG 27 2HD ARG 27 -4.221 -19.725 -24.930 206 HE ARG 27 HE ARG 27 -5.439 -17.378 -26.193 207 HH11 ARG 27 1HH1 ARG 27 -4.660 -18.955 -23.114 208 HH12 ARG 27 2HH1 ARG 27 -5.863 -18.051 -22.243 209 HH21 ARG 27 1HH2 ARG 27 -6.947 -16.264 -25.008 210 HH22 ARG 27 2HH2 ARG 27 -7.129 -16.546 -23.289 211 H LYS 28 H LYS 28 0.233 -18.081 -28.040 212 HA LYS 28 HA LYS 28 1.789 -16.051 -29.273 213 HB2 LYS 28 1HB LYS 28 1.818 -17.597 -31.259 214 HB3 LYS 28 2HB LYS 28 2.256 -18.374 -29.747 215 HG2 LYS 28 1HG LYS 28 -0.067 -19.293 -29.586 216 HG3 LYS 28 2HG LYS 28 -0.383 -18.650 -31.203 217 HD2 LYS 28 1HD LYS 28 1.388 -20.027 -32.136 218 HD3 LYS 28 2HD LYS 28 1.896 -20.528 -30.522 219 HE2 LYS 28 1HE LYS 28 0.628 -22.326 -31.489 220 HE3 LYS 28 2HE LYS 28 -0.317 -21.612 -30.173 221 HZ1 LYS 28 1HZ LYS 28 -1.698 -22.010 -32.102 222 HZ2 LYS 28 2HZ LYS 28 -0.706 -21.096 -33.061 223 HZ3 LYS 28 3HZ LYS 28 -1.566 -20.381 -31.855 224 H GLY 29 H GLY 29 1.341 -14.476 -30.651 225 HA2 GLY 29 1HA GLY 29 0.011 -13.545 -32.432 226 HA3 GLY 29 2HA GLY 29 -1.398 -14.423 -31.848 227 H ASP 30 H ASP 30 -0.562 -13.613 -28.980 228 HA ASP 30 HA ASP 30 -2.263 -11.254 -28.942 229 HB2 ASP 30 1HB ASP 30 -1.891 -13.292 -27.231 230 HB3 ASP 30 2HB ASP 30 -0.703 -12.169 -26.539 231 H ILE 31 H ILE 31 -1.616 -9.287 -27.672 232 HA ILE 31 HA ILE 31 1.256 -8.583 -28.089 233 HB ILE 31 HB ILE 31 -1.169 -6.923 -28.922 234 HG12 ILE 31 1HG1 ILE 31 0.584 -6.851 -31.007 235 HG13 ILE 31 2HG1 ILE 31 0.990 -8.439 -30.337 236 HG21 ILE 31 1HG2 ILE 31 0.447 -5.423 -27.810 237 HG22 ILE 31 2HG2 ILE 31 1.773 -6.092 -28.781 238 HG23 ILE 31 3HG2 ILE 31 0.478 -5.144 -29.554 239 HD11 ILE 31 1HD1 ILE 31 -0.609 -8.668 -32.115 240 HD12 ILE 31 2HD1 ILE 31 -1.371 -9.118 -30.572 241 HD13 ILE 31 3HD1 ILE 31 -1.727 -7.545 -31.311 242 H MET 32 H MET 32 2.171 -7.583 -26.434 243 HA MET 32 HA MET 32 0.420 -6.577 -24.225 244 HB2 MET 32 1HB MET 32 1.864 -7.727 -22.614 245 HB3 MET 32 2HB MET 32 1.129 -8.877 -23.738 246 HG2 MET 32 1HG MET 32 3.335 -8.660 -25.077 247 HG3 MET 32 2HG MET 32 3.986 -7.925 -23.607 248 HE1 MET 32 1HE MET 32 2.807 -12.287 -24.324 249 HE2 MET 32 2HE MET 32 1.532 -11.053 -24.428 250 HE3 MET 32 3HE MET 32 2.933 -10.977 -25.520 251 H THR 33 H THR 33 1.407 -5.032 -22.832 252 HA THR 33 HA THR 33 3.418 -3.384 -24.234 253 HB THR 33 HB THR 33 1.984 -2.874 -21.567 254 HG1 THR 33 HG1 THR 33 0.823 -1.412 -23.220 255 HG21 THR 33 1HG2 THR 33 2.459 -0.498 -22.122 256 HG22 THR 33 2HG2 THR 33 3.344 -1.020 -23.574 257 HG23 THR 33 3HG2 THR 33 3.965 -1.431 -21.959 258 H VAL 34 H VAL 34 5.543 -3.251 -23.630 259 HA VAL 34 HA VAL 34 6.400 -4.904 -21.271 260 HB VAL 34 HB VAL 34 8.019 -3.661 -23.537 261 HG11 VAL 34 1HG1 VAL 34 9.924 -5.011 -22.582 262 HG12 VAL 34 2HG1 VAL 34 9.404 -3.685 -21.542 263 HG13 VAL 34 3HG1 VAL 34 8.913 -5.353 -21.157 264 HG21 VAL 34 1HG2 VAL 34 6.640 -5.695 -24.146 265 HG22 VAL 34 2HG2 VAL 34 8.389 -5.927 -24.329 266 HG23 VAL 34 3HG2 VAL 34 7.548 -6.607 -22.925 267 H LEU 35 H LEU 35 6.867 -3.932 -19.440 268 HA LEU 35 HA LEU 35 6.991 -0.972 -19.386 269 HB2 LEU 35 1HB LEU 35 6.789 -3.026 -17.164 270 HB3 LEU 35 2HB LEU 35 6.755 -1.284 -16.947 271 HG LEU 35 HG LEU 35 4.638 -2.908 -18.389 272 HD11 LEU 35 1HD1 LEU 35 4.669 -3.289 -15.965 273 HD12 LEU 35 2HD1 LEU 35 3.265 -2.298 -16.412 274 HD13 LEU 35 3HD1 LEU 35 4.681 -1.534 -15.671 275 HD21 LEU 35 1HD2 LEU 35 4.756 -0.664 -19.357 276 HD22 LEU 35 2HD2 LEU 35 4.766 0.059 -17.733 277 HD23 LEU 35 3HD2 LEU 35 3.316 -0.783 -18.323 278 H GLU 36 H GLU 36 8.849 -3.841 -18.407 279 HA GLU 36 HA GLU 36 11.288 -2.174 -18.134 280 HB2 GLU 36 1HB GLU 36 10.098 -2.262 -15.917 281 HB3 GLU 36 2HB GLU 36 10.259 -4.026 -15.938 282 HG2 GLU 36 1HG GLU 36 11.961 -2.896 -14.515 283 HG3 GLU 36 2HG GLU 36 12.690 -3.844 -15.820 284 H ARG 37 H ARG 37 13.264 -3.566 -18.012 285 HA ARG 37 HA ARG 37 12.788 -6.370 -19.009 286 HB2 ARG 37 1HB ARG 37 14.897 -4.426 -20.025 287 HB3 ARG 37 2HB ARG 37 14.700 -6.113 -20.521 288 HG2 ARG 37 1HG ARG 37 12.390 -5.492 -21.377 289 HG3 ARG 37 2HG ARG 37 12.842 -3.801 -21.097 290 HD2 ARG 37 1HD ARG 37 14.134 -5.780 -23.011 291 HD3 ARG 37 2HD ARG 37 13.265 -4.279 -23.419 292 HE ARG 37 HE ARG 37 15.122 -2.997 -22.577 293 HH11 ARG 37 1HH1 ARG 37 15.835 -6.449 -22.759 294 HH12 ARG 37 2HH1 ARG 37 17.556 -6.190 -22.641 295 HH21 ARG 37 1HH2 ARG 37 17.339 -2.743 -22.477 296 HH22 ARG 37 2HH2 ARG 37 18.393 -4.143 -22.509 297 H ASP 38 H ASP 38 14.432 -7.832 -18.386 298 HA ASP 38 HA ASP 38 15.805 -8.801 -16.856 299 HB2 ASP 38 1HB ASP 38 17.436 -7.094 -17.910 300 HB3 ASP 38 2HB ASP 38 17.227 -6.167 -16.414 301 H THR 39 H THR 39 13.348 -7.901 -16.149 302 HA THR 39 HA THR 39 13.303 -6.268 -13.796 303 HB THR 39 HB THR 39 11.377 -6.594 -15.381 304 HG1 THR 39 HG1 THR 39 11.060 -7.167 -12.614 305 HG21 THR 39 1HG2 THR 39 9.990 -8.589 -15.222 306 HG22 THR 39 2HG2 THR 39 11.040 -9.296 -13.987 307 HG23 THR 39 3HG2 THR 39 11.633 -9.083 -15.656 308 H GLN 40 H GLN 40 14.198 -9.537 -14.207 309 HA GLN 40 HA GLN 40 13.475 -10.194 -11.382 310 HB2 GLN 40 1HB GLN 40 12.544 -11.405 -13.632 311 HB3 GLN 40 2HB GLN 40 14.016 -12.334 -13.383 312 HG2 GLN 40 1HG GLN 40 12.403 -13.584 -12.246 313 HG3 GLN 40 2HG GLN 40 13.181 -12.675 -10.943 314 HE21 GLN 40 1HE2 GLN 40 9.504 -12.498 -10.472 315 HE22 GLN 40 2HE2 GLN 40 10.722 -13.758 -10.520 316 H GLY 41 H GLY 41 16.137 -9.246 -13.075 317 HA2 GLY 41 1HA GLY 41 18.389 -9.514 -12.546 318 HA3 GLY 41 2HA GLY 41 17.963 -10.727 -11.326 319 H LEU 42 H LEU 42 16.616 -10.992 -14.464 320 HA LEU 42 HA LEU 42 18.585 -13.038 -15.317 321 HB2 LEU 42 1HB LEU 42 15.554 -13.194 -15.493 322 HB3 LEU 42 2HB LEU 42 16.658 -14.325 -16.257 323 HG LEU 42 HG LEU 42 16.368 -13.949 -13.247 324 HD11 LEU 42 1HD1 LEU 42 15.200 -16.079 -15.107 325 HD12 LEU 42 2HD1 LEU 42 14.299 -14.802 -14.241 326 HD13 LEU 42 3HD1 LEU 42 15.114 -16.068 -13.323 327 HD21 LEU 42 1HD2 LEU 42 17.548 -16.156 -13.173 328 HD22 LEU 42 2HD2 LEU 42 18.556 -14.858 -13.823 329 HD23 LEU 42 3HD2 LEU 42 17.819 -16.049 -14.928 330 H ASP 43 H ASP 43 19.461 -12.088 -17.130 331 HA ASP 43 HA ASP 43 18.114 -10.029 -18.588 332 HB2 ASP 43 1HB ASP 43 20.615 -10.435 -18.618 333 HB3 ASP 43 2HB ASP 43 20.309 -11.825 -19.665 334 H GLY 44 H GLY 44 16.979 -10.105 -20.463 335 HA2 GLY 44 1HA GLY 44 15.880 -11.172 -22.267 336 HA3 GLY 44 2HA GLY 44 16.297 -12.748 -21.595 337 H TRP 45 H TRP 45 15.146 -11.521 -18.845 338 HA TRP 45 HA TRP 45 12.326 -12.228 -19.565 339 HB2 TRP 45 1HB TRP 45 13.833 -12.126 -16.948 340 HB3 TRP 45 2HB TRP 45 12.075 -12.269 -17.033 341 HD1 TRP 45 HD1 TRP 45 15.263 -14.215 -17.990 342 HE1 TRP 45 HE1 TRP 45 14.729 -16.670 -18.313 343 HE3 TRP 45 HE3 TRP 45 10.180 -13.875 -17.542 344 HZ2 TRP 45 HZ2 TRP 45 12.382 -18.310 -18.375 345 HZ3 TRP 45 HZ3 TRP 45 8.818 -15.980 -17.722 346 HH2 TRP 45 HH2 TRP 45 9.928 -18.169 -18.136 347 H TRP 46 H TRP 46 10.772 -10.710 -19.728 348 HA TRP 46 HA TRP 46 11.510 -7.974 -18.763 349 HB2 TRP 46 1HB TRP 46 9.845 -8.775 -21.169 350 HB3 TRP 46 2HB TRP 46 10.284 -7.131 -20.706 351 HD1 TRP 46 HD1 TRP 46 13.461 -8.683 -20.167 352 HE1 TRP 46 HE1 TRP 46 15.005 -8.762 -22.174 353 HE3 TRP 46 HE3 TRP 46 9.954 -7.696 -23.757 354 HZ2 TRP 46 HZ2 TRP 46 14.771 -8.413 -25.000 355 HZ3 TRP 46 HZ3 TRP 46 10.687 -7.606 -26.152 356 HH2 TRP 46 HH2 TRP 46 13.082 -7.954 -26.747 357 H LEU 47 H LEU 47 9.868 -6.682 -17.881 358 HA LEU 47 HA LEU 47 7.578 -8.210 -16.795 359 HB2 LEU 47 1HB LEU 47 8.857 -6.582 -15.372 360 HB3 LEU 47 2HB LEU 47 8.394 -5.301 -16.474 361 HG LEU 47 HG LEU 47 6.003 -5.692 -15.882 362 HD11 LEU 47 1HD1 LEU 47 6.107 -8.026 -15.140 363 HD12 LEU 47 2HD1 LEU 47 5.533 -7.007 -13.811 364 HD13 LEU 47 3HD1 LEU 47 7.211 -7.585 -13.822 365 HD21 LEU 47 1HD2 LEU 47 7.883 -5.104 -13.568 366 HD22 LEU 47 2HD2 LEU 47 6.166 -4.650 -13.655 367 HD23 LEU 47 3HD2 LEU 47 7.332 -3.941 -14.790 368 H CYS 48 H CYS 48 5.800 -8.402 -18.016 369 HA CYS 48 HA CYS 48 5.180 -6.145 -19.875 370 HB2 CYS 48 1HB CYS 48 4.426 -9.076 -20.069 371 HB3 CYS 48 2HB CYS 48 4.048 -7.811 -21.251 372 HG CYS 48 HG CYS 48 6.985 -8.907 -20.261 373 H SER 49 H SER 49 2.818 -5.918 -20.352 374 HA SER 49 HA SER 49 1.113 -6.710 -18.031 375 HB2 SER 49 1HB SER 49 1.122 -4.008 -19.411 376 HB3 SER 49 2HB SER 49 0.020 -4.501 -18.107 377 HG SER 49 HG SER 49 2.784 -4.738 -17.708 378 H LEU 50 H LEU 50 -0.787 -7.542 -18.563 379 HA LEU 50 HA LEU 50 -2.056 -7.092 -21.185 380 HB2 LEU 50 1HB LEU 50 -0.285 -8.772 -21.695 381 HB3 LEU 50 2HB LEU 50 -0.884 -9.783 -20.394 382 HG LEU 50 HG LEU 50 -3.015 -10.101 -21.626 383 HD11 LEU 50 1HD1 LEU 50 -3.026 -8.084 -23.021 384 HD12 LEU 50 2HD1 LEU 50 -3.079 -9.527 -24.057 385 HD13 LEU 50 3HD1 LEU 50 -1.559 -8.621 -23.848 386 HD21 LEU 50 1HD2 LEU 50 -0.468 -10.819 -23.111 387 HD22 LEU 50 2HD2 LEU 50 -2.047 -11.617 -23.311 388 HD23 LEU 50 3HD2 LEU 50 -1.199 -11.713 -21.753 389 H HIS 51 H HIS 51 -4.242 -7.750 -21.095 390 HA HIS 51 HA HIS 51 -6.243 -8.297 -20.151 391 HB2 HIS 51 1HB HIS 51 -4.742 -10.517 -20.121 392 HB3 HIS 51 2HB HIS 51 -5.007 -10.376 -18.385 393 HD1 HIS 51 HD1 HIS 51 -7.776 -9.993 -17.818 394 HD2 HIS 51 HD2 HIS 51 -6.669 -11.888 -21.368 395 HE1 HIS 51 HE1 HIS 51 -9.808 -11.303 -18.627 396 H GLY 52 H GLY 52 -4.512 -6.305 -18.636 397 HA2 GLY 52 1HA GLY 52 -5.138 -4.940 -16.852 398 HA3 GLY 52 2HA GLY 52 -6.297 -6.165 -16.317 399 H ARG 53 H ARG 53 -3.346 -7.671 -16.873 400 HA ARG 53 HA ARG 53 -2.493 -7.334 -14.018 401 HB2 ARG 53 1HB ARG 53 -2.472 -9.808 -15.794 402 HB3 ARG 53 2HB ARG 53 -1.667 -9.687 -14.229 403 HG2 ARG 53 1HG ARG 53 -3.886 -9.252 -13.172 404 HG3 ARG 53 2HG ARG 53 -4.647 -9.553 -14.749 405 HD2 ARG 53 1HD ARG 53 -4.685 -11.596 -13.395 406 HD3 ARG 53 2HD ARG 53 -3.598 -11.806 -14.785 407 HE ARG 53 HE ARG 53 -2.098 -10.838 -12.553 408 HH11 ARG 53 1HH1 ARG 53 -3.673 -13.835 -13.583 409 HH12 ARG 53 2HH1 ARG 53 -2.533 -14.823 -12.713 410 HH21 ARG 53 1HH2 ARG 53 -0.711 -12.162 -11.492 411 HH22 ARG 53 2HH2 ARG 53 -0.879 -13.886 -11.565 412 H GLN 54 H GLN 54 -0.214 -7.847 -13.686 413 HA GLN 54 HA GLN 54 1.450 -7.354 -16.112 414 HB2 GLN 54 1HB GLN 54 2.100 -6.630 -13.229 415 HB3 GLN 54 2HB GLN 54 3.087 -6.306 -14.646 416 HG2 GLN 54 1HG GLN 54 2.151 -4.265 -14.573 417 HG3 GLN 54 2HG GLN 54 0.769 -5.039 -15.354 418 HE21 GLN 54 1HE2 GLN 54 0.017 -3.114 -12.081 419 HE22 GLN 54 2HE2 GLN 54 1.214 -2.769 -13.303 420 H GLY 55 H GLY 55 3.435 -8.601 -16.136 421 HA2 GLY 55 1HA GLY 55 4.095 -10.456 -14.054 422 HA3 GLY 55 2HA GLY 55 3.136 -11.287 -15.292 423 H ILE 56 H ILE 56 5.755 -12.026 -14.734 424 HA ILE 56 HA ILE 56 7.526 -10.689 -16.627 425 HB ILE 56 HB ILE 56 9.222 -12.298 -15.975 426 HG12 ILE 56 1HG1 ILE 56 7.076 -13.762 -14.382 427 HG13 ILE 56 2HG1 ILE 56 7.722 -14.322 -15.923 428 HG21 ILE 56 1HG2 ILE 56 8.552 -10.395 -14.405 429 HG22 ILE 56 2HG2 ILE 56 7.623 -11.585 -13.464 430 HG23 ILE 56 3HG2 ILE 56 9.386 -11.742 -13.623 431 HD11 ILE 56 1HD1 ILE 56 10.024 -14.409 -14.854 432 HD12 ILE 56 2HD1 ILE 56 9.237 -14.070 -13.289 433 HD13 ILE 56 3HD1 ILE 56 8.842 -15.556 -14.188 434 H VAL 57 H VAL 57 8.342 -11.426 -18.533 435 HA VAL 57 HA VAL 57 7.146 -13.873 -19.754 436 HB VAL 57 HB VAL 57 7.108 -11.055 -20.964 437 HG11 VAL 57 1HG1 VAL 57 7.575 -12.578 -22.745 438 HG12 VAL 57 2HG1 VAL 57 6.361 -13.732 -22.148 439 HG13 VAL 57 3HG1 VAL 57 5.844 -12.191 -22.842 440 HG21 VAL 57 1HG2 VAL 57 4.843 -12.868 -20.049 441 HG22 VAL 57 2HG2 VAL 57 5.300 -11.273 -19.399 442 HG23 VAL 57 3HG2 VAL 57 4.623 -11.390 -21.025 443 HA PRO 58 HA PRO 58 11.414 -13.682 -21.051 444 HB2 PRO 58 1HB PRO 58 11.567 -15.779 -22.785 445 HB3 PRO 58 2HB PRO 58 11.493 -15.997 -21.008 446 HG2 PRO 58 1HG PRO 58 9.293 -16.173 -23.027 447 HG3 PRO 58 2HG PRO 58 9.695 -17.296 -21.702 448 HD2 PRO 58 1HD PRO 58 7.723 -15.417 -21.545 449 HD3 PRO 58 2HD PRO 58 8.686 -15.936 -20.127 450 H GLY 59 H GLY 59 12.050 -12.109 -22.325 451 HA2 GLY 59 1HA GLY 59 10.555 -11.049 -24.474 452 HA3 GLY 59 2HA GLY 59 12.225 -10.674 -24.080 453 H ASN 60 H ASN 60 12.931 -13.614 -24.445 454 HA ASN 60 HA ASN 60 13.608 -13.444 -27.258 455 HB2 ASN 60 1HB ASN 60 13.772 -15.723 -25.252 456 HB3 ASN 60 2HB ASN 60 14.373 -15.829 -26.911 457 HD21 ASN 60 1HD2 ASN 60 17.142 -14.850 -24.594 458 HD22 ASN 60 2HD2 ASN 60 16.008 -16.176 -24.660 459 H ARG 61 H ARG 61 10.656 -14.093 -25.841 460 HA ARG 61 HA ARG 61 9.815 -15.819 -28.154 461 HB2 ARG 61 1HB ARG 61 8.508 -15.472 -25.423 462 HB3 ARG 61 2HB ARG 61 7.909 -16.480 -26.735 463 HG2 ARG 61 1HG ARG 61 10.117 -17.766 -26.579 464 HG3 ARG 61 2HG ARG 61 10.401 -16.884 -25.065 465 HD2 ARG 61 1HD ARG 61 8.093 -17.714 -24.321 466 HD3 ARG 61 2HD ARG 61 8.119 -18.796 -25.714 467 HE ARG 61 HE ARG 61 9.592 -19.041 -23.218 468 HH11 ARG 61 1HH1 ARG 61 9.489 -20.119 -26.589 469 HH12 ARG 61 2HH1 ARG 61 10.428 -21.551 -26.244 470 HH21 ARG 61 1HH2 ARG 61 10.776 -20.896 -22.860 471 HH22 ARG 61 2HH2 ARG 61 11.120 -21.992 -24.179 472 H LEU 62 H LEU 62 10.126 -12.728 -27.498 473 HA LEU 62 HA LEU 62 7.383 -11.957 -28.430 474 HB2 LEU 62 1HB LEU 62 9.378 -10.399 -26.738 475 HB3 LEU 62 2HB LEU 62 7.859 -9.774 -27.333 476 HG LEU 62 HG LEU 62 8.138 -11.974 -25.278 477 HD11 LEU 62 1HD1 LEU 62 7.267 -9.055 -25.001 478 HD12 LEU 62 2HD1 LEU 62 8.815 -9.734 -24.441 479 HD13 LEU 62 3HD1 LEU 62 7.293 -10.255 -23.694 480 HD21 LEU 62 1HD2 LEU 62 5.697 -10.586 -26.446 481 HD22 LEU 62 2HD2 LEU 62 5.679 -11.562 -24.968 482 HD23 LEU 62 3HD2 LEU 62 6.105 -12.325 -26.499 483 H LYS 63 H LYS 63 7.239 -10.289 -29.971 484 HA LYS 63 HA LYS 63 9.849 -9.441 -31.216 485 HB2 LYS 63 1HB LYS 63 8.418 -10.813 -32.760 486 HB3 LYS 63 2HB LYS 63 7.111 -9.628 -32.551 487 HG2 LYS 63 1HG LYS 63 8.858 -7.868 -33.358 488 HG3 LYS 63 2HG LYS 63 9.769 -9.255 -33.960 489 HD2 LYS 63 1HD LYS 63 6.877 -8.672 -34.680 490 HD3 LYS 63 2HD LYS 63 8.263 -8.111 -35.627 491 HE2 LYS 63 1HE LYS 63 9.012 -10.512 -35.837 492 HE3 LYS 63 2HE LYS 63 7.469 -10.989 -35.092 493 HZ1 LYS 63 1HZ LYS 63 7.755 -9.425 -37.591 494 HZ2 LYS 63 2HZ LYS 63 6.317 -9.856 -36.901 495 HZ3 LYS 63 3HZ LYS 63 7.335 -11.015 -37.506 496 H ILE 64 H ILE 64 10.269 -7.394 -30.679 497 HA ILE 64 HA ILE 64 8.385 -5.556 -29.548 498 HB ILE 64 HB ILE 64 11.100 -5.144 -30.904 499 HG12 ILE 64 1HG1 ILE 64 11.099 -6.471 -28.794 500 HG13 ILE 64 2HG1 ILE 64 12.030 -4.978 -28.713 501 HG21 ILE 64 1HG2 ILE 64 9.352 -3.101 -29.463 502 HG22 ILE 64 2HG2 ILE 64 11.113 -2.893 -29.718 503 HG23 ILE 64 3HG2 ILE 64 10.021 -3.032 -31.110 504 HD11 ILE 64 1HD1 ILE 64 9.236 -5.328 -27.508 505 HD12 ILE 64 2HD1 ILE 64 10.765 -5.365 -26.612 506 HD13 ILE 64 3HD1 ILE 64 10.248 -3.868 -27.395 507 H LEU 65 H LEU 65 7.047 -4.082 -30.407 508 HA LEU 65 HA LEU 65 6.839 -4.047 -33.399 509 HB2 LEU 65 1HB LEU 65 4.776 -3.468 -31.247 510 HB3 LEU 65 2HB LEU 65 4.494 -3.394 -32.981 511 HG LEU 65 HG LEU 65 5.186 -5.897 -31.413 512 HD11 LEU 65 1HD1 LEU 65 2.814 -6.478 -31.792 513 HD12 LEU 65 2HD1 LEU 65 2.547 -4.884 -32.529 514 HD13 LEU 65 3HD1 LEU 65 3.003 -5.012 -30.821 515 HD21 LEU 65 1HD2 LEU 65 4.473 -7.099 -33.467 516 HD22 LEU 65 2HD2 LEU 65 5.926 -6.118 -33.737 517 HD23 LEU 65 3HD2 LEU 65 4.341 -5.546 -34.323 518 H VAL 66 H VAL 66 7.855 -2.296 -34.181 519 HA VAL 66 HA VAL 66 7.081 0.347 -32.997 520 HB VAL 66 HB VAL 66 9.785 -0.426 -34.213 521 HG11 VAL 66 1HG1 VAL 66 9.221 1.833 -34.954 522 HG12 VAL 66 2HG1 VAL 66 8.744 2.297 -33.295 523 HG13 VAL 66 3HG1 VAL 66 10.443 1.941 -33.680 524 HG21 VAL 66 1HG2 VAL 66 9.067 0.548 -31.413 525 HG22 VAL 66 2HG2 VAL 66 9.498 -1.114 -31.853 526 HG23 VAL 66 3HG2 VAL 66 10.704 0.176 -32.006 527 H GLY 67 H GLY 67 5.988 1.572 -34.393 528 HA2 GLY 67 1HA GLY 67 5.942 0.689 -37.252 529 HA3 GLY 67 2HA GLY 67 4.642 1.553 -36.416 530 H MET 68 H MET 68 7.616 2.859 -35.526 531 HA MET 68 HA MET 68 7.015 5.281 -37.041 532 HB2 MET 68 1HB MET 68 9.252 4.601 -35.105 533 HB3 MET 68 2HB MET 68 8.999 6.189 -35.831 534 HG2 MET 68 1HG MET 68 6.764 6.314 -34.794 535 HG3 MET 68 2HG MET 68 7.037 4.734 -34.026 536 HE1 MET 68 1HE MET 68 6.317 7.559 -32.397 537 HE2 MET 68 2HE MET 68 6.431 5.927 -31.701 538 HE3 MET 68 3HE MET 68 7.363 7.262 -30.986 539 H TYR 69 H TYR 69 7.274 4.472 -39.158 540 HA TYR 69 HA TYR 69 10.138 4.352 -40.047 541 HB2 TYR 69 1HB TYR 69 8.584 2.293 -40.409 542 HB3 TYR 69 2HB TYR 69 7.766 3.293 -41.606 543 HD1 TYR 69 HD1 TYR 69 11.085 1.794 -40.687 544 HD2 TYR 69 HD2 TYR 69 8.714 3.563 -43.812 545 HE1 TYR 69 HE1 TYR 69 12.819 1.154 -42.379 546 HE2 TYR 69 HE2 TYR 69 10.444 2.907 -45.495 547 HH TYR 69 HH TYR 69 12.497 1.952 -45.839 548 H ASP 70 H ASP 70 8.293 6.553 -39.325 549 HA ASP 70 HA ASP 70 7.358 7.791 -41.772 550 HB2 ASP 70 1HB ASP 70 6.537 8.110 -39.315 551 HB3 ASP 70 2HB ASP 70 7.890 9.245 -39.173 552 H LYS 71 H LYS 71 8.231 9.754 -42.693 553 HA LYS 71 HA LYS 71 10.953 10.558 -42.024 554 HB2 LYS 71 1HB LYS 71 11.806 9.914 -44.383 555 HB3 LYS 71 2HB LYS 71 11.742 8.677 -43.139 556 HG2 LYS 71 1HG LYS 71 10.985 7.621 -45.109 557 HG3 LYS 71 2HG LYS 71 9.531 7.888 -44.151 558 HD2 LYS 71 1HD LYS 71 9.044 9.911 -45.531 559 HD3 LYS 71 2HD LYS 71 10.462 9.547 -46.526 560 HE2 LYS 71 1HE LYS 71 9.462 7.390 -47.150 561 HE3 LYS 71 2HE LYS 71 8.088 7.708 -46.064 562 HZ1 LYS 71 1HZ LYS 71 8.801 9.336 -48.437 563 HZ2 LYS 71 2HZ LYS 71 7.535 9.630 -47.424 564 HZ3 LYS 71 3HZ LYS 71 7.545 8.268 -48.349 565 H LYS 72 H LYS 72 11.770 12.172 -43.632 566 HA LYS 72 HA LYS 72 9.489 13.654 -44.883 567 HB2 LYS 72 1HB LYS 72 10.656 15.710 -44.425 568 HB3 LYS 72 2HB LYS 72 10.551 14.807 -42.910 569 HG2 LYS 72 1HG LYS 72 12.901 14.073 -43.185 570 HG3 LYS 72 2HG LYS 72 12.997 14.952 -44.721 571 HD2 LYS 72 1HD LYS 72 12.368 17.053 -43.433 572 HD3 LYS 72 2HD LYS 72 12.660 16.119 -41.956 573 HE2 LYS 72 1HE LYS 72 14.658 16.603 -44.205 574 HE3 LYS 72 2HE LYS 72 14.648 17.445 -42.647 575 HZ1 LYS 72 1HZ LYS 72 16.256 15.647 -42.654 576 HZ2 LYS 72 2HZ LYS 72 15.100 14.537 -43.044 577 HZ3 LYS 72 3HZ LYS 72 15.054 15.281 -41.576 578 HA PRO 73 HA PRO 73 11.867 13.059 -48.550 579 HB2 PRO 73 1HB PRO 73 11.492 15.313 -50.047 580 HB3 PRO 73 2HB PRO 73 10.166 14.134 -49.768 581 HG2 PRO 73 1HG PRO 73 10.768 16.706 -48.304 582 HG3 PRO 73 2HG PRO 73 9.217 16.157 -49.017 583 HD2 PRO 73 1HD PRO 73 9.751 15.856 -46.400 584 HD3 PRO 73 2HD PRO 73 8.846 14.599 -47.318 585 H ALA 74 H ALA 74 13.921 13.624 -49.488 586 HA ALA 74 HA ALA 74 15.370 15.967 -48.421 587 HB1 ALA 74 1HB ALA 74 17.254 14.561 -47.589 588 HB2 ALA 74 2HB ALA 74 15.752 14.247 -46.687 589 HB3 ALA 74 3HB ALA 74 16.293 13.092 -47.921 590 H GLY 75 H GLY 75 15.075 16.421 -50.773 591 HA2 GLY 75 1HA GLY 75 16.593 14.703 -52.628 592 HA3 GLY 75 2HA GLY 75 15.613 16.123 -53.032 593 H GLU 76 H GLU 76 18.451 15.519 -50.934 594 HA GLU 76 HA GLU 76 20.347 16.727 -50.582 595 HB2 GLU 76 1HB GLU 76 20.664 15.621 -52.859 596 HB3 GLU 76 2HB GLU 76 20.446 17.224 -53.559 597 HG2 GLU 76 1HG GLU 76 22.816 16.782 -53.264 598 HG3 GLU 76 2HG GLU 76 22.314 18.056 -52.131 599 H PHE 77 H PHE 77 19.104 18.362 -49.450 600 HA PHE 77 HA PHE 77 18.315 20.780 -50.785 601 HB2 PHE 77 1HB PHE 77 17.301 20.061 -48.632 602 HB3 PHE 77 2HB PHE 77 18.874 20.255 -47.847 603 HD1 PHE 77 HD1 PHE 77 16.009 22.032 -49.387 604 HD2 PHE 77 HD2 PHE 77 19.733 22.465 -47.260 605 HE1 PHE 77 HE1 PHE 77 15.476 24.424 -48.945 606 HE2 PHE 77 HE2 PHE 77 19.209 24.865 -46.820 607 HZ PHE 77 HZ PHE 77 17.086 25.854 -47.666 608 H ILE 78 H ILE 78 19.484 22.385 -51.483 609 HA ILE 78 HA ILE 78 21.903 23.209 -50.009 610 HB ILE 78 HB ILE 78 22.665 21.702 -51.911 611 HG12 ILE 78 1HG1 ILE 78 23.404 24.618 -52.350 612 HG13 ILE 78 2HG1 ILE 78 23.987 23.642 -50.993 613 HG21 ILE 78 1HG2 ILE 78 22.387 22.416 -54.250 614 HG22 ILE 78 2HG2 ILE 78 20.805 22.187 -53.493 615 HG23 ILE 78 3HG2 ILE 78 21.438 23.830 -53.734 616 HD11 ILE 78 1HD1 ILE 78 25.037 22.065 -52.646 617 HD12 ILE 78 2HD1 ILE 78 24.544 23.167 -53.961 618 HD13 ILE 78 3HD1 ILE 78 25.698 23.716 -52.722 619 H VAL 79 H VAL 79 22.262 25.498 -50.349 620 HA VAL 79 HA VAL 79 20.182 26.971 -51.848 621 HB VAL 79 HB VAL 79 19.244 26.702 -49.544 622 HG11 VAL 79 1HG1 VAL 79 20.330 27.697 -47.583 623 HG12 VAL 79 2HG1 VAL 79 21.369 26.438 -48.295 624 HG13 VAL 79 3HG1 VAL 79 21.737 28.157 -48.571 625 HG21 VAL 79 1HG2 VAL 79 18.796 28.771 -50.827 626 HG22 VAL 79 2HG2 VAL 79 18.791 29.049 -49.077 627 HG23 VAL 79 3HG2 VAL 79 20.190 29.554 -50.049 628 H THR 80 H THR 80 20.999 28.988 -52.538 629 HA THR 80 HA THR 80 23.892 29.448 -51.927 630 HB THR 80 HB THR 80 24.107 30.220 -54.335 631 HG1 THR 80 HG1 THR 80 21.787 30.500 -54.614 632 HG21 THR 80 1HG2 THR 80 23.155 27.342 -54.078 633 HG22 THR 80 2HG2 THR 80 24.784 27.907 -53.641 634 HG23 THR 80 3HG2 THR 80 24.223 28.008 -55.323 635 H ASP 81 H ASP 81 23.940 31.195 -50.746 636 HA ASP 81 HA ASP 81 23.494 33.224 -49.848 637 HB2 ASP 81 1HB ASP 81 24.938 33.629 -51.934 638 HB3 ASP 81 2HB ASP 81 23.498 34.245 -52.706 639 HXT ASP 81 H02 ASP 81 20.273 34.574 -51.350 Start of MODEL 12 1 H2 GLY 1 2H0 GLY 1 2.107 7.814 -10.214 2 H GLY 1 1H0 GLY 1 0.719 7.523 -11.096 3 HA2 GLY 1 1HA GLY 1 2.030 5.575 -9.237 4 HA3 GLY 1 2HA GLY 1 0.536 5.263 -10.144 5 H SER 2 H SER 2 2.537 7.072 -12.038 6 HA SER 2 HA SER 2 4.007 4.758 -13.163 7 HB2 SER 2 1HB SER 2 1.869 4.821 -14.394 8 HB3 SER 2 2HB SER 2 2.123 6.543 -14.756 9 HG SER 2 HG SER 2 2.763 5.053 -16.444 10 H MET 3 H MET 3 6.043 5.328 -13.652 11 HA MET 3 HA MET 3 6.586 8.133 -14.458 12 HB2 MET 3 1HB MET 3 7.992 6.669 -12.193 13 HB3 MET 3 2HB MET 3 8.605 8.126 -12.967 14 HG2 MET 3 1HG MET 3 6.530 9.326 -12.260 15 HG3 MET 3 2HG MET 3 6.050 7.875 -11.361 16 HE1 MET 3 1HE MET 3 7.208 10.177 -8.407 17 HE2 MET 3 2HE MET 3 6.269 10.627 -9.850 18 HE3 MET 3 3HE MET 3 5.942 9.092 -9.014 19 H LYS 4 H LYS 4 7.642 8.012 -16.311 20 HA LYS 4 HA LYS 4 9.132 7.397 -17.929 21 HB2 LYS 4 1HB LYS 4 10.400 8.021 -15.601 22 HB3 LYS 4 2HB LYS 4 11.087 6.432 -15.906 23 HG2 LYS 4 1HG LYS 4 12.594 7.947 -16.900 24 HG3 LYS 4 2HG LYS 4 11.663 7.310 -18.269 25 HD2 LYS 4 1HD LYS 4 10.227 9.335 -18.219 26 HD3 LYS 4 2HD LYS 4 11.150 9.953 -16.832 27 HE2 LYS 4 1HE LYS 4 13.210 9.942 -18.222 28 HE3 LYS 4 2HE LYS 4 12.262 9.371 -19.607 29 HZ1 LYS 4 1HZ LYS 4 12.572 11.764 -19.669 30 HZ2 LYS 4 2HZ LYS 4 11.842 11.946 -18.196 31 HZ3 LYS 4 3HZ LYS 4 10.973 11.420 -19.495 32 H TYR 5 H TYR 5 7.382 5.080 -17.341 33 HA TYR 5 HA TYR 5 8.947 2.668 -17.336 34 HB2 TYR 5 1HB TYR 5 6.150 3.371 -18.251 35 HB3 TYR 5 2HB TYR 5 6.835 1.779 -18.586 36 HD1 TYR 5 HD1 TYR 5 5.289 3.871 -16.034 37 HD2 TYR 5 HD2 TYR 5 7.558 0.286 -16.683 38 HE1 TYR 5 HE1 TYR 5 4.595 2.999 -13.793 39 HE2 TYR 5 HE2 TYR 5 6.856 -0.575 -14.467 40 HH TYR 5 HH TYR 5 4.734 1.295 -12.288 41 H LEU 6 H LEU 6 9.275 1.192 -19.132 42 HA LEU 6 HA LEU 6 10.644 2.370 -21.314 43 HB2 LEU 6 1HB LEU 6 9.550 -0.368 -20.712 44 HB3 LEU 6 2HB LEU 6 10.149 -0.039 -22.318 45 HG LEU 6 HG LEU 6 11.756 -1.220 -20.864 46 HD11 LEU 6 1HD1 LEU 6 12.453 0.117 -22.830 47 HD12 LEU 6 2HD1 LEU 6 13.691 0.087 -21.550 48 HD13 LEU 6 3HD1 LEU 6 12.685 1.533 -21.776 49 HD21 LEU 6 1HD2 LEU 6 12.997 -0.080 -19.133 50 HD22 LEU 6 2HD2 LEU 6 11.282 -0.034 -18.722 51 HD23 LEU 6 3HD2 LEU 6 12.067 1.415 -19.382 52 H ASN 7 H ASN 7 7.336 1.116 -21.110 53 HA ASN 7 HA ASN 7 5.521 1.347 -22.475 54 HB2 ASN 7 1HB ASN 7 6.079 3.709 -21.688 55 HB3 ASN 7 2HB ASN 7 6.731 3.983 -23.311 56 HD21 ASN 7 1HD2 ASN 7 3.604 4.877 -24.491 57 HD22 ASN 7 2HD2 ASN 7 5.330 5.128 -24.455 58 H VAL 8 H VAL 8 7.423 -0.225 -23.771 59 HA VAL 8 HA VAL 8 6.838 0.477 -26.611 60 HB VAL 8 HB VAL 8 8.738 -1.031 -27.200 61 HG11 VAL 8 1HG1 VAL 8 10.540 0.564 -26.747 62 HG12 VAL 8 2HG1 VAL 8 9.051 1.434 -27.159 63 HG13 VAL 8 3HG1 VAL 8 9.579 1.324 -25.464 64 HG21 VAL 8 1HG2 VAL 8 8.875 -2.359 -25.156 65 HG22 VAL 8 2HG2 VAL 8 10.440 -1.606 -25.499 66 HG23 VAL 8 3HG2 VAL 8 9.396 -0.937 -24.235 67 H LEU 9 H LEU 9 6.376 -1.689 -27.821 68 HA LEU 9 HA LEU 9 5.121 -3.613 -25.926 69 HB2 LEU 9 1HB LEU 9 3.097 -3.638 -27.360 70 HB3 LEU 9 2HB LEU 9 3.317 -2.149 -26.453 71 HG LEU 9 HG LEU 9 4.378 -2.122 -29.232 72 HD11 LEU 9 1HD1 LEU 9 1.420 -2.254 -28.575 73 HD12 LEU 9 2HD1 LEU 9 2.346 -3.367 -29.600 74 HD13 LEU 9 3HD1 LEU 9 2.084 -1.691 -30.128 75 HD21 LEU 9 1HD2 LEU 9 4.393 -0.153 -27.670 76 HD22 LEU 9 2HD2 LEU 9 2.620 -0.197 -27.649 77 HD23 LEU 9 3HD2 LEU 9 3.483 0.146 -29.166 78 H ALA 10 H ALA 10 4.426 -5.592 -26.941 79 HA ALA 10 HA ALA 10 6.018 -6.256 -29.365 80 HB1 ALA 10 1HB ALA 10 6.155 -7.810 -26.740 81 HB2 ALA 10 2HB ALA 10 7.076 -8.126 -28.232 82 HB3 ALA 10 3HB ALA 10 7.397 -6.661 -27.286 83 H LYS 11 H LYS 11 5.516 -8.372 -30.212 84 HA LYS 11 HA LYS 11 2.743 -9.293 -29.499 85 HB2 LYS 11 1HB LYS 11 3.040 -8.486 -31.858 86 HB3 LYS 11 2HB LYS 11 4.305 -9.704 -32.080 87 HG2 LYS 11 1HG LYS 11 2.671 -11.511 -31.667 88 HG3 LYS 11 2HG LYS 11 1.408 -10.309 -31.363 89 HD2 LYS 11 1HD LYS 11 1.039 -11.043 -33.557 90 HD3 LYS 11 2HD LYS 11 1.819 -9.461 -33.733 91 HE2 LYS 11 1HE LYS 11 3.996 -10.564 -34.143 92 HE3 LYS 11 2HE LYS 11 3.241 -12.156 -33.890 93 HZ1 LYS 11 1HZ LYS 11 3.396 -11.621 -36.244 94 HZ2 LYS 11 2HZ LYS 11 2.510 -10.240 -36.035 95 HZ3 LYS 11 3HZ LYS 11 1.814 -11.713 -35.796 96 H ALA 12 H ALA 12 2.569 -11.361 -28.744 97 HA ALA 12 HA ALA 12 5.029 -12.777 -28.125 98 HB1 ALA 12 1HB ALA 12 3.425 -14.544 -27.308 99 HB2 ALA 12 2HB ALA 12 3.221 -12.944 -26.570 100 HB3 ALA 12 3HB ALA 12 2.098 -13.483 -27.840 101 H LEU 13 H LEU 13 5.960 -14.428 -29.130 102 HA LEU 13 HA LEU 13 4.942 -15.127 -31.834 103 HB2 LEU 13 1HB LEU 13 7.534 -15.801 -30.409 104 HB3 LEU 13 2HB LEU 13 7.172 -16.150 -32.099 105 HG LEU 13 HG LEU 13 7.414 -13.359 -30.904 106 HD11 LEU 13 1HD1 LEU 13 9.567 -13.275 -32.087 107 HD12 LEU 13 2HD1 LEU 13 9.351 -14.961 -32.626 108 HD13 LEU 13 3HD1 LEU 13 9.550 -14.580 -30.896 109 HD21 LEU 13 1HD2 LEU 13 7.118 -14.319 -33.787 110 HD22 LEU 13 2HD2 LEU 13 7.494 -12.648 -33.300 111 HD23 LEU 13 3HD2 LEU 13 5.934 -13.364 -32.856 112 H TYR 14 H TYR 14 5.304 -16.362 -28.616 113 HA TYR 14 HA TYR 14 4.305 -19.035 -29.509 114 HB2 TYR 14 1HB TYR 14 6.251 -18.474 -27.253 115 HB3 TYR 14 2HB TYR 14 5.640 -20.058 -27.739 116 HD1 TYR 14 HD1 TYR 14 6.521 -21.169 -29.778 117 HD2 TYR 14 HD2 TYR 14 7.948 -17.308 -28.563 118 HE1 TYR 14 HE1 TYR 14 8.447 -21.372 -31.356 119 HE2 TYR 14 HE2 TYR 14 9.881 -17.511 -30.106 120 HH TYR 14 HH TYR 14 10.354 -20.376 -32.190 121 H ASP 15 H ASP 15 3.147 -20.143 -27.734 122 HA ASP 15 HA ASP 15 1.616 -18.187 -26.081 123 HB2 ASP 15 1HB ASP 15 0.026 -20.124 -25.868 124 HB3 ASP 15 2HB ASP 15 0.227 -19.550 -27.528 125 H ASN 16 H ASN 16 1.172 -18.775 -23.866 126 HA ASN 16 HA ASN 16 2.874 -20.855 -22.635 127 HB2 ASN 16 1HB ASN 16 4.286 -18.745 -22.936 128 HB3 ASN 16 2HB ASN 16 3.172 -17.960 -21.811 129 HD21 ASN 16 1HD2 ASN 16 4.896 -19.105 -19.043 130 HD22 ASN 16 2HD2 ASN 16 3.885 -17.896 -19.814 131 H VAL 17 H VAL 17 1.963 -21.625 -20.774 132 HA VAL 17 HA VAL 17 -0.267 -20.075 -19.563 133 HB VAL 17 HB VAL 17 -0.756 -22.226 -18.380 134 HG11 VAL 17 1HG1 VAL 17 -0.787 -22.421 -21.424 135 HG12 VAL 17 2HG1 VAL 17 -1.821 -23.333 -20.303 136 HG13 VAL 17 3HG1 VAL 17 -1.985 -21.571 -20.418 137 HG21 VAL 17 1HG2 VAL 17 1.227 -23.487 -20.330 138 HG22 VAL 17 2HG2 VAL 17 1.517 -23.268 -18.580 139 HG23 VAL 17 3HG2 VAL 17 0.213 -24.333 -19.142 140 H ALA 18 H ALA 18 -0.120 -19.639 -17.306 141 HA ALA 18 HA ALA 18 2.690 -19.426 -16.432 142 HB1 ALA 18 1HB ALA 18 1.720 -17.873 -14.733 143 HB2 ALA 18 2HB ALA 18 1.337 -17.385 -16.393 144 HB3 ALA 18 3HB ALA 18 0.104 -18.182 -15.387 145 H GLU 19 H GLU 19 3.537 -20.574 -14.786 146 HA GLU 19 HA GLU 19 1.680 -22.383 -13.261 147 HB2 GLU 19 1HB GLU 19 4.708 -22.412 -13.575 148 HB3 GLU 19 2HB GLU 19 3.773 -23.516 -12.558 149 HG2 GLU 19 1HG GLU 19 2.499 -24.176 -14.656 150 HG3 GLU 19 2HG GLU 19 3.725 -23.279 -15.567 151 H SER 20 H SER 20 3.167 -19.404 -13.097 152 HA SER 20 HA SER 20 3.135 -19.431 -10.099 153 HB2 SER 20 1HB SER 20 5.454 -19.385 -10.915 154 HB3 SER 20 2HB SER 20 5.061 -18.023 -11.980 155 HG SER 20 HG SER 20 6.063 -17.465 -9.911 156 HA PRO 21 HA PRO 21 0.464 -16.010 -10.872 157 HB2 PRO 21 1HB PRO 21 0.647 -14.529 -8.598 158 HB3 PRO 21 2HB PRO 21 -0.156 -16.132 -8.625 159 HG2 PRO 21 1HG PRO 21 2.660 -15.466 -7.822 160 HG3 PRO 21 2HG PRO 21 1.417 -16.382 -6.910 161 HD2 PRO 21 1HD PRO 21 3.281 -17.651 -8.369 162 HD3 PRO 21 2HD PRO 21 1.587 -18.247 -8.323 163 H ASP 22 H ASP 22 3.845 -15.606 -10.137 164 HA ASP 22 HA ASP 22 3.967 -12.746 -10.744 165 HB2 ASP 22 1HB ASP 22 6.116 -14.895 -10.537 166 HB3 ASP 22 2HB ASP 22 6.411 -13.149 -10.606 167 H GLU 23 H GLU 23 3.819 -15.665 -12.530 168 HA GLU 23 HA GLU 23 5.301 -14.629 -14.863 169 HB2 GLU 23 1HB GLU 23 5.481 -16.994 -13.996 170 HB3 GLU 23 2HB GLU 23 3.789 -17.221 -14.438 171 HG2 GLU 23 1HG GLU 23 4.376 -16.703 -16.792 172 HG3 GLU 23 2HG GLU 23 6.067 -16.563 -16.290 173 H LEU 24 H LEU 24 4.237 -14.001 -16.785 174 HA LEU 24 HA LEU 24 1.311 -13.640 -16.479 175 HB2 LEU 24 1HB LEU 24 3.382 -12.179 -17.767 176 HB3 LEU 24 2HB LEU 24 2.313 -12.781 -19.034 177 HG LEU 24 HG LEU 24 1.460 -11.134 -16.632 178 HD11 LEU 24 1HD1 LEU 24 2.801 -9.930 -18.314 179 HD12 LEU 24 2HD1 LEU 24 1.133 -9.336 -18.213 180 HD13 LEU 24 3HD1 LEU 24 1.625 -10.393 -19.562 181 HD21 LEU 24 1HD2 LEU 24 -0.400 -12.556 -17.300 182 HD22 LEU 24 2HD2 LEU 24 -0.156 -12.130 -19.002 183 HD23 LEU 24 3HD2 LEU 24 -0.712 -10.901 -17.842 184 H SER 25 H SER 25 -0.162 -14.856 -17.512 185 HA SER 25 HA SER 25 0.732 -16.990 -19.354 186 HB2 SER 25 1HB SER 25 -1.736 -17.499 -19.387 187 HB3 SER 25 2HB SER 25 -1.048 -17.531 -17.750 188 HG SER 25 HG SER 25 -2.207 -15.185 -18.830 189 H PHE 26 H PHE 26 0.580 -16.754 -21.575 190 HA PHE 26 HA PHE 26 -1.039 -14.552 -22.701 191 HB2 PHE 26 1HB PHE 26 0.878 -13.616 -23.958 192 HB3 PHE 26 2HB PHE 26 1.033 -13.374 -22.219 193 HD1 PHE 26 HD1 PHE 26 2.776 -14.405 -20.935 194 HD2 PHE 26 HD2 PHE 26 2.383 -15.244 -25.132 195 HE1 PHE 26 HE1 PHE 26 5.022 -15.455 -20.923 196 HE2 PHE 26 HE2 PHE 26 4.668 -16.268 -25.147 197 HZ PHE 26 HZ PHE 26 5.983 -16.377 -23.039 198 H ARG 27 H ARG 27 -0.917 -14.651 -25.168 199 HA ARG 27 HA ARG 27 -0.352 -17.471 -25.986 200 HB2 ARG 27 1HB ARG 27 -2.742 -15.789 -26.784 201 HB3 ARG 27 2HB ARG 27 -2.345 -17.393 -27.413 202 HG2 ARG 27 1HG ARG 27 -2.488 -18.258 -25.036 203 HG3 ARG 27 2HG ARG 27 -3.161 -16.680 -24.578 204 HD2 ARG 27 1HD ARG 27 -4.286 -18.524 -26.707 205 HD3 ARG 27 2HD ARG 27 -4.892 -18.396 -25.043 206 HE ARG 27 HE ARG 27 -4.863 -15.791 -26.113 207 HH11 ARG 27 1HH1 ARG 27 -6.592 -18.809 -26.729 208 HH12 ARG 27 2HH1 ARG 27 -7.995 -17.984 -27.352 209 HH21 ARG 27 1HH2 ARG 27 -6.680 -14.811 -26.929 210 HH22 ARG 27 2HH2 ARG 27 -8.046 -15.763 -27.450 211 H LYS 28 H LYS 28 0.192 -17.797 -28.128 212 HA LYS 28 HA LYS 28 1.831 -15.785 -29.289 213 HB2 LYS 28 1HB LYS 28 2.051 -17.233 -31.182 214 HB3 LYS 28 2HB LYS 28 2.027 -18.223 -29.729 215 HG2 LYS 28 1HG LYS 28 -0.561 -18.425 -30.313 216 HG3 LYS 28 2HG LYS 28 0.031 -18.071 -31.944 217 HD2 LYS 28 1HD LYS 28 0.979 -20.296 -30.105 218 HD3 LYS 28 2HD LYS 28 -0.082 -20.503 -31.504 219 HE2 LYS 28 1HE LYS 28 1.733 -19.795 -33.014 220 HE3 LYS 28 2HE LYS 28 2.802 -19.492 -31.623 221 HZ1 LYS 28 1HZ LYS 28 3.237 -21.662 -32.545 222 HZ2 LYS 28 2HZ LYS 28 1.657 -22.117 -32.372 223 HZ3 LYS 28 3HZ LYS 28 2.594 -21.836 -31.039 224 H GLY 29 H GLY 29 1.516 -14.267 -30.790 225 HA2 GLY 29 1HA GLY 29 0.353 -13.064 -32.431 226 HA3 GLY 29 2HA GLY 29 -1.094 -14.032 -32.140 227 H ASP 30 H ASP 30 -0.496 -13.372 -29.095 228 HA ASP 30 HA ASP 30 -2.329 -11.116 -29.026 229 HB2 ASP 30 1HB ASP 30 -1.935 -13.186 -27.381 230 HB3 ASP 30 2HB ASP 30 -0.820 -12.054 -26.603 231 H ILE 31 H ILE 31 -1.873 -9.141 -27.772 232 HA ILE 31 HA ILE 31 0.930 -8.184 -28.278 233 HB ILE 31 HB ILE 31 -1.656 -6.542 -28.247 234 HG12 ILE 31 1HG1 ILE 31 -1.681 -8.077 -30.157 235 HG13 ILE 31 2HG1 ILE 31 -1.531 -6.395 -30.661 236 HG21 ILE 31 1HG2 ILE 31 1.228 -5.819 -28.966 237 HG22 ILE 31 2HG2 ILE 31 -0.168 -4.783 -29.350 238 HG23 ILE 31 3HG2 ILE 31 0.231 -5.141 -27.659 239 HD11 ILE 31 1HD1 ILE 31 0.835 -6.696 -31.151 240 HD12 ILE 31 2HD1 ILE 31 0.773 -8.360 -30.521 241 HD13 ILE 31 3HD1 ILE 31 -0.125 -7.938 -31.992 242 H MET 32 H MET 32 2.027 -7.405 -26.548 243 HA MET 32 HA MET 32 0.457 -6.474 -24.197 244 HB2 MET 32 1HB MET 32 2.024 -7.628 -22.674 245 HB3 MET 32 2HB MET 32 1.013 -8.727 -23.596 246 HG2 MET 32 1HG MET 32 3.915 -8.082 -24.278 247 HG3 MET 32 2HG MET 32 3.391 -9.455 -23.305 248 HE1 MET 32 1HE MET 32 1.469 -11.685 -25.922 249 HE2 MET 32 2HE MET 32 1.928 -11.487 -24.221 250 HE3 MET 32 3HE MET 32 0.696 -10.425 -24.949 251 H THR 33 H THR 33 1.434 -4.903 -22.936 252 HA THR 33 HA THR 33 3.533 -3.398 -24.370 253 HB THR 33 HB THR 33 2.152 -2.743 -21.721 254 HG1 THR 33 HG1 THR 33 0.854 -1.399 -23.093 255 HG21 THR 33 1HG2 THR 33 4.223 -1.447 -22.115 256 HG22 THR 33 2HG2 THR 33 2.788 -0.411 -22.278 257 HG23 THR 33 3HG2 THR 33 3.635 -0.996 -23.731 258 H VAL 34 H VAL 34 5.644 -3.392 -23.817 259 HA VAL 34 HA VAL 34 6.477 -5.058 -21.481 260 HB VAL 34 HB VAL 34 8.089 -3.728 -23.710 261 HG11 VAL 34 1HG1 VAL 34 9.469 -3.717 -21.724 262 HG12 VAL 34 2HG1 VAL 34 9.001 -5.391 -21.326 263 HG13 VAL 34 3HG1 VAL 34 10.021 -5.054 -22.746 264 HG21 VAL 34 1HG2 VAL 34 6.766 -5.784 -24.349 265 HG22 VAL 34 2HG2 VAL 34 8.524 -5.990 -24.503 266 HG23 VAL 34 3HG2 VAL 34 7.671 -6.693 -23.106 267 H LEU 35 H LEU 35 6.639 -4.098 -19.607 268 HA LEU 35 HA LEU 35 6.631 -1.145 -19.478 269 HB2 LEU 35 1HB LEU 35 6.400 -3.297 -17.351 270 HB3 LEU 35 2HB LEU 35 6.245 -1.568 -17.064 271 HG LEU 35 HG LEU 35 4.371 -3.222 -18.784 272 HD11 LEU 35 1HD1 LEU 35 2.817 -2.898 -16.873 273 HD12 LEU 35 2HD1 LEU 35 4.137 -2.142 -15.953 274 HD13 LEU 35 3HD1 LEU 35 4.246 -3.856 -16.441 275 HD21 LEU 35 1HD2 LEU 35 2.900 -1.207 -18.642 276 HD22 LEU 35 2HD2 LEU 35 4.411 -0.865 -19.500 277 HD23 LEU 35 3HD2 LEU 35 4.210 -0.329 -17.817 278 H GLU 36 H GLU 36 8.628 -3.924 -18.564 279 HA GLU 36 HA GLU 36 10.939 -2.125 -18.141 280 HB2 GLU 36 1HB GLU 36 9.753 -2.423 -15.923 281 HB3 GLU 36 2HB GLU 36 10.027 -4.159 -16.056 282 HG2 GLU 36 1HG GLU 36 11.656 -3.024 -14.579 283 HG3 GLU 36 2HG GLU 36 12.424 -3.842 -15.948 284 H ARG 37 H ARG 37 12.989 -3.382 -18.217 285 HA ARG 37 HA ARG 37 12.583 -6.130 -19.381 286 HB2 ARG 37 1HB ARG 37 14.503 -3.962 -20.300 287 HB3 ARG 37 2HB ARG 37 14.620 -5.665 -20.772 288 HG2 ARG 37 1HG ARG 37 12.272 -5.475 -21.670 289 HG3 ARG 37 2HG ARG 37 12.390 -3.723 -21.435 290 HD2 ARG 37 1HD ARG 37 14.581 -5.131 -22.942 291 HD3 ARG 37 2HD ARG 37 13.018 -4.904 -23.745 292 HE ARG 37 HE ARG 37 13.335 -2.595 -23.792 293 HH11 ARG 37 1HH1 ARG 37 16.059 -4.069 -22.062 294 HH12 ARG 37 2HH1 ARG 37 17.027 -2.626 -22.205 295 HH21 ARG 37 1HH2 ARG 37 14.631 -0.816 -23.929 296 HH22 ARG 37 2HH2 ARG 37 16.232 -0.834 -23.239 297 H ASP 38 H ASP 38 14.114 -7.636 -18.870 298 HA ASP 38 HA ASP 38 15.539 -8.764 -17.512 299 HB2 ASP 38 1HB ASP 38 17.088 -6.169 -17.427 300 HB3 ASP 38 2HB ASP 38 17.727 -7.813 -17.252 301 H THR 39 H THR 39 13.297 -7.749 -16.500 302 HA THR 39 HA THR 39 13.501 -5.914 -14.368 303 HB THR 39 HB THR 39 11.477 -6.400 -15.788 304 HG1 THR 39 HG1 THR 39 11.432 -6.348 -12.975 305 HG21 THR 39 1HG2 THR 39 11.119 -8.832 -13.966 306 HG22 THR 39 2HG2 THR 39 11.625 -8.920 -15.667 307 HG23 THR 39 3HG2 THR 39 10.026 -8.291 -15.248 308 H GLN 40 H GLN 40 14.242 -9.240 -14.261 309 HA GLN 40 HA GLN 40 13.736 -9.282 -11.300 310 HB2 GLN 40 1HB GLN 40 12.838 -11.028 -13.308 311 HB3 GLN 40 2HB GLN 40 14.194 -11.881 -12.572 312 HG2 GLN 40 1HG GLN 40 11.786 -10.770 -11.086 313 HG3 GLN 40 2HG GLN 40 12.037 -12.463 -11.528 314 HE21 GLN 40 1HE2 GLN 40 14.346 -13.130 -8.940 315 HE22 GLN 40 2HE2 GLN 40 13.773 -13.635 -10.511 316 H GLY 41 H GLY 41 16.101 -8.499 -13.288 317 HA2 GLY 41 1HA GLY 41 18.421 -8.533 -12.981 318 HA3 GLY 41 2HA GLY 41 18.220 -9.651 -11.617 319 H LEU 42 H LEU 42 16.332 -10.931 -13.869 320 HA LEU 42 HA LEU 42 18.385 -12.827 -14.823 321 HB2 LEU 42 1HB LEU 42 15.346 -12.823 -15.067 322 HB3 LEU 42 2HB LEU 42 16.407 -14.111 -15.625 323 HG LEU 42 HG LEU 42 16.046 -13.293 -12.721 324 HD11 LEU 42 1HD1 LEU 42 14.921 -15.648 -14.291 325 HD12 LEU 42 2HD1 LEU 42 13.994 -14.245 -13.697 326 HD13 LEU 42 3HD1 LEU 42 14.739 -15.375 -12.545 327 HD21 LEU 42 1HD2 LEU 42 18.235 -14.314 -13.084 328 HD22 LEU 42 2HD2 LEU 42 17.497 -15.654 -13.993 329 HD23 LEU 42 3HD2 LEU 42 17.179 -15.461 -12.252 330 H ASP 43 H ASP 43 19.320 -12.377 -16.687 331 HA ASP 43 HA ASP 43 18.515 -10.261 -18.394 332 HB2 ASP 43 1HB ASP 43 20.822 -11.341 -18.108 333 HB3 ASP 43 2HB ASP 43 20.245 -12.638 -19.169 334 H GLY 44 H GLY 44 17.213 -10.155 -20.122 335 HA2 GLY 44 1HA GLY 44 16.010 -10.963 -21.945 336 HA3 GLY 44 2HA GLY 44 16.372 -12.624 -21.483 337 H TRP 45 H TRP 45 15.150 -11.190 -18.703 338 HA TRP 45 HA TRP 45 12.405 -12.199 -19.393 339 HB2 TRP 45 1HB TRP 45 13.918 -11.919 -16.802 340 HB3 TRP 45 2HB TRP 45 12.151 -12.024 -16.829 341 HD1 TRP 45 HD1 TRP 45 15.260 -14.148 -17.562 342 HE1 TRP 45 HE1 TRP 45 14.620 -16.599 -17.741 343 HE3 TRP 45 HE3 TRP 45 10.187 -13.553 -17.464 344 HZ2 TRP 45 HZ2 TRP 45 12.202 -18.134 -17.824 345 HZ3 TRP 45 HZ3 TRP 45 8.731 -15.585 -17.593 346 HH2 TRP 45 HH2 TRP 45 9.747 -17.850 -17.772 347 H TRP 46 H TRP 46 10.907 -10.714 -19.886 348 HA TRP 46 HA TRP 46 11.405 -7.930 -18.926 349 HB2 TRP 46 1HB TRP 46 9.795 -8.968 -21.276 350 HB3 TRP 46 2HB TRP 46 10.047 -7.268 -20.857 351 HD1 TRP 46 HD1 TRP 46 13.346 -8.485 -20.234 352 HE1 TRP 46 HE1 TRP 46 14.936 -8.365 -22.205 353 HE3 TRP 46 HE3 TRP 46 9.825 -7.937 -23.895 354 HZ2 TRP 46 HZ2 TRP 46 14.702 -8.104 -25.052 355 HZ3 TRP 46 HZ3 TRP 46 10.580 -7.790 -26.279 356 HH2 TRP 46 HH2 TRP 46 13.016 -7.857 -26.834 357 H LEU 47 H LEU 47 9.782 -6.709 -18.012 358 HA LEU 47 HA LEU 47 7.525 -8.256 -16.870 359 HB2 LEU 47 1HB LEU 47 8.790 -6.549 -15.511 360 HB3 LEU 47 2HB LEU 47 8.264 -5.315 -16.641 361 HG LEU 47 HG LEU 47 5.881 -5.821 -15.996 362 HD11 LEU 47 1HD1 LEU 47 7.244 -7.475 -13.825 363 HD12 LEU 47 2HD1 LEU 47 6.170 -8.090 -15.106 364 HD13 LEU 47 3HD1 LEU 47 5.525 -7.022 -13.850 365 HD21 LEU 47 1HD2 LEU 47 7.786 -4.974 -13.772 366 HD22 LEU 47 2HD2 LEU 47 6.045 -4.612 -13.852 367 HD23 LEU 47 3HD2 LEU 47 7.145 -3.926 -15.060 368 H CYS 48 H CYS 48 5.661 -8.406 -18.009 369 HA CYS 48 HA CYS 48 5.078 -6.188 -19.936 370 HB2 CYS 48 1HB CYS 48 4.337 -9.122 -20.133 371 HB3 CYS 48 2HB CYS 48 3.919 -7.859 -21.302 372 HG CYS 48 HG CYS 48 6.910 -8.881 -20.374 373 H SER 49 H SER 49 2.731 -5.906 -20.350 374 HA SER 49 HA SER 49 1.076 -6.698 -17.994 375 HB2 SER 49 1HB SER 49 -0.172 -4.563 -18.350 376 HB3 SER 49 2HB SER 49 1.509 -4.337 -17.821 377 HG SER 49 HG SER 49 0.964 -2.953 -19.545 378 H LEU 50 H LEU 50 -0.755 -7.716 -18.407 379 HA LEU 50 HA LEU 50 -2.174 -7.460 -20.961 380 HB2 LEU 50 1HB LEU 50 -0.278 -9.100 -21.430 381 HB3 LEU 50 2HB LEU 50 -0.953 -10.134 -20.185 382 HG LEU 50 HG LEU 50 -3.043 -10.344 -21.545 383 HD11 LEU 50 1HD1 LEU 50 -1.394 -8.832 -23.612 384 HD12 LEU 50 2HD1 LEU 50 -2.922 -8.303 -22.882 385 HD13 LEU 50 3HD1 LEU 50 -2.904 -9.711 -23.963 386 HD21 LEU 50 1HD2 LEU 50 -2.050 -11.852 -23.224 387 HD22 LEU 50 2HD2 LEU 50 -1.286 -12.043 -21.627 388 HD23 LEU 50 3HD2 LEU 50 -0.446 -11.135 -22.905 389 H HIS 51 H HIS 51 -4.308 -8.326 -20.726 390 HA HIS 51 HA HIS 51 -6.208 -8.944 -19.610 391 HB2 HIS 51 1HB HIS 51 -4.570 -11.030 -19.452 392 HB3 HIS 51 2HB HIS 51 -4.651 -10.686 -17.725 393 HD1 HIS 51 HD1 HIS 51 -7.386 -10.382 -16.909 394 HD2 HIS 51 HD2 HIS 51 -6.477 -12.754 -20.214 395 HE1 HIS 51 HE1 HIS 51 -9.361 -11.942 -17.277 396 H GLY 52 H GLY 52 -4.533 -6.668 -18.441 397 HA2 GLY 52 1HA GLY 52 -4.998 -5.157 -16.737 398 HA3 GLY 52 2HA GLY 52 -6.218 -6.273 -16.107 399 H ARG 53 H ARG 53 -3.128 -7.676 -16.633 400 HA ARG 53 HA ARG 53 -2.332 -7.281 -13.783 401 HB2 ARG 53 1HB ARG 53 -2.251 -9.855 -15.419 402 HB3 ARG 53 2HB ARG 53 -1.553 -9.640 -13.815 403 HG2 ARG 53 1HG ARG 53 -3.852 -9.179 -12.941 404 HG3 ARG 53 2HG ARG 53 -4.496 -9.546 -14.551 405 HD2 ARG 53 1HD ARG 53 -4.649 -11.545 -13.171 406 HD3 ARG 53 2HD ARG 53 -3.428 -11.792 -14.438 407 HE ARG 53 HE ARG 53 -2.208 -10.771 -12.046 408 HH11 ARG 53 1HH1 ARG 53 -3.489 -13.781 -13.377 409 HH12 ARG 53 2HH1 ARG 53 -2.434 -14.765 -12.395 410 HH21 ARG 53 1HH2 ARG 53 -0.906 -12.087 -10.845 411 HH22 ARG 53 2HH2 ARG 53 -0.997 -13.810 -10.990 412 H GLN 54 H GLN 54 -0.002 -7.786 -13.489 413 HA GLN 54 HA GLN 54 1.565 -7.430 -16.008 414 HB2 GLN 54 1HB GLN 54 2.335 -6.520 -13.210 415 HB3 GLN 54 2HB GLN 54 3.310 -6.371 -14.673 416 HG2 GLN 54 1HG GLN 54 2.470 -4.238 -14.441 417 HG3 GLN 54 2HG GLN 54 1.337 -4.953 -15.596 418 HE21 GLN 54 1HE2 GLN 54 0.138 -4.047 -11.767 419 HE22 GLN 54 2HE2 GLN 54 1.828 -4.282 -12.131 420 H GLY 55 H GLY 55 3.506 -8.724 -16.072 421 HA2 GLY 55 1HA GLY 55 4.232 -10.450 -13.891 422 HA3 GLY 55 2HA GLY 55 3.258 -11.348 -15.079 423 H ILE 56 H ILE 56 5.904 -12.062 -14.582 424 HA ILE 56 HA ILE 56 7.618 -10.701 -16.530 425 HB ILE 56 HB ILE 56 9.363 -12.263 -15.871 426 HG12 ILE 56 1HG1 ILE 56 7.275 -13.703 -14.190 427 HG13 ILE 56 2HG1 ILE 56 7.907 -14.311 -15.716 428 HG21 ILE 56 1HG2 ILE 56 7.828 -11.445 -13.359 429 HG22 ILE 56 2HG2 ILE 56 9.587 -11.604 -13.550 430 HG23 ILE 56 3HG2 ILE 56 8.724 -10.297 -14.382 431 HD11 ILE 56 1HD1 ILE 56 10.213 -14.344 -14.694 432 HD12 ILE 56 2HD1 ILE 56 9.459 -13.923 -13.133 433 HD13 ILE 56 3HD1 ILE 56 9.039 -15.447 -13.942 434 H VAL 57 H VAL 57 8.395 -11.468 -18.441 435 HA VAL 57 HA VAL 57 7.146 -13.925 -19.591 436 HB VAL 57 HB VAL 57 7.190 -11.110 -20.825 437 HG11 VAL 57 1HG1 VAL 57 6.488 -13.782 -22.053 438 HG12 VAL 57 2HG1 VAL 57 5.967 -12.230 -22.735 439 HG13 VAL 57 3HG1 VAL 57 7.690 -12.596 -22.596 440 HG21 VAL 57 1HG2 VAL 57 5.325 -11.356 -19.285 441 HG22 VAL 57 2HG2 VAL 57 4.702 -11.421 -20.949 442 HG23 VAL 57 3HG2 VAL 57 4.878 -12.924 -20.008 443 HA PRO 58 HA PRO 58 11.436 -13.938 -20.817 444 HB2 PRO 58 1HB PRO 58 11.517 -16.025 -22.578 445 HB3 PRO 58 2HB PRO 58 11.403 -16.262 -20.805 446 HG2 PRO 58 1HG PRO 58 9.208 -16.302 -22.857 447 HG3 PRO 58 2HG PRO 58 9.539 -17.469 -21.545 448 HD2 PRO 58 1HD PRO 58 7.674 -15.515 -21.332 449 HD3 PRO 58 2HD PRO 58 8.634 -16.077 -19.927 450 H GLY 59 H GLY 59 12.163 -12.371 -22.116 451 HA2 GLY 59 1HA GLY 59 10.636 -11.183 -24.161 452 HA3 GLY 59 2HA GLY 59 12.362 -10.942 -23.882 453 H ASN 60 H ASN 60 12.886 -13.872 -24.382 454 HA ASN 60 HA ASN 60 13.385 -13.676 -27.200 455 HB2 ASN 60 1HB ASN 60 13.520 -15.933 -25.191 456 HB3 ASN 60 2HB ASN 60 13.790 -16.226 -26.914 457 HD21 ASN 60 1HD2 ASN 60 16.839 -14.992 -24.763 458 HD22 ASN 60 2HD2 ASN 60 15.417 -15.798 -24.153 459 H ARG 61 H ARG 61 10.511 -14.626 -25.459 460 HA ARG 61 HA ARG 61 9.462 -16.057 -27.850 461 HB2 ARG 61 1HB ARG 61 8.251 -15.542 -25.116 462 HB3 ARG 61 2HB ARG 61 7.422 -16.374 -26.433 463 HG2 ARG 61 1HG ARG 61 9.315 -18.060 -26.427 464 HG3 ARG 61 2HG ARG 61 9.880 -17.307 -24.921 465 HD2 ARG 61 1HD ARG 61 7.614 -17.709 -23.931 466 HD3 ARG 61 2HD ARG 61 7.135 -18.531 -25.420 467 HE ARG 61 HE ARG 61 9.510 -19.710 -24.309 468 HH11 ARG 61 1HH1 ARG 61 6.002 -19.651 -23.914 469 HH12 ARG 61 2HH1 ARG 61 5.969 -21.171 -23.071 470 HH21 ARG 61 1HH2 ARG 61 9.384 -21.687 -23.260 471 HH22 ARG 61 2HH2 ARG 61 7.839 -22.305 -22.742 472 H LEU 62 H LEU 62 9.983 -12.936 -27.260 473 HA LEU 62 HA LEU 62 7.308 -12.058 -28.293 474 HB2 LEU 62 1HB LEU 62 9.297 -10.536 -26.570 475 HB3 LEU 62 2HB LEU 62 7.787 -9.908 -27.189 476 HG LEU 62 HG LEU 62 8.042 -12.078 -25.096 477 HD11 LEU 62 1HD1 LEU 62 8.756 -9.880 -24.298 478 HD12 LEU 62 2HD1 LEU 62 7.181 -10.275 -23.596 479 HD13 LEU 62 3HD1 LEU 62 7.278 -9.127 -24.942 480 HD21 LEU 62 1HD2 LEU 62 5.568 -11.562 -24.809 481 HD22 LEU 62 2HD2 LEU 62 6.005 -12.456 -26.271 482 HD23 LEU 62 3HD2 LEU 62 5.646 -10.713 -26.359 483 H LYS 63 H LYS 63 7.328 -10.288 -29.784 484 HA LYS 63 HA LYS 63 10.037 -9.468 -30.735 485 HB2 LYS 63 1HB LYS 63 9.018 -11.109 -32.330 486 HB3 LYS 63 2HB LYS 63 7.690 -9.965 -32.593 487 HG2 LYS 63 1HG LYS 63 9.222 -8.320 -33.500 488 HG3 LYS 63 2HG LYS 63 10.619 -9.317 -33.050 489 HD2 LYS 63 1HD LYS 63 9.831 -11.093 -34.595 490 HD3 LYS 63 2HD LYS 63 8.505 -10.023 -35.113 491 HE2 LYS 63 1HE LYS 63 10.133 -8.335 -35.870 492 HE3 LYS 63 2HE LYS 63 11.467 -9.353 -35.303 493 HZ1 LYS 63 1HZ LYS 63 11.112 -9.590 -37.680 494 HZ2 LYS 63 2HZ LYS 63 9.566 -10.123 -37.440 495 HZ3 LYS 63 3HZ LYS 63 10.843 -11.024 -36.915 496 H ILE 64 H ILE 64 10.282 -7.383 -30.468 497 HA ILE 64 HA ILE 64 8.223 -5.624 -29.583 498 HB ILE 64 HB ILE 64 10.971 -5.044 -30.802 499 HG12 ILE 64 1HG1 ILE 64 10.944 -6.376 -28.670 500 HG13 ILE 64 2HG1 ILE 64 11.798 -4.842 -28.576 501 HG21 ILE 64 1HG2 ILE 64 9.017 -3.137 -29.416 502 HG22 ILE 64 2HG2 ILE 64 10.749 -2.786 -29.610 503 HG23 ILE 64 3HG2 ILE 64 9.721 -2.992 -31.038 504 HD11 ILE 64 1HD1 ILE 64 8.948 -5.226 -27.529 505 HD12 ILE 64 2HD1 ILE 64 10.414 -5.357 -26.528 506 HD13 ILE 64 3HD1 ILE 64 9.995 -3.808 -27.288 507 H LEU 65 H LEU 65 6.894 -4.248 -30.562 508 HA LEU 65 HA LEU 65 6.876 -4.201 -33.546 509 HB2 LEU 65 1HB LEU 65 4.777 -4.860 -32.353 510 HB3 LEU 65 2HB LEU 65 4.807 -3.319 -31.498 511 HG LEU 65 HG LEU 65 4.539 -2.128 -33.668 512 HD11 LEU 65 1HD1 LEU 65 4.229 -4.950 -34.789 513 HD12 LEU 65 2HD1 LEU 65 5.473 -3.747 -35.238 514 HD13 LEU 65 3HD1 LEU 65 3.771 -3.454 -35.648 515 HD21 LEU 65 1HD2 LEU 65 2.170 -2.748 -33.982 516 HD22 LEU 65 2HD2 LEU 65 2.605 -2.643 -32.264 517 HD23 LEU 65 3HD2 LEU 65 2.433 -4.238 -33.036 518 H VAL 66 H VAL 66 7.667 -2.384 -34.490 519 HA VAL 66 HA VAL 66 7.743 0.139 -32.941 520 HB VAL 66 HB VAL 66 9.890 -1.056 -32.466 521 HG11 VAL 66 1HG1 VAL 66 10.082 -2.427 -34.480 522 HG12 VAL 66 2HG1 VAL 66 10.357 -0.977 -35.476 523 HG13 VAL 66 3HG1 VAL 66 11.547 -1.464 -34.248 524 HG21 VAL 66 1HG2 VAL 66 9.891 1.412 -32.572 525 HG22 VAL 66 2HG2 VAL 66 11.451 0.721 -33.052 526 HG23 VAL 66 3HG2 VAL 66 10.342 1.336 -34.291 527 H GLY 67 H GLY 67 7.767 2.009 -34.271 528 HA2 GLY 67 1HA GLY 67 8.046 1.709 -37.149 529 HA3 GLY 67 2HA GLY 67 6.368 1.923 -36.634 530 H MET 68 H MET 68 9.491 3.392 -37.061 531 HA MET 68 HA MET 68 10.227 5.541 -37.067 532 HB2 MET 68 1HB MET 68 8.473 5.345 -38.930 533 HB3 MET 68 2HB MET 68 7.432 6.330 -37.899 534 HG2 MET 68 1HG MET 68 9.269 8.057 -37.823 535 HG3 MET 68 2HG MET 68 10.166 7.085 -38.996 536 HE1 MET 68 1HE MET 68 7.981 7.407 -42.246 537 HE2 MET 68 2HE MET 68 9.513 6.824 -41.554 538 HE3 MET 68 3HE MET 68 7.974 6.057 -41.097 539 H TYR 69 H TYR 69 10.266 5.381 -34.579 540 HA TYR 69 HA TYR 69 8.517 7.504 -33.429 541 HB2 TYR 69 1HB TYR 69 10.271 5.461 -32.012 542 HB3 TYR 69 2HB TYR 69 9.165 6.619 -31.249 543 HD1 TYR 69 HD1 TYR 69 9.337 3.365 -31.322 544 HD2 TYR 69 HD2 TYR 69 6.751 6.314 -33.114 545 HE1 TYR 69 HE1 TYR 69 7.484 1.680 -31.482 546 HE2 TYR 69 HE2 TYR 69 4.943 4.625 -33.282 547 HH TYR 69 HH TYR 69 4.300 2.485 -32.864 548 H ASP 70 H ASP 70 9.510 9.131 -32.125 549 HA ASP 70 HA ASP 70 10.977 10.847 -31.861 550 HB2 ASP 70 1HB ASP 70 12.872 8.497 -31.538 551 HB3 ASP 70 2HB ASP 70 13.256 10.169 -31.089 552 H LYS 71 H LYS 71 10.528 10.476 -34.618 553 HA LYS 71 HA LYS 71 13.177 10.793 -35.896 554 HB2 LYS 71 1HB LYS 71 11.339 9.513 -37.008 555 HB3 LYS 71 2HB LYS 71 10.397 11.014 -37.119 556 HG2 LYS 71 1HG LYS 71 12.240 12.025 -38.469 557 HG3 LYS 71 2HG LYS 71 13.109 10.482 -38.400 558 HD2 LYS 71 1HD LYS 71 11.167 9.376 -39.500 559 HD3 LYS 71 2HD LYS 71 10.380 10.963 -39.658 560 HE2 LYS 71 1HE LYS 71 13.068 10.160 -40.858 561 HE3 LYS 71 2HE LYS 71 11.531 10.285 -41.738 562 HZ1 LYS 71 1HZ LYS 71 12.871 12.264 -42.036 563 HZ2 LYS 71 2HZ LYS 71 12.937 12.531 -40.411 564 HZ3 LYS 71 3HZ LYS 71 11.497 12.653 -41.206 565 H LYS 72 H LYS 72 14.146 12.689 -35.652 566 HA LYS 72 HA LYS 72 12.559 15.188 -36.124 567 HB2 LYS 72 1HB LYS 72 14.255 16.340 -34.670 568 HB3 LYS 72 2HB LYS 72 13.225 15.206 -33.807 569 HG2 LYS 72 1HG LYS 72 15.766 14.035 -34.760 570 HG3 LYS 72 2HG LYS 72 15.951 15.340 -33.575 571 HD2 LYS 72 1HD LYS 72 14.562 14.206 -31.977 572 HD3 LYS 72 2HD LYS 72 14.036 13.028 -33.186 573 HE2 LYS 72 1HE LYS 72 16.447 12.293 -33.387 574 HE3 LYS 72 2HE LYS 72 16.790 13.296 -31.957 575 HZ1 LYS 72 1HZ LYS 72 14.806 11.085 -32.094 576 HZ2 LYS 72 2HZ LYS 72 15.125 11.996 -30.753 577 HZ3 LYS 72 3HZ LYS 72 16.282 10.988 -31.363 578 HA PRO 73 HA PRO 73 15.706 15.846 -39.261 579 HB2 PRO 73 1HB PRO 73 16.147 18.530 -39.264 580 HB3 PRO 73 2HB PRO 73 14.586 17.851 -39.827 581 HG2 PRO 73 1HG PRO 73 15.304 18.955 -37.121 582 HG3 PRO 73 2HG PRO 73 13.931 19.396 -38.188 583 HD2 PRO 73 1HD PRO 73 13.638 17.627 -36.163 584 HD3 PRO 73 2HD PRO 73 12.781 17.397 -37.727 585 H ALA 74 H ALA 74 17.992 17.112 -39.387 586 HA ALA 74 HA ALA 74 20.141 17.183 -38.622 587 HB1 ALA 74 1HB ALA 74 18.894 17.945 -35.936 588 HB2 ALA 74 2HB ALA 74 20.569 18.235 -36.456 589 HB3 ALA 74 3HB ALA 74 19.236 19.082 -37.271 590 H GLY 75 H GLY 75 19.496 14.710 -38.944 591 HA2 GLY 75 1HA GLY 75 20.453 13.279 -36.503 592 HA3 GLY 75 2HA GLY 75 19.275 12.587 -37.632 593 H GLU 76 H GLU 76 21.321 11.016 -37.310 594 HA GLU 76 HA GLU 76 23.671 11.589 -38.842 595 HB2 GLU 76 1HB GLU 76 22.557 9.442 -37.223 596 HB3 GLU 76 2HB GLU 76 23.319 8.787 -38.680 597 HG2 GLU 76 1HG GLU 76 24.731 10.786 -36.898 598 HG3 GLU 76 2HG GLU 76 24.761 9.041 -36.576 599 H PHE 77 H PHE 77 24.470 10.277 -40.672 600 HA PHE 77 HA PHE 77 22.320 9.358 -42.534 601 HB2 PHE 77 1HB PHE 77 22.910 11.804 -42.934 602 HB3 PHE 77 2HB PHE 77 24.538 11.261 -43.370 603 HD1 PHE 77 HD1 PHE 77 24.967 10.209 -45.501 604 HD2 PHE 77 HD2 PHE 77 20.948 11.159 -44.311 605 HE1 PHE 77 HE1 PHE 77 24.184 9.781 -47.828 606 HE2 PHE 77 HE2 PHE 77 20.150 10.746 -46.641 607 HZ PHE 77 HZ PHE 77 21.776 10.054 -48.405 608 H ILE 78 H ILE 78 22.980 7.692 -43.898 609 HA ILE 78 HA ILE 78 25.536 6.421 -43.156 610 HB ILE 78 HB ILE 78 23.292 5.405 -44.977 611 HG12 ILE 78 1HG1 ILE 78 23.884 4.665 -42.078 612 HG13 ILE 78 2HG1 ILE 78 22.627 5.805 -42.561 613 HG21 ILE 78 1HG2 ILE 78 25.525 4.328 -45.393 614 HG22 ILE 78 2HG2 ILE 78 25.634 3.897 -43.668 615 HG23 ILE 78 3HG2 ILE 78 24.376 3.180 -44.700 616 HD11 ILE 78 1HD1 ILE 78 21.568 3.699 -42.133 617 HD12 ILE 78 2HD1 ILE 78 21.536 3.965 -43.892 618 HD13 ILE 78 3HD1 ILE 78 22.712 2.834 -43.183 619 H VAL 79 H VAL 79 27.322 6.521 -44.418 620 HA VAL 79 HA VAL 79 26.994 7.594 -47.185 621 HB VAL 79 HB VAL 79 29.292 8.513 -46.940 622 HG11 VAL 79 1HG1 VAL 79 28.733 10.368 -45.450 623 HG12 VAL 79 2HG1 VAL 79 27.284 9.898 -46.372 624 HG13 VAL 79 3HG1 VAL 79 27.454 9.414 -44.663 625 HG21 VAL 79 1HG2 VAL 79 29.089 7.626 -44.016 626 HG22 VAL 79 2HG2 VAL 79 30.160 6.898 -45.240 627 HG23 VAL 79 3HG2 VAL 79 30.403 8.583 -44.734 628 H THR 80 H THR 80 28.750 6.959 -48.689 629 HA THR 80 HA THR 80 29.060 4.096 -48.759 630 HB THR 80 HB THR 80 30.661 6.074 -50.424 631 HG1 THR 80 HG1 THR 80 28.770 6.144 -51.782 632 HG21 THR 80 1HG2 THR 80 29.322 3.391 -51.020 633 HG22 THR 80 2HG2 THR 80 31.071 3.694 -50.880 634 HG23 THR 80 3HG2 THR 80 30.159 4.401 -52.222 635 H ASP 81 H ASP 81 31.024 2.883 -48.644 636 HA ASP 81 HA ASP 81 33.039 3.862 -46.783 637 HB2 ASP 81 1HB ASP 81 34.064 1.655 -47.079 638 HB3 ASP 81 2HB ASP 81 32.328 1.433 -46.867 639 HXT ASP 81 H02 ASP 81 35.668 4.314 -48.902 Start of MODEL 13 1 H2 GLY 1 2H0 GLY 1 11.043 10.448 -12.115 2 H GLY 1 1H0 GLY 1 12.215 10.314 -10.977 3 HA2 GLY 1 1HA GLY 1 10.759 9.403 -9.354 4 HA3 GLY 1 2HA GLY 1 9.887 10.763 -10.099 5 H SER 2 H SER 2 10.579 7.722 -11.520 6 HA SER 2 HA SER 2 9.334 6.007 -12.415 7 HB2 SER 2 1HB SER 2 7.372 6.584 -10.167 8 HB3 SER 2 2HB SER 2 7.556 5.062 -11.068 9 HG SER 2 HG SER 2 8.686 4.950 -9.118 10 H MET 3 H MET 3 8.694 8.898 -13.115 11 HA MET 3 HA MET 3 5.871 8.913 -13.804 12 HB2 MET 3 1HB MET 3 8.159 10.698 -14.699 13 HB3 MET 3 2HB MET 3 6.437 11.033 -14.933 14 HG2 MET 3 1HG MET 3 6.094 11.215 -12.549 15 HG3 MET 3 2HG MET 3 7.768 10.733 -12.234 16 HE1 MET 3 1HE MET 3 7.839 14.517 -11.230 17 HE2 MET 3 2HE MET 3 6.490 13.383 -10.996 18 HE3 MET 3 3HE MET 3 8.156 12.844 -10.716 19 H LYS 4 H LYS 4 8.657 7.543 -15.263 20 HA LYS 4 HA LYS 4 7.192 7.167 -17.806 21 HB2 LYS 4 1HB LYS 4 10.040 8.209 -17.613 22 HB3 LYS 4 2HB LYS 4 9.250 7.677 -19.107 23 HG2 LYS 4 1HG LYS 4 7.563 9.485 -18.838 24 HG3 LYS 4 2HG LYS 4 8.398 10.031 -17.372 25 HD2 LYS 4 1HD LYS 4 10.439 10.441 -18.705 26 HD3 LYS 4 2HD LYS 4 9.546 9.977 -20.171 27 HE2 LYS 4 1HE LYS 4 7.891 11.775 -19.719 28 HE3 LYS 4 2HE LYS 4 8.820 12.256 -18.282 29 HZ1 LYS 4 1HZ LYS 4 10.685 12.758 -19.761 30 HZ2 LYS 4 2HZ LYS 4 9.358 13.648 -20.164 31 HZ3 LYS 4 3HZ LYS 4 9.791 12.348 -21.083 32 H TYR 5 H TYR 5 7.836 5.317 -18.924 33 HA TYR 5 HA TYR 5 9.839 3.495 -17.755 34 HB2 TYR 5 1HB TYR 5 8.192 1.647 -17.645 35 HB3 TYR 5 2HB TYR 5 7.815 2.918 -16.478 36 HD1 TYR 5 HD1 TYR 5 5.894 4.507 -16.932 37 HD2 TYR 5 HD2 TYR 5 6.658 1.078 -19.415 38 HE1 TYR 5 HE1 TYR 5 3.623 4.706 -17.924 39 HE2 TYR 5 HE2 TYR 5 4.388 1.279 -20.384 40 HH TYR 5 HH TYR 5 2.523 2.639 -20.587 41 H LEU 6 H LEU 6 9.603 1.432 -19.475 42 HA LEU 6 HA LEU 6 10.487 2.571 -21.891 43 HB2 LEU 6 1HB LEU 6 9.340 -0.191 -21.404 44 HB3 LEU 6 2HB LEU 6 10.260 0.283 -22.831 45 HG LEU 6 HG LEU 6 11.348 0.287 -19.997 46 HD11 LEU 6 1HD1 LEU 6 11.705 -1.678 -22.279 47 HD12 LEU 6 2HD1 LEU 6 10.746 -1.943 -20.802 48 HD13 LEU 6 3HD1 LEU 6 12.506 -1.743 -20.688 49 HD21 LEU 6 1HD2 LEU 6 13.555 0.440 -21.136 50 HD22 LEU 6 2HD2 LEU 6 12.552 1.867 -21.413 51 HD23 LEU 6 3HD2 LEU 6 12.723 0.646 -22.699 52 H ASN 7 H ASN 7 7.277 1.167 -21.248 53 HA ASN 7 HA ASN 7 5.340 1.177 -22.412 54 HB2 ASN 7 1HB ASN 7 5.734 3.624 -21.740 55 HB3 ASN 7 2HB ASN 7 6.115 3.909 -23.443 56 HD21 ASN 7 1HD2 ASN 7 2.758 4.397 -24.132 57 HD22 ASN 7 2HD2 ASN 7 4.427 4.869 -24.342 58 H VAL 8 H VAL 8 7.239 -0.229 -23.907 59 HA VAL 8 HA VAL 8 6.431 0.477 -26.707 60 HB VAL 8 HB VAL 8 8.343 -0.934 -27.421 61 HG11 VAL 8 1HG1 VAL 8 9.258 1.284 -25.541 62 HG12 VAL 8 2HG1 VAL 8 10.109 0.687 -26.984 63 HG13 VAL 8 3HG1 VAL 8 8.571 1.559 -27.156 64 HG21 VAL 8 1HG2 VAL 8 10.111 -1.575 -25.811 65 HG22 VAL 8 2HG2 VAL 8 9.085 -1.022 -24.466 66 HG23 VAL 8 3HG2 VAL 8 8.576 -2.398 -25.472 67 H LEU 9 H LEU 9 5.954 -1.649 -27.965 68 HA LEU 9 HA LEU 9 4.802 -3.651 -26.058 69 HB2 LEU 9 1HB LEU 9 2.895 -3.797 -27.769 70 HB3 LEU 9 2HB LEU 9 2.885 -2.486 -26.601 71 HG LEU 9 HG LEU 9 4.175 -1.820 -29.189 72 HD11 LEU 9 1HD1 LEU 9 1.189 -2.320 -28.995 73 HD12 LEU 9 2HD1 LEU 9 2.350 -3.212 -30.009 74 HD13 LEU 9 3HD1 LEU 9 2.020 -1.491 -30.328 75 HD21 LEU 9 1HD2 LEU 9 1.998 -0.466 -27.524 76 HD22 LEU 9 2HD2 LEU 9 3.000 0.281 -28.796 77 HD23 LEU 9 3HD2 LEU 9 3.741 -0.235 -27.259 78 H ALA 10 H ALA 10 4.438 -5.730 -26.881 79 HA ALA 10 HA ALA 10 5.953 -6.331 -29.365 80 HB1 ALA 10 1HB ALA 10 7.509 -6.420 -27.398 81 HB2 ALA 10 2HB ALA 10 6.469 -7.675 -26.683 82 HB3 ALA 10 3HB ALA 10 7.305 -7.982 -28.221 83 H LYS 11 H LYS 11 5.359 -8.154 -30.428 84 HA LYS 11 HA LYS 11 2.772 -9.345 -29.579 85 HB2 LYS 11 1HB LYS 11 3.063 -8.395 -31.866 86 HB3 LYS 11 2HB LYS 11 4.321 -9.594 -32.189 87 HG2 LYS 11 1HG LYS 11 2.722 -11.403 -32.018 88 HG3 LYS 11 2HG LYS 11 1.467 -10.286 -31.441 89 HD2 LYS 11 1HD LYS 11 1.611 -9.059 -33.598 90 HD3 LYS 11 2HD LYS 11 2.772 -10.273 -34.187 91 HE2 LYS 11 1HE LYS 11 1.098 -12.040 -33.864 92 HE3 LYS 11 2HE LYS 11 -0.051 -10.855 -33.222 93 HZ1 LYS 11 1HZ LYS 11 1.007 -10.881 -35.984 94 HZ2 LYS 11 2HZ LYS 11 -0.060 -9.772 -35.374 95 HZ3 LYS 11 3HZ LYS 11 -0.510 -11.354 -35.518 96 H ALA 12 H ALA 12 2.584 -11.402 -28.912 97 HA ALA 12 HA ALA 12 5.038 -12.863 -28.333 98 HB1 ALA 12 1HB ALA 12 3.274 -13.046 -26.745 99 HB2 ALA 12 2HB ALA 12 2.085 -13.451 -27.994 100 HB3 ALA 12 3HB ALA 12 3.354 -14.618 -27.554 101 H LEU 13 H LEU 13 5.945 -14.484 -29.390 102 HA LEU 13 HA LEU 13 4.822 -15.218 -32.047 103 HB2 LEU 13 1HB LEU 13 7.446 -15.892 -30.695 104 HB3 LEU 13 2HB LEU 13 7.033 -16.288 -32.362 105 HG LEU 13 HG LEU 13 7.298 -13.453 -31.282 106 HD11 LEU 13 1HD1 LEU 13 9.437 -14.628 -31.170 107 HD12 LEU 13 2HD1 LEU 13 9.461 -13.429 -32.473 108 HD13 LEU 13 3HD1 LEU 13 9.264 -15.155 -32.859 109 HD21 LEU 13 1HD2 LEU 13 7.065 -14.554 -34.116 110 HD22 LEU 13 2HD2 LEU 13 7.422 -12.863 -33.710 111 HD23 LEU 13 3HD2 LEU 13 5.861 -13.565 -33.262 112 H TYR 14 H TYR 14 5.268 -16.424 -28.820 113 HA TYR 14 HA TYR 14 4.168 -19.078 -29.628 114 HB2 TYR 14 1HB TYR 14 6.214 -18.613 -27.446 115 HB3 TYR 14 2HB TYR 14 5.628 -20.162 -28.057 116 HD1 TYR 14 HD1 TYR 14 6.312 -20.889 -30.414 117 HD2 TYR 14 HD2 TYR 14 8.028 -17.449 -28.501 118 HE1 TYR 14 HE1 TYR 14 8.202 -20.897 -32.059 119 HE2 TYR 14 HE2 TYR 14 9.912 -17.463 -30.131 120 HH TYR 14 HH TYR 14 10.149 -19.903 -32.724 121 H ASP 15 H ASP 15 2.924 -20.092 -27.844 122 HA ASP 15 HA ASP 15 1.653 -18.025 -26.126 123 HB2 ASP 15 1HB ASP 15 -0.042 -19.837 -25.726 124 HB3 ASP 15 2HB ASP 15 0.071 -19.291 -27.402 125 H ASN 16 H ASN 16 1.131 -18.613 -23.876 126 HA ASN 16 HA ASN 16 2.785 -20.711 -22.638 127 HB2 ASN 16 1HB ASN 16 4.164 -18.524 -22.810 128 HB3 ASN 16 2HB ASN 16 3.005 -17.855 -21.663 129 HD21 ASN 16 1HD2 ASN 16 4.699 -19.152 -18.939 130 HD22 ASN 16 2HD2 ASN 16 3.632 -17.941 -19.632 131 H VAL 17 H VAL 17 2.005 -21.255 -20.534 132 HA VAL 17 HA VAL 17 -0.328 -19.659 -19.590 133 HB VAL 17 HB VAL 17 -1.288 -21.745 -20.504 134 HG11 VAL 17 1HG1 VAL 17 -0.655 -23.978 -19.659 135 HG12 VAL 17 2HG1 VAL 17 0.735 -23.180 -20.440 136 HG13 VAL 17 3HG1 VAL 17 0.633 -23.246 -18.664 137 HG21 VAL 17 1HG2 VAL 17 -1.167 -21.879 -17.469 138 HG22 VAL 17 2HG2 VAL 17 -2.223 -20.795 -18.401 139 HG23 VAL 17 3HG2 VAL 17 -2.426 -22.562 -18.511 140 H ALA 18 H ALA 18 -0.011 -18.967 -17.581 141 HA ALA 18 HA ALA 18 2.625 -19.366 -16.469 142 HB1 ALA 18 1HB ALA 18 1.743 -17.843 -14.690 143 HB2 ALA 18 2HB ALA 18 1.535 -17.195 -16.327 144 HB3 ALA 18 3HB ALA 18 0.153 -17.907 -15.465 145 H GLU 19 H GLU 19 3.257 -20.637 -14.827 146 HA GLU 19 HA GLU 19 1.146 -22.315 -13.510 147 HB2 GLU 19 1HB GLU 19 4.162 -22.652 -13.601 148 HB3 GLU 19 2HB GLU 19 3.017 -23.751 -12.818 149 HG2 GLU 19 1HG GLU 19 1.922 -24.078 -15.075 150 HG3 GLU 19 2HG GLU 19 3.267 -23.173 -15.787 151 H SER 20 H SER 20 3.127 -19.588 -13.144 152 HA SER 20 HA SER 20 2.887 -19.727 -10.163 153 HB2 SER 20 1HB SER 20 5.064 -19.204 -10.014 154 HB3 SER 20 2HB SER 20 5.169 -19.414 -11.781 155 HG SER 20 HG SER 20 5.874 -17.365 -11.341 156 HA PRO 21 HA PRO 21 0.433 -16.136 -10.616 157 HB2 PRO 21 1HB PRO 21 0.798 -14.727 -8.321 158 HB3 PRO 21 2HB PRO 21 0.007 -16.334 -8.319 159 HG2 PRO 21 1HG PRO 21 2.882 -15.651 -7.756 160 HG3 PRO 21 2HG PRO 21 1.750 -16.610 -6.761 161 HD2 PRO 21 1HD PRO 21 3.498 -17.801 -8.434 162 HD3 PRO 21 2HD PRO 21 1.827 -18.446 -8.217 163 H ASP 22 H ASP 22 3.864 -15.700 -10.098 164 HA ASP 22 HA ASP 22 3.824 -12.814 -10.649 165 HB2 ASP 22 1HB ASP 22 6.079 -14.846 -10.362 166 HB3 ASP 22 2HB ASP 22 6.300 -13.099 -10.520 167 H GLU 23 H GLU 23 3.829 -15.745 -12.379 168 HA GLU 23 HA GLU 23 5.248 -14.718 -14.740 169 HB2 GLU 23 1HB GLU 23 5.478 -17.068 -13.856 170 HB3 GLU 23 2HB GLU 23 3.779 -17.331 -14.235 171 HG2 GLU 23 1HG GLU 23 4.278 -16.852 -16.618 172 HG3 GLU 23 2HG GLU 23 5.986 -16.688 -16.186 173 H LEU 24 H LEU 24 4.182 -14.279 -16.739 174 HA LEU 24 HA LEU 24 1.253 -13.844 -16.437 175 HB2 LEU 24 1HB LEU 24 3.407 -12.417 -17.682 176 HB3 LEU 24 2HB LEU 24 2.245 -12.882 -18.925 177 HG LEU 24 HG LEU 24 1.613 -11.296 -16.423 178 HD11 LEU 24 1HD1 LEU 24 1.769 -10.475 -19.340 179 HD12 LEU 24 2HD1 LEU 24 2.973 -10.089 -18.086 180 HD13 LEU 24 3HD1 LEU 24 1.332 -9.428 -17.974 181 HD21 LEU 24 1HD2 LEU 24 -0.152 -12.135 -18.757 182 HD22 LEU 24 2HD2 LEU 24 -0.580 -10.853 -17.595 183 HD23 LEU 24 3HD2 LEU 24 -0.369 -12.514 -17.031 184 H SER 25 H SER 25 -0.247 -14.899 -17.587 185 HA SER 25 HA SER 25 0.566 -16.965 -19.538 186 HB2 SER 25 1HB SER 25 -2.184 -15.968 -18.642 187 HB3 SER 25 2HB SER 25 -1.884 -17.339 -19.728 188 HG SER 25 HG SER 25 -2.231 -17.761 -17.377 189 H PHE 26 H PHE 26 0.354 -16.644 -21.774 190 HA PHE 26 HA PHE 26 -1.141 -14.359 -22.837 191 HB2 PHE 26 1HB PHE 26 0.813 -13.419 -24.048 192 HB3 PHE 26 2HB PHE 26 0.919 -13.186 -22.293 193 HD1 PHE 26 HD1 PHE 26 2.616 -14.302 -20.961 194 HD2 PHE 26 HD2 PHE 26 2.333 -15.016 -25.205 195 HE1 PHE 26 HE1 PHE 26 4.842 -15.380 -20.915 196 HE2 PHE 26 HE2 PHE 26 4.596 -16.076 -25.174 197 HZ PHE 26 HZ PHE 26 5.860 -16.250 -23.028 198 H ARG 27 H ARG 27 -1.023 -14.512 -25.325 199 HA ARG 27 HA ARG 27 -0.479 -17.369 -26.015 200 HB2 ARG 27 1HB ARG 27 -2.797 -15.698 -27.016 201 HB3 ARG 27 2HB ARG 27 -2.469 -17.402 -27.381 202 HG2 ARG 27 1HG ARG 27 -2.576 -17.707 -24.777 203 HG3 ARG 27 2HG ARG 27 -3.423 -16.147 -24.815 204 HD2 ARG 27 1HD ARG 27 -4.962 -17.161 -26.541 205 HD3 ARG 27 2HD ARG 27 -4.206 -18.730 -26.190 206 HE ARG 27 HE ARG 27 -6.084 -17.210 -24.521 207 HH11 ARG 27 1HH1 ARG 27 -3.702 -19.825 -24.484 208 HH12 ARG 27 2HH1 ARG 27 -4.374 -20.536 -23.041 209 HH21 ARG 27 1HH2 ARG 27 -6.876 -18.169 -22.690 210 HH22 ARG 27 2HH2 ARG 27 -6.145 -19.614 -22.048 211 H LYS 28 H LYS 28 0.074 -17.867 -28.147 212 HA LYS 28 HA LYS 28 1.762 -15.988 -29.467 213 HB2 LYS 28 1HB LYS 28 1.684 -17.565 -31.384 214 HB3 LYS 28 2HB LYS 28 1.996 -18.367 -29.855 215 HG2 LYS 28 1HG LYS 28 -0.393 -19.051 -29.730 216 HG3 LYS 28 2HG LYS 28 -0.622 -18.395 -31.359 217 HD2 LYS 28 1HD LYS 28 1.071 -19.962 -32.218 218 HD3 LYS 28 2HD LYS 28 1.403 -20.523 -30.570 219 HE2 LYS 28 1HE LYS 28 -1.041 -21.205 -30.405 220 HE3 LYS 28 2HE LYS 28 -1.162 -20.909 -32.157 221 HZ1 LYS 28 1HZ LYS 28 0.653 -22.538 -32.425 222 HZ2 LYS 28 2HZ LYS 28 -0.659 -23.220 -31.707 223 HZ3 LYS 28 3HZ LYS 28 0.660 -22.822 -30.794 224 H GLY 29 H GLY 29 1.376 -14.408 -30.886 225 HA2 GLY 29 1HA GLY 29 0.136 -13.289 -32.545 226 HA3 GLY 29 2HA GLY 29 -1.303 -14.216 -32.145 227 H ASP 30 H ASP 30 -0.470 -13.464 -29.152 228 HA ASP 30 HA ASP 30 -2.250 -11.125 -29.082 229 HB2 ASP 30 1HB ASP 30 -2.051 -13.198 -27.447 230 HB3 ASP 30 2HB ASP 30 -0.763 -12.238 -26.705 231 H ILE 31 H ILE 31 -1.572 -9.199 -27.724 232 HA ILE 31 HA ILE 31 1.339 -8.592 -28.096 233 HB ILE 31 HB ILE 31 -1.031 -6.776 -28.806 234 HG12 ILE 31 1HG1 ILE 31 0.598 -6.691 -30.958 235 HG13 ILE 31 2HG1 ILE 31 1.058 -8.275 -30.364 236 HG21 ILE 31 1HG2 ILE 31 0.694 -5.418 -27.687 237 HG22 ILE 31 2HG2 ILE 31 1.971 -6.135 -28.707 238 HG23 ILE 31 3HG2 ILE 31 0.724 -5.083 -29.431 239 HD11 ILE 31 1HD1 ILE 31 -0.683 -8.355 -32.118 240 HD12 ILE 31 2HD1 ILE 31 -1.210 -9.095 -30.597 241 HD13 ILE 31 3HD1 ILE 31 -1.787 -7.466 -31.042 242 H MET 32 H MET 32 2.303 -7.718 -26.372 243 HA MET 32 HA MET 32 0.571 -6.649 -24.173 244 HB2 MET 32 1HB MET 32 2.142 -7.700 -22.564 245 HB3 MET 32 2HB MET 32 1.238 -8.867 -23.510 246 HG2 MET 32 1HG MET 32 3.540 -8.560 -25.007 247 HG3 MET 32 2HG MET 32 4.131 -8.434 -23.344 248 HE1 MET 32 1HE MET 32 1.105 -10.518 -25.036 249 HE2 MET 32 2HE MET 32 2.521 -10.617 -26.110 250 HE3 MET 32 3HE MET 32 1.944 -12.066 -25.238 251 H THR 33 H THR 33 1.527 -5.050 -22.856 252 HA THR 33 HA THR 33 3.533 -3.455 -24.320 253 HB THR 33 HB THR 33 2.161 -2.867 -21.649 254 HG1 THR 33 HG1 THR 33 0.770 -1.596 -22.988 255 HG21 THR 33 1HG2 THR 33 4.178 -1.485 -22.123 256 HG22 THR 33 2HG2 THR 33 2.686 -0.520 -22.211 257 HG23 THR 33 3HG2 THR 33 3.479 -1.039 -23.709 258 H VAL 34 H VAL 34 5.637 -3.372 -23.825 259 HA VAL 34 HA VAL 34 6.608 -4.992 -21.498 260 HB VAL 34 HB VAL 34 8.106 -3.689 -23.832 261 HG11 VAL 34 1HG1 VAL 34 10.063 -5.044 -22.969 262 HG12 VAL 34 2HG1 VAL 34 9.580 -3.697 -21.921 263 HG13 VAL 34 3HG1 VAL 34 9.118 -5.353 -21.497 264 HG21 VAL 34 1HG2 VAL 34 8.482 -5.971 -24.626 265 HG22 VAL 34 2HG2 VAL 34 7.640 -6.638 -23.210 266 HG23 VAL 34 3HG2 VAL 34 6.734 -5.703 -24.433 267 H LEU 35 H LEU 35 6.982 -4.004 -19.671 268 HA LEU 35 HA LEU 35 6.941 -1.043 -19.634 269 HB2 LEU 35 1HB LEU 35 6.796 -3.063 -17.364 270 HB3 LEU 35 2HB LEU 35 6.432 -1.344 -17.261 271 HG LEU 35 HG LEU 35 4.856 -3.379 -18.897 272 HD11 LEU 35 1HD1 LEU 35 4.709 -3.847 -16.519 273 HD12 LEU 35 2HD1 LEU 35 3.172 -3.197 -17.121 274 HD13 LEU 35 3HD1 LEU 35 4.270 -2.159 -16.186 275 HD21 LEU 35 1HD2 LEU 35 4.629 -1.090 -19.768 276 HD22 LEU 35 2HD2 LEU 35 4.182 -0.506 -18.146 277 HD23 LEU 35 3HD2 LEU 35 3.124 -1.647 -19.022 278 H GLU 36 H GLU 36 8.883 -3.812 -18.566 279 HA GLU 36 HA GLU 36 11.274 -2.084 -18.243 280 HB2 GLU 36 1HB GLU 36 9.967 -2.291 -16.039 281 HB3 GLU 36 2HB GLU 36 10.349 -4.016 -16.086 282 HG2 GLU 36 1HG GLU 36 12.739 -3.516 -15.990 283 HG3 GLU 36 2HG GLU 36 12.400 -1.774 -16.039 284 H ARG 37 H ARG 37 13.249 -3.615 -17.980 285 HA ARG 37 HA ARG 37 12.706 -6.329 -19.107 286 HB2 ARG 37 1HB ARG 37 14.985 -4.474 -19.898 287 HB3 ARG 37 2HB ARG 37 14.765 -6.141 -20.429 288 HG2 ARG 37 1HG ARG 37 12.609 -5.431 -21.502 289 HG3 ARG 37 2HG ARG 37 13.086 -3.767 -21.135 290 HD2 ARG 37 1HD ARG 37 15.315 -4.360 -22.272 291 HD3 ARG 37 2HD ARG 37 14.442 -5.763 -22.929 292 HE ARG 37 HE ARG 37 12.984 -3.313 -23.338 293 HH11 ARG 37 1HH1 ARG 37 15.689 -5.165 -24.648 294 HH12 ARG 37 2HH1 ARG 37 15.579 -4.404 -26.209 295 HH21 ARG 37 1HH2 ARG 37 12.908 -2.366 -25.343 296 HH22 ARG 37 2HH2 ARG 37 14.026 -2.838 -26.593 297 H ASP 38 H ASP 38 14.245 -7.869 -18.441 298 HA ASP 38 HA ASP 38 15.597 -8.912 -16.978 299 HB2 ASP 38 1HB ASP 38 17.153 -6.312 -16.865 300 HB3 ASP 38 2HB ASP 38 17.763 -7.959 -16.594 301 H THR 39 H THR 39 13.284 -7.799 -16.065 302 HA THR 39 HA THR 39 13.505 -6.041 -13.840 303 HB THR 39 HB THR 39 11.468 -6.349 -15.279 304 HG1 THR 39 HG1 THR 39 11.149 -5.451 -13.243 305 HG21 THR 39 1HG2 THR 39 9.975 -8.270 -14.919 306 HG22 THR 39 2HG2 THR 39 11.115 -8.997 -13.786 307 HG23 THR 39 3HG2 THR 39 11.544 -8.844 -15.510 308 H GLN 40 H GLN 40 14.012 -9.427 -14.057 309 HA GLN 40 HA GLN 40 13.741 -9.713 -11.093 310 HB2 GLN 40 1HB GLN 40 12.731 -11.249 -13.218 311 HB3 GLN 40 2HB GLN 40 14.114 -12.168 -12.631 312 HG2 GLN 40 1HG GLN 40 11.916 -11.125 -10.825 313 HG3 GLN 40 2HG GLN 40 11.857 -12.715 -11.600 314 HE21 GLN 40 1HE2 GLN 40 13.912 -12.228 -8.193 315 HE22 GLN 40 2HE2 GLN 40 12.873 -10.998 -8.873 316 H GLY 41 H GLY 41 15.985 -8.803 -13.228 317 HA2 GLY 41 1HA GLY 41 18.313 -8.825 -13.035 318 HA3 GLY 41 2HA GLY 41 18.210 -10.069 -11.766 319 H LEU 42 H LEU 42 16.193 -11.253 -13.940 320 HA LEU 42 HA LEU 42 18.166 -13.076 -15.112 321 HB2 LEU 42 1HB LEU 42 15.153 -12.876 -15.411 322 HB3 LEU 42 2HB LEU 42 16.148 -14.174 -16.061 323 HG LEU 42 HG LEU 42 15.827 -13.581 -13.106 324 HD11 LEU 42 1HD1 LEU 42 13.681 -14.235 -14.171 325 HD12 LEU 42 2HD1 LEU 42 14.287 -15.497 -13.076 326 HD13 LEU 42 3HD1 LEU 42 14.466 -15.688 -14.836 327 HD21 LEU 42 1HD2 LEU 42 17.897 -14.787 -13.610 328 HD22 LEU 42 2HD2 LEU 42 16.999 -15.965 -14.593 329 HD23 LEU 42 3HD2 LEU 42 16.736 -15.878 -12.834 330 H ASP 43 H ASP 43 19.187 -12.572 -16.929 331 HA ASP 43 HA ASP 43 18.541 -10.385 -18.604 332 HB2 ASP 43 1HB ASP 43 20.770 -11.619 -18.361 333 HB3 ASP 43 2HB ASP 43 20.096 -12.884 -19.397 334 H GLY 44 H GLY 44 17.108 -10.133 -20.183 335 HA2 GLY 44 1HA GLY 44 15.894 -10.770 -22.067 336 HA3 GLY 44 2HA GLY 44 16.237 -12.468 -21.744 337 H TRP 45 H TRP 45 15.057 -11.277 -18.841 338 HA TRP 45 HA TRP 45 12.285 -12.154 -19.609 339 HB2 TRP 45 1HB TRP 45 13.796 -12.025 -16.999 340 HB3 TRP 45 2HB TRP 45 12.029 -12.129 -17.044 341 HD1 TRP 45 HD1 TRP 45 15.134 -14.162 -18.129 342 HE1 TRP 45 HE1 TRP 45 14.522 -16.613 -18.356 343 HE3 TRP 45 HE3 TRP 45 10.087 -13.687 -17.406 344 HZ2 TRP 45 HZ2 TRP 45 12.137 -18.194 -18.231 345 HZ3 TRP 45 HZ3 TRP 45 8.667 -15.753 -17.466 346 HH2 TRP 45 HH2 TRP 45 9.695 -17.983 -17.876 347 H TRP 46 H TRP 46 10.719 -10.663 -19.855 348 HA TRP 46 HA TRP 46 11.418 -7.917 -18.924 349 HB2 TRP 46 1HB TRP 46 9.683 -8.826 -21.223 350 HB3 TRP 46 2HB TRP 46 10.041 -7.149 -20.794 351 HD1 TRP 46 HD1 TRP 46 13.294 -8.492 -20.263 352 HE1 TRP 46 HE1 TRP 46 14.822 -8.514 -22.277 353 HE3 TRP 46 HE3 TRP 46 9.705 -7.849 -23.853 354 HZ2 TRP 46 HZ2 TRP 46 14.543 -8.289 -25.115 355 HZ3 TRP 46 HZ3 TRP 46 10.409 -7.776 -26.250 356 HH2 TRP 46 HH2 TRP 46 12.818 -8.002 -26.864 357 H LEU 47 H LEU 47 9.889 -6.613 -17.971 358 HA LEU 47 HA LEU 47 7.644 -8.049 -16.691 359 HB2 LEU 47 1HB LEU 47 9.096 -6.320 -15.517 360 HB3 LEU 47 2HB LEU 47 8.433 -5.106 -16.594 361 HG LEU 47 HG LEU 47 6.158 -5.600 -15.674 362 HD11 LEU 47 1HD1 LEU 47 6.522 -7.865 -14.785 363 HD12 LEU 47 2HD1 LEU 47 6.078 -6.775 -13.460 364 HD13 LEU 47 3HD1 LEU 47 7.769 -7.252 -13.675 365 HD21 LEU 47 1HD2 LEU 47 6.619 -4.384 -13.550 366 HD22 LEU 47 2HD2 LEU 47 7.520 -3.693 -14.916 367 HD23 LEU 47 3HD2 LEU 47 8.350 -4.736 -13.732 368 H CYS 48 H CYS 48 5.802 -8.273 -17.854 369 HA CYS 48 HA CYS 48 5.123 -6.052 -19.738 370 HB2 CYS 48 1HB CYS 48 4.524 -9.002 -20.042 371 HB3 CYS 48 2HB CYS 48 4.118 -7.732 -21.189 372 HG CYS 48 HG CYS 48 7.082 -8.780 -20.182 373 H SER 49 H SER 49 2.794 -5.875 -20.209 374 HA SER 49 HA SER 49 1.076 -6.868 -17.985 375 HB2 SER 49 1HB SER 49 -0.272 -4.784 -18.349 376 HB3 SER 49 2HB SER 49 1.339 -4.513 -17.665 377 HG SER 49 HG SER 49 0.796 -3.076 -19.392 378 H LEU 50 H LEU 50 -0.669 -7.983 -18.567 379 HA LEU 50 HA LEU 50 -1.839 -7.770 -21.250 380 HB2 LEU 50 1HB LEU 50 0.253 -9.266 -21.346 381 HB3 LEU 50 2HB LEU 50 -0.615 -10.405 -20.349 382 HG LEU 50 HG LEU 50 -0.405 -10.828 -22.854 383 HD11 LEU 50 1HD1 LEU 50 -1.940 -12.068 -21.326 384 HD12 LEU 50 2HD1 LEU 50 -2.491 -11.960 -23.014 385 HD13 LEU 50 3HD1 LEU 50 -3.221 -10.927 -21.780 386 HD21 LEU 50 1HD2 LEU 50 -2.761 -8.924 -23.066 387 HD22 LEU 50 2HD2 LEU 50 -1.965 -9.829 -24.366 388 HD23 LEU 50 3HD2 LEU 50 -1.103 -8.518 -23.553 389 H HIS 51 H HIS 51 -3.980 -8.498 -21.189 390 HA HIS 51 HA HIS 51 -5.994 -9.047 -20.260 391 HB2 HIS 51 1HB HIS 51 -4.645 -11.287 -20.219 392 HB3 HIS 51 2HB HIS 51 -4.662 -11.076 -18.471 393 HD1 HIS 51 HD1 HIS 51 -7.250 -10.776 -17.464 394 HD2 HIS 51 HD2 HIS 51 -6.831 -12.445 -21.254 395 HE1 HIS 51 HE1 HIS 51 -9.412 -12.007 -17.968 396 H GLY 52 H GLY 52 -4.511 -6.893 -18.943 397 HA2 GLY 52 1HA GLY 52 -4.966 -5.497 -17.156 398 HA3 GLY 52 2HA GLY 52 -6.189 -6.650 -16.606 399 H ARG 53 H ARG 53 -3.300 -8.310 -17.026 400 HA ARG 53 HA ARG 53 -2.601 -7.984 -14.129 401 HB2 ARG 53 1HB ARG 53 -2.280 -10.368 -16.006 402 HB3 ARG 53 2HB ARG 53 -1.644 -10.285 -14.364 403 HG2 ARG 53 1HG ARG 53 -3.995 -9.959 -13.547 404 HG3 ARG 53 2HG ARG 53 -4.544 -10.345 -15.193 405 HD2 ARG 53 1HD ARG 53 -3.336 -12.506 -15.078 406 HD3 ARG 53 2HD ARG 53 -2.797 -12.104 -13.433 407 HE ARG 53 HE ARG 53 -5.643 -11.932 -13.591 408 HH11 ARG 53 1HH1 ARG 53 -3.064 -14.352 -13.467 409 HH12 ARG 53 2HH1 ARG 53 -4.106 -15.561 -12.771 410 HH21 ARG 53 1HH2 ARG 53 -6.913 -13.518 -12.676 411 HH22 ARG 53 2HH2 ARG 53 -6.246 -15.095 -12.332 412 H GLN 54 H GLN 54 -0.253 -8.400 -13.743 413 HA GLN 54 HA GLN 54 1.459 -7.643 -16.054 414 HB2 GLN 54 1HB GLN 54 0.981 -5.623 -14.712 415 HB3 GLN 54 2HB GLN 54 1.475 -6.477 -13.250 416 HG2 GLN 54 1HG GLN 54 3.767 -6.661 -14.193 417 HG3 GLN 54 2HG GLN 54 3.248 -5.659 -15.557 418 HE21 GLN 54 1HE2 GLN 54 2.785 -2.745 -13.424 419 HE22 GLN 54 2HE2 GLN 54 1.949 -3.613 -14.690 420 H GLY 55 H GLY 55 3.472 -8.669 -15.906 421 HA2 GLY 55 1HA GLY 55 4.363 -10.154 -13.624 422 HA3 GLY 55 2HA GLY 55 3.435 -11.219 -14.691 423 H ILE 56 H ILE 56 5.890 -12.045 -14.440 424 HA ILE 56 HA ILE 56 7.650 -10.695 -16.363 425 HB ILE 56 HB ILE 56 9.331 -12.358 -15.787 426 HG12 ILE 56 1HG1 ILE 56 7.228 -13.737 -14.072 427 HG13 ILE 56 2HG1 ILE 56 7.777 -14.330 -15.643 428 HG21 ILE 56 1HG2 ILE 56 8.801 -10.407 -14.220 429 HG22 ILE 56 2HG2 ILE 56 7.907 -11.563 -13.199 430 HG23 ILE 56 3HG2 ILE 56 9.655 -11.769 -13.470 431 HD11 ILE 56 1HD1 ILE 56 10.113 -14.472 -14.691 432 HD12 ILE 56 2HD1 ILE 56 9.417 -14.108 -13.095 433 HD13 ILE 56 3HD1 ILE 56 8.934 -15.587 -13.959 434 H VAL 57 H VAL 57 8.300 -11.399 -18.334 435 HA VAL 57 HA VAL 57 6.974 -13.813 -19.492 436 HB VAL 57 HB VAL 57 7.049 -10.989 -20.678 437 HG11 VAL 57 1HG1 VAL 57 6.254 -13.627 -21.933 438 HG12 VAL 57 2HG1 VAL 57 5.779 -12.045 -22.587 439 HG13 VAL 57 3HG1 VAL 57 7.499 -12.478 -22.479 440 HG21 VAL 57 1HG2 VAL 57 4.557 -11.259 -20.761 441 HG22 VAL 57 2HG2 VAL 57 4.728 -12.786 -19.867 442 HG23 VAL 57 3HG2 VAL 57 5.204 -11.251 -19.118 443 HA PRO 58 HA PRO 58 11.237 -13.923 -20.823 444 HB2 PRO 58 1HB PRO 58 11.199 -15.961 -22.656 445 HB3 PRO 58 2HB PRO 58 11.146 -16.242 -20.884 446 HG2 PRO 58 1HG PRO 58 8.877 -16.159 -22.853 447 HG3 PRO 58 2HG PRO 58 9.229 -17.376 -21.585 448 HD2 PRO 58 1HD PRO 58 7.427 -15.392 -21.247 449 HD3 PRO 58 2HD PRO 58 8.421 -16.008 -19.899 450 H GLY 59 H GLY 59 11.920 -12.301 -22.069 451 HA2 GLY 59 1HA GLY 59 10.285 -11.082 -24.056 452 HA3 GLY 59 2HA GLY 59 11.979 -10.724 -23.713 453 H ASN 60 H ASN 60 12.728 -13.577 -24.315 454 HA ASN 60 HA ASN 60 13.307 -13.187 -27.091 455 HB2 ASN 60 1HB ASN 60 13.487 -15.655 -25.318 456 HB3 ASN 60 2HB ASN 60 14.092 -15.576 -26.975 457 HD21 ASN 60 1HD2 ASN 60 17.178 -14.427 -25.897 458 HD22 ASN 60 2HD2 ASN 60 16.237 -15.465 -26.943 459 H ARG 61 H ARG 61 10.467 -14.419 -25.508 460 HA ARG 61 HA ARG 61 9.610 -15.887 -27.952 461 HB2 ARG 61 1HB ARG 61 8.211 -15.342 -25.299 462 HB3 ARG 61 2HB ARG 61 7.500 -16.236 -26.640 463 HG2 ARG 61 1HG ARG 61 9.463 -17.856 -26.447 464 HG3 ARG 61 2HG ARG 61 9.853 -17.046 -24.915 465 HD2 ARG 61 1HD ARG 61 7.462 -17.460 -24.194 466 HD3 ARG 61 2HD ARG 61 7.249 -18.434 -25.654 467 HE ARG 61 HE ARG 61 9.512 -19.388 -24.208 468 HH11 ARG 61 1HH1 ARG 61 5.988 -19.363 -23.984 469 HH12 ARG 61 2HH1 ARG 61 5.943 -20.748 -22.926 470 HH21 ARG 61 1HH2 ARG 61 9.371 -21.206 -22.890 471 HH22 ARG 61 2HH2 ARG 61 7.813 -21.783 -22.360 472 H LEU 62 H LEU 62 9.874 -12.702 -27.186 473 HA LEU 62 HA LEU 62 7.237 -11.970 -28.397 474 HB2 LEU 62 1HB LEU 62 9.057 -10.301 -26.637 475 HB3 LEU 62 2HB LEU 62 7.473 -9.863 -27.240 476 HG LEU 62 HG LEU 62 8.034 -11.961 -25.143 477 HD11 LEU 62 1HD1 LEU 62 8.374 -9.632 -24.384 478 HD12 LEU 62 2HD1 LEU 62 6.931 -10.323 -23.629 479 HD13 LEU 62 3HD1 LEU 62 6.761 -9.185 -24.980 480 HD21 LEU 62 1HD2 LEU 62 5.410 -10.966 -26.319 481 HD22 LEU 62 2HD2 LEU 62 5.558 -11.973 -24.861 482 HD23 LEU 62 3HD2 LEU 62 6.079 -12.611 -26.419 483 H LYS 63 H LYS 63 7.164 -10.349 -29.963 484 HA LYS 63 HA LYS 63 9.829 -9.487 -31.043 485 HB2 LYS 63 1HB LYS 63 8.396 -11.179 -32.373 486 HB3 LYS 63 2HB LYS 63 7.298 -9.838 -32.680 487 HG2 LYS 63 1HG LYS 63 10.250 -9.704 -33.354 488 HG3 LYS 63 2HG LYS 63 9.084 -10.445 -34.457 489 HD2 LYS 63 1HD LYS 63 7.789 -8.328 -34.514 490 HD3 LYS 63 2HD LYS 63 9.010 -7.574 -33.475 491 HE2 LYS 63 1HE LYS 63 9.553 -8.771 -36.226 492 HE3 LYS 63 2HE LYS 63 9.331 -7.044 -35.891 493 HZ1 LYS 63 1HZ LYS 63 11.678 -7.660 -35.967 494 HZ2 LYS 63 2HZ LYS 63 11.473 -8.726 -34.719 495 HZ3 LYS 63 3HZ LYS 63 11.276 -7.107 -34.468 496 H ILE 64 H ILE 64 10.104 -7.391 -30.566 497 HA ILE 64 HA ILE 64 7.966 -5.689 -29.700 498 HB ILE 64 HB ILE 64 10.810 -4.950 -30.563 499 HG12 ILE 64 1HG1 ILE 64 9.636 -5.423 -27.775 500 HG13 ILE 64 2HG1 ILE 64 10.598 -6.606 -28.662 501 HG21 ILE 64 1HG2 ILE 64 9.277 -2.959 -30.550 502 HG22 ILE 64 2HG2 ILE 64 8.777 -3.352 -28.891 503 HG23 ILE 64 3HG2 ILE 64 10.450 -2.865 -29.236 504 HD11 ILE 64 1HD1 ILE 64 12.535 -4.984 -28.668 505 HD12 ILE 64 2HD1 ILE 64 11.564 -3.918 -27.620 506 HD13 ILE 64 3HD1 ILE 64 12.032 -5.527 -27.053 507 H LEU 65 H LEU 65 6.734 -4.219 -30.682 508 HA LEU 65 HA LEU 65 7.140 -3.811 -33.631 509 HB2 LEU 65 1HB LEU 65 4.557 -3.820 -32.029 510 HB3 LEU 65 2HB LEU 65 4.698 -3.488 -33.747 511 HG LEU 65 HG LEU 65 5.282 -6.161 -32.418 512 HD11 LEU 65 1HD1 LEU 65 3.186 -6.860 -33.557 513 HD12 LEU 65 2HD1 LEU 65 2.926 -5.184 -34.094 514 HD13 LEU 65 3HD1 LEU 65 2.901 -5.587 -32.360 515 HD21 LEU 65 1HD2 LEU 65 6.625 -5.867 -34.459 516 HD22 LEU 65 2HD2 LEU 65 5.177 -5.384 -35.370 517 HD23 LEU 65 3HD2 LEU 65 5.319 -7.041 -34.739 518 H VAL 66 H VAL 66 7.187 -1.763 -34.309 519 HA VAL 66 HA VAL 66 7.806 0.472 -34.006 520 HB VAL 66 HB VAL 66 4.831 0.629 -33.393 521 HG11 VAL 66 1HG1 VAL 66 6.022 2.792 -33.506 522 HG12 VAL 66 2HG1 VAL 66 6.708 2.354 -35.090 523 HG13 VAL 66 3HG1 VAL 66 4.952 2.598 -34.904 524 HG21 VAL 66 1HG2 VAL 66 6.221 -0.093 -36.012 525 HG22 VAL 66 2HG2 VAL 66 5.027 -1.063 -35.121 526 HG23 VAL 66 3HG2 VAL 66 4.534 0.444 -35.910 527 H GLY 67 H GLY 67 9.149 0.520 -32.101 528 HA2 GLY 67 1HA GLY 67 7.930 1.117 -29.537 529 HA3 GLY 67 2HA GLY 67 9.654 1.168 -29.922 530 H MET 68 H MET 68 10.364 3.110 -31.298 531 HA MET 68 HA MET 68 8.688 5.488 -31.159 532 HB2 MET 68 1HB MET 68 10.152 6.793 -29.711 533 HB3 MET 68 2HB MET 68 9.554 5.386 -28.827 534 HG2 MET 68 1HG MET 68 11.725 5.259 -28.184 535 HG3 MET 68 2HG MET 68 11.872 4.339 -29.698 536 HE1 MET 68 1HE MET 68 14.431 5.594 -28.355 537 HE2 MET 68 2HE MET 68 14.467 4.761 -29.935 538 HE3 MET 68 3HE MET 68 15.221 6.368 -29.747 539 H TYR 69 H TYR 69 9.883 7.331 -32.227 540 HA TYR 69 HA TYR 69 12.368 6.727 -33.606 541 HB2 TYR 69 1HB TYR 69 10.180 5.684 -34.846 542 HB3 TYR 69 2HB TYR 69 10.176 7.311 -35.536 543 HD1 TYR 69 HD1 TYR 69 11.761 7.927 -37.235 544 HD2 TYR 69 HD2 TYR 69 12.276 4.248 -35.061 545 HE1 TYR 69 HE1 TYR 69 13.556 7.251 -38.793 546 HE2 TYR 69 HE2 TYR 69 14.097 3.583 -36.641 547 HH TYR 69 HH TYR 69 15.350 4.171 -38.465 548 H ASP 70 H ASP 70 12.974 8.620 -35.039 549 HA ASP 70 HA ASP 70 11.618 11.150 -34.215 550 HB2 ASP 70 1HB ASP 70 13.708 12.144 -33.634 551 HB3 ASP 70 2HB ASP 70 13.633 10.598 -32.774 552 H LYS 71 H LYS 71 13.171 12.994 -35.466 553 HA LYS 71 HA LYS 71 13.040 12.170 -38.347 554 HB2 LYS 71 1HB LYS 71 12.489 14.878 -37.078 555 HB3 LYS 71 2HB LYS 71 12.630 14.591 -38.810 556 HG2 LYS 71 1HG LYS 71 10.718 12.924 -38.586 557 HG3 LYS 71 2HG LYS 71 10.484 13.557 -36.944 558 HD2 LYS 71 1HD LYS 71 10.216 15.843 -37.887 559 HD3 LYS 71 2HD LYS 71 10.428 15.184 -39.522 560 HE2 LYS 71 1HE LYS 71 8.076 15.443 -39.181 561 HE3 LYS 71 2HE LYS 71 8.425 13.704 -39.100 562 HZ1 LYS 71 1HZ LYS 71 8.402 13.905 -36.669 563 HZ2 LYS 71 2HZ LYS 71 6.959 14.368 -37.318 564 HZ3 LYS 71 3HZ LYS 71 8.022 15.501 -36.782 565 H LYS 72 H LYS 72 14.701 12.708 -39.666 566 HA LYS 72 HA LYS 72 17.280 13.212 -38.441 567 HB2 LYS 72 1HB LYS 72 16.293 12.984 -41.313 568 HB3 LYS 72 2HB LYS 72 17.956 13.439 -40.929 569 HG2 LYS 72 1HG LYS 72 18.101 11.161 -41.341 570 HG3 LYS 72 2HG LYS 72 18.122 11.276 -39.578 571 HD2 LYS 72 1HD LYS 72 15.723 10.678 -39.517 572 HD3 LYS 72 2HD LYS 72 15.700 10.558 -41.286 573 HE2 LYS 72 1HE LYS 72 17.387 8.767 -41.202 574 HE3 LYS 72 2HE LYS 72 17.452 8.901 -39.436 575 HZ1 LYS 72 1HZ LYS 72 15.103 8.255 -39.368 576 HZ2 LYS 72 2HZ LYS 72 16.006 7.087 -40.102 577 HZ3 LYS 72 3HZ LYS 72 15.069 8.095 -41.014 578 HA PRO 73 HA PRO 73 17.018 17.620 -38.717 579 HB2 PRO 73 1HB PRO 73 19.630 18.385 -38.668 580 HB3 PRO 73 2HB PRO 73 18.824 17.643 -37.248 581 HG2 PRO 73 1HG PRO 73 20.546 16.315 -39.328 582 HG3 PRO 73 2HG PRO 73 20.685 16.238 -37.546 583 HD2 PRO 73 1HD PRO 73 19.432 14.305 -38.965 584 HD3 PRO 73 2HD PRO 73 18.834 14.819 -37.348 585 H ALA 74 H ALA 74 18.791 15.809 -41.128 586 HA ALA 74 HA ALA 74 19.221 16.126 -43.326 587 HB1 ALA 74 1HB ALA 74 16.728 16.257 -43.303 588 HB2 ALA 74 2HB ALA 74 16.850 18.029 -43.236 589 HB3 ALA 74 3HB ALA 74 17.460 17.155 -44.660 590 H GLY 75 H GLY 75 20.604 18.115 -41.492 591 HA2 GLY 75 1HA GLY 75 20.858 20.443 -43.280 592 HA3 GLY 75 2HA GLY 75 21.516 20.273 -41.654 593 H GLU 76 H GLU 76 22.243 17.519 -43.525 594 HA GLU 76 HA GLU 76 24.969 18.638 -44.043 595 HB2 GLU 76 1HB GLU 76 24.205 15.863 -43.069 596 HB3 GLU 76 2HB GLU 76 25.849 16.405 -43.476 597 HG2 GLU 76 1HG GLU 76 25.659 18.147 -41.689 598 HG3 GLU 76 2HG GLU 76 24.089 17.454 -41.230 599 H PHE 77 H PHE 77 23.705 19.048 -46.180 600 HA PHE 77 HA PHE 77 24.624 16.893 -47.983 601 HB2 PHE 77 1HB PHE 77 21.811 17.496 -47.495 602 HB3 PHE 77 2HB PHE 77 22.255 17.799 -49.176 603 HD1 PHE 77 HD1 PHE 77 21.703 15.250 -46.620 604 HD2 PHE 77 HD2 PHE 77 23.205 15.954 -50.592 605 HE1 PHE 77 HE1 PHE 77 21.587 12.809 -47.088 606 HE2 PHE 77 HE2 PHE 77 23.098 13.515 -51.078 607 HZ PHE 77 HZ PHE 77 22.292 11.934 -49.328 608 H ILE 78 H ILE 78 25.990 17.863 -49.333 609 HA ILE 78 HA ILE 78 25.210 20.452 -50.527 610 HB ILE 78 HB ILE 78 26.567 21.095 -48.551 611 HG12 ILE 78 1HG1 ILE 78 28.249 21.432 -51.065 612 HG13 ILE 78 2HG1 ILE 78 26.728 22.291 -50.794 613 HG21 ILE 78 1HG2 ILE 78 27.883 18.973 -48.292 614 HG22 ILE 78 2HG2 ILE 78 28.847 19.412 -49.725 615 HG23 ILE 78 3HG2 ILE 78 28.910 20.412 -48.254 616 HD11 ILE 78 1HD1 ILE 78 27.726 23.311 -48.714 617 HD12 ILE 78 2HD1 ILE 78 29.275 22.523 -49.120 618 HD13 ILE 78 3HD1 ILE 78 28.586 23.754 -50.207 619 H VAL 79 H VAL 79 25.744 20.543 -52.629 620 HA VAL 79 HA VAL 79 27.554 18.411 -53.702 621 HB VAL 79 HB VAL 79 26.165 18.428 -55.775 622 HG11 VAL 79 1HG1 VAL 79 24.287 17.149 -54.901 623 HG12 VAL 79 2HG1 VAL 79 25.748 16.781 -53.953 624 HG13 VAL 79 3HG1 VAL 79 24.503 17.862 -53.290 625 HG21 VAL 79 1HG2 VAL 79 25.219 20.737 -55.560 626 HG22 VAL 79 2HG2 VAL 79 23.958 19.513 -55.823 627 HG23 VAL 79 3HG2 VAL 79 24.215 20.185 -54.190 628 H THR 80 H THR 80 27.635 21.421 -52.866 629 HA THR 80 HA THR 80 28.603 23.361 -53.533 630 HB THR 80 HB THR 80 30.298 21.866 -55.535 631 HG1 THR 80 HG1 THR 80 30.362 20.427 -53.931 632 HG21 THR 80 1HG2 THR 80 32.081 23.232 -54.473 633 HG22 THR 80 2HG2 THR 80 30.878 23.918 -53.351 634 HG23 THR 80 3HG2 THR 80 30.765 24.256 -55.095 635 H ASP 81 H ASP 81 26.215 23.229 -54.689 636 HA ASP 81 HA ASP 81 26.441 23.785 -57.573 637 HB2 ASP 81 1HB ASP 81 24.408 22.576 -56.536 638 HB3 ASP 81 2HB ASP 81 23.970 24.104 -55.788 639 HXT ASP 81 H02 ASP 81 25.541 25.582 -58.298 Start of MODEL 14 1 H2 GLY 1 2H0 GLY 1 10.181 11.470 -11.007 2 H GLY 1 1H0 GLY 1 10.565 10.781 -9.586 3 HA2 GLY 1 1HA GLY 1 11.066 9.478 -12.204 4 HA3 GLY 1 2HA GLY 1 11.216 8.726 -10.597 5 H SER 2 H SER 2 9.916 7.128 -11.698 6 HA SER 2 HA SER 2 7.981 5.948 -12.008 7 HB2 SER 2 1HB SER 2 7.786 6.713 -9.575 8 HB3 SER 2 2HB SER 2 6.622 7.923 -10.154 9 HG SER 2 HG SER 2 5.394 6.191 -11.022 10 H MET 3 H MET 3 8.382 8.604 -13.594 11 HA MET 3 HA MET 3 5.558 9.085 -14.365 12 HB2 MET 3 1HB MET 3 6.418 11.106 -15.433 13 HB3 MET 3 2HB MET 3 6.906 11.017 -13.737 14 HG2 MET 3 1HG MET 3 9.153 10.232 -14.425 15 HG3 MET 3 2HG MET 3 8.664 10.339 -16.121 16 HE1 MET 3 1HE MET 3 9.950 12.227 -12.961 17 HE2 MET 3 2HE MET 3 9.459 13.909 -13.261 18 HE3 MET 3 3HE MET 3 8.231 12.677 -12.885 19 H LYS 4 H LYS 4 8.269 7.315 -15.470 20 HA LYS 4 HA LYS 4 6.936 6.881 -18.070 21 HB2 LYS 4 1HB LYS 4 9.819 7.833 -17.792 22 HB3 LYS 4 2HB LYS 4 9.188 7.016 -19.222 23 HG2 LYS 4 1HG LYS 4 7.364 8.927 -19.159 24 HG3 LYS 4 2HG LYS 4 8.587 9.774 -18.201 25 HD2 LYS 4 1HD LYS 4 8.984 10.444 -20.420 26 HD3 LYS 4 2HD LYS 4 10.221 9.205 -20.113 27 HE2 LYS 4 1HE LYS 4 8.804 7.513 -21.243 28 HE3 LYS 4 2HE LYS 4 7.535 8.728 -21.490 29 HZ1 LYS 4 1HZ LYS 4 8.832 8.451 -23.455 30 HZ2 LYS 4 2HZ LYS 4 10.240 8.805 -22.661 31 HZ3 LYS 4 3HZ LYS 4 9.080 9.966 -22.856 32 H TYR 5 H TYR 5 7.700 5.028 -19.157 33 HA TYR 5 HA TYR 5 9.558 3.192 -17.817 34 HB2 TYR 5 1HB TYR 5 7.972 1.330 -17.864 35 HB3 TYR 5 2HB TYR 5 7.370 2.600 -16.800 36 HD1 TYR 5 HD1 TYR 5 5.435 4.059 -17.554 37 HD2 TYR 5 HD2 TYR 5 6.760 0.663 -19.815 38 HE1 TYR 5 HE1 TYR 5 3.284 4.050 -18.817 39 HE2 TYR 5 HE2 TYR 5 4.615 0.628 -21.043 40 HH TYR 5 HH TYR 5 2.064 3.056 -20.480 41 H LEU 6 H LEU 6 9.452 1.165 -19.683 42 HA LEU 6 HA LEU 6 10.585 2.388 -21.952 43 HB2 LEU 6 1HB LEU 6 9.331 -0.340 -21.606 44 HB3 LEU 6 2HB LEU 6 10.190 0.148 -23.063 45 HG LEU 6 HG LEU 6 11.446 0.061 -20.304 46 HD11 LEU 6 1HD1 LEU 6 11.601 -1.888 -22.632 47 HD12 LEU 6 2HD1 LEU 6 10.762 -2.157 -21.086 48 HD13 LEU 6 3HD1 LEU 6 12.525 -1.983 -21.115 49 HD21 LEU 6 1HD2 LEU 6 12.640 0.417 -23.088 50 HD22 LEU 6 2HD2 LEU 6 13.582 0.166 -21.596 51 HD23 LEU 6 3HD2 LEU 6 12.599 1.628 -21.788 52 H ASN 7 H ASN 7 7.211 1.383 -21.552 53 HA ASN 7 HA ASN 7 5.339 1.875 -22.728 54 HB2 ASN 7 1HB ASN 7 6.633 4.183 -22.296 55 HB3 ASN 7 2HB ASN 7 6.544 4.246 -24.061 56 HD21 ASN 7 1HD2 ASN 7 2.898 4.264 -23.992 57 HD22 ASN 7 2HD2 ASN 7 4.220 3.470 -24.835 58 H VAL 8 H VAL 8 7.238 0.108 -24.124 59 HA VAL 8 HA VAL 8 6.230 0.553 -26.897 60 HB VAL 8 HB VAL 8 8.092 -0.909 -27.624 61 HG11 VAL 8 1HG1 VAL 8 9.880 0.755 -27.470 62 HG12 VAL 8 2HG1 VAL 8 8.319 1.576 -27.686 63 HG13 VAL 8 3HG1 VAL 8 9.080 1.521 -26.082 64 HG21 VAL 8 1HG2 VAL 8 9.119 -0.659 -24.773 65 HG22 VAL 8 2HG2 VAL 8 8.489 -2.143 -25.518 66 HG23 VAL 8 3HG2 VAL 8 9.984 -1.409 -26.128 67 H LEU 9 H LEU 9 5.750 -1.614 -27.968 68 HA LEU 9 HA LEU 9 4.780 -3.574 -25.931 69 HB2 LEU 9 1HB LEU 9 2.858 -3.879 -27.686 70 HB3 LEU 9 2HB LEU 9 2.744 -2.667 -26.428 71 HG LEU 9 HG LEU 9 3.867 -1.758 -29.039 72 HD11 LEU 9 1HD1 LEU 9 2.020 -3.197 -29.758 73 HD12 LEU 9 2HD1 LEU 9 1.610 -1.487 -29.982 74 HD13 LEU 9 3HD1 LEU 9 0.924 -2.390 -28.610 75 HD21 LEU 9 1HD2 LEU 9 2.628 0.268 -28.451 76 HD22 LEU 9 2HD2 LEU 9 3.533 -0.272 -27.019 77 HD23 LEU 9 3HD2 LEU 9 1.788 -0.581 -27.128 78 H ALA 10 H ALA 10 4.267 -5.697 -26.900 79 HA ALA 10 HA ALA 10 5.814 -6.264 -29.360 80 HB1 ALA 10 1HB ALA 10 7.172 -7.944 -28.275 81 HB2 ALA 10 2HB ALA 10 7.397 -6.403 -27.419 82 HB3 ALA 10 3HB ALA 10 6.357 -7.665 -26.717 83 H LYS 11 H LYS 11 5.189 -8.108 -30.422 84 HA LYS 11 HA LYS 11 2.661 -9.348 -29.456 85 HB2 LYS 11 1HB LYS 11 2.782 -8.446 -31.789 86 HB3 LYS 11 2HB LYS 11 4.062 -9.618 -32.147 87 HG2 LYS 11 1HG LYS 11 2.562 -11.473 -31.891 88 HG3 LYS 11 2HG LYS 11 1.347 -10.464 -31.104 89 HD2 LYS 11 1HD LYS 11 0.508 -10.844 -33.250 90 HD3 LYS 11 2HD LYS 11 1.129 -9.186 -33.282 91 HE2 LYS 11 1HE LYS 11 3.172 -9.960 -34.416 92 HE3 LYS 11 2HE LYS 11 2.604 -11.644 -34.309 93 HZ1 LYS 11 1HZ LYS 11 1.224 -9.465 -35.780 94 HZ2 LYS 11 2HZ LYS 11 0.696 -11.021 -35.672 95 HZ3 LYS 11 3HZ LYS 11 2.095 -10.680 -36.474 96 H ALA 12 H ALA 12 2.560 -11.426 -28.809 97 HA ALA 12 HA ALA 12 5.088 -12.790 -28.298 98 HB1 ALA 12 1HB ALA 12 2.184 -13.572 -27.904 99 HB2 ALA 12 2HB ALA 12 3.559 -14.583 -27.409 100 HB3 ALA 12 3HB ALA 12 3.323 -12.989 -26.675 101 H LEU 13 H LEU 13 5.997 -14.421 -29.367 102 HA LEU 13 HA LEU 13 4.852 -15.141 -32.019 103 HB2 LEU 13 1HB LEU 13 7.505 -15.779 -30.686 104 HB3 LEU 13 2HB LEU 13 7.071 -16.223 -32.335 105 HG LEU 13 HG LEU 13 7.291 -13.357 -31.330 106 HD11 LEU 13 1HD1 LEU 13 9.269 -15.053 -32.906 107 HD12 LEU 13 2HD1 LEU 13 9.461 -14.507 -31.223 108 HD13 LEU 13 3HD1 LEU 13 9.442 -13.321 -32.541 109 HD21 LEU 13 1HD2 LEU 13 7.377 -12.849 -33.789 110 HD22 LEU 13 2HD2 LEU 13 5.826 -13.538 -33.273 111 HD23 LEU 13 3HD2 LEU 13 7.015 -14.557 -34.124 112 H TYR 14 H TYR 14 5.373 -16.413 -28.825 113 HA TYR 14 HA TYR 14 4.296 -19.065 -29.677 114 HB2 TYR 14 1HB TYR 14 6.367 -18.591 -27.519 115 HB3 TYR 14 2HB TYR 14 5.785 -20.150 -28.106 116 HD1 TYR 14 HD1 TYR 14 8.076 -17.340 -28.689 117 HD2 TYR 14 HD2 TYR 14 6.535 -20.980 -30.369 118 HE1 TYR 14 HE1 TYR 14 9.969 -17.385 -30.302 119 HE2 TYR 14 HE2 TYR 14 8.423 -21.007 -32.008 120 HH TYR 14 HH TYR 14 10.977 -18.508 -32.005 121 H ASP 15 H ASP 15 3.233 -20.184 -27.779 122 HA ASP 15 HA ASP 15 1.908 -18.139 -26.064 123 HB2 ASP 15 1HB ASP 15 0.181 -19.864 -25.739 124 HB3 ASP 15 2HB ASP 15 0.403 -19.497 -27.451 125 H ASN 16 H ASN 16 1.498 -18.645 -23.861 126 HA ASN 16 HA ASN 16 2.964 -20.869 -22.612 127 HB2 ASN 16 1HB ASN 16 4.637 -18.939 -22.942 128 HB3 ASN 16 2HB ASN 16 3.662 -18.042 -21.778 129 HD21 ASN 16 1HD2 ASN 16 5.050 -19.597 -18.996 130 HD22 ASN 16 2HD2 ASN 16 4.005 -18.362 -19.658 131 H VAL 17 H VAL 17 1.608 -21.569 -21.007 132 HA VAL 17 HA VAL 17 -0.258 -19.581 -19.800 133 HB VAL 17 HB VAL 17 -1.289 -21.722 -20.578 134 HG11 VAL 17 1HG1 VAL 17 0.479 -23.073 -18.496 135 HG12 VAL 17 2HG1 VAL 17 -0.815 -23.850 -19.434 136 HG13 VAL 17 3HG1 VAL 17 0.634 -23.243 -20.258 137 HG21 VAL 17 1HG2 VAL 17 -1.269 -21.479 -17.541 138 HG22 VAL 17 2HG2 VAL 17 -2.241 -20.477 -18.646 139 HG23 VAL 17 3HG2 VAL 17 -2.533 -22.229 -18.537 140 H ALA 18 H ALA 18 0.015 -19.019 -17.648 141 HA ALA 18 HA ALA 18 2.738 -19.437 -16.662 142 HB1 ALA 18 1HB ALA 18 1.754 -17.209 -16.539 143 HB2 ALA 18 2HB ALA 18 0.372 -17.837 -15.602 144 HB3 ALA 18 3HB ALA 18 1.990 -17.836 -14.897 145 H GLU 19 H GLU 19 3.317 -20.378 -14.717 146 HA GLU 19 HA GLU 19 1.151 -21.977 -13.371 147 HB2 GLU 19 1HB GLU 19 2.825 -23.517 -12.625 148 HB3 GLU 19 2HB GLU 19 2.962 -23.335 -14.377 149 HG2 GLU 19 1HG GLU 19 4.910 -21.837 -14.070 150 HG3 GLU 19 2HG GLU 19 4.762 -22.012 -12.313 151 H SER 20 H SER 20 3.471 -19.417 -13.104 152 HA SER 20 HA SER 20 3.120 -19.350 -10.134 153 HB2 SER 20 1HB SER 20 5.077 -17.913 -11.964 154 HB3 SER 20 2HB SER 20 5.002 -17.724 -10.202 155 HG SER 20 HG SER 20 5.491 -20.148 -11.617 156 HA PRO 21 HA PRO 21 0.408 -15.972 -10.737 157 HB2 PRO 21 1HB PRO 21 0.612 -14.483 -8.466 158 HB3 PRO 21 2HB PRO 21 -0.097 -16.132 -8.464 159 HG2 PRO 21 1HG PRO 21 2.704 -15.283 -7.771 160 HG3 PRO 21 2HG PRO 21 1.578 -16.317 -6.838 161 HD2 PRO 21 1HD PRO 21 3.506 -17.372 -8.429 162 HD3 PRO 21 2HD PRO 21 1.893 -18.149 -8.263 163 H ASP 22 H ASP 22 3.771 -15.278 -10.071 164 HA ASP 22 HA ASP 22 3.610 -12.449 -10.822 165 HB2 ASP 22 1HB ASP 22 5.978 -14.302 -10.349 166 HB3 ASP 22 2HB ASP 22 6.062 -12.539 -10.505 167 H GLU 23 H GLU 23 3.545 -15.328 -12.501 168 HA GLU 23 HA GLU 23 5.161 -14.407 -14.797 169 HB2 GLU 23 1HB GLU 23 5.429 -16.690 -13.788 170 HB3 GLU 23 2HB GLU 23 3.745 -17.009 -14.181 171 HG2 GLU 23 1HG GLU 23 4.322 -16.617 -16.585 172 HG3 GLU 23 2HG GLU 23 6.010 -16.517 -16.065 173 H LEU 24 H LEU 24 4.152 -13.969 -16.799 174 HA LEU 24 HA LEU 24 1.228 -13.555 -16.557 175 HB2 LEU 24 1HB LEU 24 3.361 -12.221 -17.886 176 HB3 LEU 24 2HB LEU 24 2.259 -12.818 -19.126 177 HG LEU 24 HG LEU 24 1.473 -11.086 -16.761 178 HD11 LEU 24 1HD1 LEU 24 1.225 -9.318 -18.410 179 HD12 LEU 24 2HD1 LEU 24 1.743 -10.424 -19.706 180 HD13 LEU 24 3HD1 LEU 24 2.883 -9.953 -18.422 181 HD21 LEU 24 1HD2 LEU 24 -0.676 -10.777 -18.037 182 HD22 LEU 24 2HD2 LEU 24 -0.448 -12.413 -17.400 183 HD23 LEU 24 3HD2 LEU 24 -0.163 -12.091 -19.125 184 H SER 25 H SER 25 -0.283 -14.712 -17.571 185 HA SER 25 HA SER 25 0.523 -16.951 -19.332 186 HB2 SER 25 1HB SER 25 -2.201 -15.922 -18.421 187 HB3 SER 25 2HB SER 25 -1.951 -17.330 -19.473 188 HG SER 25 HG SER 25 -0.805 -17.076 -16.887 189 H PHE 26 H PHE 26 0.854 -16.548 -21.456 190 HA PHE 26 HA PHE 26 -0.852 -14.472 -22.757 191 HB2 PHE 26 1HB PHE 26 1.089 -13.635 -24.010 192 HB3 PHE 26 2HB PHE 26 1.243 -13.345 -22.277 193 HD1 PHE 26 HD1 PHE 26 2.966 -14.403 -20.958 194 HD2 PHE 26 HD2 PHE 26 2.544 -15.317 -25.142 195 HE1 PHE 26 HE1 PHE 26 5.196 -15.493 -20.933 196 HE2 PHE 26 HE2 PHE 26 4.793 -16.390 -25.137 197 HZ PHE 26 HZ PHE 26 6.127 -16.475 -23.030 198 H ARG 27 H ARG 27 -0.839 -14.699 -25.156 199 HA ARG 27 HA ARG 27 -0.396 -17.567 -25.875 200 HB2 ARG 27 1HB ARG 27 -2.699 -15.780 -26.722 201 HB3 ARG 27 2HB ARG 27 -2.440 -17.449 -27.239 202 HG2 ARG 27 1HG ARG 27 -2.973 -16.555 -24.370 203 HG3 ARG 27 2HG ARG 27 -4.174 -17.259 -25.462 204 HD2 ARG 27 1HD ARG 27 -2.931 -19.368 -25.543 205 HD3 ARG 27 2HD ARG 27 -1.618 -18.668 -24.578 206 HE ARG 27 HE ARG 27 -4.087 -18.444 -23.161 207 HH11 ARG 27 1HH1 ARG 27 -1.644 -20.855 -24.021 208 HH12 ARG 27 2HH1 ARG 27 -1.981 -21.826 -22.615 209 HH21 ARG 27 1HH2 ARG 27 -4.464 -19.754 -21.396 210 HH22 ARG 27 2HH2 ARG 27 -3.546 -21.214 -21.163 211 H LYS 28 H LYS 28 0.072 -18.005 -28.044 212 HA LYS 28 HA LYS 28 1.825 -16.145 -29.305 213 HB2 LYS 28 1HB LYS 28 1.794 -17.674 -31.208 214 HB3 LYS 28 2HB LYS 28 1.903 -18.576 -29.698 215 HG2 LYS 28 1HG LYS 28 -0.744 -18.727 -29.972 216 HG3 LYS 28 2HG LYS 28 -0.345 -18.471 -31.679 217 HD2 LYS 28 1HD LYS 28 0.804 -20.638 -29.885 218 HD3 LYS 28 2HD LYS 28 -0.495 -20.872 -31.063 219 HE2 LYS 28 1HE LYS 28 1.054 -20.242 -32.893 220 HE3 LYS 28 2HE LYS 28 2.360 -20.009 -31.706 221 HZ1 LYS 28 1HZ LYS 28 2.481 -22.205 -32.670 222 HZ2 LYS 28 2HZ LYS 28 0.933 -22.555 -32.216 223 HZ3 LYS 28 3HZ LYS 28 2.099 -22.338 -31.068 224 H GLY 29 H GLY 29 1.504 -14.536 -30.723 225 HA2 GLY 29 1HA GLY 29 0.342 -13.277 -32.317 226 HA3 GLY 29 2HA GLY 29 -1.114 -14.238 -32.049 227 H ASP 30 H ASP 30 -0.336 -13.566 -28.970 228 HA ASP 30 HA ASP 30 -2.230 -11.337 -28.825 229 HB2 ASP 30 1HB ASP 30 -1.862 -13.402 -27.227 230 HB3 ASP 30 2HB ASP 30 -0.592 -12.393 -26.515 231 H ILE 31 H ILE 31 -1.676 -9.310 -27.614 232 HA ILE 31 HA ILE 31 1.204 -8.548 -28.006 233 HB ILE 31 HB ILE 31 -1.264 -6.868 -28.732 234 HG12 ILE 31 1HG1 ILE 31 0.306 -6.768 -30.913 235 HG13 ILE 31 2HG1 ILE 31 0.865 -8.313 -30.282 236 HG21 ILE 31 1HG2 ILE 31 0.450 -5.414 -27.686 237 HG22 ILE 31 2HG2 ILE 31 1.712 -6.104 -28.737 238 HG23 ILE 31 3HG2 ILE 31 0.399 -5.117 -29.430 239 HD11 ILE 31 1HD1 ILE 31 -1.346 -9.248 -30.427 240 HD12 ILE 31 2HD1 ILE 31 -2.024 -7.670 -30.897 241 HD13 ILE 31 3HD1 ILE 31 -0.908 -8.529 -31.983 242 H MET 32 H MET 32 2.144 -7.632 -26.343 243 HA MET 32 HA MET 32 0.437 -6.584 -24.118 244 HB2 MET 32 1HB MET 32 1.957 -7.686 -22.537 245 HB3 MET 32 2HB MET 32 1.190 -8.857 -23.608 246 HG2 MET 32 1HG MET 32 3.389 -8.564 -25.036 247 HG3 MET 32 2HG MET 32 4.056 -7.973 -23.505 248 HE1 MET 32 1HE MET 32 1.481 -10.902 -24.592 249 HE2 MET 32 2HE MET 32 2.894 -10.800 -25.667 250 HE3 MET 32 3HE MET 32 2.696 -12.202 -24.594 251 H THR 33 H THR 33 1.459 -4.978 -22.803 252 HA THR 33 HA THR 33 3.432 -3.385 -24.332 253 HB THR 33 HB THR 33 2.106 -2.780 -21.656 254 HG1 THR 33 HG1 THR 33 0.602 -1.654 -22.874 255 HG21 THR 33 1HG2 THR 33 3.416 -0.973 -23.727 256 HG22 THR 33 2HG2 THR 33 4.104 -1.402 -22.139 257 HG23 THR 33 3HG2 THR 33 2.614 -0.437 -22.231 258 H VAL 34 H VAL 34 5.587 -3.257 -23.783 259 HA VAL 34 HA VAL 34 6.472 -4.977 -21.502 260 HB VAL 34 HB VAL 34 8.055 -3.629 -23.750 261 HG11 VAL 34 1HG1 VAL 34 8.995 -5.423 -21.465 262 HG12 VAL 34 2HG1 VAL 34 9.990 -4.962 -22.870 263 HG13 VAL 34 3HG1 VAL 34 9.432 -3.724 -21.733 264 HG21 VAL 34 1HG2 VAL 34 7.619 -6.604 -23.199 265 HG22 VAL 34 2HG2 VAL 34 6.670 -5.669 -24.385 266 HG23 VAL 34 3HG2 VAL 34 8.419 -5.877 -24.606 267 H LEU 35 H LEU 35 7.007 -4.096 -19.618 268 HA LEU 35 HA LEU 35 6.870 -1.160 -19.425 269 HB2 LEU 35 1HB LEU 35 7.038 -3.249 -17.240 270 HB3 LEU 35 2HB LEU 35 6.677 -1.539 -17.025 271 HG LEU 35 HG LEU 35 4.921 -3.588 -18.441 272 HD11 LEU 35 1HD1 LEU 35 4.992 -3.866 -16.011 273 HD12 LEU 35 2HD1 LEU 35 3.417 -3.241 -16.514 274 HD13 LEU 35 3HD1 LEU 35 4.611 -2.149 -15.776 275 HD21 LEU 35 1HD2 LEU 35 4.441 -0.631 -17.889 276 HD22 LEU 35 2HD2 LEU 35 3.194 -1.783 -18.417 277 HD23 LEU 35 3HD2 LEU 35 4.562 -1.425 -19.479 278 H GLU 36 H GLU 36 9.028 -3.836 -18.492 279 HA GLU 36 HA GLU 36 11.406 -2.116 -18.735 280 HB2 GLU 36 1HB GLU 36 12.208 -2.663 -16.470 281 HB3 GLU 36 2HB GLU 36 10.765 -1.645 -16.424 282 HG2 GLU 36 1HG GLU 36 9.372 -3.513 -15.861 283 HG3 GLU 36 2HG GLU 36 10.711 -4.650 -16.088 284 H ARG 37 H ARG 37 13.391 -3.631 -18.160 285 HA ARG 37 HA ARG 37 12.751 -6.404 -19.105 286 HB2 ARG 37 1HB ARG 37 15.261 -4.800 -19.649 287 HB3 ARG 37 2HB ARG 37 14.905 -6.425 -20.235 288 HG2 ARG 37 1HG ARG 37 12.934 -5.368 -21.502 289 HG3 ARG 37 2HG ARG 37 13.684 -3.810 -21.103 290 HD2 ARG 37 1HD ARG 37 14.824 -6.066 -22.756 291 HD3 ARG 37 2HD ARG 37 14.536 -4.386 -23.246 292 HE ARG 37 HE ARG 37 16.364 -4.429 -21.051 293 HH11 ARG 37 1HH1 ARG 37 16.341 -5.360 -24.454 294 HH12 ARG 37 2HH1 ARG 37 18.066 -5.177 -24.607 295 HH21 ARG 37 1HH2 ARG 37 18.535 -4.224 -21.315 296 HH22 ARG 37 2HH2 ARG 37 19.287 -4.526 -22.856 297 H ASP 38 H ASP 38 14.102 -8.033 -18.271 298 HA ASP 38 HA ASP 38 15.358 -9.127 -16.751 299 HB2 ASP 38 1HB ASP 38 17.021 -6.603 -16.597 300 HB3 ASP 38 2HB ASP 38 17.557 -8.275 -16.368 301 H THR 39 H THR 39 13.073 -7.964 -15.821 302 HA THR 39 HA THR 39 13.372 -6.144 -13.661 303 HB THR 39 HB THR 39 11.314 -6.475 -15.061 304 HG1 THR 39 HG1 THR 39 11.137 -5.473 -13.012 305 HG21 THR 39 1HG2 THR 39 10.903 -9.002 -13.401 306 HG22 THR 39 2HG2 THR 39 11.301 -8.968 -15.138 307 HG23 THR 39 3HG2 THR 39 9.761 -8.313 -14.558 308 H GLN 40 H GLN 40 13.716 -9.577 -13.688 309 HA GLN 40 HA GLN 40 13.427 -9.662 -10.712 310 HB2 GLN 40 1HB GLN 40 12.072 -11.160 -12.399 311 HB3 GLN 40 2HB GLN 40 13.575 -12.076 -12.510 312 HG2 GLN 40 1HG GLN 40 13.500 -12.382 -10.016 313 HG3 GLN 40 2HG GLN 40 11.935 -11.553 -10.004 314 HE21 GLN 40 1HE2 GLN 40 11.708 -15.362 -10.259 315 HE22 GLN 40 2HE2 GLN 40 12.745 -14.342 -9.289 316 H GLY 41 H GLY 41 15.719 -8.936 -12.810 317 HA2 GLY 41 1HA GLY 41 18.039 -9.056 -12.608 318 HA3 GLY 41 2HA GLY 41 17.863 -10.200 -11.259 319 H LEU 42 H LEU 42 15.877 -11.250 -13.674 320 HA LEU 42 HA LEU 42 17.817 -13.310 -14.525 321 HB2 LEU 42 1HB LEU 42 14.821 -13.041 -14.969 322 HB3 LEU 42 2HB LEU 42 15.807 -14.405 -15.482 323 HG LEU 42 HG LEU 42 15.310 -13.609 -12.594 324 HD11 LEU 42 1HD1 LEU 42 14.110 -15.830 -14.305 325 HD12 LEU 42 2HD1 LEU 42 13.262 -14.376 -13.724 326 HD13 LEU 42 3HD1 LEU 42 13.830 -15.593 -12.565 327 HD21 LEU 42 1HD2 LEU 42 17.429 -14.802 -12.837 328 HD22 LEU 42 2HD2 LEU 42 16.638 -16.069 -13.806 329 HD23 LEU 42 3HD2 LEU 42 16.222 -15.862 -12.087 330 H ASP 43 H ASP 43 18.831 -13.107 -16.400 331 HA ASP 43 HA ASP 43 18.453 -10.899 -18.140 332 HB2 ASP 43 1HB ASP 43 20.531 -12.343 -17.835 333 HB3 ASP 43 2HB ASP 43 19.739 -13.572 -18.831 334 H GLY 44 H GLY 44 17.102 -10.516 -19.752 335 HA2 GLY 44 1HA GLY 44 15.871 -11.018 -21.656 336 HA3 GLY 44 2HA GLY 44 16.085 -12.742 -21.355 337 H TRP 45 H TRP 45 14.895 -11.471 -18.482 338 HA TRP 45 HA TRP 45 12.130 -12.254 -19.326 339 HB2 TRP 45 1HB TRP 45 13.522 -12.163 -16.648 340 HB3 TRP 45 2HB TRP 45 11.770 -12.372 -16.815 341 HD1 TRP 45 HD1 TRP 45 15.069 -14.181 -17.675 342 HE1 TRP 45 HE1 TRP 45 14.630 -16.650 -18.077 343 HE3 TRP 45 HE3 TRP 45 9.962 -14.027 -17.480 344 HZ2 TRP 45 HZ2 TRP 45 12.348 -18.365 -18.285 345 HZ3 TRP 45 HZ3 TRP 45 8.680 -16.151 -17.777 346 HH2 TRP 45 HH2 TRP 45 9.878 -18.303 -18.181 347 H TRP 46 H TRP 46 10.905 -10.596 -19.959 348 HA TRP 46 HA TRP 46 11.468 -7.936 -18.779 349 HB2 TRP 46 1HB TRP 46 9.753 -8.753 -21.141 350 HB3 TRP 46 2HB TRP 46 10.202 -7.107 -20.693 351 HD1 TRP 46 HD1 TRP 46 13.372 -8.725 -20.216 352 HE1 TRP 46 HE1 TRP 46 14.885 -8.746 -22.249 353 HE3 TRP 46 HE3 TRP 46 9.813 -7.628 -23.711 354 HZ2 TRP 46 HZ2 TRP 46 14.596 -8.300 -25.071 355 HZ3 TRP 46 HZ3 TRP 46 10.493 -7.455 -26.104 356 HH2 TRP 46 HH2 TRP 46 12.872 -7.766 -26.774 357 H LEU 47 H LEU 47 9.884 -6.708 -17.757 358 HA LEU 47 HA LEU 47 7.555 -8.236 -16.763 359 HB2 LEU 47 1HB LEU 47 8.857 -6.559 -15.347 360 HB3 LEU 47 2HB LEU 47 8.251 -5.304 -16.408 361 HG LEU 47 HG LEU 47 5.923 -5.904 -15.723 362 HD11 LEU 47 1HD1 LEU 47 6.292 -8.224 -14.977 363 HD12 LEU 47 2HD1 LEU 47 5.615 -7.245 -13.665 364 HD13 LEU 47 3HD1 LEU 47 7.347 -7.646 -13.668 365 HD21 LEU 47 1HD2 LEU 47 7.169 -4.048 -14.690 366 HD22 LEU 47 2HD2 LEU 47 7.854 -5.163 -13.488 367 HD23 LEU 47 3HD2 LEU 47 6.105 -4.832 -13.510 368 H CYS 48 H CYS 48 5.750 -8.331 -17.982 369 HA CYS 48 HA CYS 48 5.246 -6.034 -19.842 370 HB2 CYS 48 1HB CYS 48 4.511 -8.952 -20.216 371 HB3 CYS 48 2HB CYS 48 4.208 -7.633 -21.354 372 HG CYS 48 HG CYS 48 7.095 -8.777 -20.243 373 H SER 49 H SER 49 2.947 -5.641 -20.270 374 HA SER 49 HA SER 49 1.185 -6.628 -18.060 375 HB2 SER 49 1HB SER 49 0.005 -4.451 -18.200 376 HB3 SER 49 2HB SER 49 1.689 -4.293 -17.667 377 HG SER 49 HG SER 49 1.301 -2.750 -19.211 378 H LEU 50 H LEU 50 -0.666 -7.502 -18.590 379 HA LEU 50 HA LEU 50 -1.870 -7.209 -21.264 380 HB2 LEU 50 1HB LEU 50 -0.044 -8.866 -21.612 381 HB3 LEU 50 2HB LEU 50 -0.654 -9.810 -20.271 382 HG LEU 50 HG LEU 50 -2.727 -10.278 -21.558 383 HD11 LEU 50 1HD1 LEU 50 -1.237 -8.919 -23.832 384 HD12 LEU 50 2HD1 LEU 50 -2.727 -8.336 -23.071 385 HD13 LEU 50 3HD1 LEU 50 -2.738 -9.852 -23.987 386 HD21 LEU 50 1HD2 LEU 50 -0.864 -11.852 -21.519 387 HD22 LEU 50 2HD2 LEU 50 -0.096 -11.009 -22.886 388 HD23 LEU 50 3HD2 LEU 50 -1.645 -11.856 -23.113 389 H HIS 51 H HIS 51 -4.040 -7.758 -21.160 390 HA HIS 51 HA HIS 51 -6.068 -8.300 -20.267 391 HB2 HIS 51 1HB HIS 51 -4.597 -10.536 -20.205 392 HB3 HIS 51 2HB HIS 51 -4.887 -10.384 -18.472 393 HD1 HIS 51 HD1 HIS 51 -6.535 -11.344 -21.679 394 HD2 HIS 51 HD2 HIS 51 -7.651 -10.548 -17.741 395 HE1 HIS 51 HE1 HIS 51 -8.887 -12.229 -21.388 396 H GLY 52 H GLY 52 -4.401 -6.298 -18.744 397 HA2 GLY 52 1HA GLY 52 -4.979 -4.950 -16.931 398 HA3 GLY 52 2HA GLY 52 -6.191 -6.142 -16.443 399 H ARG 53 H ARG 53 -3.267 -7.705 -16.962 400 HA ARG 53 HA ARG 53 -2.456 -7.473 -14.085 401 HB2 ARG 53 1HB ARG 53 -2.425 -9.888 -15.953 402 HB3 ARG 53 2HB ARG 53 -1.678 -9.833 -14.350 403 HG2 ARG 53 1HG ARG 53 -3.903 -9.426 -13.348 404 HG3 ARG 53 2HG ARG 53 -4.641 -9.560 -14.953 405 HD2 ARG 53 1HD ARG 53 -4.835 -11.688 -13.769 406 HD3 ARG 53 2HD ARG 53 -3.753 -11.858 -15.168 407 HE ARG 53 HE ARG 53 -2.111 -11.260 -12.977 408 HH11 ARG 53 1HH1 ARG 53 -4.287 -13.893 -13.860 409 HH12 ARG 53 2HH1 ARG 53 -3.347 -15.081 -12.996 410 HH21 ARG 53 1HH2 ARG 53 -0.939 -12.846 -11.911 411 HH22 ARG 53 2HH2 ARG 53 -1.499 -14.491 -11.921 412 H GLN 54 H GLN 54 -0.090 -8.119 -13.866 413 HA GLN 54 HA GLN 54 1.420 -7.777 -16.373 414 HB2 GLN 54 1HB GLN 54 3.012 -6.254 -15.367 415 HB3 GLN 54 2HB GLN 54 1.397 -5.547 -15.317 416 HG2 GLN 54 1HG GLN 54 1.208 -6.213 -12.922 417 HG3 GLN 54 2HG GLN 54 2.868 -6.833 -12.992 418 HE21 GLN 54 1HE2 GLN 54 3.972 -3.707 -11.928 419 HE22 GLN 54 2HE2 GLN 54 3.900 -5.430 -11.658 420 H GLY 55 H GLY 55 3.525 -8.768 -16.238 421 HA2 GLY 55 1HA GLY 55 4.361 -10.238 -13.929 422 HA3 GLY 55 2HA GLY 55 3.401 -11.296 -14.982 423 H ILE 56 H ILE 56 5.949 -12.027 -14.594 424 HA ILE 56 HA ILE 56 7.745 -10.788 -16.510 425 HB ILE 56 HB ILE 56 9.344 -12.538 -15.921 426 HG12 ILE 56 1HG1 ILE 56 7.115 -13.876 -14.338 427 HG13 ILE 56 2HG1 ILE 56 7.711 -14.450 -15.895 428 HG21 ILE 56 1HG2 ILE 56 9.599 -12.054 -13.564 429 HG22 ILE 56 2HG2 ILE 56 8.858 -10.625 -14.308 430 HG23 ILE 56 3HG2 ILE 56 7.858 -11.752 -13.364 431 HD11 ILE 56 1HD1 ILE 56 9.187 -14.402 -13.252 432 HD12 ILE 56 2HD1 ILE 56 8.736 -15.805 -14.243 433 HD13 ILE 56 3HD1 ILE 56 10.000 -14.691 -14.809 434 H VAL 57 H VAL 57 8.425 -11.457 -18.467 435 HA VAL 57 HA VAL 57 7.116 -13.822 -19.727 436 HB VAL 57 HB VAL 57 7.202 -10.973 -20.849 437 HG11 VAL 57 1HG1 VAL 57 6.372 -13.576 -22.161 438 HG12 VAL 57 2HG1 VAL 57 5.938 -11.977 -22.787 439 HG13 VAL 57 3HG1 VAL 57 7.641 -12.449 -22.681 440 HG21 VAL 57 1HG2 VAL 57 4.708 -11.227 -20.940 441 HG22 VAL 57 2HG2 VAL 57 4.872 -12.757 -20.046 442 HG23 VAL 57 3HG2 VAL 57 5.364 -11.221 -19.295 443 HA PRO 58 HA PRO 58 11.394 -13.850 -20.988 444 HB2 PRO 58 1HB PRO 58 11.450 -15.933 -22.757 445 HB3 PRO 58 2HB PRO 58 11.333 -16.178 -20.983 446 HG2 PRO 58 1HG PRO 58 9.144 -16.184 -23.037 447 HG3 PRO 58 2HG PRO 58 9.463 -17.359 -21.728 448 HD2 PRO 58 1HD PRO 58 7.617 -15.367 -21.531 449 HD3 PRO 58 2HD PRO 58 8.544 -15.966 -20.119 450 H GLY 59 H GLY 59 12.092 -12.250 -22.256 451 HA2 GLY 59 1HA GLY 59 10.570 -11.098 -24.335 452 HA3 GLY 59 2HA GLY 59 12.271 -10.780 -23.993 453 H ASN 60 H ASN 60 12.832 -13.742 -24.496 454 HA ASN 60 HA ASN 60 13.543 -13.558 -27.260 455 HB2 ASN 60 1HB ASN 60 14.642 -15.085 -25.669 456 HB3 ASN 60 2HB ASN 60 13.136 -16.002 -25.492 457 HD21 ASN 60 1HD2 ASN 60 15.444 -16.465 -28.828 458 HD22 ASN 60 2HD2 ASN 60 15.684 -15.097 -27.772 459 H ARG 61 H ARG 61 10.567 -14.575 -25.650 460 HA ARG 61 HA ARG 61 9.545 -15.810 -28.138 461 HB2 ARG 61 1HB ARG 61 8.246 -15.379 -25.414 462 HB3 ARG 61 2HB ARG 61 7.521 -16.255 -26.768 463 HG2 ARG 61 1HG ARG 61 9.501 -17.841 -26.687 464 HG3 ARG 61 2HG ARG 61 9.969 -17.053 -25.166 465 HD2 ARG 61 1HD ARG 61 7.676 -17.569 -24.273 466 HD3 ARG 61 2HD ARG 61 7.347 -18.476 -25.755 467 HE ARG 61 HE ARG 61 9.756 -19.420 -24.515 468 HH11 ARG 61 1HH1 ARG 61 6.241 -19.619 -24.194 469 HH12 ARG 61 2HH1 ARG 61 6.317 -21.093 -23.272 470 HH21 ARG 61 1HH2 ARG 61 9.756 -21.342 -23.369 471 HH22 ARG 61 2HH2 ARG 61 8.254 -22.058 -22.849 472 H LEU 62 H LEU 62 10.012 -12.700 -27.346 473 HA LEU 62 HA LEU 62 7.324 -11.814 -28.334 474 HB2 LEU 62 1HB LEU 62 9.382 -10.354 -26.645 475 HB3 LEU 62 2HB LEU 62 7.897 -9.664 -27.249 476 HG LEU 62 HG LEU 62 8.087 -11.886 -25.203 477 HD11 LEU 62 1HD1 LEU 62 7.324 -8.935 -24.969 478 HD12 LEU 62 2HD1 LEU 62 8.795 -9.700 -24.325 479 HD13 LEU 62 3HD1 LEU 62 7.209 -10.124 -23.657 480 HD21 LEU 62 1HD2 LEU 62 5.633 -11.449 -24.935 481 HD22 LEU 62 2HD2 LEU 62 6.062 -12.175 -26.487 482 HD23 LEU 62 3HD2 LEU 62 5.687 -10.435 -26.391 483 H LYS 63 H LYS 63 7.171 -10.386 -29.990 484 HA LYS 63 HA LYS 63 9.749 -9.513 -31.272 485 HB2 LYS 63 1HB LYS 63 8.482 -11.144 -32.630 486 HB3 LYS 63 2HB LYS 63 7.050 -10.119 -32.556 487 HG2 LYS 63 1HG LYS 63 9.458 -8.747 -33.574 488 HG3 LYS 63 2HG LYS 63 8.933 -10.118 -34.568 489 HD2 LYS 63 1HD LYS 63 6.657 -9.182 -34.705 490 HD3 LYS 63 2HD LYS 63 7.144 -7.809 -33.697 491 HE2 LYS 63 1HE LYS 63 8.352 -8.501 -36.406 492 HE3 LYS 63 2HE LYS 63 7.100 -7.274 -36.130 493 HZ1 LYS 63 1HZ LYS 63 9.231 -6.215 -36.183 494 HZ2 LYS 63 2HZ LYS 63 9.857 -7.231 -35.043 495 HZ3 LYS 63 3HZ LYS 63 8.684 -6.147 -34.621 496 H ILE 64 H ILE 64 10.058 -7.406 -30.971 497 HA ILE 64 HA ILE 64 8.219 -5.671 -29.751 498 HB ILE 64 HB ILE 64 10.490 -4.856 -31.634 499 HG12 ILE 64 1HG1 ILE 64 11.337 -6.386 -29.915 500 HG13 ILE 64 2HG1 ILE 64 11.924 -4.750 -29.660 501 HG21 ILE 64 1HG2 ILE 64 9.087 -2.938 -31.131 502 HG22 ILE 64 2HG2 ILE 64 9.029 -3.354 -29.403 503 HG23 ILE 64 3HG2 ILE 64 10.554 -2.799 -30.137 504 HD11 ILE 64 1HD1 ILE 64 9.712 -6.119 -28.054 505 HD12 ILE 64 2HD1 ILE 64 11.367 -5.776 -27.519 506 HD13 ILE 64 3HD1 ILE 64 10.247 -4.435 -27.817 507 H LEU 65 H LEU 65 6.544 -4.527 -30.367 508 HA LEU 65 HA LEU 65 5.799 -4.613 -33.257 509 HB2 LEU 65 1HB LEU 65 4.473 -5.762 -31.341 510 HB3 LEU 65 2HB LEU 65 3.994 -4.155 -30.860 511 HG LEU 65 HG LEU 65 2.243 -5.321 -32.062 512 HD11 LEU 65 1HD1 LEU 65 3.279 -3.103 -33.845 513 HD12 LEU 65 2HD1 LEU 65 2.430 -2.843 -32.308 514 HD13 LEU 65 3HD1 LEU 65 1.602 -3.652 -33.656 515 HD21 LEU 65 1HD2 LEU 65 3.734 -6.753 -33.464 516 HD22 LEU 65 2HD2 LEU 65 4.076 -5.339 -34.492 517 HD23 LEU 65 3HD2 LEU 65 2.423 -5.979 -34.382 518 H VAL 66 H VAL 66 6.828 -2.770 -33.940 519 HA VAL 66 HA VAL 66 7.322 -0.571 -34.240 520 HB VAL 66 HB VAL 66 4.497 -0.042 -33.198 521 HG11 VAL 66 1HG1 VAL 66 4.610 1.922 -34.738 522 HG12 VAL 66 2HG1 VAL 66 5.826 2.021 -33.457 523 HG13 VAL 66 3HG1 VAL 66 6.308 1.535 -35.098 524 HG21 VAL 66 1HG2 VAL 66 5.468 -0.705 -36.024 525 HG22 VAL 66 2HG2 VAL 66 4.471 -1.753 -34.992 526 HG23 VAL 66 3HG2 VAL 66 3.816 -0.221 -35.580 527 H GLY 67 H GLY 67 8.976 -0.671 -32.646 528 HA2 GLY 67 1HA GLY 67 8.441 0.269 -29.943 529 HA3 GLY 67 2HA GLY 67 10.017 -0.119 -30.647 530 H MET 68 H MET 68 7.464 2.246 -31.501 531 HA MET 68 HA MET 68 9.534 4.311 -31.924 532 HB2 MET 68 1HB MET 68 6.669 3.916 -32.595 533 HB3 MET 68 2HB MET 68 7.121 5.578 -32.209 534 HG2 MET 68 1HG MET 68 7.270 5.158 -34.616 535 HG3 MET 68 2HG MET 68 8.855 5.547 -33.927 536 HE1 MET 68 1HE MET 68 8.856 4.391 -36.766 537 HE2 MET 68 2HE MET 68 10.353 4.606 -35.823 538 HE3 MET 68 3HE MET 68 10.041 3.066 -36.656 539 H TYR 69 H TYR 69 9.223 6.467 -30.934 540 HA TYR 69 HA TYR 69 9.120 6.251 -28.090 541 HB2 TYR 69 1HB TYR 69 10.039 8.089 -29.968 542 HB3 TYR 69 2HB TYR 69 8.725 8.951 -29.153 543 HD1 TYR 69 HD1 TYR 69 8.962 9.679 -26.838 544 HD2 TYR 69 HD2 TYR 69 11.985 7.202 -28.648 545 HE1 TYR 69 HE1 TYR 69 10.505 10.146 -24.931 546 HE2 TYR 69 HE2 TYR 69 13.508 7.659 -26.728 547 HH TYR 69 HH TYR 69 13.782 8.739 -24.738 548 H ASP 70 H ASP 70 7.697 7.089 -26.598 549 HA ASP 70 HA ASP 70 4.895 6.877 -27.276 550 HB2 ASP 70 1HB ASP 70 4.609 7.457 -24.861 551 HB3 ASP 70 2HB ASP 70 5.751 6.134 -25.125 552 H LYS 71 H LYS 71 3.410 8.595 -26.212 553 HA LYS 71 HA LYS 71 4.153 11.252 -27.375 554 HB2 LYS 71 1HB LYS 71 1.436 10.005 -26.763 555 HB3 LYS 71 2HB LYS 71 1.671 11.681 -27.259 556 HG2 LYS 71 1HG LYS 71 1.287 10.904 -29.346 557 HG3 LYS 71 2HG LYS 71 2.985 10.415 -29.282 558 HD2 LYS 71 1HD LYS 71 1.807 8.509 -30.071 559 HD3 LYS 71 2HD LYS 71 2.164 8.159 -28.371 560 HE2 LYS 71 1HE LYS 71 -0.142 8.865 -27.749 561 HE3 LYS 71 2HE LYS 71 -0.485 9.220 -29.454 562 HZ1 LYS 71 1HZ LYS 71 0.216 6.549 -28.371 563 HZ2 LYS 71 2HZ LYS 71 -0.112 6.879 -29.954 564 HZ3 LYS 71 3HZ LYS 71 -1.298 7.033 -28.815 565 H LYS 72 H LYS 72 3.497 13.105 -26.070 566 HA LYS 72 HA LYS 72 4.368 12.894 -23.387 567 HB2 LYS 72 1HB LYS 72 2.690 15.021 -24.778 568 HB3 LYS 72 2HB LYS 72 3.322 15.188 -23.138 569 HG2 LYS 72 1HG LYS 72 5.153 16.102 -24.034 570 HG3 LYS 72 2HG LYS 72 5.581 14.486 -24.614 571 HD2 LYS 72 1HD LYS 72 4.356 14.938 -26.730 572 HD3 LYS 72 2HD LYS 72 3.972 16.570 -26.140 573 HE2 LYS 72 1HE LYS 72 6.405 17.059 -25.961 574 HE3 LYS 72 2HE LYS 72 6.769 15.440 -26.589 575 HZ1 LYS 72 1HZ LYS 72 5.639 16.051 -28.642 576 HZ2 LYS 72 2HZ LYS 72 6.859 17.113 -28.330 577 HZ3 LYS 72 3HZ LYS 72 5.294 17.554 -28.058 578 HA PRO 73 HA PRO 73 0.773 11.259 -21.495 579 HB2 PRO 73 1HB PRO 73 1.054 12.036 -18.890 580 HB3 PRO 73 2HB PRO 73 2.137 10.825 -19.649 581 HG2 PRO 73 1HG PRO 73 2.572 13.784 -19.296 582 HG3 PRO 73 2HG PRO 73 3.647 12.425 -18.830 583 HD2 PRO 73 1HD PRO 73 4.016 13.755 -21.140 584 HD3 PRO 73 2HD PRO 73 4.227 11.970 -21.063 585 H ALA 74 H ALA 74 -1.288 11.793 -20.627 586 HA ALA 74 HA ALA 74 -2.071 14.589 -21.182 587 HB1 ALA 74 1HB ALA 74 -3.287 12.724 -22.279 588 HB2 ALA 74 2HB ALA 74 -3.766 12.099 -20.680 589 HB3 ALA 74 3HB ALA 74 -4.354 13.684 -21.229 590 H GLY 75 H GLY 75 -0.890 13.186 -18.510 591 HA2 GLY 75 1HA GLY 75 -0.975 14.119 -16.345 592 HA3 GLY 75 2HA GLY 75 -2.525 14.879 -16.727 593 H GLU 76 H GLU 76 -2.662 11.723 -17.783 594 HA GLU 76 HA GLU 76 -4.385 10.883 -15.598 595 HB2 GLU 76 1HB GLU 76 -4.687 10.316 -18.054 596 HB3 GLU 76 2HB GLU 76 -3.247 9.306 -17.944 597 HG2 GLU 76 1HG GLU 76 -4.939 7.759 -17.725 598 HG3 GLU 76 2HG GLU 76 -4.534 8.077 -16.031 599 H PHE 77 H PHE 77 -3.700 9.870 -13.753 600 HA PHE 77 HA PHE 77 -1.594 7.862 -13.852 601 HB2 PHE 77 1HB PHE 77 -0.107 8.859 -12.210 602 HB3 PHE 77 2HB PHE 77 -0.210 9.914 -13.621 603 HD1 PHE 77 HD1 PHE 77 -1.141 9.524 -10.050 604 HD2 PHE 77 HD2 PHE 77 -1.205 12.117 -13.479 605 HE1 PHE 77 HE1 PHE 77 -1.751 11.439 -8.581 606 HE2 PHE 77 HE2 PHE 77 -1.817 14.040 -12.027 607 HZ PHE 77 HZ PHE 77 -2.093 13.708 -9.569 608 H ILE 78 H ILE 78 -1.317 6.920 -11.577 609 HA ILE 78 HA ILE 78 -3.777 7.316 -9.932 610 HB ILE 78 HB ILE 78 -3.820 4.883 -9.463 611 HG12 ILE 78 1HG1 ILE 78 -1.753 4.554 -11.670 612 HG13 ILE 78 2HG1 ILE 78 -1.346 4.539 -9.953 613 HG21 ILE 78 1HG2 ILE 78 -5.185 5.880 -11.351 614 HG22 ILE 78 2HG2 ILE 78 -3.912 5.374 -12.484 615 HG23 ILE 78 3HG2 ILE 78 -4.825 4.156 -11.563 616 HD11 ILE 78 1HD1 ILE 78 -1.518 2.258 -10.747 617 HD12 ILE 78 2HD1 ILE 78 -2.855 2.576 -9.621 618 HD13 ILE 78 3HD1 ILE 78 -3.153 2.546 -11.378 619 H VAL 79 H VAL 79 -3.431 6.434 -7.679 620 HA VAL 79 HA VAL 79 -0.761 7.247 -6.725 621 HB VAL 79 HB VAL 79 -1.745 6.980 -4.456 622 HG11 VAL 79 1HG1 VAL 79 -1.961 9.140 -5.673 623 HG12 VAL 79 2HG1 VAL 79 -3.537 8.615 -6.308 624 HG13 VAL 79 3HG1 VAL 79 -3.317 8.857 -4.559 625 HG21 VAL 79 1HG2 VAL 79 -4.341 6.243 -5.897 626 HG22 VAL 79 2HG2 VAL 79 -3.334 5.122 -4.946 627 HG23 VAL 79 3HG2 VAL 79 -4.138 6.488 -4.150 628 H THR 80 H THR 80 0.390 5.825 -5.168 629 HA THR 80 HA THR 80 0.528 3.094 -6.187 630 HB THR 80 HB THR 80 2.293 2.873 -4.376 631 HG1 THR 80 HG1 THR 80 1.285 4.508 -3.017 632 HG21 THR 80 1HG2 THR 80 3.910 4.408 -5.395 633 HG22 THR 80 2HG2 THR 80 2.596 5.349 -6.133 634 HG23 THR 80 3HG2 THR 80 2.901 3.673 -6.658 635 H ASP 81 H ASP 81 0.164 1.193 -4.966 636 HA ASP 81 HA ASP 81 -1.953 1.427 -2.945 637 HB2 ASP 81 1HB ASP 81 -2.193 -0.981 -3.123 638 HB3 ASP 81 2HB ASP 81 -2.114 -0.319 -4.753 639 HXT ASP 81 H02 ASP 81 1.023 -0.081 -3.093 Start of MODEL 15 1 H2 GLY 1 2H0 GLY 1 -1.053 5.636 -14.875 2 H GLY 1 1H0 GLY 1 -0.294 7.074 -14.970 3 HA2 GLY 1 1HA GLY 1 -1.327 5.485 -17.260 4 HA3 GLY 1 2HA GLY 1 -0.623 7.110 -17.416 5 H SER 2 H SER 2 0.700 5.976 -18.977 6 HA SER 2 HA SER 2 2.772 4.142 -18.044 7 HB2 SER 2 1HB SER 2 3.638 4.498 -20.391 8 HB3 SER 2 2HB SER 2 1.952 3.943 -20.306 9 HG SER 2 HG SER 2 2.935 6.538 -20.846 10 H MET 3 H MET 3 3.149 5.979 -16.274 11 HA MET 3 HA MET 3 4.620 8.313 -17.113 12 HB2 MET 3 1HB MET 3 4.370 6.954 -14.408 13 HB3 MET 3 2HB MET 3 5.130 8.528 -14.677 14 HG2 MET 3 1HG MET 3 2.228 7.858 -15.275 15 HG3 MET 3 2HG MET 3 2.818 8.736 -13.852 16 HE1 MET 3 1HE MET 3 1.092 11.593 -15.970 17 HE2 MET 3 2HE MET 3 0.554 9.904 -15.807 18 HE3 MET 3 3HE MET 3 1.167 10.785 -14.387 19 H LYS 4 H LYS 4 6.389 7.983 -18.243 20 HA LYS 4 HA LYS 4 8.584 7.618 -18.706 21 HB2 LYS 4 1HB LYS 4 8.945 7.157 -15.727 22 HB3 LYS 4 2HB LYS 4 10.208 7.551 -16.890 23 HG2 LYS 4 1HG LYS 4 7.899 9.386 -16.123 24 HG3 LYS 4 2HG LYS 4 9.554 9.491 -15.509 25 HD2 LYS 4 1HD LYS 4 10.370 9.850 -17.844 26 HD3 LYS 4 2HD LYS 4 8.683 9.864 -18.402 27 HE2 LYS 4 1HE LYS 4 8.208 11.777 -16.899 28 HE3 LYS 4 2HE LYS 4 9.905 11.775 -16.373 29 HZ1 LYS 4 1HZ LYS 4 8.974 12.243 -19.151 30 HZ2 LYS 4 2HZ LYS 4 10.551 12.234 -18.663 31 HZ3 LYS 4 3HZ LYS 4 9.524 13.404 -18.117 32 H TYR 5 H TYR 5 6.674 5.207 -18.310 33 HA TYR 5 HA TYR 5 8.547 2.995 -17.920 34 HB2 TYR 5 1HB TYR 5 5.694 3.274 -18.907 35 HB3 TYR 5 2HB TYR 5 6.588 1.767 -19.148 36 HD1 TYR 5 HD1 TYR 5 4.412 3.417 -16.905 37 HD2 TYR 5 HD2 TYR 5 7.893 0.896 -16.980 38 HE1 TYR 5 HE1 TYR 5 3.907 2.632 -14.592 39 HE2 TYR 5 HE2 TYR 5 7.398 0.111 -14.706 40 HH TYR 5 HH TYR 5 5.958 0.237 -12.912 41 H LEU 6 H LEU 6 8.962 1.431 -19.723 42 HA LEU 6 HA LEU 6 10.193 2.773 -21.939 43 HB2 LEU 6 1HB LEU 6 9.317 -0.124 -21.656 44 HB3 LEU 6 2HB LEU 6 10.413 0.493 -22.889 45 HG LEU 6 HG LEU 6 10.975 0.510 -19.905 46 HD11 LEU 6 1HD1 LEU 6 10.833 -1.742 -20.825 47 HD12 LEU 6 2HD1 LEU 6 12.508 -1.327 -20.417 48 HD13 LEU 6 3HD1 LEU 6 11.979 -1.305 -22.119 49 HD21 LEU 6 1HD2 LEU 6 13.307 0.973 -20.595 50 HD22 LEU 6 2HD2 LEU 6 12.198 2.287 -21.020 51 HD23 LEU 6 3HD2 LEU 6 12.756 1.158 -22.280 52 H ASN 7 H ASN 7 7.082 1.163 -21.504 53 HA ASN 7 HA ASN 7 5.151 1.172 -22.713 54 HB2 ASN 7 1HB ASN 7 5.619 3.671 -22.285 55 HB3 ASN 7 2HB ASN 7 6.092 3.750 -23.987 56 HD21 ASN 7 1HD2 ASN 7 2.808 4.283 -24.927 57 HD22 ASN 7 2HD2 ASN 7 4.510 4.626 -25.121 58 H VAL 8 H VAL 8 7.286 -0.301 -23.872 59 HA VAL 8 HA VAL 8 6.850 0.086 -26.814 60 HB VAL 8 HB VAL 8 8.850 -1.652 -25.320 61 HG11 VAL 8 1HG1 VAL 8 8.276 -2.693 -27.422 62 HG12 VAL 8 2HG1 VAL 8 8.491 -1.151 -28.295 63 HG13 VAL 8 3HG1 VAL 8 9.893 -1.976 -27.569 64 HG21 VAL 8 1HG2 VAL 8 10.567 -0.079 -26.232 65 HG22 VAL 8 2HG2 VAL 8 9.254 0.948 -26.853 66 HG23 VAL 8 3HG2 VAL 8 9.450 0.709 -25.105 67 H LEU 9 H LEU 9 5.561 -1.379 -27.824 68 HA LEU 9 HA LEU 9 4.554 -3.608 -26.134 69 HB2 LEU 9 1HB LEU 9 3.041 -3.609 -28.438 70 HB3 LEU 9 2HB LEU 9 2.555 -3.049 -26.855 71 HG LEU 9 HG LEU 9 3.829 -1.192 -28.864 72 HD11 LEU 9 1HD1 LEU 9 0.888 -1.905 -28.531 73 HD12 LEU 9 2HD1 LEU 9 1.914 -2.279 -29.937 74 HD13 LEU 9 3HD1 LEU 9 1.528 -0.590 -29.548 75 HD21 LEU 9 1HD2 LEU 9 2.582 0.529 -27.570 76 HD22 LEU 9 2HD2 LEU 9 3.627 -0.401 -26.480 77 HD23 LEU 9 3HD2 LEU 9 1.888 -0.738 -26.530 78 H ALA 10 H ALA 10 4.248 -5.663 -26.981 79 HA ALA 10 HA ALA 10 5.861 -6.295 -29.380 80 HB1 ALA 10 1HB ALA 10 7.371 -6.442 -27.379 81 HB2 ALA 10 2HB ALA 10 6.262 -7.639 -26.670 82 HB3 ALA 10 3HB ALA 10 7.129 -8.009 -28.180 83 H LYS 11 H LYS 11 5.371 -8.317 -30.299 84 HA LYS 11 HA LYS 11 2.697 -9.397 -29.468 85 HB2 LYS 11 1HB LYS 11 2.935 -8.543 -31.793 86 HB3 LYS 11 2HB LYS 11 4.252 -9.686 -32.069 87 HG2 LYS 11 1HG LYS 11 1.922 -11.097 -31.084 88 HG3 LYS 11 2HG LYS 11 1.457 -10.081 -32.450 89 HD2 LYS 11 1HD LYS 11 3.853 -11.942 -32.543 90 HD3 LYS 11 2HD LYS 11 2.215 -12.458 -32.981 91 HE2 LYS 11 1HE LYS 11 2.114 -10.597 -34.653 92 HE3 LYS 11 2HE LYS 11 3.820 -10.238 -34.296 93 HZ1 LYS 11 1HZ LYS 11 3.600 -11.694 -36.213 94 HZ2 LYS 11 2HZ LYS 11 2.779 -12.816 -35.328 95 HZ3 LYS 11 3HZ LYS 11 4.363 -12.499 -34.991 96 H ALA 12 H ALA 12 2.545 -11.499 -28.761 97 HA ALA 12 HA ALA 12 5.028 -12.904 -28.202 98 HB1 ALA 12 1HB ALA 12 3.245 -13.141 -26.637 99 HB2 ALA 12 2HB ALA 12 2.103 -13.622 -27.908 100 HB3 ALA 12 3HB ALA 12 3.424 -14.714 -27.439 101 H LEU 13 H LEU 13 5.980 -14.506 -29.243 102 HA LEU 13 HA LEU 13 5.003 -15.200 -31.964 103 HB2 LEU 13 1HB LEU 13 7.567 -15.783 -30.444 104 HB3 LEU 13 2HB LEU 13 7.252 -16.337 -32.084 105 HG LEU 13 HG LEU 13 7.324 -13.406 -31.297 106 HD11 LEU 13 1HD1 LEU 13 9.503 -14.482 -30.864 107 HD12 LEU 13 2HD1 LEU 13 9.588 -13.376 -32.243 108 HD13 LEU 13 3HD1 LEU 13 9.514 -15.133 -32.522 109 HD21 LEU 13 1HD2 LEU 13 7.377 -14.870 -33.979 110 HD22 LEU 13 2HD2 LEU 13 7.652 -13.127 -33.779 111 HD23 LEU 13 3HD2 LEU 13 6.079 -13.824 -33.356 112 H TYR 14 H TYR 14 5.357 -16.538 -28.771 113 HA TYR 14 HA TYR 14 4.428 -19.206 -29.766 114 HB2 TYR 14 1HB TYR 14 6.200 -18.619 -27.365 115 HB3 TYR 14 2HB TYR 14 5.680 -20.215 -27.919 116 HD1 TYR 14 HD1 TYR 14 6.779 -21.292 -29.852 117 HD2 TYR 14 HD2 TYR 14 7.937 -17.354 -28.587 118 HE1 TYR 14 HE1 TYR 14 8.839 -21.431 -31.265 119 HE2 TYR 14 HE2 TYR 14 10.001 -17.504 -29.973 120 HH TYR 14 HH TYR 14 11.241 -18.789 -31.395 121 H ASP 15 H ASP 15 3.015 -20.293 -28.152 122 HA ASP 15 HA ASP 15 1.637 -18.293 -26.432 123 HB2 ASP 15 1HB ASP 15 -0.164 -19.943 -26.271 124 HB3 ASP 15 2HB ASP 15 0.142 -19.500 -27.951 125 H ASN 16 H ASN 16 1.350 -18.703 -24.255 126 HA ASN 16 HA ASN 16 3.015 -20.887 -23.077 127 HB2 ASN 16 1HB ASN 16 4.391 -18.772 -23.430 128 HB3 ASN 16 2HB ASN 16 3.290 -17.961 -22.305 129 HD21 ASN 16 1HD2 ASN 16 4.936 -19.119 -19.469 130 HD22 ASN 16 2HD2 ASN 16 3.795 -18.014 -20.207 131 H VAL 17 H VAL 17 2.031 -21.748 -21.310 132 HA VAL 17 HA VAL 17 -0.149 -20.160 -20.053 133 HB VAL 17 HB VAL 17 -0.738 -22.446 -19.035 134 HG11 VAL 17 1HG1 VAL 17 -2.068 -23.104 -20.999 135 HG12 VAL 17 2HG1 VAL 17 -2.075 -21.339 -20.788 136 HG13 VAL 17 3HG1 VAL 17 -1.048 -22.077 -22.039 137 HG21 VAL 17 1HG2 VAL 17 1.386 -23.636 -19.671 138 HG22 VAL 17 2HG2 VAL 17 -0.069 -24.463 -20.247 139 HG23 VAL 17 3HG2 VAL 17 0.910 -23.512 -21.383 140 H ALA 18 H ALA 18 0.344 -19.262 -18.189 141 HA ALA 18 HA ALA 18 2.926 -19.927 -16.956 142 HB1 ALA 18 1HB ALA 18 2.397 -17.586 -17.316 143 HB2 ALA 18 2HB ALA 18 0.868 -17.758 -16.415 144 HB3 ALA 18 3HB ALA 18 2.413 -17.922 -15.571 145 H GLU 19 H GLU 19 3.132 -21.180 -15.208 146 HA GLU 19 HA GLU 19 0.685 -21.832 -13.634 147 HB2 GLU 19 1HB GLU 19 1.954 -23.673 -12.717 148 HB3 GLU 19 2HB GLU 19 1.990 -23.724 -14.480 149 HG2 GLU 19 1HG GLU 19 4.271 -22.729 -14.435 150 HG3 GLU 19 2HG GLU 19 4.237 -22.799 -12.663 151 H SER 20 H SER 20 3.534 -19.900 -13.598 152 HA SER 20 HA SER 20 3.612 -19.675 -10.659 153 HB2 SER 20 1HB SER 20 5.695 -19.414 -11.960 154 HB3 SER 20 2HB SER 20 4.960 -18.060 -12.837 155 HG SER 20 HG SER 20 6.321 -17.406 -11.089 156 HA PRO 21 HA PRO 21 0.570 -16.488 -10.908 157 HB2 PRO 21 1HB PRO 21 0.867 -15.200 -8.550 158 HB3 PRO 21 2HB PRO 21 0.234 -16.875 -8.644 159 HG2 PRO 21 1HG PRO 21 3.040 -15.961 -8.070 160 HG3 PRO 21 2HG PRO 21 2.005 -17.080 -7.122 161 HD2 PRO 21 1HD PRO 21 3.822 -17.997 -8.897 162 HD3 PRO 21 2HD PRO 21 2.227 -18.801 -8.693 163 H ASP 22 H ASP 22 3.965 -15.826 -10.570 164 HA ASP 22 HA ASP 22 3.625 -12.911 -10.986 165 HB2 ASP 22 1HB ASP 22 5.303 -13.969 -9.363 166 HB3 ASP 22 2HB ASP 22 6.198 -14.508 -10.794 167 H GLU 23 H GLU 23 3.840 -15.722 -12.872 168 HA GLU 23 HA GLU 23 5.262 -14.380 -15.085 169 HB2 GLU 23 1HB GLU 23 5.906 -16.677 -14.420 170 HB3 GLU 23 2HB GLU 23 4.263 -17.229 -14.754 171 HG2 GLU 23 1HG GLU 23 4.497 -16.648 -17.076 172 HG3 GLU 23 2HG GLU 23 6.089 -15.951 -16.748 173 H LEU 24 H LEU 24 4.229 -13.856 -17.000 174 HA LEU 24 HA LEU 24 1.294 -13.686 -16.747 175 HB2 LEU 24 1HB LEU 24 3.385 -12.243 -18.113 176 HB3 LEU 24 2HB LEU 24 2.148 -12.733 -19.270 177 HG LEU 24 HG LEU 24 1.628 -11.164 -16.724 178 HD11 LEU 24 1HD1 LEU 24 1.313 -9.257 -18.238 179 HD12 LEU 24 2HD1 LEU 24 1.754 -10.278 -19.629 180 HD13 LEU 24 3HD1 LEU 24 2.955 -9.916 -18.364 181 HD21 LEU 24 1HD2 LEU 24 -0.595 -10.700 -17.826 182 HD22 LEU 24 2HD2 LEU 24 -0.372 -12.386 -17.329 183 HD23 LEU 24 3HD2 LEU 24 -0.194 -11.938 -19.042 184 H SER 25 H SER 25 -0.136 -14.905 -17.768 185 HA SER 25 HA SER 25 0.787 -17.028 -19.613 186 HB2 SER 25 1HB SER 25 -0.927 -17.490 -17.833 187 HB3 SER 25 2HB SER 25 -2.008 -16.320 -18.610 188 HG SER 25 HG SER 25 -2.385 -18.528 -19.215 189 H PHE 26 H PHE 26 0.434 -16.912 -21.841 190 HA PHE 26 HA PHE 26 -1.278 -14.795 -22.959 191 HB2 PHE 26 1HB PHE 26 0.570 -13.745 -24.245 192 HB3 PHE 26 2HB PHE 26 0.703 -13.477 -22.506 193 HD1 PHE 26 HD1 PHE 26 2.117 -15.453 -25.349 194 HD2 PHE 26 HD2 PHE 26 2.592 -14.197 -21.258 195 HE1 PHE 26 HE1 PHE 26 4.458 -16.307 -25.355 196 HE2 PHE 26 HE2 PHE 26 4.902 -15.085 -21.244 197 HZ PHE 26 HZ PHE 26 5.854 -16.132 -23.296 198 H ARG 27 H ARG 27 -1.180 -14.845 -25.415 199 HA ARG 27 HA ARG 27 -0.490 -17.622 -26.299 200 HB2 ARG 27 1HB ARG 27 -2.844 -15.920 -27.155 201 HB3 ARG 27 2HB ARG 27 -2.412 -17.476 -27.859 202 HG2 ARG 27 1HG ARG 27 -3.228 -17.053 -24.950 203 HG3 ARG 27 2HG ARG 27 -4.283 -17.665 -26.238 204 HD2 ARG 27 1HD ARG 27 -2.734 -19.580 -26.580 205 HD3 ARG 27 2HD ARG 27 -1.724 -18.983 -25.250 206 HE ARG 27 HE ARG 27 -4.344 -19.285 -24.261 207 HH11 ARG 27 1HH1 ARG 27 -1.719 -21.375 -25.436 208 HH12 ARG 27 2HH1 ARG 27 -2.210 -22.694 -24.416 209 HH21 ARG 27 1HH2 ARG 27 -4.894 -21.033 -23.005 210 HH22 ARG 27 2HH2 ARG 27 -3.972 -22.509 -23.078 211 H LYS 28 H LYS 28 0.133 -17.887 -28.463 212 HA LYS 28 HA LYS 28 1.799 -15.810 -29.520 213 HB2 LYS 28 1HB LYS 28 1.846 -17.205 -31.601 214 HB3 LYS 28 2HB LYS 28 2.259 -18.070 -30.133 215 HG2 LYS 28 1HG LYS 28 -0.258 -18.809 -30.135 216 HG3 LYS 28 2HG LYS 28 -0.182 -18.384 -31.855 217 HD2 LYS 28 1HD LYS 28 1.669 -19.947 -32.189 218 HD3 LYS 28 2HD LYS 28 1.789 -20.220 -30.441 219 HE2 LYS 28 1HE LYS 28 -0.708 -20.979 -30.625 220 HE3 LYS 28 2HE LYS 28 -0.340 -21.181 -32.352 221 HZ1 LYS 28 1HZ LYS 28 0.066 -23.220 -31.101 222 HZ2 LYS 28 2HZ LYS 28 1.114 -22.450 -30.083 223 HZ3 LYS 28 3HZ LYS 28 1.502 -22.648 -31.680 224 H GLY 29 H GLY 29 1.393 -14.136 -30.811 225 HA2 GLY 29 1HA GLY 29 0.121 -12.945 -32.453 226 HA3 GLY 29 2HA GLY 29 -1.297 -13.924 -32.073 227 H ASP 30 H ASP 30 -0.577 -13.471 -29.072 228 HA ASP 30 HA ASP 30 -2.353 -11.221 -28.730 229 HB2 ASP 30 1HB ASP 30 -1.850 -13.326 -27.227 230 HB3 ASP 30 2HB ASP 30 -0.574 -12.304 -26.545 231 H ILE 31 H ILE 31 -1.866 -9.246 -27.598 232 HA ILE 31 HA ILE 31 0.903 -8.244 -28.204 233 HB ILE 31 HB ILE 31 -1.687 -6.614 -28.149 234 HG12 ILE 31 1HG1 ILE 31 -1.849 -8.191 -30.004 235 HG13 ILE 31 2HG1 ILE 31 -1.657 -6.541 -30.579 236 HG21 ILE 31 1HG2 ILE 31 -0.245 -4.907 -29.376 237 HG22 ILE 31 2HG2 ILE 31 0.243 -5.219 -27.698 238 HG23 ILE 31 3HG2 ILE 31 1.163 -5.943 -29.035 239 HD11 ILE 31 1HD1 ILE 31 0.676 -6.963 -31.171 240 HD12 ILE 31 2HD1 ILE 31 0.575 -8.601 -30.485 241 HD13 ILE 31 3HD1 ILE 31 -0.379 -8.178 -31.917 242 H MET 32 H MET 32 2.010 -7.490 -26.474 243 HA MET 32 HA MET 32 0.449 -6.538 -24.105 244 HB2 MET 32 1HB MET 32 1.945 -7.757 -22.610 245 HB3 MET 32 2HB MET 32 1.112 -8.862 -23.700 246 HG2 MET 32 1HG MET 32 3.272 -8.657 -25.167 247 HG3 MET 32 2HG MET 32 4.015 -8.076 -23.664 248 HE1 MET 32 1HE MET 32 2.426 -12.282 -24.627 249 HE2 MET 32 2HE MET 32 1.292 -10.913 -24.630 250 HE3 MET 32 3HE MET 32 2.671 -10.928 -25.755 251 H THR 33 H THR 33 1.729 -5.124 -22.700 252 HA THR 33 HA THR 33 3.746 -3.653 -24.354 253 HB THR 33 HB THR 33 2.117 -2.602 -22.007 254 HG1 THR 33 HG1 THR 33 0.728 -2.979 -23.693 255 HG21 THR 33 1HG2 THR 33 3.837 -1.229 -24.119 256 HG22 THR 33 2HG2 THR 33 4.184 -1.330 -22.374 257 HG23 THR 33 3HG2 THR 33 2.791 -0.390 -22.953 258 H VAL 34 H VAL 34 5.793 -3.578 -23.741 259 HA VAL 34 HA VAL 34 6.593 -4.922 -21.245 260 HB VAL 34 HB VAL 34 8.246 -3.468 -23.384 261 HG11 VAL 34 1HG1 VAL 34 9.471 -3.522 -21.288 262 HG12 VAL 34 2HG1 VAL 34 9.086 -5.239 -21.053 263 HG13 VAL 34 3HG1 VAL 34 10.165 -4.737 -22.375 264 HG21 VAL 34 1HG2 VAL 34 8.850 -5.717 -24.188 265 HG22 VAL 34 2HG2 VAL 34 7.810 -6.461 -22.954 266 HG23 VAL 34 3HG2 VAL 34 7.092 -5.493 -24.266 267 H LEU 35 H LEU 35 6.823 -3.913 -19.382 268 HA LEU 35 HA LEU 35 6.598 -0.963 -19.296 269 HB2 LEU 35 1HB LEU 35 6.751 -3.079 -17.109 270 HB3 LEU 35 2HB LEU 35 6.452 -1.368 -16.846 271 HG LEU 35 HG LEU 35 4.611 -3.253 -18.360 272 HD11 LEU 35 1HD1 LEU 35 3.157 -2.999 -16.366 273 HD12 LEU 35 2HD1 LEU 35 4.432 -2.059 -15.566 274 HD13 LEU 35 3HD1 LEU 35 4.704 -3.768 -15.973 275 HD21 LEU 35 1HD2 LEU 35 4.262 -0.340 -17.525 276 HD22 LEU 35 2HD2 LEU 35 2.969 -1.378 -18.172 277 HD23 LEU 35 3HD2 LEU 35 4.362 -0.966 -19.191 278 H GLU 36 H GLU 36 8.763 -3.595 -18.270 279 HA GLU 36 HA GLU 36 11.127 -1.875 -18.559 280 HB2 GLU 36 1HB GLU 36 11.945 -2.338 -16.301 281 HB3 GLU 36 2HB GLU 36 10.454 -1.390 -16.261 282 HG2 GLU 36 1HG GLU 36 9.180 -3.440 -15.778 283 HG3 GLU 36 2HG GLU 36 10.693 -4.362 -15.749 284 H ARG 37 H ARG 37 13.128 -3.371 -18.080 285 HA ARG 37 HA ARG 37 12.460 -6.144 -19.010 286 HB2 ARG 37 1HB ARG 37 14.845 -4.438 -19.764 287 HB3 ARG 37 2HB ARG 37 14.565 -6.104 -20.263 288 HG2 ARG 37 1HG ARG 37 12.504 -5.311 -21.483 289 HG3 ARG 37 2HG ARG 37 13.026 -3.654 -21.125 290 HD2 ARG 37 1HD ARG 37 14.558 -5.753 -22.722 291 HD3 ARG 37 2HD ARG 37 13.818 -4.279 -23.358 292 HE ARG 37 HE ARG 37 15.547 -2.976 -22.360 293 HH11 ARG 37 1HH1 ARG 37 16.102 -6.423 -21.814 294 HH12 ARG 37 2HH1 ARG 37 17.726 -6.172 -21.239 295 HH21 ARG 37 1HH2 ARG 37 17.670 -2.752 -21.681 296 HH22 ARG 37 2HH2 ARG 37 18.596 -4.155 -21.216 297 H ASP 38 H ASP 38 13.948 -7.754 -18.410 298 HA ASP 38 HA ASP 38 15.318 -8.903 -17.026 299 HB2 ASP 38 1HB ASP 38 16.927 -6.332 -16.890 300 HB3 ASP 38 2HB ASP 38 17.520 -7.982 -16.640 301 H THR 39 H THR 39 13.076 -7.937 -15.897 302 HA THR 39 HA THR 39 13.438 -6.140 -13.731 303 HB THR 39 HB THR 39 11.322 -6.450 -15.017 304 HG1 THR 39 HG1 THR 39 11.096 -5.480 -13.019 305 HG21 THR 39 1HG2 THR 39 11.366 -8.939 -15.171 306 HG22 THR 39 2HG2 THR 39 9.837 -8.326 -14.519 307 HG23 THR 39 3HG2 THR 39 11.034 -9.025 -13.425 308 H GLN 40 H GLN 40 13.990 -9.493 -13.829 309 HA GLN 40 HA GLN 40 13.960 -9.617 -10.833 310 HB2 GLN 40 1HB GLN 40 13.620 -11.630 -13.040 311 HB3 GLN 40 2HB GLN 40 14.115 -12.150 -11.415 312 HG2 GLN 40 1HG GLN 40 12.058 -11.038 -10.504 313 HG3 GLN 40 2HG GLN 40 11.538 -10.738 -12.166 314 HE21 GLN 40 1HE2 GLN 40 9.894 -13.841 -11.057 315 HE22 GLN 40 2HE2 GLN 40 9.857 -12.158 -10.610 316 H GLY 41 H GLY 41 15.988 -8.719 -13.155 317 HA2 GLY 41 1HA GLY 41 18.317 -8.632 -13.128 318 HA3 GLY 41 2HA GLY 41 18.356 -9.816 -11.806 319 H LEU 42 H LEU 42 16.305 -11.262 -13.759 320 HA LEU 42 HA LEU 42 18.313 -13.009 -14.953 321 HB2 LEU 42 1HB LEU 42 15.283 -12.944 -15.201 322 HB3 LEU 42 2HB LEU 42 16.323 -14.219 -15.822 323 HG LEU 42 HG LEU 42 15.938 -13.546 -12.886 324 HD11 LEU 42 1HD1 LEU 42 14.617 -15.619 -12.832 325 HD12 LEU 42 2HD1 LEU 42 14.853 -15.834 -14.584 326 HD13 LEU 42 3HD1 LEU 42 13.912 -14.455 -13.966 327 HD21 LEU 42 1HD2 LEU 42 17.405 -15.849 -14.247 328 HD22 LEU 42 2HD2 LEU 42 17.057 -15.738 -12.506 329 HD23 LEU 42 3HD2 LEU 42 18.135 -14.553 -13.266 330 H ASP 43 H ASP 43 19.155 -12.729 -16.914 331 HA ASP 43 HA ASP 43 18.508 -10.511 -18.570 332 HB2 ASP 43 1HB ASP 43 20.693 -11.715 -18.601 333 HB3 ASP 43 2HB ASP 43 19.886 -13.126 -19.303 334 H GLY 44 H GLY 44 17.046 -10.189 -20.093 335 HA2 GLY 44 1HA GLY 44 15.639 -10.742 -21.849 336 HA3 GLY 44 2HA GLY 44 15.971 -12.453 -21.585 337 H TRP 45 H TRP 45 14.976 -11.308 -18.577 338 HA TRP 45 HA TRP 45 12.189 -12.202 -19.222 339 HB2 TRP 45 1HB TRP 45 13.800 -12.095 -16.682 340 HB3 TRP 45 2HB TRP 45 12.033 -12.236 -16.659 341 HD1 TRP 45 HD1 TRP 45 15.157 -14.221 -17.671 342 HE1 TRP 45 HE1 TRP 45 14.565 -16.666 -18.036 343 HE3 TRP 45 HE3 TRP 45 10.077 -13.764 -17.358 344 HZ2 TRP 45 HZ2 TRP 45 12.180 -18.246 -18.159 345 HZ3 TRP 45 HZ3 TRP 45 8.663 -15.815 -17.590 346 HH2 TRP 45 HH2 TRP 45 9.719 -18.036 -17.986 347 H TRP 46 H TRP 46 10.919 -10.594 -19.837 348 HA TRP 46 HA TRP 46 11.437 -7.909 -18.687 349 HB2 TRP 46 1HB TRP 46 9.789 -8.731 -21.086 350 HB3 TRP 46 2HB TRP 46 10.237 -7.084 -20.634 351 HD1 TRP 46 HD1 TRP 46 13.400 -8.550 -20.030 352 HE1 TRP 46 HE1 TRP 46 14.961 -8.683 -22.014 353 HE3 TRP 46 HE3 TRP 46 9.902 -7.876 -23.695 354 HZ2 TRP 46 HZ2 TRP 46 14.745 -8.500 -24.863 355 HZ3 TRP 46 HZ3 TRP 46 10.648 -7.897 -26.080 356 HH2 TRP 46 HH2 TRP 46 13.059 -8.188 -26.650 357 H LEU 47 H LEU 47 9.846 -6.665 -17.726 358 HA LEU 47 HA LEU 47 7.521 -8.185 -16.730 359 HB2 LEU 47 1HB LEU 47 8.834 -6.553 -15.301 360 HB3 LEU 47 2HB LEU 47 8.277 -5.274 -16.361 361 HG LEU 47 HG LEU 47 5.910 -5.851 -15.708 362 HD11 LEU 47 1HD1 LEU 47 5.588 -7.144 -13.628 363 HD12 LEU 47 2HD1 LEU 47 7.325 -7.523 -13.584 364 HD13 LEU 47 3HD1 LEU 47 6.304 -8.152 -14.894 365 HD21 LEU 47 1HD2 LEU 47 6.083 -4.721 -13.522 366 HD22 LEU 47 2HD2 LEU 47 7.139 -3.960 -14.723 367 HD23 LEU 47 3HD2 LEU 47 7.833 -5.037 -13.490 368 H CYS 48 H CYS 48 5.835 -8.377 -18.081 369 HA CYS 48 HA CYS 48 5.259 -6.065 -19.901 370 HB2 CYS 48 1HB CYS 48 4.493 -8.987 -20.181 371 HB3 CYS 48 2HB CYS 48 4.120 -7.694 -21.330 372 HG CYS 48 HG CYS 48 7.063 -8.821 -20.356 373 H SER 49 H SER 49 2.929 -5.727 -20.308 374 HA SER 49 HA SER 49 1.252 -6.545 -17.971 375 HB2 SER 49 1HB SER 49 0.103 -4.315 -18.279 376 HB3 SER 49 2HB SER 49 1.761 -4.234 -17.651 377 HG SER 49 HG SER 49 2.491 -3.707 -19.717 378 H LEU 50 H LEU 50 -0.608 -7.462 -18.428 379 HA LEU 50 HA LEU 50 -1.973 -7.197 -21.013 380 HB2 LEU 50 1HB LEU 50 -0.102 -8.762 -21.532 381 HB3 LEU 50 2HB LEU 50 -0.595 -9.776 -20.191 382 HG LEU 50 HG LEU 50 -2.727 -10.276 -21.375 383 HD11 LEU 50 1HD1 LEU 50 -2.839 -9.786 -23.809 384 HD12 LEU 50 2HD1 LEU 50 -1.391 -8.770 -23.651 385 HD13 LEU 50 3HD1 LEU 50 -2.894 -8.310 -22.828 386 HD21 LEU 50 1HD2 LEU 50 -0.815 -11.781 -21.471 387 HD22 LEU 50 2HD2 LEU 50 -0.149 -10.876 -22.852 388 HD23 LEU 50 3HD2 LEU 50 -1.676 -11.770 -23.022 389 H HIS 51 H HIS 51 -4.119 -8.003 -20.811 390 HA HIS 51 HA HIS 51 -6.028 -8.721 -19.777 391 HB2 HIS 51 1HB HIS 51 -4.453 -10.811 -19.910 392 HB3 HIS 51 2HB HIS 51 -4.397 -10.670 -18.151 393 HD1 HIS 51 HD1 HIS 51 -5.706 -13.130 -19.590 394 HD2 HIS 51 HD2 HIS 51 -7.786 -9.782 -18.240 395 HE1 HIS 51 HE1 HIS 51 -8.108 -13.847 -19.234 396 H GLY 52 H GLY 52 -4.595 -6.511 -18.385 397 HA2 GLY 52 1HA GLY 52 -5.104 -5.262 -16.496 398 HA3 GLY 52 2HA GLY 52 -6.203 -6.547 -15.974 399 H ARG 53 H ARG 53 -3.106 -7.733 -16.702 400 HA ARG 53 HA ARG 53 -2.250 -7.603 -13.830 401 HB2 ARG 53 1HB ARG 53 -1.863 -9.875 -15.827 402 HB3 ARG 53 2HB ARG 53 -1.265 -9.836 -14.169 403 HG2 ARG 53 1HG ARG 53 -3.655 -9.767 -13.390 404 HG3 ARG 53 2HG ARG 53 -4.139 -10.042 -15.082 405 HD2 ARG 53 1HD ARG 53 -2.658 -12.066 -15.107 406 HD3 ARG 53 2HD ARG 53 -2.356 -11.815 -13.376 407 HE ARG 53 HE ARG 53 -5.175 -11.932 -13.918 408 HH11 ARG 53 1HH1 ARG 53 -2.343 -14.022 -13.582 409 HH12 ARG 53 2HH1 ARG 53 -3.299 -15.408 -13.136 410 HH21 ARG 53 1HH2 ARG 53 -6.334 -13.748 -13.347 411 HH22 ARG 53 2HH2 ARG 53 -5.520 -15.251 -13.002 412 H GLN 54 H GLN 54 0.138 -7.929 -13.665 413 HA GLN 54 HA GLN 54 1.585 -7.460 -16.201 414 HB2 GLN 54 1HB GLN 54 3.242 -6.063 -15.055 415 HB3 GLN 54 2HB GLN 54 1.655 -5.291 -15.038 416 HG2 GLN 54 1HG GLN 54 1.320 -6.019 -12.711 417 HG3 GLN 54 2HG GLN 54 2.910 -6.800 -12.729 418 HE21 GLN 54 1HE2 GLN 54 4.394 -3.902 -11.550 419 HE22 GLN 54 2HE2 GLN 54 4.232 -5.641 -11.493 420 H GLY 55 H GLY 55 3.643 -8.602 -16.136 421 HA2 GLY 55 1HA GLY 55 4.400 -10.191 -13.874 422 HA3 GLY 55 2HA GLY 55 3.394 -11.157 -14.973 423 H ILE 56 H ILE 56 5.980 -11.927 -14.545 424 HA ILE 56 HA ILE 56 7.747 -10.689 -16.488 425 HB ILE 56 HB ILE 56 9.380 -12.373 -15.859 426 HG12 ILE 56 1HG1 ILE 56 7.184 -13.761 -14.278 427 HG13 ILE 56 2HG1 ILE 56 7.811 -14.332 -15.822 428 HG21 ILE 56 1HG2 ILE 56 7.874 -11.648 -13.300 429 HG22 ILE 56 2HG2 ILE 56 9.626 -11.814 -13.541 430 HG23 ILE 56 3HG2 ILE 56 8.763 -10.449 -14.267 431 HD11 ILE 56 1HD1 ILE 56 8.868 -15.634 -14.146 432 HD12 ILE 56 2HD1 ILE 56 10.101 -14.485 -14.711 433 HD13 ILE 56 3HD1 ILE 56 9.260 -14.207 -13.168 434 H VAL 57 H VAL 57 8.427 -11.392 -18.440 435 HA VAL 57 HA VAL 57 7.127 -13.792 -19.641 436 HB VAL 57 HB VAL 57 7.169 -10.970 -20.823 437 HG11 VAL 57 1HG1 VAL 57 5.927 -12.044 -22.744 438 HG12 VAL 57 2HG1 VAL 57 7.653 -12.440 -22.628 439 HG13 VAL 57 3HG1 VAL 57 6.432 -13.612 -22.091 440 HG21 VAL 57 1HG2 VAL 57 4.873 -12.780 -20.021 441 HG22 VAL 57 2HG2 VAL 57 5.342 -11.233 -19.274 442 HG23 VAL 57 3HG2 VAL 57 4.697 -11.257 -20.926 443 HA PRO 58 HA PRO 58 11.389 -13.806 -20.923 444 HB2 PRO 58 1HB PRO 58 11.455 -15.940 -22.629 445 HB3 PRO 58 2HB PRO 58 11.355 -16.130 -20.847 446 HG2 PRO 58 1HG PRO 58 9.155 -16.229 -22.887 447 HG3 PRO 58 2HG PRO 58 9.491 -17.351 -21.538 448 HD2 PRO 58 1HD PRO 58 7.626 -15.371 -21.407 449 HD3 PRO 58 2HD PRO 58 8.556 -15.920 -19.975 450 H GLY 59 H GLY 59 12.071 -12.252 -22.238 451 HA2 GLY 59 1HA GLY 59 10.612 -11.126 -24.352 452 HA3 GLY 59 2HA GLY 59 12.329 -10.892 -24.044 453 H ASN 60 H ASN 60 12.855 -13.819 -24.433 454 HA ASN 60 HA ASN 60 13.463 -13.754 -27.227 455 HB2 ASN 60 1HB ASN 60 14.600 -15.138 -25.442 456 HB3 ASN 60 2HB ASN 60 13.192 -16.213 -25.461 457 HD21 ASN 60 1HD2 ASN 60 14.857 -18.112 -27.856 458 HD22 ASN 60 2HD2 ASN 60 14.130 -18.026 -26.271 459 H ARG 61 H ARG 61 10.539 -14.669 -25.502 460 HA ARG 61 HA ARG 61 9.494 -16.102 -27.882 461 HB2 ARG 61 1HB ARG 61 8.249 -15.528 -25.166 462 HB3 ARG 61 2HB ARG 61 7.467 -16.428 -26.468 463 HG2 ARG 61 1HG ARG 61 9.439 -18.039 -26.384 464 HG3 ARG 61 2HG ARG 61 9.897 -17.245 -24.864 465 HD2 ARG 61 1HD ARG 61 7.569 -17.709 -24.008 466 HD3 ARG 61 2HD ARG 61 7.252 -18.631 -25.483 467 HE ARG 61 HE ARG 61 8.800 -19.461 -23.159 468 HH11 ARG 61 1HH1 ARG 61 8.269 -20.121 -26.598 469 HH12 ARG 61 2HH1 ARG 61 8.851 -21.757 -26.457 470 HH21 ARG 61 1HH2 ARG 61 9.521 -21.548 -23.072 471 HH22 ARG 61 2HH2 ARG 61 9.551 -22.545 -24.500 472 H LEU 62 H LEU 62 9.956 -12.945 -27.260 473 HA LEU 62 HA LEU 62 7.267 -12.121 -28.296 474 HB2 LEU 62 1HB LEU 62 9.326 -10.545 -26.719 475 HB3 LEU 62 2HB LEU 62 7.817 -9.910 -27.344 476 HG LEU 62 HG LEU 62 8.058 -12.018 -25.181 477 HD11 LEU 62 1HD1 LEU 62 8.802 -9.797 -24.440 478 HD12 LEU 62 2HD1 LEU 62 7.239 -10.191 -23.705 479 HD13 LEU 62 3HD1 LEU 62 7.311 -9.061 -25.071 480 HD21 LEU 62 1HD2 LEU 62 5.645 -10.612 -26.398 481 HD22 LEU 62 2HD2 LEU 62 5.609 -11.538 -24.884 482 HD23 LEU 62 3HD2 LEU 62 6.003 -12.359 -26.397 483 H LYS 63 H LYS 63 7.174 -10.436 -29.819 484 HA LYS 63 HA LYS 63 9.750 -9.888 -31.252 485 HB2 LYS 63 1HB LYS 63 8.008 -11.373 -32.444 486 HB3 LYS 63 2HB LYS 63 6.993 -9.939 -32.523 487 HG2 LYS 63 1HG LYS 63 8.071 -10.045 -34.611 488 HG3 LYS 63 2HG LYS 63 8.974 -8.806 -33.720 489 HD2 LYS 63 1HD LYS 63 10.700 -10.500 -33.138 490 HD3 LYS 63 2HD LYS 63 9.771 -11.735 -34.009 491 HE2 LYS 63 1HE LYS 63 10.022 -10.417 -36.105 492 HE3 LYS 63 2HE LYS 63 11.012 -9.235 -35.220 493 HZ1 LYS 63 1HZ LYS 63 11.670 -12.112 -35.567 494 HZ2 LYS 63 2HZ LYS 63 12.590 -11.023 -34.740 495 HZ3 LYS 63 3HZ LYS 63 12.388 -10.864 -36.371 496 H ILE 64 H ILE 64 10.287 -7.824 -30.959 497 HA ILE 64 HA ILE 64 8.546 -5.848 -29.846 498 HB ILE 64 HB ILE 64 11.145 -5.510 -31.443 499 HG12 ILE 64 1HG1 ILE 64 11.473 -6.913 -29.454 500 HG13 ILE 64 2HG1 ILE 64 12.279 -5.357 -29.288 501 HG21 ILE 64 1HG2 ILE 64 11.299 -3.310 -30.134 502 HG22 ILE 64 2HG2 ILE 64 10.065 -3.364 -31.408 503 HG23 ILE 64 3HG2 ILE 64 9.587 -3.541 -29.707 504 HD11 ILE 64 1HD1 ILE 64 11.272 -5.954 -27.157 505 HD12 ILE 64 2HD1 ILE 64 10.386 -4.567 -27.807 506 HD13 ILE 64 3HD1 ILE 64 9.684 -6.199 -27.907 507 H LEU 65 H LEU 65 7.163 -4.453 -30.769 508 HA LEU 65 HA LEU 65 6.599 -4.821 -33.651 509 HB2 LEU 65 1HB LEU 65 5.144 -3.391 -31.396 510 HB3 LEU 65 2HB LEU 65 4.551 -3.461 -33.057 511 HG LEU 65 HG LEU 65 5.053 -5.930 -31.372 512 HD11 LEU 65 1HD1 LEU 65 3.307 -4.481 -30.397 513 HD12 LEU 65 2HD1 LEU 65 2.660 -6.007 -31.017 514 HD13 LEU 65 3HD1 LEU 65 2.435 -4.504 -31.946 515 HD21 LEU 65 1HD2 LEU 65 3.641 -5.450 -34.031 516 HD22 LEU 65 2HD2 LEU 65 3.537 -6.960 -33.109 517 HD23 LEU 65 3HD2 LEU 65 5.102 -6.428 -33.746 518 H VAL 66 H VAL 66 5.429 -2.358 -34.214 519 HA VAL 66 HA VAL 66 7.683 -0.854 -35.054 520 HB VAL 66 HB VAL 66 5.465 -0.885 -36.218 521 HG11 VAL 66 1HG1 VAL 66 3.604 0.495 -35.427 522 HG12 VAL 66 2HG1 VAL 66 3.996 -0.742 -34.218 523 HG13 VAL 66 3HG1 VAL 66 4.514 0.939 -33.965 524 HG21 VAL 66 1HG2 VAL 66 5.455 1.444 -36.909 525 HG22 VAL 66 2HG2 VAL 66 6.326 1.931 -35.439 526 HG23 VAL 66 3HG2 VAL 66 7.131 0.914 -36.660 527 H GLY 67 H GLY 67 8.593 1.055 -34.323 528 HA2 GLY 67 1HA GLY 67 7.666 2.606 -32.135 529 HA3 GLY 67 2HA GLY 67 8.821 1.380 -31.537 530 H MET 68 H MET 68 9.967 3.700 -31.214 531 HA MET 68 HA MET 68 11.217 4.672 -33.689 532 HB2 MET 68 1HB MET 68 11.654 5.370 -30.761 533 HB3 MET 68 2HB MET 68 12.489 6.142 -32.116 534 HG2 MET 68 1HG MET 68 10.318 6.905 -33.012 535 HG3 MET 68 2HG MET 68 9.498 6.186 -31.611 536 HE1 MET 68 1HE MET 68 9.352 10.076 -30.871 537 HE2 MET 68 2HE MET 68 9.241 9.298 -32.467 538 HE3 MET 68 3HE MET 68 8.395 8.589 -31.068 539 H TYR 69 H TYR 69 13.026 3.927 -34.537 540 HA TYR 69 HA TYR 69 15.302 3.125 -32.960 541 HB2 TYR 69 1HB TYR 69 15.363 0.841 -34.281 542 HB3 TYR 69 2HB TYR 69 14.516 0.945 -32.738 543 HD1 TYR 69 HD1 TYR 69 12.391 -0.015 -32.585 544 HD2 TYR 69 HD2 TYR 69 13.725 1.408 -36.427 545 HE1 TYR 69 HE1 TYR 69 10.307 -0.901 -33.657 546 HE2 TYR 69 HE2 TYR 69 11.642 0.558 -37.468 547 HH TYR 69 HH TYR 69 9.649 -0.441 -37.151 548 H ASP 70 H ASP 70 17.164 3.137 -34.379 549 HA ASP 70 HA ASP 70 16.759 4.648 -36.803 550 HB2 ASP 70 1HB ASP 70 19.238 3.084 -36.005 551 HB3 ASP 70 2HB ASP 70 19.154 4.526 -37.028 552 H LYS 71 H LYS 71 17.642 1.306 -36.046 553 HA LYS 71 HA LYS 71 17.683 -0.652 -37.276 554 HB2 LYS 71 1HB LYS 71 15.226 0.611 -37.784 555 HB3 LYS 71 2HB LYS 71 15.804 0.185 -39.382 556 HG2 LYS 71 1HG LYS 71 14.465 -1.628 -38.673 557 HG3 LYS 71 2HG LYS 71 16.133 -2.198 -38.489 558 HD2 LYS 71 1HD LYS 71 15.953 -2.349 -36.216 559 HD3 LYS 71 2HD LYS 71 15.030 -0.842 -36.101 560 HE2 LYS 71 1HE LYS 71 13.032 -2.092 -37.038 561 HE3 LYS 71 2HE LYS 71 13.966 -3.590 -36.847 562 HZ1 LYS 71 1HZ LYS 71 14.131 -3.061 -34.463 563 HZ2 LYS 71 2HZ LYS 71 12.552 -3.190 -34.935 564 HZ3 LYS 71 3HZ LYS 71 13.216 -1.702 -34.680 565 H LYS 72 H LYS 72 17.412 -1.217 -39.966 566 HA LYS 72 HA LYS 72 19.332 0.577 -41.356 567 HB2 LYS 72 1HB LYS 72 20.345 -1.318 -42.474 568 HB3 LYS 72 2HB LYS 72 20.504 -1.538 -40.730 569 HG2 LYS 72 1HG LYS 72 18.558 -3.108 -40.792 570 HG3 LYS 72 2HG LYS 72 18.520 -2.925 -42.559 571 HD2 LYS 72 1HD LYS 72 20.919 -3.651 -42.606 572 HD3 LYS 72 2HD LYS 72 20.787 -4.008 -40.869 573 HE2 LYS 72 1HE LYS 72 18.986 -5.625 -41.334 574 HE3 LYS 72 2HE LYS 72 19.053 -5.223 -43.064 575 HZ1 LYS 72 1HZ LYS 72 20.304 -7.231 -42.574 576 HZ2 LYS 72 2HZ LYS 72 21.273 -6.428 -41.505 577 HZ3 LYS 72 3HZ LYS 72 21.325 -6.054 -43.112 578 HA PRO 73 HA PRO 73 15.846 0.545 -44.042 579 HB2 PRO 73 1HB PRO 73 16.834 0.513 -46.605 580 HB3 PRO 73 2HB PRO 73 16.919 1.963 -45.552 581 HG2 PRO 73 1HG PRO 73 19.028 -0.135 -46.045 582 HG3 PRO 73 2HG PRO 73 19.169 1.651 -46.144 583 HD2 PRO 73 1HD PRO 73 19.950 0.321 -43.943 584 HD3 PRO 73 2HD PRO 73 19.095 1.897 -43.804 585 H ALA 74 H ALA 74 14.481 -0.945 -45.066 586 HA ALA 74 HA ALA 74 15.473 -3.490 -46.091 587 HB1 ALA 74 1HB ALA 74 14.328 -4.869 -44.368 588 HB2 ALA 74 2HB ALA 74 15.596 -3.874 -43.615 589 HB3 ALA 74 3HB ALA 74 13.887 -3.397 -43.468 590 H GLY 75 H GLY 75 13.424 -4.899 -46.520 591 HA2 GLY 75 1HA GLY 75 10.890 -3.459 -46.719 592 HA3 GLY 75 2HA GLY 75 11.675 -3.792 -48.286 593 H GLU 76 H GLU 76 10.981 -5.634 -49.179 594 HA GLU 76 HA GLU 76 10.410 -7.812 -49.473 595 HB2 GLU 76 1HB GLU 76 12.722 -7.830 -48.300 596 HB3 GLU 76 2HB GLU 76 11.858 -8.499 -46.918 597 HG2 GLU 76 1HG GLU 76 11.093 -10.389 -48.322 598 HG3 GLU 76 2HG GLU 76 11.929 -9.684 -49.717 599 H PHE 77 H PHE 77 8.282 -6.491 -48.459 600 HA PHE 77 HA PHE 77 6.906 -8.730 -47.155 601 HB2 PHE 77 1HB PHE 77 5.847 -7.362 -45.445 602 HB3 PHE 77 2HB PHE 77 7.599 -7.287 -45.239 603 HD1 PHE 77 HD1 PHE 77 4.578 -5.393 -46.261 604 HD2 PHE 77 HD2 PHE 77 8.824 -5.213 -45.594 605 HE1 PHE 77 HE1 PHE 77 4.481 -2.907 -46.358 606 HE2 PHE 77 HE2 PHE 77 8.743 -2.725 -45.696 607 HZ PHE 77 HZ PHE 77 6.569 -1.565 -46.087 608 H ILE 78 H ILE 78 4.521 -8.399 -47.322 609 HA ILE 78 HA ILE 78 3.653 -6.310 -49.226 610 HB ILE 78 HB ILE 78 2.252 -7.983 -50.455 611 HG12 ILE 78 1HG1 ILE 78 3.941 -10.121 -49.095 612 HG13 ILE 78 2HG1 ILE 78 2.294 -9.715 -48.607 613 HG21 ILE 78 1HG2 ILE 78 4.506 -7.234 -51.336 614 HG22 ILE 78 2HG2 ILE 78 5.215 -8.714 -50.652 615 HG23 ILE 78 3HG2 ILE 78 3.991 -8.820 -51.940 616 HD11 ILE 78 1HD1 ILE 78 1.484 -10.343 -50.894 617 HD12 ILE 78 2HD1 ILE 78 3.136 -10.880 -51.290 618 HD13 ILE 78 3HD1 ILE 78 2.223 -11.690 -49.999 619 H VAL 79 H VAL 79 1.262 -6.041 -49.036 620 HA VAL 79 HA VAL 79 -0.155 -7.411 -46.912 621 HB VAL 79 HB VAL 79 1.347 -5.779 -45.614 622 HG11 VAL 79 1HG1 VAL 79 1.369 -3.946 -47.284 623 HG12 VAL 79 2HG1 VAL 79 -0.347 -3.626 -46.945 624 HG13 VAL 79 3HG1 VAL 79 0.874 -3.386 -45.674 625 HG21 VAL 79 1HG2 VAL 79 -0.826 -6.606 -44.712 626 HG22 VAL 79 2HG2 VAL 79 -0.373 -4.999 -44.111 627 HG23 VAL 79 3HG2 VAL 79 -1.617 -5.150 -45.367 628 H THR 80 H THR 80 -2.416 -6.653 -46.952 629 HA THR 80 HA THR 80 -4.318 -6.073 -48.056 630 HB THR 80 HB THR 80 -2.877 -3.520 -48.849 631 HG1 THR 80 HG1 THR 80 -3.142 -2.859 -46.755 632 HG21 THR 80 1HG2 THR 80 -5.712 -4.132 -47.884 633 HG22 THR 80 2HG2 THR 80 -5.245 -3.730 -49.558 634 HG23 THR 80 3HG2 THR 80 -5.075 -2.517 -48.271 635 H ASP 81 H ASP 81 -3.987 -7.794 -49.613 636 HA ASP 81 HA ASP 81 -2.937 -7.550 -52.195 637 HB2 ASP 81 1HB ASP 81 -5.504 -9.075 -51.577 638 HB3 ASP 81 2HB ASP 81 -4.234 -9.511 -52.721 639 HXT ASP 81 H02 ASP 81 -5.680 -6.431 -51.059 Start of MODEL 16 1 H2 GLY 1 2H0 GLY 1 1.795 14.762 -19.274 2 H GLY 1 1H0 GLY 1 2.124 15.972 -18.236 3 HA2 GLY 1 1HA GLY 1 4.204 14.313 -19.559 4 HA3 GLY 1 2HA GLY 1 4.487 15.548 -18.315 5 H SER 2 H SER 2 5.648 13.936 -17.232 6 HA SER 2 HA SER 2 6.001 12.383 -15.586 7 HB2 SER 2 1HB SER 2 4.417 14.038 -14.472 8 HB3 SER 2 2HB SER 2 3.122 12.858 -14.752 9 HG SER 2 HG SER 2 4.282 11.368 -13.522 10 H MET 3 H MET 3 5.048 11.306 -18.120 11 HA MET 3 HA MET 3 3.632 8.851 -17.160 12 HB2 MET 3 1HB MET 3 2.527 8.790 -19.345 13 HB3 MET 3 2HB MET 3 2.192 10.307 -18.505 14 HG2 MET 3 1HG MET 3 3.895 11.456 -19.893 15 HG3 MET 3 2HG MET 3 4.228 9.939 -20.737 16 HE1 MET 3 1HE MET 3 1.965 13.094 -20.500 17 HE2 MET 3 2HE MET 3 0.425 12.545 -21.198 18 HE3 MET 3 3HE MET 3 0.947 11.940 -19.610 19 H LYS 4 H LYS 4 6.646 9.517 -17.716 20 HA LYS 4 HA LYS 4 7.138 7.796 -20.042 21 HB2 LYS 4 1HB LYS 4 8.997 9.324 -18.206 22 HB3 LYS 4 2HB LYS 4 9.569 8.213 -19.458 23 HG2 LYS 4 1HG LYS 4 8.280 9.542 -21.156 24 HG3 LYS 4 2HG LYS 4 7.955 10.749 -19.894 25 HD2 LYS 4 1HD LYS 4 10.378 11.091 -19.589 26 HD3 LYS 4 2HD LYS 4 10.714 9.815 -20.779 27 HE2 LYS 4 1HE LYS 4 9.514 11.150 -22.517 28 HE3 LYS 4 2HE LYS 4 9.292 12.453 -21.330 29 HZ1 LYS 4 1HZ LYS 4 11.923 11.408 -22.246 30 HZ2 LYS 4 2HZ LYS 4 11.704 12.639 -21.164 31 HZ3 LYS 4 3HZ LYS 4 11.243 12.827 -22.736 32 H TYR 5 H TYR 5 7.460 5.800 -20.082 33 HA TYR 5 HA TYR 5 9.071 4.394 -18.079 34 HB2 TYR 5 1HB TYR 5 7.549 2.542 -17.821 35 HB3 TYR 5 2HB TYR 5 6.689 3.994 -17.318 36 HD1 TYR 5 HD1 TYR 5 5.093 5.100 -19.102 37 HD2 TYR 5 HD2 TYR 5 6.599 1.074 -19.392 38 HE1 TYR 5 HE1 TYR 5 3.276 4.533 -20.696 39 HE2 TYR 5 HE2 TYR 5 4.764 0.514 -20.985 40 HH TYR 5 HH TYR 5 2.383 2.970 -22.047 41 H LEU 6 H LEU 6 9.208 2.002 -19.501 42 HA LEU 6 HA LEU 6 10.619 2.754 -21.803 43 HB2 LEU 6 1HB LEU 6 9.206 0.146 -21.176 44 HB3 LEU 6 2HB LEU 6 10.279 0.371 -22.552 45 HG LEU 6 HG LEU 6 11.082 0.560 -19.635 46 HD11 LEU 6 1HD1 LEU 6 10.553 -1.700 -20.480 47 HD12 LEU 6 2HD1 LEU 6 12.275 -1.503 -20.096 48 HD13 LEU 6 3HD1 LEU 6 11.735 -1.471 -21.795 49 HD21 LEU 6 1HD2 LEU 6 12.489 2.081 -20.905 50 HD22 LEU 6 2HD2 LEU 6 12.747 0.850 -22.170 51 HD23 LEU 6 3HD2 LEU 6 13.414 0.612 -20.539 52 H ASN 7 H ASN 7 7.186 1.798 -21.642 53 HA ASN 7 HA ASN 7 5.484 1.990 -23.145 54 HB2 ASN 7 1HB ASN 7 6.523 4.413 -22.880 55 HB3 ASN 7 2HB ASN 7 6.886 4.206 -24.596 56 HD21 ASN 7 1HD2 ASN 7 3.377 4.049 -25.494 57 HD22 ASN 7 2HD2 ASN 7 4.895 3.245 -25.846 58 H VAL 8 H VAL 8 7.388 0.045 -23.789 59 HA VAL 8 HA VAL 8 7.422 0.076 -26.795 60 HB VAL 8 HB VAL 8 9.014 -1.623 -24.780 61 HG11 VAL 8 1HG1 VAL 8 8.594 -2.955 -26.771 62 HG12 VAL 8 2HG1 VAL 8 9.056 -1.604 -27.839 63 HG13 VAL 8 3HG1 VAL 8 10.276 -2.405 -26.817 64 HG21 VAL 8 1HG2 VAL 8 11.000 -0.431 -25.689 65 HG22 VAL 8 2HG2 VAL 8 9.922 0.594 -26.664 66 HG23 VAL 8 3HG2 VAL 8 9.865 0.669 -24.894 67 H LEU 9 H LEU 9 6.418 -1.807 -27.800 68 HA LEU 9 HA LEU 9 5.047 -3.657 -25.933 69 HB2 LEU 9 1HB LEU 9 3.003 -3.586 -27.344 70 HB3 LEU 9 2HB LEU 9 3.268 -2.162 -26.361 71 HG LEU 9 HG LEU 9 4.113 -2.087 -29.246 72 HD11 LEU 9 1HD1 LEU 9 1.824 -1.391 -29.861 73 HD12 LEU 9 2HD1 LEU 9 1.270 -1.735 -28.199 74 HD13 LEU 9 3HD1 LEU 9 1.843 -3.057 -29.242 75 HD21 LEU 9 1HD2 LEU 9 3.444 0.290 -29.010 76 HD22 LEU 9 2HD2 LEU 9 4.612 -0.150 -27.752 77 HD23 LEU 9 3HD2 LEU 9 2.890 -0.027 -27.344 78 H ALA 10 H ALA 10 4.484 -5.671 -26.909 79 HA ALA 10 HA ALA 10 5.943 -6.234 -29.436 80 HB1 ALA 10 1HB ALA 10 6.494 -7.649 -26.795 81 HB2 ALA 10 2HB ALA 10 7.262 -7.983 -28.372 82 HB3 ALA 10 3HB ALA 10 7.561 -6.438 -27.550 83 H LYS 11 H LYS 11 5.349 -8.147 -30.459 84 HA LYS 11 HA LYS 11 2.767 -9.289 -29.528 85 HB2 LYS 11 1HB LYS 11 3.003 -8.465 -31.887 86 HB3 LYS 11 2HB LYS 11 4.246 -9.698 -32.153 87 HG2 LYS 11 1HG LYS 11 2.577 -11.477 -31.669 88 HG3 LYS 11 2HG LYS 11 1.354 -10.242 -31.362 89 HD2 LYS 11 1HD LYS 11 0.921 -10.990 -33.527 90 HD3 LYS 11 2HD LYS 11 1.759 -9.438 -33.745 91 HE2 LYS 11 1HE LYS 11 3.875 -10.643 -34.159 92 HE3 LYS 11 2HE LYS 11 3.052 -12.195 -33.881 93 HZ1 LYS 11 1HZ LYS 11 1.642 -11.714 -35.781 94 HZ2 LYS 11 2HZ LYS 11 3.223 -11.672 -36.242 95 HZ3 LYS 11 3HZ LYS 11 2.387 -10.266 -36.032 96 H ALA 12 H ALA 12 2.558 -11.371 -28.869 97 HA ALA 12 HA ALA 12 4.987 -12.861 -28.250 98 HB1 ALA 12 1HB ALA 12 3.366 -14.564 -27.425 99 HB2 ALA 12 2HB ALA 12 3.040 -12.949 -26.759 100 HB3 ALA 12 3HB ALA 12 2.031 -13.584 -28.080 101 H LEU 13 H LEU 13 5.923 -14.457 -29.338 102 HA LEU 13 HA LEU 13 4.864 -15.148 -32.033 103 HB2 LEU 13 1HB LEU 13 7.450 -15.841 -30.585 104 HB3 LEU 13 2HB LEU 13 7.070 -16.304 -32.240 105 HG LEU 13 HG LEU 13 7.299 -13.425 -31.312 106 HD11 LEU 13 1HD1 LEU 13 9.516 -13.452 -32.388 107 HD12 LEU 13 2HD1 LEU 13 9.346 -15.194 -32.701 108 HD13 LEU 13 3HD1 LEU 13 9.440 -14.592 -31.026 109 HD21 LEU 13 1HD2 LEU 13 7.531 -13.012 -33.768 110 HD22 LEU 13 2HD2 LEU 13 5.945 -13.665 -33.326 111 HD23 LEU 13 3HD2 LEU 13 7.172 -14.726 -34.068 112 H TYR 14 H TYR 14 5.441 -16.485 -28.848 113 HA TYR 14 HA TYR 14 4.264 -19.099 -29.711 114 HB2 TYR 14 1HB TYR 14 6.249 -18.614 -27.475 115 HB3 TYR 14 2HB TYR 14 5.651 -20.175 -28.042 116 HD1 TYR 14 HD1 TYR 14 7.993 -17.407 -28.679 117 HD2 TYR 14 HD2 TYR 14 6.496 -21.139 -30.192 118 HE1 TYR 14 HE1 TYR 14 9.931 -17.537 -30.235 119 HE2 TYR 14 HE2 TYR 14 8.434 -21.263 -31.767 120 HH TYR 14 HH TYR 14 10.376 -20.287 -32.481 121 H ASP 15 H ASP 15 3.134 -20.183 -27.809 122 HA ASP 15 HA ASP 15 1.731 -18.096 -26.216 123 HB2 ASP 15 1HB ASP 15 0.057 -19.887 -25.819 124 HB3 ASP 15 2HB ASP 15 0.270 -19.552 -27.537 125 H ASN 16 H ASN 16 1.194 -18.700 -23.966 126 HA ASN 16 HA ASN 16 3.054 -20.608 -22.701 127 HB2 ASN 16 1HB ASN 16 4.229 -18.352 -22.918 128 HB3 ASN 16 2HB ASN 16 2.979 -17.702 -21.845 129 HD21 ASN 16 1HD2 ASN 16 4.790 -18.615 -19.043 130 HD22 ASN 16 2HD2 ASN 16 3.746 -17.465 -19.875 131 H VAL 17 H VAL 17 2.376 -21.328 -20.720 132 HA VAL 17 HA VAL 17 -0.039 -20.015 -19.546 133 HB VAL 17 HB VAL 17 -0.856 -22.129 -20.422 134 HG11 VAL 17 1HG1 VAL 17 1.536 -23.479 -19.088 135 HG12 VAL 17 2HG1 VAL 17 0.177 -24.322 -19.872 136 HG13 VAL 17 3HG1 VAL 17 1.260 -23.299 -20.835 137 HG21 VAL 17 1HG2 VAL 17 -1.551 -21.517 -18.108 138 HG22 VAL 17 2HG2 VAL 17 -1.567 -23.269 -18.389 139 HG23 VAL 17 3HG2 VAL 17 -0.242 -22.529 -17.464 140 H ALA 18 H ALA 18 0.405 -19.267 -17.599 141 HA ALA 18 HA ALA 18 3.141 -19.436 -16.687 142 HB1 ALA 18 1HB ALA 18 1.910 -17.350 -16.446 143 HB2 ALA 18 2HB ALA 18 0.627 -18.164 -15.515 144 HB3 ALA 18 3HB ALA 18 2.239 -17.990 -14.823 145 H GLU 19 H GLU 19 3.947 -20.391 -14.843 146 HA GLU 19 HA GLU 19 2.062 -22.250 -13.422 147 HB2 GLU 19 1HB GLU 19 3.969 -23.611 -12.813 148 HB3 GLU 19 2HB GLU 19 3.863 -23.433 -14.565 149 HG2 GLU 19 1HG GLU 19 6.051 -23.002 -14.494 150 HG3 GLU 19 2HG GLU 19 5.606 -21.399 -13.894 151 H SER 20 H SER 20 4.426 -19.665 -13.129 152 HA SER 20 HA SER 20 4.065 -19.603 -10.188 153 HB2 SER 20 1HB SER 20 5.820 -18.073 -12.143 154 HB3 SER 20 2HB SER 20 5.691 -17.644 -10.425 155 HG SER 20 HG SER 20 6.269 -20.323 -11.118 156 HA PRO 21 HA PRO 21 0.981 -16.498 -10.686 157 HB2 PRO 21 1HB PRO 21 1.106 -15.079 -8.366 158 HB3 PRO 21 2HB PRO 21 0.539 -16.779 -8.406 159 HG2 PRO 21 1HG PRO 21 3.279 -15.720 -7.755 160 HG3 PRO 21 2HG PRO 21 2.263 -16.858 -6.812 161 HD2 PRO 21 1HD PRO 21 4.211 -17.748 -8.466 162 HD3 PRO 21 2HD PRO 21 2.648 -18.630 -8.311 163 H ASP 22 H ASP 22 4.307 -15.638 -10.167 164 HA ASP 22 HA ASP 22 3.957 -12.781 -10.694 165 HB2 ASP 22 1HB ASP 22 6.416 -14.575 -10.535 166 HB3 ASP 22 2HB ASP 22 6.468 -12.816 -10.716 167 H GLU 23 H GLU 23 3.971 -15.593 -12.572 168 HA GLU 23 HA GLU 23 5.316 -14.392 -14.905 169 HB2 GLU 23 1HB GLU 23 5.795 -16.721 -14.098 170 HB3 GLU 23 2HB GLU 23 4.110 -17.129 -14.430 171 HG2 GLU 23 1HG GLU 23 4.500 -16.527 -16.816 172 HG3 GLU 23 2HG GLU 23 6.203 -16.290 -16.406 173 H LEU 24 H LEU 24 4.232 -13.990 -16.860 174 HA LEU 24 HA LEU 24 1.284 -13.775 -16.556 175 HB2 LEU 24 1HB LEU 24 3.337 -12.273 -17.892 176 HB3 LEU 24 2HB LEU 24 2.125 -12.790 -19.067 177 HG LEU 24 HG LEU 24 1.535 -11.254 -16.516 178 HD11 LEU 24 1HD1 LEU 24 2.825 -9.949 -18.140 179 HD12 LEU 24 2HD1 LEU 24 1.146 -9.361 -18.040 180 HD13 LEU 24 3HD1 LEU 24 1.656 -10.365 -19.415 181 HD21 LEU 24 1HD2 LEU 24 -0.416 -12.515 -17.106 182 HD22 LEU 24 2HD2 LEU 24 -0.250 -12.103 -18.832 183 HD23 LEU 24 3HD2 LEU 24 -0.694 -10.846 -17.648 184 H SER 25 H SER 25 -0.159 -14.940 -17.626 185 HA SER 25 HA SER 25 0.764 -16.975 -19.584 186 HB2 SER 25 1HB SER 25 -2.005 -16.322 -18.470 187 HB3 SER 25 2HB SER 25 -1.639 -17.649 -19.596 188 HG SER 25 HG SER 25 -0.413 -17.352 -17.043 189 H PHE 26 H PHE 26 0.296 -16.820 -21.781 190 HA PHE 26 HA PHE 26 -1.475 -14.728 -22.814 191 HB2 PHE 26 1HB PHE 26 0.309 -13.626 -24.161 192 HB3 PHE 26 2HB PHE 26 0.475 -13.334 -22.425 193 HD1 PHE 26 HD1 PHE 26 1.919 -15.136 -25.336 194 HD2 PHE 26 HD2 PHE 26 2.353 -14.157 -21.166 195 HE1 PHE 26 HE1 PHE 26 4.266 -15.964 -25.384 196 HE2 PHE 26 HE2 PHE 26 4.679 -15.012 -21.202 197 HZ PHE 26 HZ PHE 26 5.647 -15.911 -23.315 198 H ARG 27 H ARG 27 -1.397 -14.860 -25.319 199 HA ARG 27 HA ARG 27 -0.668 -17.678 -26.038 200 HB2 ARG 27 1HB ARG 27 -3.035 -16.049 -27.013 201 HB3 ARG 27 2HB ARG 27 -2.597 -17.657 -27.585 202 HG2 ARG 27 1HG ARG 27 -3.437 -16.957 -24.734 203 HG3 ARG 27 2HG ARG 27 -4.454 -17.744 -25.946 204 HD2 ARG 27 1HD ARG 27 -2.893 -19.683 -26.000 205 HD3 ARG 27 2HD ARG 27 -1.862 -18.880 -24.811 206 HE ARG 27 HE ARG 27 -3.380 -19.352 -23.110 207 HH11 ARG 27 1HH1 ARG 27 -4.712 -20.468 -26.186 208 HH12 ARG 27 2HH1 ARG 27 -5.920 -21.447 -25.406 209 HH21 ARG 27 1HH2 ARG 27 -4.953 -20.621 -22.197 210 HH22 ARG 27 2HH2 ARG 27 -6.059 -21.526 -23.192 211 H LYS 28 H LYS 28 -0.101 -18.086 -28.203 212 HA LYS 28 HA LYS 28 1.698 -16.186 -29.313 213 HB2 LYS 28 1HB LYS 28 1.736 -17.686 -31.291 214 HB3 LYS 28 2HB LYS 28 1.927 -18.551 -29.774 215 HG2 LYS 28 1HG LYS 28 -0.627 -19.013 -29.936 216 HG3 LYS 28 2HG LYS 28 -0.431 -18.586 -31.641 217 HD2 LYS 28 1HD LYS 28 1.164 -20.719 -30.149 218 HD3 LYS 28 2HD LYS 28 -0.241 -21.052 -31.171 219 HE2 LYS 28 1HE LYS 28 2.354 -19.755 -32.135 220 HE3 LYS 28 2HE LYS 28 1.957 -21.474 -32.298 221 HZ1 LYS 28 1HZ LYS 28 1.432 -20.217 -34.301 222 HZ2 LYS 28 2HZ LYS 28 0.369 -19.270 -33.471 223 HZ3 LYS 28 3HZ LYS 28 0.066 -20.883 -33.651 224 H GLY 29 H GLY 29 1.436 -14.501 -30.627 225 HA2 GLY 29 1HA GLY 29 0.364 -13.258 -32.333 226 HA3 GLY 29 2HA GLY 29 -1.124 -14.188 -32.095 227 H ASP 30 H ASP 30 -0.342 -13.534 -29.010 228 HA ASP 30 HA ASP 30 -2.215 -11.303 -28.818 229 HB2 ASP 30 1HB ASP 30 -1.863 -13.298 -27.202 230 HB3 ASP 30 2HB ASP 30 -0.431 -12.422 -26.630 231 H ILE 31 H ILE 31 -1.589 -9.270 -27.600 232 HA ILE 31 HA ILE 31 1.272 -8.519 -28.089 233 HB ILE 31 HB ILE 31 -1.212 -6.874 -28.820 234 HG12 ILE 31 1HG1 ILE 31 0.456 -6.716 -30.948 235 HG13 ILE 31 2HG1 ILE 31 0.965 -8.280 -30.318 236 HG21 ILE 31 1HG2 ILE 31 0.406 -5.366 -27.723 237 HG22 ILE 31 2HG2 ILE 31 1.736 -6.008 -28.733 238 HG23 ILE 31 3HG2 ILE 31 0.410 -5.071 -29.471 239 HD11 ILE 31 1HD1 ILE 31 -0.695 -8.526 -32.070 240 HD12 ILE 31 2HD1 ILE 31 -1.318 -9.119 -30.521 241 HD13 ILE 31 3HD1 ILE 31 -1.846 -7.537 -31.134 242 H MET 32 H MET 32 2.224 -7.493 -26.466 243 HA MET 32 HA MET 32 0.506 -6.540 -24.214 244 HB2 MET 32 1HB MET 32 1.981 -7.682 -22.639 245 HB3 MET 32 2HB MET 32 1.235 -8.822 -23.759 246 HG2 MET 32 1HG MET 32 3.396 -8.662 -25.140 247 HG3 MET 32 2HG MET 32 4.101 -7.859 -23.729 248 HE1 MET 32 1HE MET 32 2.864 -12.265 -24.170 249 HE2 MET 32 2HE MET 32 1.602 -11.021 -24.299 250 HE3 MET 32 3HE MET 32 2.963 -11.039 -25.450 251 H THR 33 H THR 33 1.471 -5.003 -22.863 252 HA THR 33 HA THR 33 3.490 -3.358 -24.271 253 HB THR 33 HB THR 33 2.007 -2.812 -21.652 254 HG1 THR 33 HG1 THR 33 0.611 -1.604 -22.972 255 HG21 THR 33 1HG2 THR 33 4.032 -1.423 -21.985 256 HG22 THR 33 2HG2 THR 33 2.561 -0.451 -22.163 257 HG23 THR 33 3HG2 THR 33 3.457 -0.978 -23.607 258 H VAL 34 H VAL 34 5.591 -3.237 -23.654 259 HA VAL 34 HA VAL 34 6.447 -4.902 -21.329 260 HB VAL 34 HB VAL 34 8.055 -3.452 -23.498 261 HG11 VAL 34 1HG1 VAL 34 9.991 -4.761 -22.562 262 HG12 VAL 34 2HG1 VAL 34 9.387 -3.504 -21.472 263 HG13 VAL 34 3HG1 VAL 34 8.973 -5.206 -21.181 264 HG21 VAL 34 1HG2 VAL 34 6.818 -5.485 -24.284 265 HG22 VAL 34 2HG2 VAL 34 8.578 -5.704 -24.329 266 HG23 VAL 34 3HG2 VAL 34 7.628 -6.438 -23.018 267 H LEU 35 H LEU 35 6.676 -3.983 -19.427 268 HA LEU 35 HA LEU 35 6.592 -1.029 -19.237 269 HB2 LEU 35 1HB LEU 35 6.523 -3.154 -17.075 270 HB3 LEU 35 2HB LEU 35 6.226 -1.438 -16.846 271 HG LEU 35 HG LEU 35 4.457 -3.366 -18.390 272 HD11 LEU 35 1HD1 LEU 35 4.180 -2.003 -15.682 273 HD12 LEU 35 2HD1 LEU 35 4.408 -3.741 -15.983 274 HD13 LEU 35 3HD1 LEU 35 2.902 -2.943 -16.479 275 HD21 LEU 35 1HD2 LEU 35 2.827 -1.475 -18.394 276 HD22 LEU 35 2HD2 LEU 35 4.263 -1.145 -19.378 277 HD23 LEU 35 3HD2 LEU 35 4.101 -0.403 -17.763 278 H GLU 36 H GLU 36 8.592 -3.815 -18.320 279 HA GLU 36 HA GLU 36 10.980 -2.080 -18.146 280 HB2 GLU 36 1HB GLU 36 9.563 -3.032 -15.817 281 HB3 GLU 36 2HB GLU 36 11.116 -3.870 -15.929 282 HG2 GLU 36 1HG GLU 36 10.817 -0.863 -16.098 283 HG3 GLU 36 2HG GLU 36 11.119 -1.730 -14.586 284 H ARG 37 H ARG 37 12.995 -3.516 -17.890 285 HA ARG 37 HA ARG 37 12.476 -6.278 -18.950 286 HB2 ARG 37 1HB ARG 37 14.589 -4.363 -19.957 287 HB3 ARG 37 2HB ARG 37 14.378 -6.041 -20.467 288 HG2 ARG 37 1HG ARG 37 11.996 -5.281 -21.180 289 HG3 ARG 37 2HG ARG 37 12.662 -3.652 -21.054 290 HD2 ARG 37 1HD ARG 37 13.605 -5.904 -22.816 291 HD3 ARG 37 2HD ARG 37 12.901 -4.354 -23.327 292 HE ARG 37 HE ARG 37 15.192 -3.780 -21.784 293 HH11 ARG 37 1HH1 ARG 37 14.529 -5.427 -24.839 294 HH12 ARG 37 2HH1 ARG 37 16.107 -5.064 -25.483 295 HH21 ARG 37 1HH2 ARG 37 17.174 -3.363 -22.657 296 HH22 ARG 37 2HH2 ARG 37 17.588 -3.905 -24.262 297 H ASP 38 H ASP 38 14.080 -7.796 -18.477 298 HA ASP 38 HA ASP 38 15.564 -8.856 -17.137 299 HB2 ASP 38 1HB ASP 38 17.046 -6.213 -17.107 300 HB3 ASP 38 2HB ASP 38 17.724 -7.833 -16.883 301 H THR 39 H THR 39 13.290 -7.822 -16.074 302 HA THR 39 HA THR 39 13.602 -6.041 -13.897 303 HB THR 39 HB THR 39 11.525 -6.269 -15.216 304 HG1 THR 39 HG1 THR 39 11.525 -6.645 -12.436 305 HG21 THR 39 1HG2 THR 39 11.493 -8.683 -15.645 306 HG22 THR 39 2HG2 THR 39 10.016 -8.231 -14.777 307 HG23 THR 39 3HG2 THR 39 11.332 -9.027 -13.909 308 H GLN 40 H GLN 40 14.386 -9.297 -13.903 309 HA GLN 40 HA GLN 40 14.208 -9.353 -10.905 310 HB2 GLN 40 1HB GLN 40 13.668 -11.496 -12.960 311 HB3 GLN 40 2HB GLN 40 14.092 -11.905 -11.294 312 HG2 GLN 40 1HG GLN 40 12.131 -10.594 -10.498 313 HG3 GLN 40 2HG GLN 40 11.674 -10.309 -12.182 314 HE21 GLN 40 1HE2 GLN 40 10.018 -13.392 -10.619 315 HE22 GLN 40 2HE2 GLN 40 10.328 -11.808 -9.943 316 H GLY 41 H GLY 41 16.251 -8.681 -13.243 317 HA2 GLY 41 1HA GLY 41 18.576 -8.824 -13.280 318 HA3 GLY 41 2HA GLY 41 18.533 -9.991 -11.939 319 H LEU 42 H LEU 42 16.294 -11.172 -13.943 320 HA LEU 42 HA LEU 42 18.090 -13.170 -15.082 321 HB2 LEU 42 1HB LEU 42 15.091 -12.773 -15.306 322 HB3 LEU 42 2HB LEU 42 15.971 -14.144 -15.966 323 HG LEU 42 HG LEU 42 15.756 -13.484 -13.006 324 HD11 LEU 42 1HD1 LEU 42 13.574 -14.086 -13.994 325 HD12 LEU 42 2HD1 LEU 42 14.163 -15.371 -12.927 326 HD13 LEU 42 3HD1 LEU 42 14.290 -15.557 -14.698 327 HD21 LEU 42 1HD2 LEU 42 16.848 -15.919 -14.485 328 HD22 LEU 42 2HD2 LEU 42 16.570 -15.835 -12.727 329 HD23 LEU 42 3HD2 LEU 42 17.773 -14.774 -13.478 330 H ASP 43 H ASP 43 19.023 -12.942 -16.983 331 HA ASP 43 HA ASP 43 18.631 -10.696 -18.666 332 HB2 ASP 43 1HB ASP 43 20.709 -12.108 -18.511 333 HB3 ASP 43 2HB ASP 43 19.840 -13.408 -19.342 334 H GLY 44 H GLY 44 17.184 -10.251 -20.167 335 HA2 GLY 44 1HA GLY 44 15.826 -10.658 -22.003 336 HA3 GLY 44 2HA GLY 44 16.099 -12.391 -21.828 337 H TRP 45 H TRP 45 15.015 -11.303 -18.819 338 HA TRP 45 HA TRP 45 12.240 -12.152 -19.568 339 HB2 TRP 45 1HB TRP 45 13.759 -12.045 -16.968 340 HB3 TRP 45 2HB TRP 45 11.997 -12.202 -17.013 341 HD1 TRP 45 HD1 TRP 45 15.151 -14.119 -18.143 342 HE1 TRP 45 HE1 TRP 45 14.604 -16.588 -18.418 343 HE3 TRP 45 HE3 TRP 45 10.112 -13.803 -17.387 344 HZ2 TRP 45 HZ2 TRP 45 12.264 -18.238 -18.288 345 HZ3 TRP 45 HZ3 TRP 45 8.741 -15.890 -17.439 346 HH2 TRP 45 HH2 TRP 45 9.825 -18.094 -17.892 347 H TRP 46 H TRP 46 10.721 -10.650 -19.881 348 HA TRP 46 HA TRP 46 11.347 -7.929 -18.838 349 HB2 TRP 46 1HB TRP 46 9.597 -8.752 -21.164 350 HB3 TRP 46 2HB TRP 46 10.054 -7.102 -20.723 351 HD1 TRP 46 HD1 TRP 46 13.247 -8.463 -20.243 352 HE1 TRP 46 HE1 TRP 46 14.739 -8.637 -22.276 353 HE3 TRP 46 HE3 TRP 46 9.601 -7.985 -23.785 354 HZ2 TRP 46 HZ2 TRP 46 14.407 -8.568 -25.122 355 HZ3 TRP 46 HZ3 TRP 46 10.255 -8.090 -26.200 356 HH2 TRP 46 HH2 TRP 46 12.646 -8.387 -26.848 357 H LEU 47 H LEU 47 9.820 -6.682 -17.825 358 HA LEU 47 HA LEU 47 7.520 -8.144 -16.671 359 HB2 LEU 47 1HB LEU 47 8.806 -6.511 -15.282 360 HB3 LEU 47 2HB LEU 47 8.443 -5.247 -16.450 361 HG LEU 47 HG LEU 47 6.027 -5.458 -15.917 362 HD11 LEU 47 1HD1 LEU 47 5.903 -7.769 -15.144 363 HD12 LEU 47 2HD1 LEU 47 5.371 -6.690 -13.842 364 HD13 LEU 47 3HD1 LEU 47 6.997 -7.416 -13.787 365 HD21 LEU 47 1HD2 LEU 47 7.450 -3.793 -14.793 366 HD22 LEU 47 2HD2 LEU 47 7.842 -4.971 -13.523 367 HD23 LEU 47 3HD2 LEU 47 6.174 -4.380 -13.709 368 H CYS 48 H CYS 48 5.823 -8.401 -17.989 369 HA CYS 48 HA CYS 48 5.209 -6.175 -19.900 370 HB2 CYS 48 1HB CYS 48 4.581 -9.133 -20.090 371 HB3 CYS 48 2HB CYS 48 4.161 -7.900 -21.289 372 HG CYS 48 HG CYS 48 7.136 -8.886 -20.246 373 H SER 49 H SER 49 2.846 -5.970 -20.369 374 HA SER 49 HA SER 49 1.142 -6.897 -18.114 375 HB2 SER 49 1HB SER 49 1.962 -4.639 -17.560 376 HB3 SER 49 2HB SER 49 1.315 -4.031 -19.096 377 HG SER 49 HG SER 49 0.031 -4.012 -16.928 378 H LEU 50 H LEU 50 -0.749 -7.636 -18.702 379 HA LEU 50 HA LEU 50 -2.201 -6.535 -20.976 380 HB2 LEU 50 1HB LEU 50 -2.436 -8.617 -22.153 381 HB3 LEU 50 2HB LEU 50 -0.754 -8.145 -22.121 382 HG LEU 50 HG LEU 50 -1.011 -9.876 -19.940 383 HD11 LEU 50 1HD1 LEU 50 -2.545 -10.971 -22.334 384 HD12 LEU 50 2HD1 LEU 50 -3.214 -10.617 -20.722 385 HD13 LEU 50 3HD1 LEU 50 -2.018 -11.914 -20.920 386 HD21 LEU 50 1HD2 LEU 50 0.347 -11.367 -21.285 387 HD22 LEU 50 2HD2 LEU 50 0.852 -9.683 -21.532 388 HD23 LEU 50 3HD2 LEU 50 -0.135 -10.502 -22.765 389 H HIS 51 H HIS 51 -4.407 -7.176 -20.942 390 HA HIS 51 HA HIS 51 -6.389 -7.654 -19.902 391 HB2 HIS 51 1HB HIS 51 -5.345 -9.945 -20.490 392 HB3 HIS 51 2HB HIS 51 -5.096 -10.126 -18.754 393 HD1 HIS 51 HD1 HIS 51 -7.795 -10.125 -21.388 394 HD2 HIS 51 HD2 HIS 51 -7.447 -10.428 -17.252 395 HE1 HIS 51 HE1 HIS 51 -10.028 -10.944 -20.512 396 H GLY 52 H GLY 52 -4.680 -5.925 -18.324 397 HA2 GLY 52 1HA GLY 52 -4.934 -4.904 -16.271 398 HA3 GLY 52 2HA GLY 52 -6.162 -6.111 -15.855 399 H ARG 53 H ARG 53 -3.297 -7.670 -16.789 400 HA ARG 53 HA ARG 53 -2.360 -7.822 -13.942 401 HB2 ARG 53 1HB ARG 53 -2.375 -9.972 -16.106 402 HB3 ARG 53 2HB ARG 53 -1.608 -10.130 -14.520 403 HG2 ARG 53 1HG ARG 53 -3.833 -9.878 -13.446 404 HG3 ARG 53 2HG ARG 53 -4.574 -9.823 -15.062 405 HD2 ARG 53 1HD ARG 53 -3.575 -12.049 -15.564 406 HD3 ARG 53 2HD ARG 53 -2.901 -12.095 -13.929 407 HE ARG 53 HE ARG 53 -5.010 -12.529 -13.042 408 HH11 ARG 53 1HH1 ARG 53 -5.352 -11.847 -16.493 409 HH12 ARG 53 2HH1 ARG 53 -6.981 -12.467 -16.546 410 HH21 ARG 53 1HH2 ARG 53 -7.082 -13.303 -13.195 411 HH22 ARG 53 2HH2 ARG 53 -7.943 -13.266 -14.708 412 H GLN 54 H GLN 54 -0.048 -8.128 -13.761 413 HA GLN 54 HA GLN 54 1.464 -7.752 -16.265 414 HB2 GLN 54 1HB GLN 54 2.973 -6.145 -15.234 415 HB3 GLN 54 2HB GLN 54 1.331 -5.501 -15.256 416 HG2 GLN 54 1HG GLN 54 1.068 -6.073 -12.868 417 HG3 GLN 54 2HG GLN 54 2.720 -6.723 -12.847 418 HE21 GLN 54 1HE2 GLN 54 4.020 -3.641 -11.972 419 HE22 GLN 54 2HE2 GLN 54 4.015 -5.379 -11.808 420 H GLY 55 H GLY 55 3.424 -8.822 -16.229 421 HA2 GLY 55 1HA GLY 55 4.407 -10.122 -13.836 422 HA3 GLY 55 2HA GLY 55 3.457 -11.246 -14.836 423 H ILE 56 H ILE 56 6.013 -11.934 -14.496 424 HA ILE 56 HA ILE 56 7.735 -10.709 -16.496 425 HB ILE 56 HB ILE 56 9.393 -12.388 -15.880 426 HG12 ILE 56 1HG1 ILE 56 7.238 -13.695 -14.176 427 HG13 ILE 56 2HG1 ILE 56 7.810 -14.327 -15.712 428 HG21 ILE 56 1HG2 ILE 56 8.905 -10.404 -14.359 429 HG22 ILE 56 2HG2 ILE 56 7.969 -11.513 -13.326 430 HG23 ILE 56 3HG2 ILE 56 9.713 -11.776 -13.578 431 HD11 ILE 56 1HD1 ILE 56 9.360 -14.115 -13.122 432 HD12 ILE 56 2HD1 ILE 56 8.894 -15.583 -14.012 433 HD13 ILE 56 3HD1 ILE 56 10.123 -14.492 -14.687 434 H VAL 57 H VAL 57 8.400 -11.487 -18.416 435 HA VAL 57 HA VAL 57 7.091 -13.915 -19.538 436 HB VAL 57 HB VAL 57 7.067 -11.107 -20.761 437 HG11 VAL 57 1HG1 VAL 57 6.419 -13.790 -22.002 438 HG12 VAL 57 2HG1 VAL 57 5.828 -12.251 -22.658 439 HG13 VAL 57 3HG1 VAL 57 7.569 -12.559 -22.563 440 HG21 VAL 57 1HG2 VAL 57 5.242 -11.406 -19.201 441 HG22 VAL 57 2HG2 VAL 57 4.596 -11.469 -20.849 442 HG23 VAL 57 3HG2 VAL 57 4.822 -12.980 -19.929 443 HA PRO 58 HA PRO 58 11.338 -13.931 -20.906 444 HB2 PRO 58 1HB PRO 58 11.353 -16.038 -22.656 445 HB3 PRO 58 2HB PRO 58 11.318 -16.265 -20.880 446 HG2 PRO 58 1HG PRO 58 9.043 -16.330 -22.840 447 HG3 PRO 58 2HG PRO 58 9.435 -17.479 -21.527 448 HD2 PRO 58 1HD PRO 58 7.565 -15.518 -21.277 449 HD3 PRO 58 2HD PRO 58 8.566 -16.070 -19.897 450 H GLY 59 H GLY 59 11.963 -12.334 -22.217 451 HA2 GLY 59 1HA GLY 59 10.324 -11.265 -24.276 452 HA3 GLY 59 2HA GLY 59 11.998 -10.837 -23.933 453 H ASN 60 H ASN 60 12.648 -13.816 -24.370 454 HA ASN 60 HA ASN 60 13.424 -13.646 -27.114 455 HB2 ASN 60 1HB ASN 60 14.500 -15.118 -25.436 456 HB3 ASN 60 2HB ASN 60 13.024 -16.085 -25.339 457 HD21 ASN 60 1HD2 ASN 60 15.579 -16.523 -28.486 458 HD22 ASN 60 2HD2 ASN 60 15.746 -15.185 -27.378 459 H ARG 61 H ARG 61 10.449 -14.727 -25.537 460 HA ARG 61 HA ARG 61 9.467 -15.980 -28.028 461 HB2 ARG 61 1HB ARG 61 8.108 -15.486 -25.358 462 HB3 ARG 61 2HB ARG 61 7.415 -16.396 -26.695 463 HG2 ARG 61 1HG ARG 61 9.360 -18.001 -26.506 464 HG3 ARG 61 2HG ARG 61 9.802 -17.160 -25.002 465 HD2 ARG 61 1HD ARG 61 7.422 -17.570 -24.200 466 HD3 ARG 61 2HD ARG 61 7.194 -18.600 -25.622 467 HE ARG 61 HE ARG 61 9.513 -19.441 -24.176 468 HH11 ARG 61 1HH1 ARG 61 5.989 -19.549 -23.960 469 HH12 ARG 61 2HH1 ARG 61 6.003 -20.911 -22.876 470 HH21 ARG 61 1HH2 ARG 61 9.440 -21.219 -22.818 471 HH22 ARG 61 2HH2 ARG 61 7.910 -21.855 -22.284 472 H LEU 62 H LEU 62 9.927 -12.855 -27.308 473 HA LEU 62 HA LEU 62 7.254 -12.011 -28.378 474 HB2 LEU 62 1HB LEU 62 9.188 -10.454 -26.631 475 HB3 LEU 62 2HB LEU 62 7.656 -9.875 -27.246 476 HG LEU 62 HG LEU 62 8.028 -12.057 -25.175 477 HD11 LEU 62 1HD1 LEU 62 8.513 -9.819 -24.326 478 HD12 LEU 62 2HD1 LEU 62 6.957 -10.368 -23.681 479 HD13 LEU 62 3HD1 LEU 62 6.992 -9.193 -25.010 480 HD21 LEU 62 1HD2 LEU 62 5.553 -11.862 -24.907 481 HD22 LEU 62 2HD2 LEU 62 6.050 -12.569 -26.445 482 HD23 LEU 62 3HD2 LEU 62 5.499 -10.871 -26.381 483 H LYS 63 H LYS 63 7.193 -10.444 -29.979 484 HA LYS 63 HA LYS 63 9.857 -9.766 -31.191 485 HB2 LYS 63 1HB LYS 63 8.050 -11.267 -32.401 486 HB3 LYS 63 2HB LYS 63 7.265 -9.733 -32.738 487 HG2 LYS 63 1HG LYS 63 10.126 -10.457 -33.529 488 HG3 LYS 63 2HG LYS 63 8.715 -10.537 -34.603 489 HD2 LYS 63 1HD LYS 63 8.351 -8.088 -34.232 490 HD3 LYS 63 2HD LYS 63 9.853 -8.060 -33.291 491 HE2 LYS 63 1HE LYS 63 11.109 -8.853 -35.270 492 HE3 LYS 63 2HE LYS 63 9.605 -8.766 -36.226 493 HZ1 LYS 63 1HZ LYS 63 10.824 -6.474 -34.765 494 HZ2 LYS 63 2HZ LYS 63 9.470 -6.410 -35.701 495 HZ3 LYS 63 3HZ LYS 63 10.943 -6.717 -36.391 496 H ILE 64 H ILE 64 10.379 -7.733 -30.829 497 HA ILE 64 HA ILE 64 8.668 -5.702 -29.831 498 HB ILE 64 HB ILE 64 11.301 -5.422 -31.386 499 HG12 ILE 64 1HG1 ILE 64 11.589 -6.873 -29.436 500 HG13 ILE 64 2HG1 ILE 64 12.413 -5.333 -29.212 501 HG21 ILE 64 1HG2 ILE 64 9.771 -3.444 -29.637 502 HG22 ILE 64 2HG2 ILE 64 11.491 -3.251 -30.022 503 HG23 ILE 64 3HG2 ILE 64 10.288 -3.246 -31.320 504 HD11 ILE 64 1HD1 ILE 64 11.375 -5.972 -27.111 505 HD12 ILE 64 2HD1 ILE 64 10.504 -4.565 -27.751 506 HD13 ILE 64 3HD1 ILE 64 9.797 -6.191 -27.900 507 H LEU 65 H LEU 65 7.318 -4.266 -30.771 508 HA LEU 65 HA LEU 65 6.935 -4.470 -33.681 509 HB2 LEU 65 1HB LEU 65 5.342 -3.115 -31.476 510 HB3 LEU 65 2HB LEU 65 4.855 -3.197 -33.171 511 HG LEU 65 HG LEU 65 5.255 -5.632 -31.390 512 HD11 LEU 65 1HD1 LEU 65 2.686 -4.223 -32.173 513 HD12 LEU 65 2HD1 LEU 65 3.422 -4.255 -30.558 514 HD13 LEU 65 3HD1 LEU 65 2.809 -5.753 -31.281 515 HD21 LEU 65 1HD2 LEU 65 4.018 -5.297 -34.149 516 HD22 LEU 65 2HD2 LEU 65 3.930 -6.778 -33.178 517 HD23 LEU 65 3HD2 LEU 65 5.507 -6.189 -33.740 518 H VAL 66 H VAL 66 6.464 -2.413 -34.755 519 HA VAL 66 HA VAL 66 8.738 -0.649 -34.480 520 HB VAL 66 HB VAL 66 7.701 -1.308 -36.690 521 HG11 VAL 66 1HG1 VAL 66 5.676 -0.194 -37.496 522 HG12 VAL 66 2HG1 VAL 66 5.305 -1.131 -36.034 523 HG13 VAL 66 3HG1 VAL 66 5.474 0.635 -35.938 524 HG21 VAL 66 1HG2 VAL 66 8.005 0.826 -37.785 525 HG22 VAL 66 2HG2 VAL 66 7.736 1.710 -36.270 526 HG23 VAL 66 3HG2 VAL 66 9.187 0.693 -36.470 527 H GLY 67 H GLY 67 8.698 1.611 -33.962 528 HA2 GLY 67 1HA GLY 67 6.418 3.061 -33.195 529 HA3 GLY 67 2HA GLY 67 7.024 2.259 -31.736 530 H MET 68 H MET 68 9.771 2.322 -32.196 531 HA MET 68 HA MET 68 10.390 5.102 -31.611 532 HB2 MET 68 1HB MET 68 11.949 2.537 -31.902 533 HB3 MET 68 2HB MET 68 12.812 4.077 -32.044 534 HG2 MET 68 1HG MET 68 12.987 3.363 -29.771 535 HG3 MET 68 2HG MET 68 11.901 4.763 -29.820 536 HE1 MET 68 1HE MET 68 10.580 4.551 -27.642 537 HE2 MET 68 2HE MET 68 10.009 3.010 -26.956 538 HE3 MET 68 3HE MET 68 11.753 3.309 -27.132 539 H TYR 69 H TYR 69 11.526 6.550 -32.901 540 HA TYR 69 HA TYR 69 11.499 5.932 -35.821 541 HB2 TYR 69 1HB TYR 69 10.618 8.253 -34.213 542 HB3 TYR 69 2HB TYR 69 11.617 8.667 -35.615 543 HD1 TYR 69 HD1 TYR 69 8.566 6.676 -34.652 544 HD2 TYR 69 HD2 TYR 69 10.690 8.735 -37.781 545 HE1 TYR 69 HE1 TYR 69 6.620 6.367 -36.192 546 HE2 TYR 69 HE2 TYR 69 8.740 8.421 -39.306 547 HH TYR 69 HH TYR 69 6.621 7.607 -39.543 548 H ASP 70 H ASP 70 13.156 6.732 -37.085 549 HA ASP 70 HA ASP 70 15.307 7.106 -37.672 550 HB2 ASP 70 1HB ASP 70 14.551 9.291 -36.359 551 HB3 ASP 70 2HB ASP 70 15.843 8.804 -35.261 552 H LYS 71 H LYS 71 17.574 7.677 -35.849 553 HA LYS 71 HA LYS 71 17.961 5.033 -34.544 554 HB2 LYS 71 1HB LYS 71 19.954 4.601 -35.910 555 HB3 LYS 71 2HB LYS 71 18.539 4.792 -36.951 556 HG2 LYS 71 1HG LYS 71 19.392 7.339 -37.013 557 HG3 LYS 71 2HG LYS 71 20.934 6.569 -36.652 558 HD2 LYS 71 1HD LYS 71 20.806 5.228 -38.656 559 HD3 LYS 71 2HD LYS 71 19.119 5.711 -38.942 560 HE2 LYS 71 1HE LYS 71 21.422 7.702 -38.879 561 HE3 LYS 71 2HE LYS 71 20.882 6.900 -40.368 562 HZ1 LYS 71 1HZ LYS 71 18.759 7.934 -40.169 563 HZ2 LYS 71 2HZ LYS 71 19.863 9.134 -39.945 564 HZ3 LYS 71 3HZ LYS 71 19.048 8.492 -38.650 565 H LYS 72 H LYS 72 20.161 4.981 -33.492 566 HA LYS 72 HA LYS 72 20.653 7.550 -32.115 567 HB2 LYS 72 1HB LYS 72 21.475 4.670 -31.758 568 HB3 LYS 72 2HB LYS 72 22.581 5.914 -31.170 569 HG2 LYS 72 1HG LYS 72 21.249 5.299 -29.320 570 HG3 LYS 72 2HG LYS 72 20.667 6.889 -29.837 571 HD2 LYS 72 1HD LYS 72 18.778 5.804 -31.038 572 HD3 LYS 72 2HD LYS 72 19.363 4.210 -30.504 573 HE2 LYS 72 1HE LYS 72 18.480 6.487 -28.673 574 HE3 LYS 72 2HE LYS 72 17.498 5.077 -29.099 575 HZ1 LYS 72 1HZ LYS 72 18.625 4.812 -26.958 576 HZ2 LYS 72 2HZ LYS 72 20.100 4.953 -27.677 577 HZ3 LYS 72 3HZ LYS 72 19.144 3.663 -28.035 578 HA PRO 73 HA PRO 73 24.060 8.425 -34.818 579 HB2 PRO 73 1HB PRO 73 25.858 9.725 -33.234 580 HB3 PRO 73 2HB PRO 73 24.294 10.477 -33.686 581 HG2 PRO 73 1HG PRO 73 25.017 8.964 -31.176 582 HG3 PRO 73 2HG PRO 73 24.269 10.588 -31.329 583 HD2 PRO 73 1HD PRO 73 22.771 8.392 -30.901 584 HD3 PRO 73 2HD PRO 73 22.203 9.700 -31.994 585 H ALA 74 H ALA 74 26.430 7.911 -35.120 586 HA ALA 74 HA ALA 74 27.564 5.930 -33.258 587 HB1 ALA 74 1HB ALA 74 26.244 4.550 -34.873 588 HB2 ALA 74 2HB ALA 74 27.071 5.354 -36.231 589 HB3 ALA 74 3HB ALA 74 27.991 4.320 -35.109 590 H GLY 75 H GLY 75 29.865 5.908 -33.454 591 HA2 GLY 75 1HA GLY 75 31.253 7.255 -35.575 592 HA3 GLY 75 2HA GLY 75 31.025 8.345 -34.201 593 H GLU 76 H GLU 76 31.673 4.808 -34.234 594 HA GLU 76 HA GLU 76 33.558 5.030 -32.098 595 HB2 GLU 76 1HB GLU 76 33.060 2.829 -34.134 596 HB3 GLU 76 2HB GLU 76 34.206 2.688 -32.793 597 HG2 GLU 76 1HG GLU 76 31.209 3.070 -32.576 598 HG3 GLU 76 2HG GLU 76 32.126 1.603 -32.205 599 H PHE 77 H PHE 77 35.693 5.352 -32.047 600 HA PHE 77 HA PHE 77 37.257 5.122 -34.536 601 HB2 PHE 77 1HB PHE 77 36.284 7.502 -34.229 602 HB3 PHE 77 2HB PHE 77 37.405 7.653 -32.877 603 HD1 PHE 77 HD1 PHE 77 39.854 7.685 -33.291 604 HD2 PHE 77 HD2 PHE 77 37.026 7.463 -36.525 605 HE1 PHE 77 HE1 PHE 77 41.648 8.314 -34.907 606 HE2 PHE 77 HE2 PHE 77 38.802 8.099 -38.136 607 HZ PHE 77 HZ PHE 77 41.126 8.522 -37.334 608 H ILE 78 H ILE 78 38.817 3.735 -33.908 609 HA ILE 78 HA ILE 78 40.315 4.361 -31.434 610 HB ILE 78 HB ILE 78 38.743 2.776 -30.586 611 HG12 ILE 78 1HG1 ILE 78 41.148 1.068 -31.243 612 HG13 ILE 78 2HG1 ILE 78 41.244 2.451 -30.150 613 HG21 ILE 78 1HG2 ILE 78 37.765 1.866 -32.640 614 HG22 ILE 78 2HG2 ILE 78 39.281 1.033 -33.044 615 HG23 ILE 78 3HG2 ILE 78 38.329 0.520 -31.640 616 HD11 ILE 78 1HD1 ILE 78 39.494 -0.013 -29.762 617 HD12 ILE 78 2HD1 ILE 78 40.959 0.396 -28.856 618 HD13 ILE 78 3HD1 ILE 78 39.504 1.404 -28.686 619 H VAL 79 H VAL 79 42.374 4.438 -31.899 620 HA VAL 79 HA VAL 79 43.212 3.664 -34.580 621 HB VAL 79 HB VAL 79 45.290 4.910 -34.037 622 HG11 VAL 79 1HG1 VAL 79 43.252 6.103 -34.847 623 HG12 VAL 79 2HG1 VAL 79 42.782 6.424 -33.160 624 HG13 VAL 79 3HG1 VAL 79 44.277 7.124 -33.813 625 HG21 VAL 79 1HG2 VAL 79 45.475 4.321 -31.620 626 HG22 VAL 79 2HG2 VAL 79 45.549 6.075 -31.883 627 HG23 VAL 79 3HG2 VAL 79 44.059 5.341 -31.262 628 H THR 80 H THR 80 43.305 2.025 -31.600 629 HA THR 80 HA THR 80 45.878 0.694 -32.160 630 HB THR 80 HB THR 80 45.272 -0.652 -30.117 631 HG1 THR 80 HG1 THR 80 43.078 -0.570 -30.026 632 HG21 THR 80 1HG2 THR 80 46.566 1.504 -29.977 633 HG22 THR 80 2HG2 THR 80 45.587 1.171 -28.533 634 HG23 THR 80 3HG2 THR 80 45.025 2.366 -29.722 635 H ASP 81 H ASP 81 42.502 0.282 -32.756 636 HA ASP 81 HA ASP 81 42.892 -2.564 -33.590 637 HB2 ASP 81 1HB ASP 81 40.403 -1.004 -32.811 638 HB3 ASP 81 2HB ASP 81 40.308 -2.520 -33.705 639 HXT ASP 81 H02 ASP 81 41.674 0.310 -34.636 Start of MODEL 17 1 H2 GLY 1 2H0 GLY 1 8.664 10.291 -8.563 2 H GLY 1 1H0 GLY 1 7.349 11.060 -7.939 3 HA2 GLY 1 1HA GLY 1 7.026 12.406 -9.895 4 HA3 GLY 1 2HA GLY 1 8.705 12.596 -9.336 5 H SER 2 H SER 2 10.240 10.913 -10.356 6 HA SER 2 HA SER 2 9.837 11.149 -13.298 7 HB2 SER 2 1HB SER 2 12.291 10.482 -11.634 8 HB3 SER 2 2HB SER 2 12.253 10.516 -13.409 9 HG SER 2 HG SER 2 11.471 12.714 -11.792 10 H MET 3 H MET 3 8.513 9.484 -13.880 11 HA MET 3 HA MET 3 9.492 6.722 -13.259 12 HB2 MET 3 1HB MET 3 7.090 6.105 -13.967 13 HB3 MET 3 2HB MET 3 7.346 6.816 -12.372 14 HG2 MET 3 1HG MET 3 6.610 9.016 -13.196 15 HG3 MET 3 2HG MET 3 6.378 8.336 -14.819 16 HE1 MET 3 1HE MET 3 3.861 9.113 -14.953 17 HE2 MET 3 2HE MET 3 2.679 8.838 -13.651 18 HE3 MET 3 3HE MET 3 4.072 9.912 -13.377 19 H LYS 4 H LYS 4 11.084 7.079 -14.958 20 HA LYS 4 HA LYS 4 10.049 7.352 -17.713 21 HB2 LYS 4 1HB LYS 4 12.864 6.920 -16.634 22 HB3 LYS 4 2HB LYS 4 12.449 7.169 -18.338 23 HG2 LYS 4 1HG LYS 4 11.518 9.403 -17.762 24 HG3 LYS 4 2HG LYS 4 12.032 9.159 -16.080 25 HD2 LYS 4 1HD LYS 4 14.378 8.909 -16.849 26 HD3 LYS 4 2HD LYS 4 13.846 9.216 -18.517 27 HE2 LYS 4 1HE LYS 4 12.989 11.441 -17.822 28 HE3 LYS 4 2HE LYS 4 13.552 11.134 -16.166 29 HZ1 LYS 4 1HZ LYS 4 15.811 10.985 -17.033 30 HZ2 LYS 4 2HZ LYS 4 15.150 12.448 -17.419 31 HZ3 LYS 4 3HZ LYS 4 15.287 11.275 -18.570 32 H TYR 5 H TYR 5 8.898 5.554 -18.216 33 HA TYR 5 HA TYR 5 10.260 2.904 -17.909 34 HB2 TYR 5 1HB TYR 5 7.492 3.857 -17.487 35 HB3 TYR 5 2HB TYR 5 7.617 2.363 -18.426 36 HD1 TYR 5 HD1 TYR 5 9.249 3.832 -15.334 37 HD2 TYR 5 HD2 TYR 5 7.524 0.382 -17.224 38 HE1 TYR 5 HE1 TYR 5 9.660 2.487 -13.273 39 HE2 TYR 5 HE2 TYR 5 7.939 -0.955 -15.159 40 HH TYR 5 HH TYR 5 9.618 0.385 -12.337 41 H LEU 6 H LEU 6 9.706 1.319 -19.644 42 HA LEU 6 HA LEU 6 10.510 2.478 -22.133 43 HB2 LEU 6 1HB LEU 6 9.358 -0.267 -21.540 44 HB3 LEU 6 2HB LEU 6 10.214 0.182 -23.016 45 HG LEU 6 HG LEU 6 11.470 0.274 -20.250 46 HD11 LEU 6 1HD1 LEU 6 12.490 -1.850 -20.791 47 HD12 LEU 6 2HD1 LEU 6 11.628 -1.899 -22.357 48 HD13 LEU 6 3HD1 LEU 6 10.727 -1.990 -20.825 49 HD21 LEU 6 1HD2 LEU 6 13.591 0.279 -21.490 50 HD22 LEU 6 2HD2 LEU 6 12.605 1.678 -21.937 51 HD23 LEU 6 3HD2 LEU 6 12.706 0.282 -23.040 52 H ASN 7 H ASN 7 7.407 1.063 -21.122 53 HA ASN 7 HA ASN 7 5.316 1.133 -22.002 54 HB2 ASN 7 1HB ASN 7 5.920 3.624 -21.531 55 HB3 ASN 7 2HB ASN 7 5.975 3.783 -23.291 56 HD21 ASN 7 1HD2 ASN 7 2.369 2.801 -21.561 57 HD22 ASN 7 2HD2 ASN 7 3.848 2.131 -20.921 58 H VAL 8 H VAL 8 7.468 0.011 -23.792 59 HA VAL 8 HA VAL 8 6.336 0.527 -26.485 60 HB VAL 8 HB VAL 8 8.103 -1.002 -27.307 61 HG11 VAL 8 1HG1 VAL 8 10.034 0.406 -26.846 62 HG12 VAL 8 2HG1 VAL 8 8.586 1.421 -27.002 63 HG13 VAL 8 3HG1 VAL 8 9.253 1.071 -25.394 64 HG21 VAL 8 1HG2 VAL 8 8.866 -1.293 -24.365 65 HG22 VAL 8 2HG2 VAL 8 8.303 -2.569 -25.466 66 HG23 VAL 8 3HG2 VAL 8 9.879 -1.808 -25.730 67 H LEU 9 H LEU 9 5.981 -1.723 -27.759 68 HA LEU 9 HA LEU 9 4.673 -3.651 -25.912 69 HB2 LEU 9 1HB LEU 9 2.780 -3.775 -27.627 70 HB3 LEU 9 2HB LEU 9 2.770 -2.457 -26.469 71 HG LEU 9 HG LEU 9 4.051 -1.850 -29.090 72 HD11 LEU 9 1HD1 LEU 9 1.048 -2.239 -28.788 73 HD12 LEU 9 2HD1 LEU 9 2.141 -3.204 -29.809 74 HD13 LEU 9 3HD1 LEU 9 1.870 -1.489 -30.179 75 HD21 LEU 9 1HD2 LEU 9 3.719 -0.209 -27.188 76 HD22 LEU 9 2HD2 LEU 9 1.967 -0.385 -27.404 77 HD23 LEU 9 3HD2 LEU 9 2.962 0.295 -28.715 78 H ALA 10 H ALA 10 4.332 -5.722 -26.747 79 HA ALA 10 HA ALA 10 5.907 -6.321 -29.206 80 HB1 ALA 10 1HB ALA 10 6.261 -7.854 -26.621 81 HB2 ALA 10 2HB ALA 10 7.266 -7.898 -28.092 82 HB3 ALA 10 3HB ALA 10 7.281 -6.467 -27.045 83 H LYS 11 H LYS 11 5.366 -8.168 -30.277 84 HA LYS 11 HA LYS 11 2.728 -9.356 -29.575 85 HB2 LYS 11 1HB LYS 11 3.151 -8.508 -31.895 86 HB3 LYS 11 2HB LYS 11 4.516 -9.623 -32.032 87 HG2 LYS 11 1HG LYS 11 2.914 -11.526 -31.701 88 HG3 LYS 11 2HG LYS 11 1.583 -10.358 -31.765 89 HD2 LYS 11 1HD LYS 11 2.286 -9.692 -34.030 90 HD3 LYS 11 2HD LYS 11 3.650 -10.832 -33.944 91 HE2 LYS 11 1HE LYS 11 2.027 -12.689 -33.599 92 HE3 LYS 11 2HE LYS 11 0.697 -11.534 -33.800 93 HZ1 LYS 11 1HZ LYS 11 2.729 -12.179 -35.854 94 HZ2 LYS 11 2HZ LYS 11 1.488 -11.111 -36.045 95 HZ3 LYS 11 3HZ LYS 11 1.171 -12.715 -35.845 96 H ALA 12 H ALA 12 2.540 -11.423 -28.885 97 HA ALA 12 HA ALA 12 4.986 -12.860 -28.193 98 HB1 ALA 12 1HB ALA 12 3.319 -13.178 -26.630 99 HB2 ALA 12 2HB ALA 12 2.039 -13.313 -27.852 100 HB3 ALA 12 3HB ALA 12 3.179 -14.649 -27.599 101 H LEU 13 H LEU 13 5.952 -14.470 -29.171 102 HA LEU 13 HA LEU 13 4.943 -15.290 -31.853 103 HB2 LEU 13 1HB LEU 13 7.554 -15.841 -30.400 104 HB3 LEU 13 2HB LEU 13 7.197 -16.300 -32.063 105 HG LEU 13 HG LEU 13 7.319 -13.425 -31.069 106 HD11 LEU 13 1HD1 LEU 13 9.403 -15.076 -32.550 107 HD12 LEU 13 2HD1 LEU 13 9.500 -14.535 -30.857 108 HD13 LEU 13 3HD1 LEU 13 9.519 -13.340 -32.168 109 HD21 LEU 13 1HD2 LEU 13 7.208 -14.634 -33.868 110 HD22 LEU 13 2HD2 LEU 13 7.505 -12.918 -33.510 111 HD23 LEU 13 3HD2 LEU 13 5.950 -13.652 -33.079 112 H TYR 14 H TYR 14 5.255 -16.384 -28.579 113 HA TYR 14 HA TYR 14 4.355 -19.127 -29.363 114 HB2 TYR 14 1HB TYR 14 6.205 -18.339 -27.084 115 HB3 TYR 14 2HB TYR 14 5.614 -19.970 -27.419 116 HD1 TYR 14 HD1 TYR 14 6.595 -21.325 -29.208 117 HD2 TYR 14 HD2 TYR 14 7.899 -17.274 -28.594 118 HE1 TYR 14 HE1 TYR 14 8.561 -21.717 -30.700 119 HE2 TYR 14 HE2 TYR 14 9.866 -17.677 -30.070 120 HH TYR 14 HH TYR 14 10.441 -20.820 -31.648 121 H ASP 15 H ASP 15 3.014 -20.146 -27.673 122 HA ASP 15 HA ASP 15 1.497 -18.100 -26.136 123 HB2 ASP 15 1HB ASP 15 -0.176 -20.002 -25.886 124 HB3 ASP 15 2HB ASP 15 0.014 -19.351 -27.514 125 H ASN 16 H ASN 16 1.106 -18.313 -23.949 126 HA ASN 16 HA ASN 16 2.469 -20.468 -22.461 127 HB2 ASN 16 1HB ASN 16 4.139 -18.584 -23.040 128 HB3 ASN 16 2HB ASN 16 3.202 -17.571 -21.935 129 HD21 ASN 16 1HD2 ASN 16 4.385 -19.167 -19.002 130 HD22 ASN 16 2HD2 ASN 16 3.093 -18.204 -19.695 131 H VAL 17 H VAL 17 0.796 -21.051 -21.130 132 HA VAL 17 HA VAL 17 -1.005 -18.961 -20.058 133 HB VAL 17 HB VAL 17 -2.016 -21.120 -20.775 134 HG11 VAL 17 1HG1 VAL 17 -0.120 -22.646 -20.319 135 HG12 VAL 17 2HG1 VAL 17 -0.344 -22.415 -18.571 136 HG13 VAL 17 3HG1 VAL 17 -1.607 -23.213 -19.537 137 HG21 VAL 17 1HG2 VAL 17 -3.362 -21.563 -18.790 138 HG22 VAL 17 2HG2 VAL 17 -2.144 -20.794 -17.746 139 HG23 VAL 17 3HG2 VAL 17 -3.053 -19.818 -18.930 140 H ALA 18 H ALA 18 -0.879 -18.256 -17.916 141 HA ALA 18 HA ALA 18 1.714 -18.656 -16.666 142 HB1 ALA 18 1HB ALA 18 0.664 -16.455 -16.571 143 HB2 ALA 18 2HB ALA 18 -0.770 -17.142 -15.763 144 HB3 ALA 18 3HB ALA 18 0.796 -17.113 -14.930 145 H GLU 19 H GLU 19 2.224 -20.261 -15.323 146 HA GLU 19 HA GLU 19 -0.010 -21.667 -13.897 147 HB2 GLU 19 1HB GLU 19 1.528 -23.482 -13.530 148 HB3 GLU 19 2HB GLU 19 1.483 -23.089 -15.251 149 HG2 GLU 19 1HG GLU 19 3.634 -21.930 -15.073 150 HG3 GLU 19 2HG GLU 19 3.673 -22.228 -13.327 151 H SER 20 H SER 20 2.569 -19.431 -13.557 152 HA SER 20 HA SER 20 2.449 -19.673 -10.572 153 HB2 SER 20 1HB SER 20 4.504 -18.350 -12.385 154 HB3 SER 20 2HB SER 20 4.548 -18.338 -10.610 155 HG SER 20 HG SER 20 4.593 -20.649 -12.276 156 HA PRO 21 HA PRO 21 0.169 -15.963 -10.736 157 HB2 PRO 21 1HB PRO 21 0.650 -14.713 -8.363 158 HB3 PRO 21 2HB PRO 21 -0.247 -16.264 -8.466 159 HG2 PRO 21 1HG PRO 21 2.666 -15.809 -7.862 160 HG3 PRO 21 2HG PRO 21 1.470 -16.780 -6.951 161 HD2 PRO 21 1HD PRO 21 3.173 -17.918 -8.727 162 HD3 PRO 21 2HD PRO 21 1.483 -18.504 -8.543 163 H ASP 22 H ASP 22 3.626 -15.680 -10.214 164 HA ASP 22 HA ASP 22 3.714 -12.791 -10.674 165 HB2 ASP 22 1HB ASP 22 5.923 -14.886 -10.642 166 HB3 ASP 22 2HB ASP 22 6.145 -13.131 -10.536 167 H GLU 23 H GLU 23 3.341 -15.520 -12.594 168 HA GLU 23 HA GLU 23 5.008 -14.655 -14.850 169 HB2 GLU 23 1HB GLU 23 4.731 -17.023 -14.056 170 HB3 GLU 23 2HB GLU 23 3.043 -16.945 -14.564 171 HG2 GLU 23 1HG GLU 23 3.751 -16.597 -16.882 172 HG3 GLU 23 2HG GLU 23 5.448 -16.629 -16.360 173 H LEU 24 H LEU 24 4.222 -13.824 -16.793 174 HA LEU 24 HA LEU 24 1.439 -12.833 -16.653 175 HB2 LEU 24 1HB LEU 24 3.573 -11.543 -17.361 176 HB3 LEU 24 2HB LEU 24 3.404 -12.386 -18.867 177 HG LEU 24 HG LEU 24 2.569 -9.962 -18.565 178 HD11 LEU 24 1HD1 LEU 24 2.393 -11.332 -20.594 179 HD12 LEU 24 2HD1 LEU 24 1.039 -10.214 -20.366 180 HD13 LEU 24 3HD1 LEU 24 0.828 -11.938 -20.006 181 HD21 LEU 24 1HD2 LEU 24 0.316 -9.607 -17.948 182 HD22 LEU 24 2HD2 LEU 24 1.084 -10.502 -16.620 183 HD23 LEU 24 3HD2 LEU 24 0.014 -11.346 -17.764 184 H SER 25 H SER 25 -0.184 -13.563 -17.900 185 HA SER 25 HA SER 25 0.354 -16.041 -19.452 186 HB2 SER 25 1HB SER 25 -1.445 -15.973 -17.686 187 HB3 SER 25 2HB SER 25 -2.309 -14.785 -18.677 188 HG SER 25 HG SER 25 -2.351 -16.376 -20.350 189 H PHE 26 H PHE 26 0.224 -16.112 -21.652 190 HA PHE 26 HA PHE 26 -1.301 -14.064 -23.125 191 HB2 PHE 26 1HB PHE 26 0.672 -13.311 -24.424 192 HB3 PHE 26 2HB PHE 26 0.761 -12.839 -22.726 193 HD1 PHE 26 HD1 PHE 26 2.465 -13.748 -21.239 194 HD2 PHE 26 HD2 PHE 26 2.185 -15.075 -25.323 195 HE1 PHE 26 HE1 PHE 26 4.686 -14.828 -21.035 196 HE2 PHE 26 HE2 PHE 26 4.437 -16.115 -25.135 197 HZ PHE 26 HZ PHE 26 5.691 -16.000 -22.991 198 H ARG 27 H ARG 27 -1.070 -14.481 -25.562 199 HA ARG 27 HA ARG 27 -0.425 -17.366 -26.043 200 HB2 ARG 27 1HB ARG 27 -2.781 -15.825 -27.170 201 HB3 ARG 27 2HB ARG 27 -2.314 -17.476 -27.602 202 HG2 ARG 27 1HG ARG 27 -2.548 -17.940 -25.032 203 HG3 ARG 27 2HG ARG 27 -3.534 -16.463 -25.042 204 HD2 ARG 27 1HD ARG 27 -3.957 -18.942 -26.754 205 HD3 ARG 27 2HD ARG 27 -4.919 -18.481 -25.335 206 HE ARG 27 HE ARG 27 -5.064 -16.293 -27.048 207 HH11 ARG 27 1HH1 ARG 27 -5.933 -19.708 -27.318 208 HH12 ARG 27 2HH1 ARG 27 -7.205 -19.390 -28.466 209 HH21 ARG 27 1HH2 ARG 27 -6.707 -15.967 -28.514 210 HH22 ARG 27 2HH2 ARG 27 -7.637 -17.306 -29.123 211 H LYS 28 H LYS 28 0.152 -17.872 -28.262 212 HA LYS 28 HA LYS 28 1.827 -15.908 -29.498 213 HB2 LYS 28 1HB LYS 28 1.831 -17.464 -31.451 214 HB3 LYS 28 2HB LYS 28 2.221 -18.245 -29.925 215 HG2 LYS 28 1HG LYS 28 -0.171 -19.054 -29.799 216 HG3 LYS 28 2HG LYS 28 -0.373 -18.481 -31.467 217 HD2 LYS 28 1HD LYS 28 1.326 -19.988 -32.262 218 HD3 LYS 28 2HD LYS 28 1.851 -20.346 -30.607 219 HE2 LYS 28 1HE LYS 28 -0.709 -21.117 -30.367 220 HE3 LYS 28 2HE LYS 28 -0.508 -21.406 -32.114 221 HZ1 LYS 28 1HZ LYS 28 0.131 -23.349 -30.822 222 HZ2 LYS 28 2HZ LYS 28 1.207 -22.473 -29.925 223 HZ3 LYS 28 3HZ LYS 28 1.483 -22.730 -31.540 224 H GLY 29 H GLY 29 1.416 -14.361 -30.944 225 HA2 GLY 29 1HA GLY 29 0.123 -13.313 -32.647 226 HA3 GLY 29 2HA GLY 29 -1.281 -14.272 -32.191 227 H ASP 30 H ASP 30 -0.522 -13.531 -29.244 228 HA ASP 30 HA ASP 30 -2.292 -11.200 -29.157 229 HB2 ASP 30 1HB ASP 30 -1.998 -13.329 -27.552 230 HB3 ASP 30 2HB ASP 30 -0.847 -12.252 -26.745 231 H ILE 31 H ILE 31 -1.674 -9.287 -27.766 232 HA ILE 31 HA ILE 31 1.239 -8.625 -28.069 233 HB ILE 31 HB ILE 31 -1.142 -6.866 -28.875 234 HG12 ILE 31 1HG1 ILE 31 0.591 -6.742 -30.949 235 HG13 ILE 31 2HG1 ILE 31 1.039 -8.326 -30.334 236 HG21 ILE 31 1HG2 ILE 31 0.501 -5.454 -27.689 237 HG22 ILE 31 2HG2 ILE 31 1.829 -6.133 -28.661 238 HG23 ILE 31 3HG2 ILE 31 0.581 -5.120 -29.427 239 HD11 ILE 31 1HD1 ILE 31 -0.596 -8.462 -32.148 240 HD12 ILE 31 2HD1 ILE 31 -1.245 -9.124 -30.640 241 HD13 ILE 31 3HD1 ILE 31 -1.754 -7.508 -31.186 242 H MET 32 H MET 32 2.147 -7.715 -26.353 243 HA MET 32 HA MET 32 0.362 -6.728 -24.150 244 HB2 MET 32 1HB MET 32 1.945 -7.720 -22.548 245 HB3 MET 32 2HB MET 32 1.222 -8.946 -23.582 246 HG2 MET 32 1HG MET 32 3.484 -8.369 -25.004 247 HG3 MET 32 2HG MET 32 4.043 -8.091 -23.351 248 HE1 MET 32 1HE MET 32 2.881 -10.573 -26.047 249 HE2 MET 32 2HE MET 32 2.448 -12.028 -25.125 250 HE3 MET 32 3HE MET 32 1.426 -10.583 -25.021 251 H THR 33 H THR 33 1.340 -5.167 -22.756 252 HA THR 33 HA THR 33 3.223 -3.387 -24.190 253 HB THR 33 HB THR 33 1.992 -3.096 -21.404 254 HG1 THR 33 HG1 THR 33 0.359 -3.175 -22.951 255 HG21 THR 33 1HG2 THR 33 2.415 -0.677 -21.780 256 HG22 THR 33 2HG2 THR 33 3.201 -1.057 -23.327 257 HG23 THR 33 3HG2 THR 33 3.928 -1.608 -21.796 258 H VAL 34 H VAL 34 5.404 -3.257 -23.685 259 HA VAL 34 HA VAL 34 6.374 -5.028 -21.455 260 HB VAL 34 HB VAL 34 7.852 -3.804 -23.822 261 HG11 VAL 34 1HG1 VAL 34 9.361 -3.706 -21.930 262 HG12 VAL 34 2HG1 VAL 34 8.926 -5.355 -21.429 263 HG13 VAL 34 3HG1 VAL 34 9.845 -5.088 -22.929 264 HG21 VAL 34 1HG2 VAL 34 7.527 -6.734 -23.059 265 HG22 VAL 34 2HG2 VAL 34 6.469 -5.904 -24.231 266 HG23 VAL 34 3HG2 VAL 34 8.206 -6.074 -24.561 267 H LEU 35 H LEU 35 6.867 -4.103 -19.634 268 HA LEU 35 HA LEU 35 6.871 -1.139 -19.517 269 HB2 LEU 35 1HB LEU 35 6.722 -3.277 -17.363 270 HB3 LEU 35 2HB LEU 35 6.579 -1.549 -17.083 271 HG LEU 35 HG LEU 35 4.631 -3.201 -18.731 272 HD11 LEU 35 1HD1 LEU 35 4.457 -2.139 -15.882 273 HD12 LEU 35 2HD1 LEU 35 4.585 -3.845 -16.370 274 HD13 LEU 35 3HD1 LEU 35 3.132 -2.913 -16.774 275 HD21 LEU 35 1HD2 LEU 35 4.511 -0.318 -17.741 276 HD22 LEU 35 2HD2 LEU 35 3.167 -1.199 -18.509 277 HD23 LEU 35 3HD2 LEU 35 4.642 -0.859 -19.433 278 H GLU 36 H GLU 36 8.784 -3.934 -18.336 279 HA GLU 36 HA GLU 36 11.166 -2.159 -18.131 280 HB2 GLU 36 1HB GLU 36 9.883 -2.304 -15.942 281 HB3 GLU 36 2HB GLU 36 10.218 -4.031 -15.920 282 HG2 GLU 36 1HG GLU 36 11.741 -2.748 -14.465 283 HG3 GLU 36 2HG GLU 36 12.609 -3.611 -15.738 284 H ARG 37 H ARG 37 13.208 -3.498 -17.829 285 HA ARG 37 HA ARG 37 12.907 -6.294 -18.898 286 HB2 ARG 37 1HB ARG 37 14.839 -4.153 -19.840 287 HB3 ARG 37 2HB ARG 37 14.962 -5.865 -20.268 288 HG2 ARG 37 1HG ARG 37 12.799 -5.758 -21.410 289 HG3 ARG 37 2HG ARG 37 12.611 -4.074 -20.951 290 HD2 ARG 37 1HD ARG 37 14.918 -5.106 -22.633 291 HD3 ARG 37 2HD ARG 37 13.414 -4.459 -23.311 292 HE ARG 37 HE ARG 37 13.940 -2.295 -22.479 293 HH11 ARG 37 1HH1 ARG 37 16.592 -4.560 -21.869 294 HH12 ARG 37 2HH1 ARG 37 17.731 -3.275 -21.568 295 HH21 ARG 37 1HH2 ARG 37 15.451 -0.730 -22.082 296 HH22 ARG 37 2HH2 ARG 37 17.094 -1.157 -21.687 297 H ASP 38 H ASP 38 14.606 -7.703 -18.263 298 HA ASP 38 HA ASP 38 15.942 -8.639 -16.674 299 HB2 ASP 38 1HB ASP 38 17.583 -6.940 -17.669 300 HB3 ASP 38 2HB ASP 38 17.261 -5.948 -16.240 301 H THR 39 H THR 39 13.453 -7.839 -16.024 302 HA THR 39 HA THR 39 13.254 -6.090 -13.787 303 HB THR 39 HB THR 39 11.419 -6.563 -15.407 304 HG1 THR 39 HG1 THR 39 11.065 -6.958 -12.635 305 HG21 THR 39 1HG2 THR 39 11.736 -9.015 -15.668 306 HG22 THR 39 2HG2 THR 39 10.076 -8.616 -15.189 307 HG23 THR 39 3HG2 THR 39 11.208 -9.259 -13.984 308 H GLN 40 H GLN 40 14.496 -9.212 -13.797 309 HA GLN 40 HA GLN 40 13.827 -9.527 -10.906 310 HB2 GLN 40 1HB GLN 40 12.526 -10.960 -12.735 311 HB3 GLN 40 2HB GLN 40 13.993 -11.937 -12.675 312 HG2 GLN 40 1HG GLN 40 13.664 -12.099 -10.169 313 HG3 GLN 40 2HG GLN 40 12.097 -11.308 -10.392 314 HE21 GLN 40 1HE2 GLN 40 12.106 -15.172 -10.575 315 HE22 GLN 40 2HE2 GLN 40 13.094 -14.115 -9.591 316 H GLY 41 H GLY 41 16.335 -8.874 -12.834 317 HA2 GLY 41 1HA GLY 41 18.618 -9.244 -12.516 318 HA3 GLY 41 2HA GLY 41 18.244 -10.361 -11.179 319 H LEU 42 H LEU 42 16.547 -10.728 -14.130 320 HA LEU 42 HA LEU 42 18.274 -13.000 -14.991 321 HB2 LEU 42 1HB LEU 42 15.238 -12.762 -15.147 322 HB3 LEU 42 2HB LEU 42 16.195 -14.075 -15.817 323 HG LEU 42 HG LEU 42 15.907 -13.469 -12.857 324 HD11 LEU 42 1HD1 LEU 42 13.781 -14.176 -13.884 325 HD12 LEU 42 2HD1 LEU 42 14.432 -15.449 -12.837 326 HD13 LEU 42 3HD1 LEU 42 14.584 -15.591 -14.604 327 HD21 LEU 42 1HD2 LEU 42 18.004 -14.631 -13.332 328 HD22 LEU 42 2HD2 LEU 42 17.145 -15.836 -14.324 329 HD23 LEU 42 3HD2 LEU 42 16.857 -15.748 -12.570 330 H ASP 43 H ASP 43 19.271 -12.141 -16.770 331 HA ASP 43 HA ASP 43 18.104 -10.015 -18.298 332 HB2 ASP 43 1HB ASP 43 20.581 -10.521 -18.141 333 HB3 ASP 43 2HB ASP 43 20.294 -11.919 -19.193 334 H GLY 44 H GLY 44 17.284 -10.100 -20.389 335 HA2 GLY 44 1HA GLY 44 16.211 -11.120 -22.212 336 HA3 GLY 44 2HA GLY 44 16.509 -12.710 -21.494 337 H TRP 45 H TRP 45 15.238 -11.370 -18.875 338 HA TRP 45 HA TRP 45 12.461 -12.087 -19.701 339 HB2 TRP 45 1HB TRP 45 13.821 -11.830 -17.012 340 HB3 TRP 45 2HB TRP 45 12.073 -12.035 -17.194 341 HD1 TRP 45 HD1 TRP 45 15.352 -13.929 -18.036 342 HE1 TRP 45 HE1 TRP 45 14.900 -16.428 -18.136 343 HE3 TRP 45 HE3 TRP 45 10.281 -13.751 -17.394 344 HZ2 TRP 45 HZ2 TRP 45 12.622 -18.151 -17.967 345 HZ3 TRP 45 HZ3 TRP 45 8.995 -15.896 -17.353 346 HH2 TRP 45 HH2 TRP 45 10.170 -18.076 -17.644 347 H TRP 46 H TRP 46 10.809 -10.643 -19.744 348 HA TRP 46 HA TRP 46 11.498 -7.841 -18.950 349 HB2 TRP 46 1HB TRP 46 9.708 -8.817 -21.200 350 HB3 TRP 46 2HB TRP 46 10.080 -7.138 -20.813 351 HD1 TRP 46 HD1 TRP 46 13.377 -8.482 -20.501 352 HE1 TRP 46 HE1 TRP 46 14.757 -8.491 -22.630 353 HE3 TRP 46 HE3 TRP 46 9.538 -7.838 -23.802 354 HZ2 TRP 46 HZ2 TRP 46 14.266 -8.245 -25.431 355 HZ3 TRP 46 HZ3 TRP 46 10.058 -7.755 -26.248 356 HH2 TRP 46 HH2 TRP 46 12.412 -7.949 -27.044 357 H LEU 47 H LEU 47 9.853 -6.630 -17.991 358 HA LEU 47 HA LEU 47 7.658 -8.215 -16.771 359 HB2 LEU 47 1HB LEU 47 8.907 -6.524 -15.422 360 HB3 LEU 47 2HB LEU 47 8.432 -5.278 -16.561 361 HG LEU 47 HG LEU 47 6.031 -5.704 -15.932 362 HD11 LEU 47 1HD1 LEU 47 7.319 -7.363 -13.720 363 HD12 LEU 47 2HD1 LEU 47 6.250 -7.971 -15.004 364 HD13 LEU 47 3HD1 LEU 47 5.612 -6.863 -13.781 365 HD21 LEU 47 1HD2 LEU 47 7.350 -3.838 -15.015 366 HD22 LEU 47 2HD2 LEU 47 7.941 -4.885 -13.705 367 HD23 LEU 47 3HD2 LEU 47 6.213 -4.467 -13.807 368 H CYS 48 H CYS 48 5.854 -8.483 -17.990 369 HA CYS 48 HA CYS 48 5.200 -6.292 -19.917 370 HB2 CYS 48 1HB CYS 48 4.576 -9.247 -20.113 371 HB3 CYS 48 2HB CYS 48 4.197 -8.005 -21.314 372 HG CYS 48 HG CYS 48 7.141 -8.984 -20.206 373 H SER 49 H SER 49 2.903 -6.018 -20.371 374 HA SER 49 HA SER 49 1.164 -6.943 -18.132 375 HB2 SER 49 1HB SER 49 1.843 -4.620 -17.700 376 HB3 SER 49 2HB SER 49 1.253 -4.146 -19.308 377 HG SER 49 HG SER 49 -0.345 -5.353 -17.279 378 H LEU 50 H LEU 50 -0.717 -7.718 -18.647 379 HA LEU 50 HA LEU 50 -2.031 -7.041 -21.214 380 HB2 LEU 50 1HB LEU 50 -0.455 -8.958 -21.657 381 HB3 LEU 50 2HB LEU 50 -1.339 -9.909 -20.470 382 HG LEU 50 HG LEU 50 -3.116 -8.799 -22.509 383 HD11 LEU 50 1HD1 LEU 50 -1.113 -8.949 -23.911 384 HD12 LEU 50 2HD1 LEU 50 -2.302 -10.175 -24.374 385 HD13 LEU 50 3HD1 LEU 50 -0.878 -10.641 -23.416 386 HD21 LEU 50 1HD2 LEU 50 -3.615 -10.690 -20.937 387 HD22 LEU 50 2HD2 LEU 50 -2.437 -11.676 -21.818 388 HD23 LEU 50 3HD2 LEU 50 -3.891 -11.083 -22.647 389 H HIS 51 H HIS 51 -4.260 -7.242 -21.021 390 HA HIS 51 HA HIS 51 -6.298 -7.388 -20.006 391 HB2 HIS 51 1HB HIS 51 -5.454 -9.859 -20.197 392 HB3 HIS 51 2HB HIS 51 -5.390 -9.791 -18.436 393 HD1 HIS 51 HD1 HIS 51 -7.886 -8.779 -17.419 394 HD2 HIS 51 HD2 HIS 51 -7.805 -10.737 -21.099 395 HE1 HIS 51 HE1 HIS 51 -10.256 -9.559 -17.898 396 H GLY 52 H GLY 52 -4.340 -5.704 -18.619 397 HA2 GLY 52 1HA GLY 52 -4.477 -4.378 -16.729 398 HA3 GLY 52 2HA GLY 52 -5.884 -5.310 -16.207 399 H ARG 53 H ARG 53 -3.234 -7.327 -16.884 400 HA ARG 53 HA ARG 53 -2.414 -7.362 -13.994 401 HB2 ARG 53 1HB ARG 53 -2.515 -9.639 -16.026 402 HB3 ARG 53 2HB ARG 53 -1.902 -9.765 -14.373 403 HG2 ARG 53 1HG ARG 53 -4.159 -9.233 -13.511 404 HG3 ARG 53 2HG ARG 53 -4.768 -9.172 -15.180 405 HD2 ARG 53 1HD ARG 53 -4.039 -11.507 -15.520 406 HD3 ARG 53 2HD ARG 53 -3.458 -11.561 -13.844 407 HE ARG 53 HE ARG 53 -6.204 -10.759 -13.902 408 HH11 ARG 53 1HH1 ARG 53 -4.211 -13.646 -14.290 409 HH12 ARG 53 2HH1 ARG 53 -5.493 -14.716 -13.791 410 HH21 ARG 53 1HH2 ARG 53 -7.798 -12.187 -13.277 411 HH22 ARG 53 2HH2 ARG 53 -7.486 -13.899 -13.228 412 H GLN 54 H GLN 54 -0.081 -8.066 -13.797 413 HA GLN 54 HA GLN 54 1.460 -7.774 -16.285 414 HB2 GLN 54 1HB GLN 54 3.023 -6.181 -15.325 415 HB3 GLN 54 2HB GLN 54 1.397 -5.495 -15.359 416 HG2 GLN 54 1HG GLN 54 1.141 -6.017 -12.942 417 HG3 GLN 54 2HG GLN 54 2.805 -6.630 -12.923 418 HE21 GLN 54 1HE2 GLN 54 4.008 -3.473 -12.148 419 HE22 GLN 54 2HE2 GLN 54 4.021 -5.199 -11.872 420 H GLY 55 H GLY 55 3.478 -8.805 -16.185 421 HA2 GLY 55 1HA GLY 55 4.407 -10.093 -13.773 422 HA3 GLY 55 2HA GLY 55 3.464 -11.223 -14.765 423 H ILE 56 H ILE 56 5.853 -12.115 -14.547 424 HA ILE 56 HA ILE 56 7.727 -10.822 -16.393 425 HB ILE 56 HB ILE 56 9.310 -12.569 -15.771 426 HG12 ILE 56 1HG1 ILE 56 7.048 -13.869 -14.198 427 HG13 ILE 56 2HG1 ILE 56 7.680 -14.475 -15.727 428 HG21 ILE 56 1HG2 ILE 56 8.817 -10.613 -14.203 429 HG22 ILE 56 2HG2 ILE 56 7.808 -11.721 -13.244 430 HG23 ILE 56 3HG2 ILE 56 9.549 -12.027 -13.425 431 HD11 ILE 56 1HD1 ILE 56 9.936 -14.732 -14.614 432 HD12 ILE 56 2HD1 ILE 56 9.140 -14.338 -13.069 433 HD13 ILE 56 3HD1 ILE 56 8.652 -15.784 -13.978 434 H VAL 57 H VAL 57 8.526 -11.549 -18.305 435 HA VAL 57 HA VAL 57 7.308 -13.967 -19.563 436 HB VAL 57 HB VAL 57 7.476 -11.192 -20.857 437 HG11 VAL 57 1HG1 VAL 57 6.723 -13.894 -21.996 438 HG12 VAL 57 2HG1 VAL 57 6.237 -12.369 -22.757 439 HG13 VAL 57 3HG1 VAL 57 7.955 -12.754 -22.579 440 HG21 VAL 57 1HG2 VAL 57 5.588 -11.296 -19.394 441 HG22 VAL 57 2HG2 VAL 57 5.020 -11.409 -21.071 442 HG23 VAL 57 3HG2 VAL 57 5.106 -12.872 -20.059 443 HA PRO 58 HA PRO 58 11.633 -13.903 -20.813 444 HB2 PRO 58 1HB PRO 58 11.704 -15.988 -22.577 445 HB3 PRO 58 2HB PRO 58 11.668 -16.236 -20.799 446 HG2 PRO 58 1HG PRO 58 9.413 -16.350 -22.771 447 HG3 PRO 58 2HG PRO 58 9.822 -17.495 -21.460 448 HD2 PRO 58 1HD PRO 58 7.900 -15.574 -21.231 449 HD3 PRO 58 2HD PRO 58 8.881 -16.137 -19.838 450 H GLY 59 H GLY 59 12.103 -12.199 -22.112 451 HA2 GLY 59 1HA GLY 59 10.319 -11.264 -24.119 452 HA3 GLY 59 2HA GLY 59 11.947 -10.669 -23.795 453 H ASN 60 H ASN 60 12.867 -13.575 -24.326 454 HA ASN 60 HA ASN 60 13.474 -13.194 -27.122 455 HB2 ASN 60 1HB ASN 60 13.820 -15.573 -25.264 456 HB3 ASN 60 2HB ASN 60 14.396 -15.535 -26.937 457 HD21 ASN 60 1HD2 ASN 60 16.969 -14.365 -24.345 458 HD22 ASN 60 2HD2 ASN 60 15.802 -15.660 -24.262 459 H ARG 61 H ARG 61 10.610 -14.159 -25.661 460 HA ARG 61 HA ARG 61 9.811 -15.822 -28.023 461 HB2 ARG 61 1HB ARG 61 8.490 -15.414 -25.306 462 HB3 ARG 61 2HB ARG 61 7.797 -16.347 -26.634 463 HG2 ARG 61 1HG ARG 61 9.827 -17.835 -26.568 464 HG3 ARG 61 2HG ARG 61 10.321 -16.987 -25.085 465 HD2 ARG 61 1HD ARG 61 8.133 -17.588 -24.054 466 HD3 ARG 61 2HD ARG 61 7.705 -18.488 -25.516 467 HE ARG 61 HE ARG 61 10.155 -19.529 -24.646 468 HH11 ARG 61 1HH1 ARG 61 6.878 -19.320 -23.353 469 HH12 ARG 61 2HH1 ARG 61 7.047 -20.758 -22.394 470 HH21 ARG 61 1HH2 ARG 61 10.292 -21.403 -23.417 471 HH22 ARG 61 2HH2 ARG 61 8.937 -21.920 -22.448 472 H LEU 62 H LEU 62 10.078 -12.682 -27.448 473 HA LEU 62 HA LEU 62 7.353 -12.006 -28.492 474 HB2 LEU 62 1HB LEU 62 9.169 -10.319 -26.749 475 HB3 LEU 62 2HB LEU 62 7.576 -9.880 -27.325 476 HG LEU 62 HG LEU 62 8.179 -12.040 -25.287 477 HD11 LEU 62 1HD1 LEU 62 6.961 -9.257 -24.993 478 HD12 LEU 62 2HD1 LEU 62 8.567 -9.766 -24.437 479 HD13 LEU 62 3HD1 LEU 62 7.117 -10.453 -23.694 480 HD21 LEU 62 1HD2 LEU 62 5.549 -10.984 -26.382 481 HD22 LEU 62 2HD2 LEU 62 5.701 -11.977 -24.916 482 HD23 LEU 62 3HD2 LEU 62 6.182 -12.647 -26.478 483 H LYS 63 H LYS 63 7.202 -10.279 -29.997 484 HA LYS 63 HA LYS 63 9.812 -9.353 -31.170 485 HB2 LYS 63 1HB LYS 63 8.552 -11.064 -32.564 486 HB3 LYS 63 2HB LYS 63 7.259 -9.880 -32.750 487 HG2 LYS 63 1HG LYS 63 10.078 -9.099 -33.521 488 HG3 LYS 63 2HG LYS 63 9.177 -10.190 -34.588 489 HD2 LYS 63 1HD LYS 63 7.362 -8.536 -34.802 490 HD3 LYS 63 2HD LYS 63 8.198 -7.466 -33.679 491 HE2 LYS 63 1HE LYS 63 8.808 -6.517 -35.691 492 HE3 LYS 63 2HE LYS 63 10.180 -7.581 -35.394 493 HZ1 LYS 63 1HZ LYS 63 9.206 -7.598 -37.709 494 HZ2 LYS 63 2HZ LYS 63 7.895 -8.380 -37.097 495 HZ3 LYS 63 3HZ LYS 63 9.380 -9.096 -37.022 496 H ILE 64 H ILE 64 10.027 -7.217 -30.861 497 HA ILE 64 HA ILE 64 7.972 -5.567 -29.771 498 HB ILE 64 HB ILE 64 10.570 -4.774 -31.197 499 HG12 ILE 64 1HG1 ILE 64 10.883 -6.279 -29.217 500 HG13 ILE 64 2HG1 ILE 64 11.637 -4.699 -29.059 501 HG21 ILE 64 1HG2 ILE 64 8.692 -3.134 -29.421 502 HG22 ILE 64 2HG2 ILE 64 10.366 -2.650 -29.783 503 HG23 ILE 64 3HG2 ILE 64 9.184 -2.792 -31.093 504 HD11 ILE 64 1HD1 ILE 64 9.913 -3.940 -27.505 505 HD12 ILE 64 2HD1 ILE 64 8.974 -5.422 -27.763 506 HD13 ILE 64 3HD1 ILE 64 10.545 -5.497 -26.949 507 H LEU 65 H LEU 65 6.448 -4.246 -30.654 508 HA LEU 65 HA LEU 65 6.125 -4.255 -33.597 509 HB2 LEU 65 1HB LEU 65 4.586 -2.973 -31.307 510 HB3 LEU 65 2HB LEU 65 4.257 -2.600 -32.984 511 HG LEU 65 HG LEU 65 2.576 -4.068 -32.245 512 HD11 LEU 65 1HD1 LEU 65 3.463 -4.492 -34.540 513 HD12 LEU 65 2HD1 LEU 65 2.725 -5.921 -33.791 514 HD13 LEU 65 3HD1 LEU 65 4.497 -5.782 -33.872 515 HD21 LEU 65 1HD2 LEU 65 3.773 -5.026 -30.315 516 HD22 LEU 65 2HD2 LEU 65 4.683 -6.076 -31.426 517 HD23 LEU 65 3HD2 LEU 65 2.916 -6.239 -31.282 518 H VAL 66 H VAL 66 7.334 -2.944 -34.739 519 HA VAL 66 HA VAL 66 8.541 -1.180 -35.482 520 HB VAL 66 HB VAL 66 7.070 0.564 -33.454 521 HG11 VAL 66 1HG1 VAL 66 7.592 2.380 -35.073 522 HG12 VAL 66 2HG1 VAL 66 9.065 1.655 -34.401 523 HG13 VAL 66 3HG1 VAL 66 8.537 1.231 -36.050 524 HG21 VAL 66 1HG2 VAL 66 5.557 1.087 -35.388 525 HG22 VAL 66 2HG2 VAL 66 6.348 -0.203 -36.324 526 HG23 VAL 66 3HG2 VAL 66 5.430 -0.596 -34.849 527 H GLY 67 H GLY 67 10.632 -1.516 -35.108 528 HA2 GLY 67 1HA GLY 67 11.975 -0.089 -33.041 529 HA3 GLY 67 2HA GLY 67 11.807 -1.792 -32.568 530 H MET 68 H MET 68 14.218 -1.617 -32.697 531 HA MET 68 HA MET 68 15.519 -1.351 -35.254 532 HB2 MET 68 1HB MET 68 16.292 -1.186 -32.672 533 HB3 MET 68 2HB MET 68 16.794 -2.844 -32.993 534 HG2 MET 68 1HG MET 68 18.684 -1.489 -33.419 535 HG3 MET 68 2HG MET 68 18.051 -1.929 -35.020 536 HE1 MET 68 1HE MET 68 19.291 1.734 -35.671 537 HE2 MET 68 2HE MET 68 20.074 0.465 -34.700 538 HE3 MET 68 3HE MET 68 19.303 0.051 -36.252 539 H TYR 69 H TYR 69 13.386 -3.585 -34.900 540 HA TYR 69 HA TYR 69 14.981 -5.723 -36.171 541 HB2 TYR 69 1HB TYR 69 15.024 -6.146 -33.714 542 HB3 TYR 69 2HB TYR 69 13.258 -6.160 -33.701 543 HD1 TYR 69 HD1 TYR 69 12.007 -8.090 -34.528 544 HD2 TYR 69 HD2 TYR 69 16.300 -7.982 -34.786 545 HE1 TYR 69 HE1 TYR 69 12.045 -10.543 -35.022 546 HE2 TYR 69 HE2 TYR 69 16.329 -10.427 -35.263 547 HH TYR 69 HH TYR 69 15.098 -12.345 -35.416 548 H ASP 70 H ASP 70 13.883 -6.050 -38.040 549 HA ASP 70 HA ASP 70 11.020 -6.721 -37.722 550 HB2 ASP 70 1HB ASP 70 11.160 -4.386 -38.585 551 HB3 ASP 70 2HB ASP 70 11.970 -5.024 -40.027 552 H LYS 71 H LYS 71 12.792 -8.681 -37.744 553 HA LYS 71 HA LYS 71 13.079 -9.718 -40.476 554 HB2 LYS 71 1HB LYS 71 13.221 -11.103 -37.773 555 HB3 LYS 71 2HB LYS 71 13.585 -11.875 -39.312 556 HG2 LYS 71 1HG LYS 71 15.103 -9.497 -38.143 557 HG3 LYS 71 2HG LYS 71 15.625 -11.179 -38.030 558 HD2 LYS 71 1HD LYS 71 15.258 -9.672 -40.662 559 HD3 LYS 71 2HD LYS 71 16.798 -9.868 -39.812 560 HE2 LYS 71 1HE LYS 71 16.555 -12.353 -39.990 561 HE3 LYS 71 2HE LYS 71 15.074 -12.119 -40.941 562 HZ1 LYS 71 1HZ LYS 71 17.783 -11.170 -41.708 563 HZ2 LYS 71 2HZ LYS 71 16.412 -10.923 -42.590 564 HZ3 LYS 71 3HZ LYS 71 16.989 -12.453 -42.375 565 H LYS 72 H LYS 72 11.601 -10.904 -41.544 566 HA LYS 72 HA LYS 72 8.855 -10.988 -40.500 567 HB2 LYS 72 1HB LYS 72 10.241 -11.610 -43.117 568 HB3 LYS 72 2HB LYS 72 8.655 -12.313 -42.803 569 HG2 LYS 72 1HG LYS 72 8.335 -10.299 -44.083 570 HG3 LYS 72 2HG LYS 72 7.717 -10.025 -42.450 571 HD2 LYS 72 1HD LYS 72 9.749 -8.747 -41.869 572 HD3 LYS 72 2HD LYS 72 10.428 -9.070 -43.479 573 HE2 LYS 72 1HE LYS 72 8.533 -7.852 -44.509 574 HE3 LYS 72 2HE LYS 72 7.860 -7.532 -42.897 575 HZ1 LYS 72 1HZ LYS 72 10.529 -6.592 -43.776 576 HZ2 LYS 72 2HZ LYS 72 9.756 -6.195 -42.368 577 HZ3 LYS 72 3HZ LYS 72 9.166 -5.667 -43.813 578 HA PRO 73 HA PRO 73 9.427 -14.925 -38.763 579 HB2 PRO 73 1HB PRO 73 7.021 -16.185 -38.942 580 HB3 PRO 73 2HB PRO 73 7.268 -14.723 -37.932 581 HG2 PRO 73 1HG PRO 73 6.186 -14.905 -40.737 582 HG3 PRO 73 2HG PRO 73 5.467 -14.100 -39.303 583 HD2 PRO 73 1HD PRO 73 6.898 -12.703 -41.112 584 HD3 PRO 73 2HD PRO 73 7.043 -12.351 -39.355 585 H ALA 74 H ALA 74 8.409 -14.949 -42.116 586 HA ALA 74 HA ALA 74 8.682 -16.439 -43.814 587 HB1 ALA 74 1HB ALA 74 11.045 -15.893 -43.249 588 HB2 ALA 74 2HB ALA 74 11.101 -17.321 -42.184 589 HB3 ALA 74 3HB ALA 74 10.863 -17.528 -43.934 590 H GLY 75 H GLY 75 6.694 -17.426 -42.187 591 HA2 GLY 75 1HA GLY 75 6.995 -20.286 -42.743 592 HA3 GLY 75 2HA GLY 75 6.687 -19.862 -41.041 593 H GLU 76 H GLU 76 4.859 -21.377 -42.587 594 HA GLU 76 HA GLU 76 2.529 -19.545 -42.678 595 HB2 GLU 76 1HB GLU 76 3.569 -19.720 -44.975 596 HB3 GLU 76 2HB GLU 76 3.289 -21.463 -44.922 597 HG2 GLU 76 1HG GLU 76 0.879 -21.094 -44.797 598 HG3 GLU 76 2HG GLU 76 1.129 -19.341 -44.742 599 H PHE 77 H PHE 77 0.527 -20.779 -42.427 600 HA PHE 77 HA PHE 77 0.863 -23.623 -41.635 601 HB2 PHE 77 1HB PHE 77 -0.292 -23.191 -39.490 602 HB3 PHE 77 2HB PHE 77 1.269 -22.369 -39.596 603 HD1 PHE 77 HD1 PHE 77 -2.403 -21.892 -39.545 604 HD2 PHE 77 HD2 PHE 77 1.434 -19.941 -39.694 605 HE1 PHE 77 HE1 PHE 77 -3.498 -19.717 -39.027 606 HE2 PHE 77 HE2 PHE 77 0.352 -17.759 -39.176 607 HZ PHE 77 HZ PHE 77 -2.124 -17.640 -38.845 608 H ILE 78 H ILE 78 -0.699 -21.715 -43.657 609 HA ILE 78 HA ILE 78 -3.444 -22.655 -43.029 610 HB ILE 78 HB ILE 78 -3.027 -20.231 -43.715 611 HG12 ILE 78 1HG1 ILE 78 -4.835 -21.768 -45.611 612 HG13 ILE 78 2HG1 ILE 78 -5.213 -21.479 -43.911 613 HG21 ILE 78 1HG2 ILE 78 -2.551 -19.661 -46.024 614 HG22 ILE 78 2HG2 ILE 78 -1.288 -20.779 -45.495 615 HG23 ILE 78 3HG2 ILE 78 -2.600 -21.366 -46.522 616 HD11 ILE 78 1HD1 ILE 78 -4.881 -19.366 -46.082 617 HD12 ILE 78 2HD1 ILE 78 -6.386 -19.849 -45.270 618 HD13 ILE 78 3HD1 ILE 78 -5.116 -19.006 -44.354 619 H VAL 79 H VAL 79 -4.568 -24.018 -44.501 620 HA VAL 79 HA VAL 79 -2.864 -25.305 -46.588 621 HB VAL 79 HB VAL 79 -4.863 -26.707 -44.734 622 HG11 VAL 79 1HG1 VAL 79 -4.883 -27.704 -46.982 623 HG12 VAL 79 2HG1 VAL 79 -3.104 -27.800 -46.987 624 HG13 VAL 79 3HG1 VAL 79 -4.054 -28.794 -45.859 625 HG21 VAL 79 1HG2 VAL 79 -1.818 -26.884 -44.881 626 HG22 VAL 79 2HG2 VAL 79 -2.781 -26.232 -43.534 627 HG23 VAL 79 3HG2 VAL 79 -2.855 -27.963 -43.917 628 H THR 80 H THR 80 -3.822 -25.283 -48.529 629 HA THR 80 HA THR 80 -6.737 -24.590 -48.657 630 HB THR 80 HB THR 80 -4.587 -23.963 -50.733 631 HG1 THR 80 HG1 THR 80 -4.399 -22.750 -48.756 632 HG21 THR 80 1HG2 THR 80 -6.852 -24.154 -51.685 633 HG22 THR 80 2HG2 THR 80 -6.331 -22.454 -51.652 634 HG23 THR 80 3HG2 THR 80 -7.480 -23.050 -50.435 635 H ASP 81 H ASP 81 -4.010 -26.349 -50.102 636 HA ASP 81 HA ASP 81 -5.665 -28.671 -50.691 637 HB2 ASP 81 1HB ASP 81 -5.819 -27.151 -52.777 638 HB3 ASP 81 2HB ASP 81 -4.079 -27.371 -52.969 639 HXT ASP 81 H02 ASP 81 -4.327 -30.209 -51.550 Start of MODEL 18 1 H2 GLY 1 2H0 GLY 1 14.404 9.626 -17.829 2 H GLY 1 1H0 GLY 1 15.900 9.763 -18.533 3 HA2 GLY 1 1HA GLY 1 14.141 12.085 -17.849 4 HA3 GLY 1 2HA GLY 1 15.679 12.183 -18.734 5 H SER 2 H SER 2 15.301 10.044 -20.489 6 HA SER 2 HA SER 2 13.694 11.362 -22.507 7 HB2 SER 2 1HB SER 2 14.925 8.586 -22.588 8 HB3 SER 2 2HB SER 2 14.483 9.609 -23.973 9 HG SER 2 HG SER 2 16.122 11.016 -23.426 10 H MET 3 H MET 3 13.154 8.730 -20.257 11 HA MET 3 HA MET 3 10.351 8.517 -21.084 12 HB2 MET 3 1HB MET 3 10.418 6.101 -21.453 13 HB3 MET 3 2HB MET 3 11.447 6.923 -22.626 14 HG2 MET 3 1HG MET 3 13.449 6.316 -21.305 15 HG3 MET 3 2HG MET 3 12.414 5.499 -20.122 16 HE1 MET 3 1HE MET 3 14.058 5.394 -23.678 17 HE2 MET 3 2HE MET 3 13.232 4.027 -24.461 18 HE3 MET 3 3HE MET 3 12.354 5.546 -24.176 19 H LYS 4 H LYS 4 9.340 6.781 -19.529 20 HA LYS 4 HA LYS 4 10.640 7.136 -16.842 21 HB2 LYS 4 1HB LYS 4 7.741 7.051 -17.718 22 HB3 LYS 4 2HB LYS 4 8.203 6.582 -16.081 23 HG2 LYS 4 1HG LYS 4 7.564 8.840 -15.900 24 HG3 LYS 4 2HG LYS 4 9.332 8.858 -15.848 25 HD2 LYS 4 1HD LYS 4 9.393 9.535 -18.233 26 HD3 LYS 4 2HD LYS 4 7.619 9.484 -18.294 27 HE2 LYS 4 1HE LYS 4 7.516 11.251 -16.566 28 HE3 LYS 4 2HE LYS 4 9.290 11.286 -16.493 29 HZ1 LYS 4 1HZ LYS 4 7.667 11.945 -18.893 30 HZ2 LYS 4 2HZ LYS 4 9.316 11.989 -18.813 31 HZ3 LYS 4 3HZ LYS 4 8.417 13.042 -17.917 32 H TYR 5 H TYR 5 8.921 4.925 -19.012 33 HA TYR 5 HA TYR 5 10.325 2.642 -17.836 34 HB2 TYR 5 1HB TYR 5 8.289 1.315 -17.583 35 HB3 TYR 5 2HB TYR 5 8.207 2.722 -16.531 36 HD1 TYR 5 HD1 TYR 5 6.648 4.610 -17.075 37 HD2 TYR 5 HD2 TYR 5 6.744 1.005 -19.404 38 HE1 TYR 5 HE1 TYR 5 4.462 5.215 -18.116 39 HE2 TYR 5 HE2 TYR 5 4.580 1.604 -20.435 40 HH TYR 5 HH TYR 5 2.992 3.280 -20.706 41 H LEU 6 H LEU 6 9.687 0.737 -19.533 42 HA LEU 6 HA LEU 6 10.741 1.659 -21.968 43 HB2 LEU 6 1HB LEU 6 9.414 -0.844 -21.039 44 HB3 LEU 6 2HB LEU 6 9.548 -0.626 -22.770 45 HG LEU 6 HG LEU 6 11.339 -2.017 -21.806 46 HD11 LEU 6 1HD1 LEU 6 11.641 -0.774 -23.926 47 HD12 LEU 6 2HD1 LEU 6 13.169 -0.974 -23.040 48 HD13 LEU 6 3HD1 LEU 6 12.328 0.592 -23.019 49 HD21 LEU 6 1HD2 LEU 6 12.402 0.540 -20.553 50 HD22 LEU 6 2HD2 LEU 6 13.100 -1.093 -20.455 51 HD23 LEU 6 3HD2 LEU 6 11.557 -0.733 -19.651 52 H ASN 7 H ASN 7 7.330 0.882 -21.315 53 HA ASN 7 HA ASN 7 5.420 1.328 -22.467 54 HB2 ASN 7 1HB ASN 7 6.328 3.619 -21.751 55 HB3 ASN 7 2HB ASN 7 6.791 3.842 -23.439 56 HD21 ASN 7 1HD2 ASN 7 3.648 5.167 -24.067 57 HD22 ASN 7 2HD2 ASN 7 5.385 5.298 -24.190 58 H VAL 8 H VAL 8 6.924 -0.440 -23.995 59 HA VAL 8 HA VAL 8 6.028 0.409 -26.709 60 HB VAL 8 HB VAL 8 8.523 0.707 -26.561 61 HG11 VAL 8 1HG1 VAL 8 9.030 -1.094 -24.947 62 HG12 VAL 8 2HG1 VAL 8 8.595 -2.314 -26.165 63 HG13 VAL 8 3HG1 VAL 8 9.997 -1.249 -26.425 64 HG21 VAL 8 1HG2 VAL 8 9.043 -0.430 -28.641 65 HG22 VAL 8 2HG2 VAL 8 7.666 -1.536 -28.423 66 HG23 VAL 8 3HG2 VAL 8 7.383 0.196 -28.698 67 H LEU 9 H LEU 9 5.273 -1.398 -27.964 68 HA LEU 9 HA LEU 9 4.333 -3.519 -26.114 69 HB2 LEU 9 1HB LEU 9 3.257 -3.862 -28.726 70 HB3 LEU 9 2HB LEU 9 2.439 -3.470 -27.232 71 HG LEU 9 HG LEU 9 3.671 -1.379 -29.046 72 HD11 LEU 9 1HD1 LEU 9 2.020 -2.662 -30.301 73 HD12 LEU 9 2HD1 LEU 9 1.395 -1.042 -29.944 74 HD13 LEU 9 3HD1 LEU 9 0.823 -2.445 -29.003 75 HD21 LEU 9 1HD2 LEU 9 3.147 -0.673 -26.671 76 HD22 LEU 9 2HD2 LEU 9 1.461 -1.166 -26.928 77 HD23 LEU 9 3HD2 LEU 9 2.157 0.177 -27.873 78 H ALA 10 H ALA 10 4.168 -5.722 -26.881 79 HA ALA 10 HA ALA 10 6.007 -6.391 -29.073 80 HB1 ALA 10 1HB ALA 10 7.274 -7.975 -27.790 81 HB2 ALA 10 2HB ALA 10 7.256 -6.480 -26.832 82 HB3 ALA 10 3HB ALA 10 6.178 -7.819 -26.392 83 H LYS 11 H LYS 11 5.351 -8.140 -30.237 84 HA LYS 11 HA LYS 11 2.752 -9.357 -29.437 85 HB2 LYS 11 1HB LYS 11 3.023 -8.381 -31.728 86 HB3 LYS 11 2HB LYS 11 4.285 -9.578 -32.058 87 HG2 LYS 11 1HG LYS 11 2.695 -11.403 -31.864 88 HG3 LYS 11 2HG LYS 11 1.448 -10.309 -31.252 89 HD2 LYS 11 1HD LYS 11 0.882 -10.731 -33.498 90 HD3 LYS 11 2HD LYS 11 1.552 -9.091 -33.466 91 HE2 LYS 11 1HE LYS 11 3.720 -9.956 -34.276 92 HE3 LYS 11 2HE LYS 11 3.070 -11.612 -34.261 93 HZ1 LYS 11 1HZ LYS 11 1.425 -10.908 -35.899 94 HZ2 LYS 11 2HZ LYS 11 2.946 -10.634 -36.472 95 HZ3 LYS 11 3HZ LYS 11 2.034 -9.376 -35.918 96 H ALA 12 H ALA 12 2.561 -11.446 -28.880 97 HA ALA 12 HA ALA 12 4.997 -12.891 -28.233 98 HB1 ALA 12 1HB ALA 12 3.007 -13.017 -26.822 99 HB2 ALA 12 2HB ALA 12 2.074 -13.701 -28.169 100 HB3 ALA 12 3HB ALA 12 3.416 -14.621 -27.455 101 H LEU 13 H LEU 13 6.000 -14.458 -29.292 102 HA LEU 13 HA LEU 13 5.053 -15.162 -32.020 103 HB2 LEU 13 1HB LEU 13 7.591 -15.844 -30.495 104 HB3 LEU 13 2HB LEU 13 7.289 -16.240 -32.183 105 HG LEU 13 HG LEU 13 7.438 -13.399 -31.100 106 HD11 LEU 13 1HD1 LEU 13 9.691 -13.336 -32.077 107 HD12 LEU 13 2HD1 LEU 13 9.560 -15.056 -32.522 108 HD13 LEU 13 3HD1 LEU 13 9.583 -14.570 -30.809 109 HD21 LEU 13 1HD2 LEU 13 7.766 -12.842 -33.521 110 HD22 LEU 13 2HD2 LEU 13 6.171 -13.538 -33.182 111 HD23 LEU 13 3HD2 LEU 13 7.438 -14.540 -33.930 112 H TYR 14 H TYR 14 5.479 -16.465 -28.806 113 HA TYR 14 HA TYR 14 4.337 -19.085 -29.685 114 HB2 TYR 14 1HB TYR 14 6.330 -18.617 -27.449 115 HB3 TYR 14 2HB TYR 14 5.687 -20.173 -27.980 116 HD1 TYR 14 HD1 TYR 14 6.464 -21.177 -30.143 117 HD2 TYR 14 HD2 TYR 14 8.102 -17.490 -28.672 118 HE1 TYR 14 HE1 TYR 14 8.379 -21.374 -31.739 119 HE2 TYR 14 HE2 TYR 14 10.010 -17.694 -30.234 120 HH TYR 14 HH TYR 14 11.018 -18.974 -31.850 121 H ASP 15 H ASP 15 3.171 -20.150 -27.817 122 HA ASP 15 HA ASP 15 1.718 -18.078 -26.250 123 HB2 ASP 15 1HB ASP 15 0.125 -19.939 -25.819 124 HB3 ASP 15 2HB ASP 15 0.319 -19.597 -27.544 125 H ASN 16 H ASN 16 1.250 -18.570 -23.970 126 HA ASN 16 HA ASN 16 3.099 -20.477 -22.690 127 HB2 ASN 16 1HB ASN 16 4.285 -18.249 -23.001 128 HB3 ASN 16 2HB ASN 16 3.083 -17.554 -21.905 129 HD21 ASN 16 1HD2 ASN 16 4.997 -18.414 -19.172 130 HD22 ASN 16 2HD2 ASN 16 3.907 -17.292 -19.984 131 H VAL 17 H VAL 17 2.169 -21.419 -20.997 132 HA VAL 17 HA VAL 17 -0.209 -20.119 -19.729 133 HB VAL 17 HB VAL 17 0.881 -22.976 -19.488 134 HG11 VAL 17 1HG1 VAL 17 -1.229 -23.432 -18.245 135 HG12 VAL 17 2HG1 VAL 17 -0.213 -22.248 -17.405 136 HG13 VAL 17 3HG1 VAL 17 -1.641 -21.702 -18.320 137 HG21 VAL 17 1HG2 VAL 17 -0.150 -22.609 -21.690 138 HG22 VAL 17 2HG2 VAL 17 -1.200 -23.634 -20.694 139 HG23 VAL 17 3HG2 VAL 17 -1.599 -21.914 -20.923 140 H ALA 18 H ALA 18 0.190 -19.188 -17.749 141 HA ALA 18 HA ALA 18 2.913 -18.944 -16.873 142 HB1 ALA 18 1HB ALA 18 1.883 -17.750 -14.926 143 HB2 ALA 18 2HB ALA 18 1.299 -17.139 -16.485 144 HB3 ALA 18 3HB ALA 18 0.276 -18.226 -15.509 145 H GLU 19 H GLU 19 4.053 -20.468 -15.840 146 HA GLU 19 HA GLU 19 2.551 -22.556 -14.318 147 HB2 GLU 19 1HB GLU 19 4.607 -23.812 -14.315 148 HB3 GLU 19 2HB GLU 19 4.206 -23.315 -15.958 149 HG2 GLU 19 1HG GLU 19 5.899 -21.524 -15.838 150 HG3 GLU 19 2HG GLU 19 6.307 -22.021 -14.185 151 H SER 20 H SER 20 4.204 -19.650 -13.901 152 HA SER 20 HA SER 20 4.418 -20.158 -10.953 153 HB2 SER 20 1HB SER 20 6.070 -18.309 -12.722 154 HB3 SER 20 2HB SER 20 6.159 -18.365 -10.947 155 HG SER 20 HG SER 20 6.614 -20.588 -12.664 156 HA PRO 21 HA PRO 21 1.318 -17.101 -10.808 157 HB2 PRO 21 1HB PRO 21 1.613 -15.895 -8.378 158 HB3 PRO 21 2HB PRO 21 1.094 -17.604 -8.543 159 HG2 PRO 21 1HG PRO 21 3.863 -16.520 -8.036 160 HG3 PRO 21 2HG PRO 21 2.962 -17.776 -7.125 161 HD2 PRO 21 1HD PRO 21 4.764 -18.447 -9.019 162 HD3 PRO 21 2HD PRO 21 3.233 -19.373 -8.834 163 H ASP 22 H ASP 22 4.621 -16.042 -10.411 164 HA ASP 22 HA ASP 22 4.046 -13.188 -10.628 165 HB2 ASP 22 1HB ASP 22 6.622 -14.798 -10.873 166 HB3 ASP 22 2HB ASP 22 6.538 -13.031 -10.832 167 H GLU 23 H GLU 23 4.281 -15.848 -12.744 168 HA GLU 23 HA GLU 23 5.380 -14.390 -15.028 169 HB2 GLU 23 1HB GLU 23 5.743 -16.847 -14.440 170 HB3 GLU 23 2HB GLU 23 4.079 -17.118 -14.964 171 HG2 GLU 23 1HG GLU 23 4.661 -16.262 -17.206 172 HG3 GLU 23 2HG GLU 23 6.327 -16.003 -16.662 173 H LEU 24 H LEU 24 4.247 -13.845 -16.918 174 HA LEU 24 HA LEU 24 1.312 -13.575 -16.495 175 HB2 LEU 24 1HB LEU 24 3.209 -11.798 -17.399 176 HB3 LEU 24 2HB LEU 24 2.561 -12.408 -18.899 177 HG LEU 24 HG LEU 24 0.425 -11.647 -18.355 178 HD11 LEU 24 1HD1 LEU 24 -0.169 -11.939 -16.186 179 HD12 LEU 24 2HD1 LEU 24 -0.126 -10.180 -16.382 180 HD13 LEU 24 3HD1 LEU 24 1.211 -11.026 -15.590 181 HD21 LEU 24 1HD2 LEU 24 2.535 -9.632 -17.982 182 HD22 LEU 24 2HD2 LEU 24 0.825 -9.180 -18.160 183 HD23 LEU 24 3HD2 LEU 24 1.658 -10.064 -19.454 184 H SER 25 H SER 25 -0.130 -14.714 -17.659 185 HA SER 25 HA SER 25 0.908 -16.643 -19.647 186 HB2 SER 25 1HB SER 25 -0.738 -17.391 -17.933 187 HB3 SER 25 2HB SER 25 -1.914 -16.228 -18.576 188 HG SER 25 HG SER 25 -0.683 -18.141 -20.271 189 H PHE 26 H PHE 26 0.339 -16.594 -21.813 190 HA PHE 26 HA PHE 26 -1.451 -14.550 -22.914 191 HB2 PHE 26 1HB PHE 26 0.360 -13.501 -24.285 192 HB3 PHE 26 2HB PHE 26 0.510 -13.142 -22.563 193 HD1 PHE 26 HD1 PHE 26 2.360 -13.959 -21.247 194 HD2 PHE 26 HD2 PHE 26 1.977 -15.062 -25.385 195 HE1 PHE 26 HE1 PHE 26 4.669 -14.839 -21.215 196 HE2 PHE 26 HE2 PHE 26 4.323 -15.901 -25.375 197 HZ PHE 26 HZ PHE 26 5.671 -15.799 -23.287 198 H ARG 27 H ARG 27 -1.282 -14.810 -25.435 199 HA ARG 27 HA ARG 27 -0.366 -17.599 -26.029 200 HB2 ARG 27 1HB ARG 27 -2.920 -16.259 -26.937 201 HB3 ARG 27 2HB ARG 27 -2.270 -17.750 -27.640 202 HG2 ARG 27 1HG ARG 27 -2.304 -18.770 -25.335 203 HG3 ARG 27 2HG ARG 27 -3.192 -17.340 -24.777 204 HD2 ARG 27 1HD ARG 27 -4.067 -19.182 -27.028 205 HD3 ARG 27 2HD ARG 27 -4.656 -19.282 -25.362 206 HE ARG 27 HE ARG 27 -5.368 -17.285 -27.392 207 HH11 ARG 27 1HH1 ARG 27 -5.499 -18.075 -23.948 208 HH12 ARG 27 2HH1 ARG 27 -6.799 -16.952 -23.651 209 HH21 ARG 27 1HH2 ARG 27 -7.010 -15.869 -26.927 210 HH22 ARG 27 2HH2 ARG 27 -7.635 -15.730 -25.307 211 H LYS 28 H LYS 28 0.154 -18.026 -28.250 212 HA LYS 28 HA LYS 28 1.826 -16.021 -29.370 213 HB2 LYS 28 1HB LYS 28 2.001 -17.487 -31.318 214 HB3 LYS 28 2HB LYS 28 2.133 -18.392 -29.819 215 HG2 LYS 28 1HG LYS 28 -0.413 -18.886 -30.154 216 HG3 LYS 28 2HG LYS 28 -0.080 -18.449 -31.839 217 HD2 LYS 28 1HD LYS 28 1.356 -20.590 -30.199 218 HD3 LYS 28 2HD LYS 28 0.134 -20.899 -31.437 219 HE2 LYS 28 1HE LYS 28 2.863 -19.607 -31.916 220 HE3 LYS 28 2HE LYS 28 2.443 -21.295 -32.256 221 HZ1 LYS 28 1HZ LYS 28 1.177 -18.944 -33.532 222 HZ2 LYS 28 2HZ LYS 28 0.817 -20.522 -33.856 223 HZ3 LYS 28 3HZ LYS 28 2.307 -19.921 -34.232 224 H GLY 29 H GLY 29 1.522 -14.418 -30.765 225 HA2 GLY 29 1HA GLY 29 0.386 -13.203 -32.435 226 HA3 GLY 29 2HA GLY 29 -1.062 -14.186 -32.194 227 H ASP 30 H ASP 30 -0.355 -13.537 -29.102 228 HA ASP 30 HA ASP 30 -2.243 -11.299 -28.965 229 HB2 ASP 30 1HB ASP 30 -1.950 -13.384 -27.382 230 HB3 ASP 30 2HB ASP 30 -0.657 -12.424 -26.643 231 H ILE 31 H ILE 31 -1.667 -9.337 -27.635 232 HA ILE 31 HA ILE 31 1.221 -8.590 -27.987 233 HB ILE 31 HB ILE 31 -1.223 -6.906 -28.746 234 HG12 ILE 31 1HG1 ILE 31 0.485 -6.701 -30.820 235 HG13 ILE 31 2HG1 ILE 31 0.997 -8.274 -30.219 236 HG21 ILE 31 1HG2 ILE 31 0.390 -5.445 -27.562 237 HG22 ILE 31 2HG2 ILE 31 1.726 -6.070 -28.560 238 HG23 ILE 31 3HG2 ILE 31 0.431 -5.096 -29.297 239 HD11 ILE 31 1HD1 ILE 31 -1.250 -9.157 -30.519 240 HD12 ILE 31 2HD1 ILE 31 -1.825 -7.558 -31.053 241 HD13 ILE 31 3HD1 ILE 31 -0.636 -8.458 -32.026 242 H MET 32 H MET 32 2.127 -7.561 -26.346 243 HA MET 32 HA MET 32 0.421 -6.689 -24.063 244 HB2 MET 32 1HB MET 32 2.011 -7.747 -22.528 245 HB3 MET 32 2HB MET 32 1.306 -8.933 -23.624 246 HG2 MET 32 1HG MET 32 3.443 -8.544 -25.071 247 HG3 MET 32 2HG MET 32 4.120 -7.874 -23.578 248 HE1 MET 32 1HE MET 32 2.951 -12.225 -24.504 249 HE2 MET 32 2HE MET 32 1.657 -11.009 -24.432 250 HE3 MET 32 3HE MET 32 2.971 -10.843 -25.621 251 H THR 33 H THR 33 1.525 -5.134 -22.686 252 HA THR 33 HA THR 33 3.450 -3.512 -24.305 253 HB THR 33 HB THR 33 1.994 -2.737 -21.741 254 HG1 THR 33 HG1 THR 33 0.623 -1.607 -23.190 255 HG21 THR 33 1HG2 THR 33 4.006 -1.373 -22.189 256 HG22 THR 33 2HG2 THR 33 2.539 -0.421 -22.495 257 HG23 THR 33 3HG2 THR 33 3.459 -1.094 -23.860 258 H VAL 34 H VAL 34 5.568 -3.495 -23.816 259 HA VAL 34 HA VAL 34 6.484 -4.943 -21.403 260 HB VAL 34 HB VAL 34 8.031 -3.542 -23.647 261 HG11 VAL 34 1HG1 VAL 34 10.018 -4.771 -22.702 262 HG12 VAL 34 2HG1 VAL 34 9.395 -3.506 -21.630 263 HG13 VAL 34 3HG1 VAL 34 9.025 -5.211 -21.294 264 HG21 VAL 34 1HG2 VAL 34 8.583 -5.811 -24.406 265 HG22 VAL 34 2HG2 VAL 34 7.672 -6.520 -23.054 266 HG23 VAL 34 3HG2 VAL 34 6.820 -5.624 -24.339 267 H LEU 35 H LEU 35 6.956 -4.000 -19.555 268 HA LEU 35 HA LEU 35 6.892 -1.024 -19.433 269 HB2 LEU 35 1HB LEU 35 6.703 -3.092 -17.222 270 HB3 LEU 35 2HB LEU 35 6.474 -1.358 -17.046 271 HG LEU 35 HG LEU 35 4.653 -3.245 -18.590 272 HD11 LEU 35 1HD1 LEU 35 4.361 -1.863 -15.892 273 HD12 LEU 35 2HD1 LEU 35 4.558 -3.606 -16.179 274 HD13 LEU 35 3HD1 LEU 35 3.084 -2.781 -16.714 275 HD21 LEU 35 1HD2 LEU 35 4.567 -1.008 -19.577 276 HD22 LEU 35 2HD2 LEU 35 4.367 -0.274 -17.967 277 HD23 LEU 35 3HD2 LEU 35 3.089 -1.309 -18.647 278 H GLU 36 H GLU 36 8.777 -3.894 -18.470 279 HA GLU 36 HA GLU 36 11.188 -2.192 -18.165 280 HB2 GLU 36 1HB GLU 36 9.892 -2.476 -15.945 281 HB3 GLU 36 2HB GLU 36 10.377 -4.171 -16.021 282 HG2 GLU 36 1HG GLU 36 12.737 -3.515 -15.968 283 HG3 GLU 36 2HG GLU 36 12.276 -1.803 -16.007 284 H ARG 37 H ARG 37 13.164 -3.693 -17.962 285 HA ARG 37 HA ARG 37 12.643 -6.375 -19.170 286 HB2 ARG 37 1HB ARG 37 14.831 -4.442 -19.984 287 HB3 ARG 37 2HB ARG 37 14.607 -6.081 -20.603 288 HG2 ARG 37 1HG ARG 37 12.340 -5.293 -21.492 289 HG3 ARG 37 2HG ARG 37 12.878 -3.648 -21.094 290 HD2 ARG 37 1HD ARG 37 14.122 -5.601 -23.042 291 HD3 ARG 37 2HD ARG 37 13.430 -4.002 -23.390 292 HE ARG 37 HE ARG 37 15.578 -3.772 -21.500 293 HH11 ARG 37 1HH1 ARG 37 15.098 -4.387 -24.939 294 HH12 ARG 37 2HH1 ARG 37 16.683 -3.797 -25.358 295 HH21 ARG 37 1HH2 ARG 37 17.571 -3.048 -22.096 296 HH22 ARG 37 2HH2 ARG 37 18.061 -3.044 -23.768 297 H ASP 38 H ASP 38 14.226 -7.898 -18.615 298 HA ASP 38 HA ASP 38 15.698 -8.958 -17.270 299 HB2 ASP 38 1HB ASP 38 17.123 -6.296 -17.031 300 HB3 ASP 38 2HB ASP 38 17.826 -7.918 -16.928 301 H THR 39 H THR 39 13.337 -7.823 -16.283 302 HA THR 39 HA THR 39 13.618 -6.259 -13.927 303 HB THR 39 HB THR 39 11.602 -6.374 -15.433 304 HG1 THR 39 HG1 THR 39 11.253 -5.554 -13.377 305 HG21 THR 39 1HG2 THR 39 10.013 -8.229 -15.241 306 HG22 THR 39 2HG2 THR 39 11.045 -9.052 -14.071 307 HG23 THR 39 3HG2 THR 39 11.576 -8.870 -15.763 308 H GLN 40 H GLN 40 13.822 -9.700 -14.341 309 HA GLN 40 HA GLN 40 13.212 -10.151 -11.464 310 HB2 GLN 40 1HB GLN 40 12.150 -11.432 -13.456 311 HB3 GLN 40 2HB GLN 40 13.699 -12.259 -13.585 312 HG2 GLN 40 1HG GLN 40 12.110 -13.607 -12.313 313 HG3 GLN 40 2HG GLN 40 13.429 -13.097 -11.259 314 HE21 GLN 40 1HE2 GLN 40 11.075 -12.055 -8.923 315 HE22 GLN 40 2HE2 GLN 40 12.495 -13.002 -9.297 316 H GLY 41 H GLY 41 15.816 -9.237 -13.186 317 HA2 GLY 41 1HA GLY 41 18.090 -9.386 -12.679 318 HA3 GLY 41 2HA GLY 41 17.726 -10.568 -11.398 319 H LEU 42 H LEU 42 16.127 -11.262 -14.264 320 HA LEU 42 HA LEU 42 18.140 -13.324 -15.040 321 HB2 LEU 42 1HB LEU 42 15.128 -13.245 -15.465 322 HB3 LEU 42 2HB LEU 42 16.205 -14.514 -16.031 323 HG LEU 42 HG LEU 42 15.628 -13.886 -13.117 324 HD11 LEU 42 1HD1 LEU 42 14.626 -16.134 -14.917 325 HD12 LEU 42 2HD1 LEU 42 13.662 -14.755 -14.345 326 HD13 LEU 42 3HD1 LEU 42 14.280 -15.946 -13.183 327 HD21 LEU 42 1HD2 LEU 42 16.699 -16.091 -12.702 328 HD22 LEU 42 2HD2 LEU 42 17.834 -14.908 -13.377 329 HD23 LEU 42 3HD2 LEU 42 17.152 -16.181 -14.421 330 H ASP 43 H ASP 43 19.101 -12.901 -16.936 331 HA ASP 43 HA ASP 43 18.517 -10.575 -18.436 332 HB2 ASP 43 1HB ASP 43 20.024 -13.114 -19.184 333 HB3 ASP 43 2HB ASP 43 19.959 -11.671 -20.209 334 H GLY 44 H GLY 44 17.166 -10.115 -20.032 335 HA2 GLY 44 1HA GLY 44 15.882 -10.521 -21.925 336 HA3 GLY 44 2HA GLY 44 16.182 -12.253 -21.775 337 H TRP 45 H TRP 45 15.021 -11.346 -18.758 338 HA TRP 45 HA TRP 45 12.267 -12.168 -19.583 339 HB2 TRP 45 1HB TRP 45 13.724 -12.028 -16.943 340 HB3 TRP 45 2HB TRP 45 11.960 -12.163 -17.022 341 HD1 TRP 45 HD1 TRP 45 15.095 -14.128 -18.186 342 HE1 TRP 45 HE1 TRP 45 14.525 -16.597 -18.401 343 HE3 TRP 45 HE3 TRP 45 10.081 -13.776 -17.233 344 HZ2 TRP 45 HZ2 TRP 45 12.184 -18.230 -18.191 345 HZ3 TRP 45 HZ3 TRP 45 8.701 -15.866 -17.251 346 HH2 TRP 45 HH2 TRP 45 9.757 -18.071 -17.731 347 H TRP 46 H TRP 46 10.723 -10.670 -19.906 348 HA TRP 46 HA TRP 46 11.364 -7.917 -18.952 349 HB2 TRP 46 1HB TRP 46 9.638 -8.856 -21.258 350 HB3 TRP 46 2HB TRP 46 9.996 -7.175 -20.851 351 HD1 TRP 46 HD1 TRP 46 13.248 -8.435 -20.312 352 HE1 TRP 46 HE1 TRP 46 14.771 -8.509 -22.333 353 HE3 TRP 46 HE3 TRP 46 9.636 -8.017 -23.901 354 HZ2 TRP 46 HZ2 TRP 46 14.474 -8.434 -25.174 355 HZ3 TRP 46 HZ3 TRP 46 10.328 -8.062 -26.307 356 HH2 TRP 46 HH2 TRP 46 12.736 -8.264 -26.925 357 H LEU 47 H LEU 47 9.862 -6.673 -17.931 358 HA LEU 47 HA LEU 47 7.553 -8.100 -16.759 359 HB2 LEU 47 1HB LEU 47 8.880 -6.453 -15.411 360 HB3 LEU 47 2HB LEU 47 8.473 -5.204 -16.571 361 HG LEU 47 HG LEU 47 6.079 -5.430 -15.959 362 HD11 LEU 47 1HD1 LEU 47 6.003 -7.731 -15.145 363 HD12 LEU 47 2HD1 LEU 47 5.525 -6.636 -13.840 364 HD13 LEU 47 3HD1 LEU 47 7.154 -7.344 -13.843 365 HD21 LEU 47 1HD2 LEU 47 6.326 -4.304 -13.786 366 HD22 LEU 47 2HD2 LEU 47 7.565 -3.749 -14.925 367 HD23 LEU 47 3HD2 LEU 47 7.995 -4.910 -13.647 368 H CYS 48 H CYS 48 5.783 -8.290 -18.003 369 HA CYS 48 HA CYS 48 5.227 -6.075 -19.941 370 HB2 CYS 48 1HB CYS 48 4.494 -9.014 -20.126 371 HB3 CYS 48 2HB CYS 48 4.145 -7.765 -21.330 372 HG CYS 48 HG CYS 48 7.059 -8.880 -20.255 373 H SER 49 H SER 49 2.881 -5.763 -20.358 374 HA SER 49 HA SER 49 1.191 -6.648 -18.060 375 HB2 SER 49 1HB SER 49 1.862 -4.311 -17.699 376 HB3 SER 49 2HB SER 49 1.235 -3.879 -19.306 377 HG SER 49 HG SER 49 -0.304 -5.046 -17.208 378 H LEU 50 H LEU 50 -0.807 -7.257 -18.494 379 HA LEU 50 HA LEU 50 -2.059 -6.815 -21.114 380 HB2 LEU 50 1HB LEU 50 -0.437 -9.122 -20.667 381 HB3 LEU 50 2HB LEU 50 -2.104 -9.661 -20.526 382 HG LEU 50 HG LEU 50 -0.922 -8.225 -22.923 383 HD11 LEU 50 1HD1 LEU 50 -0.008 -10.493 -22.559 384 HD12 LEU 50 2HD1 LEU 50 -1.025 -10.409 -24.015 385 HD13 LEU 50 3HD1 LEU 50 -1.663 -11.150 -22.529 386 HD21 LEU 50 1HD2 LEU 50 -3.649 -9.494 -22.499 387 HD22 LEU 50 2HD2 LEU 50 -2.991 -9.017 -24.081 388 HD23 LEU 50 3HD2 LEU 50 -3.287 -7.780 -22.847 389 H HIS 51 H HIS 51 -4.270 -6.980 -20.867 390 HA HIS 51 HA HIS 51 -6.292 -7.118 -19.831 391 HB2 HIS 51 1HB HIS 51 -5.330 -9.582 -19.994 392 HB3 HIS 51 2HB HIS 51 -5.413 -9.491 -18.233 393 HD1 HIS 51 HD1 HIS 51 -7.958 -8.690 -17.336 394 HD2 HIS 51 HD2 HIS 51 -7.635 -10.308 -21.165 395 HE1 HIS 51 HE1 HIS 51 -10.285 -9.430 -18.028 396 H GLY 52 H GLY 52 -4.251 -5.492 -18.362 397 HA2 GLY 52 1HA GLY 52 -4.537 -4.139 -16.488 398 HA3 GLY 52 2HA GLY 52 -5.845 -5.187 -15.931 399 H ARG 53 H ARG 53 -3.260 -7.187 -16.618 400 HA ARG 53 HA ARG 53 -2.220 -7.014 -13.806 401 HB2 ARG 53 1HB ARG 53 -2.520 -9.375 -15.715 402 HB3 ARG 53 2HB ARG 53 -1.551 -9.415 -14.242 403 HG2 ARG 53 1HG ARG 53 -3.617 -8.851 -12.941 404 HG3 ARG 53 2HG ARG 53 -4.553 -9.047 -14.433 405 HD2 ARG 53 1HD ARG 53 -4.603 -11.131 -13.117 406 HD3 ARG 53 2HD ARG 53 -3.731 -11.379 -14.642 407 HE ARG 53 HE ARG 53 -1.873 -10.669 -12.590 408 HH11 ARG 53 1HH1 ARG 53 -3.855 -13.424 -13.559 409 HH12 ARG 53 2HH1 ARG 53 -2.740 -14.577 -12.873 410 HH21 ARG 53 1HH2 ARG 53 -0.492 -12.203 -11.751 411 HH22 ARG 53 2HH2 ARG 53 -0.873 -13.896 -11.868 412 H GLN 54 H GLN 54 0.093 -7.647 -13.671 413 HA GLN 54 HA GLN 54 1.520 -7.439 -16.247 414 HB2 GLN 54 1HB GLN 54 3.254 -6.030 -15.274 415 HB3 GLN 54 2HB GLN 54 1.690 -5.214 -15.239 416 HG2 GLN 54 1HG GLN 54 1.457 -5.847 -12.838 417 HG3 GLN 54 2HG GLN 54 3.086 -6.533 -12.897 418 HE21 GLN 54 1HE2 GLN 54 4.476 -3.476 -12.048 419 HE22 GLN 54 2HE2 GLN 54 4.453 -5.216 -11.891 420 H GLY 55 H GLY 55 3.166 -8.857 -16.438 421 HA2 GLY 55 1HA GLY 55 3.867 -10.503 -14.093 422 HA3 GLY 55 2HA GLY 55 3.182 -11.282 -15.456 423 H ILE 56 H ILE 56 5.781 -11.955 -14.592 424 HA ILE 56 HA ILE 56 7.578 -10.558 -16.469 425 HB ILE 56 HB ILE 56 9.332 -12.059 -15.713 426 HG12 ILE 56 1HG1 ILE 56 7.243 -13.502 -14.038 427 HG13 ILE 56 2HG1 ILE 56 7.906 -14.126 -15.546 428 HG21 ILE 56 1HG2 ILE 56 7.719 -11.249 -13.250 429 HG22 ILE 56 2HG2 ILE 56 9.483 -11.319 -13.429 430 HG23 ILE 56 3HG2 ILE 56 8.561 -10.076 -14.287 431 HD11 ILE 56 1HD1 ILE 56 9.047 -15.202 -13.720 432 HD12 ILE 56 2HD1 ILE 56 10.196 -14.091 -14.498 433 HD13 ILE 56 3HD1 ILE 56 9.423 -13.643 -12.955 434 H VAL 57 H VAL 57 8.405 -11.411 -18.353 435 HA VAL 57 HA VAL 57 7.116 -13.882 -19.428 436 HB VAL 57 HB VAL 57 7.168 -11.103 -20.719 437 HG11 VAL 57 1HG1 VAL 57 6.494 -13.793 -21.909 438 HG12 VAL 57 2HG1 VAL 57 5.917 -12.269 -22.603 439 HG13 VAL 57 3HG1 VAL 57 7.657 -12.587 -22.491 440 HG21 VAL 57 1HG2 VAL 57 4.865 -12.893 -19.858 441 HG22 VAL 57 2HG2 VAL 57 5.317 -11.312 -19.179 442 HG23 VAL 57 3HG2 VAL 57 4.683 -11.412 -20.831 443 HA PRO 58 HA PRO 58 11.364 -14.079 -20.823 444 HB2 PRO 58 1HB PRO 58 11.255 -16.162 -22.596 445 HB3 PRO 58 2HB PRO 58 11.222 -16.401 -20.820 446 HG2 PRO 58 1HG PRO 58 8.921 -16.316 -22.755 447 HG3 PRO 58 2HG PRO 58 9.273 -17.518 -21.476 448 HD2 PRO 58 1HD PRO 58 7.514 -15.495 -21.118 449 HD3 PRO 58 2HD PRO 58 8.552 -16.095 -19.785 450 H GLY 59 H GLY 59 11.917 -12.362 -22.049 451 HA2 GLY 59 1HA GLY 59 10.387 -11.296 -24.161 452 HA3 GLY 59 2HA GLY 59 12.061 -10.905 -23.785 453 H ASN 60 H ASN 60 12.716 -13.855 -24.231 454 HA ASN 60 HA ASN 60 13.575 -13.715 -26.944 455 HB2 ASN 60 1HB ASN 60 14.555 -15.226 -25.259 456 HB3 ASN 60 2HB ASN 60 13.034 -16.128 -25.166 457 HD21 ASN 60 1HD2 ASN 60 15.612 -16.743 -28.253 458 HD22 ASN 60 2HD2 ASN 60 15.824 -15.389 -27.169 459 H ARG 61 H ARG 61 10.519 -14.765 -25.501 460 HA ARG 61 HA ARG 61 9.631 -15.987 -28.045 461 HB2 ARG 61 1HB ARG 61 8.191 -15.575 -25.400 462 HB3 ARG 61 2HB ARG 61 7.568 -16.493 -26.769 463 HG2 ARG 61 1HG ARG 61 9.544 -18.049 -26.534 464 HG3 ARG 61 2HG ARG 61 9.956 -17.189 -25.032 465 HD2 ARG 61 1HD ARG 61 7.611 -17.669 -24.221 466 HD3 ARG 61 2HD ARG 61 7.384 -18.693 -25.647 467 HE ARG 61 HE ARG 61 9.729 -19.538 -24.281 468 HH11 ARG 61 1HH1 ARG 61 6.226 -19.573 -23.840 469 HH12 ARG 61 2HH1 ARG 61 6.281 -20.910 -22.729 470 HH21 ARG 61 1HH2 ARG 61 9.708 -21.303 -22.893 471 HH22 ARG 61 2HH2 ARG 61 8.202 -21.889 -22.241 472 H LEU 62 H LEU 62 10.020 -12.870 -27.296 473 HA LEU 62 HA LEU 62 7.336 -12.047 -28.353 474 HB2 LEU 62 1HB LEU 62 9.235 -10.505 -26.561 475 HB3 LEU 62 2HB LEU 62 7.685 -9.948 -27.154 476 HG LEU 62 HG LEU 62 8.120 -12.161 -25.137 477 HD11 LEU 62 1HD1 LEU 62 7.009 -10.490 -23.613 478 HD12 LEU 62 2HD1 LEU 62 7.065 -9.303 -24.922 479 HD13 LEU 62 3HD1 LEU 62 8.572 -9.942 -24.232 480 HD21 LEU 62 1HD2 LEU 62 5.559 -10.996 -26.294 481 HD22 LEU 62 2HD2 LEU 62 5.644 -12.040 -24.859 482 HD23 LEU 62 3HD2 LEU 62 6.141 -12.676 -26.429 483 H LYS 63 H LYS 63 7.236 -10.286 -29.786 484 HA LYS 63 HA LYS 63 9.879 -9.393 -30.895 485 HB2 LYS 63 1HB LYS 63 8.185 -10.974 -32.258 486 HB3 LYS 63 2HB LYS 63 7.440 -9.426 -32.643 487 HG2 LYS 63 1HG LYS 63 10.369 -10.115 -33.126 488 HG3 LYS 63 2HG LYS 63 9.087 -10.253 -34.341 489 HD2 LYS 63 1HD LYS 63 8.624 -7.792 -34.048 490 HD3 LYS 63 2HD LYS 63 10.051 -7.695 -33.002 491 HE2 LYS 63 1HE LYS 63 10.050 -8.621 -35.900 492 HE3 LYS 63 2HE LYS 63 10.534 -7.011 -35.334 493 HZ1 LYS 63 1HZ LYS 63 12.445 -8.458 -35.668 494 HZ2 LYS 63 2HZ LYS 63 11.866 -9.551 -34.577 495 HZ3 LYS 63 3HZ LYS 63 12.319 -8.046 -34.077 496 H ILE 64 H ILE 64 10.172 -7.327 -30.441 497 HA ILE 64 HA ILE 64 8.178 -5.553 -29.429 498 HB ILE 64 HB ILE 64 10.936 -5.018 -30.661 499 HG12 ILE 64 1HG1 ILE 64 10.903 -6.486 -28.618 500 HG13 ILE 64 2HG1 ILE 64 11.822 -4.995 -28.444 501 HG21 ILE 64 1HG2 ILE 64 9.095 -3.149 -29.107 502 HG22 ILE 64 2HG2 ILE 64 10.835 -2.845 -29.327 503 HG23 ILE 64 3HG2 ILE 64 9.764 -2.917 -30.738 504 HD11 ILE 64 1HD1 ILE 64 8.980 -5.317 -27.376 505 HD12 ILE 64 2HD1 ILE 64 10.444 -5.607 -26.417 506 HD13 ILE 64 3HD1 ILE 64 10.110 -3.987 -27.049 507 H LEU 65 H LEU 65 6.862 -4.054 -30.385 508 HA LEU 65 HA LEU 65 7.378 -3.228 -33.158 509 HB2 LEU 65 1HB LEU 65 5.380 -3.909 -34.124 510 HB3 LEU 65 2HB LEU 65 5.975 -5.336 -33.302 511 HG LEU 65 HG LEU 65 3.724 -3.568 -32.275 512 HD11 LEU 65 1HD1 LEU 65 3.633 -6.218 -33.766 513 HD12 LEU 65 2HD1 LEU 65 3.161 -4.631 -34.421 514 HD13 LEU 65 3HD1 LEU 65 2.233 -5.350 -33.090 515 HD21 LEU 65 1HD2 LEU 65 3.165 -5.560 -30.891 516 HD22 LEU 65 2HD2 LEU 65 4.704 -4.796 -30.462 517 HD23 LEU 65 3HD2 LEU 65 4.702 -6.297 -31.410 518 H VAL 66 H VAL 66 6.068 -1.415 -33.789 519 HA VAL 66 HA VAL 66 5.274 0.678 -33.472 520 HB VAL 66 HB VAL 66 3.379 -0.646 -31.486 521 HG11 VAL 66 1HG1 VAL 66 3.194 1.794 -31.370 522 HG12 VAL 66 2HG1 VAL 66 3.158 1.919 -33.147 523 HG13 VAL 66 3HG1 VAL 66 1.805 1.168 -32.269 524 HG21 VAL 66 1HG2 VAL 66 1.887 -0.929 -33.460 525 HG22 VAL 66 2HG2 VAL 66 3.176 -0.315 -34.520 526 HG23 VAL 66 3HG2 VAL 66 3.385 -1.849 -33.646 527 H GLY 67 H GLY 67 7.042 1.741 -32.680 528 HA2 GLY 67 1HA GLY 67 7.208 2.181 -29.749 529 HA3 GLY 67 2HA GLY 67 8.394 2.675 -30.971 530 H MET 68 H MET 68 4.868 3.149 -30.829 531 HA MET 68 HA MET 68 3.577 4.998 -31.201 532 HB2 MET 68 1HB MET 68 5.666 6.211 -29.364 533 HB3 MET 68 2HB MET 68 4.215 7.070 -29.897 534 HG2 MET 68 1HG MET 68 3.688 6.192 -27.771 535 HG3 MET 68 2HG MET 68 2.832 5.189 -28.949 536 HE1 MET 68 1HE MET 68 3.550 2.377 -26.391 537 HE2 MET 68 2HE MET 68 2.850 3.998 -26.185 538 HE3 MET 68 3HE MET 68 2.397 3.006 -27.592 539 H TYR 69 H TYR 69 5.700 7.661 -31.094 540 HA TYR 69 HA TYR 69 6.545 7.463 -33.888 541 HB2 TYR 69 1HB TYR 69 5.306 9.439 -34.639 542 HB3 TYR 69 2HB TYR 69 4.184 8.168 -34.149 543 HD1 TYR 69 HD1 TYR 69 5.701 11.427 -33.084 544 HD2 TYR 69 HD2 TYR 69 2.586 8.548 -32.363 545 HE1 TYR 69 HE1 TYR 69 4.587 13.025 -31.537 546 HE2 TYR 69 HE2 TYR 69 1.471 10.165 -30.811 547 HH TYR 69 HH TYR 69 2.901 13.328 -30.009 548 H ASP 70 H ASP 70 8.002 9.148 -34.475 549 HA ASP 70 HA ASP 70 9.215 10.527 -32.154 550 HB2 ASP 70 1HB ASP 70 10.172 10.556 -35.032 551 HB3 ASP 70 2HB ASP 70 11.117 10.847 -33.565 552 H LYS 71 H LYS 71 7.852 11.235 -35.362 553 HA LYS 71 HA LYS 71 7.262 13.179 -36.431 554 HB2 LYS 71 1HB LYS 71 5.571 13.024 -34.569 555 HB3 LYS 71 2HB LYS 71 6.511 14.216 -33.679 556 HG2 LYS 71 1HG LYS 71 6.162 15.834 -35.551 557 HG3 LYS 71 2HG LYS 71 5.208 14.603 -36.408 558 HD2 LYS 71 1HD LYS 71 3.628 14.520 -34.502 559 HD3 LYS 71 2HD LYS 71 4.574 15.773 -33.671 560 HE2 LYS 71 1HE LYS 71 4.132 17.341 -35.539 561 HE3 LYS 71 2HE LYS 71 3.177 16.085 -36.361 562 HZ1 LYS 71 1HZ LYS 71 2.547 17.252 -33.703 563 HZ2 LYS 71 2HZ LYS 71 1.664 16.087 -34.464 564 HZ3 LYS 71 3HZ LYS 71 1.761 17.602 -35.111 565 H LYS 72 H LYS 72 7.907 15.363 -33.799 566 HA LYS 72 HA LYS 72 10.485 16.116 -35.097 567 HB2 LYS 72 1HB LYS 72 8.266 17.935 -34.099 568 HB3 LYS 72 2HB LYS 72 9.902 18.488 -34.488 569 HG2 LYS 72 1HG LYS 72 9.628 17.724 -36.816 570 HG3 LYS 72 2HG LYS 72 8.009 17.117 -36.435 571 HD2 LYS 72 1HD LYS 72 7.715 19.200 -37.511 572 HD3 LYS 72 2HD LYS 72 7.361 19.457 -35.793 573 HE2 LYS 72 1HE LYS 72 9.640 20.402 -35.464 574 HE3 LYS 72 2HE LYS 72 10.001 20.125 -37.180 575 HZ1 LYS 72 1HZ LYS 72 8.226 21.680 -37.734 576 HZ2 LYS 72 2HZ LYS 72 9.345 22.408 -36.768 577 HZ3 LYS 72 3HZ LYS 72 7.897 21.936 -36.138 578 HA PRO 73 HA PRO 73 11.821 15.772 -30.884 579 HB2 PRO 73 1HB PRO 73 14.196 17.073 -30.914 580 HB3 PRO 73 2HB PRO 73 13.951 15.566 -31.855 581 HG2 PRO 73 1HG PRO 73 13.744 18.423 -32.783 582 HG3 PRO 73 2HG PRO 73 14.716 17.084 -33.475 583 HD2 PRO 73 1HD PRO 73 12.276 17.740 -34.464 584 HD3 PRO 73 2HD PRO 73 12.835 16.032 -34.391 585 H ALA 74 H ALA 74 10.398 18.478 -32.024 586 HA ALA 74 HA ALA 74 10.562 19.843 -29.422 587 HB1 ALA 74 1HB ALA 74 11.102 21.263 -32.079 588 HB2 ALA 74 2HB ALA 74 10.910 22.056 -30.498 589 HB3 ALA 74 3HB ALA 74 12.299 20.983 -30.790 590 H GLY 75 H GLY 75 8.649 20.940 -28.950 591 HA2 GLY 75 1HA GLY 75 6.614 21.653 -30.743 592 HA3 GLY 75 2HA GLY 75 6.311 19.964 -30.297 593 H GLU 76 H GLU 76 7.533 20.395 -27.592 594 HA GLU 76 HA GLU 76 5.381 22.044 -26.335 595 HB2 GLU 76 1HB GLU 76 6.597 19.410 -25.413 596 HB3 GLU 76 2HB GLU 76 5.512 20.417 -24.444 597 HG2 GLU 76 1HG GLU 76 3.729 20.120 -26.123 598 HG3 GLU 76 2HG GLU 76 4.810 19.099 -27.089 599 H PHE 77 H PHE 77 6.090 22.717 -24.074 600 HA PHE 77 HA PHE 77 8.724 23.942 -24.213 601 HB2 PHE 77 1HB PHE 77 6.555 23.799 -22.092 602 HB3 PHE 77 2HB PHE 77 8.116 24.564 -21.788 603 HD1 PHE 77 HD1 PHE 77 8.748 26.663 -22.822 604 HD2 PHE 77 HD2 PHE 77 4.933 24.849 -23.646 605 HE1 PHE 77 HE1 PHE 77 7.949 28.806 -23.806 606 HE2 PHE 77 HE2 PHE 77 4.124 26.989 -24.634 607 HZ PHE 77 HZ PHE 77 5.634 28.975 -24.717 608 H ILE 78 H ILE 78 10.285 23.722 -22.393 609 HA ILE 78 HA ILE 78 10.487 20.881 -21.493 610 HB ILE 78 HB ILE 78 12.941 21.171 -21.509 611 HG12 ILE 78 1HG1 ILE 78 12.465 23.871 -22.840 612 HG13 ILE 78 2HG1 ILE 78 12.866 23.684 -21.133 613 HG21 ILE 78 1HG2 ILE 78 11.707 20.320 -23.553 614 HG22 ILE 78 2HG2 ILE 78 11.766 21.965 -24.225 615 HG23 ILE 78 3HG2 ILE 78 13.273 21.066 -23.927 616 HD11 ILE 78 1HD1 ILE 78 15.013 22.572 -21.779 617 HD12 ILE 78 2HD1 ILE 78 14.632 22.915 -23.485 618 HD13 ILE 78 3HD1 ILE 78 14.875 24.253 -22.342 619 H VAL 79 H VAL 79 11.682 20.621 -19.432 620 HA VAL 79 HA VAL 79 10.787 22.639 -17.496 621 HB VAL 79 HB VAL 79 12.372 20.063 -17.020 622 HG11 VAL 79 1HG1 VAL 79 10.796 21.866 -15.116 623 HG12 VAL 79 2HG1 VAL 79 11.537 20.309 -14.681 624 HG13 VAL 79 3HG1 VAL 79 12.566 21.670 -15.157 625 HG21 VAL 79 1HG2 VAL 79 10.212 19.505 -18.032 626 HG22 VAL 79 2HG2 VAL 79 10.166 19.113 -16.303 627 HG23 VAL 79 3HG2 VAL 79 9.365 20.585 -16.900 628 H THR 80 H THR 80 12.006 24.433 -17.996 629 HA THR 80 HA THR 80 14.959 24.194 -18.017 630 HB THR 80 HB THR 80 13.807 25.584 -19.755 631 HG1 THR 80 HG1 THR 80 15.543 26.815 -17.877 632 HG21 THR 80 1HG2 THR 80 13.070 27.391 -17.409 633 HG22 THR 80 2HG2 THR 80 11.926 26.461 -18.412 634 HG23 THR 80 3HG2 THR 80 12.875 27.776 -19.130 635 H ASP 81 H ASP 81 12.623 24.412 -15.727 636 HA ASP 81 HA ASP 81 14.074 26.283 -13.932 637 HB2 ASP 81 1HB ASP 81 11.516 26.434 -14.288 638 HB3 ASP 81 2HB ASP 81 11.392 24.907 -13.413 639 HXT ASP 81 H02 ASP 81 14.231 25.683 -11.906 Start of MODEL 19 1 H2 GLY 1 2H0 GLY 1 1.439 7.461 -15.870 2 H GLY 1 1H0 GLY 1 0.698 6.817 -14.539 3 HA2 GLY 1 1HA GLY 1 1.886 8.579 -13.155 4 HA3 GLY 1 2HA GLY 1 2.864 7.243 -13.794 5 H SER 2 H SER 2 3.593 9.944 -12.921 6 HA SER 2 HA SER 2 4.348 11.399 -15.334 7 HB2 SER 2 1HB SER 2 5.331 11.800 -12.495 8 HB3 SER 2 2HB SER 2 5.358 12.990 -13.809 9 HG SER 2 HG SER 2 3.306 13.398 -13.441 10 H MET 3 H MET 3 5.668 8.751 -13.622 11 HA MET 3 HA MET 3 8.467 9.347 -14.177 12 HB2 MET 3 1HB MET 3 7.093 6.777 -13.313 13 HB3 MET 3 2HB MET 3 8.840 7.035 -13.385 14 HG2 MET 3 1HG MET 3 6.881 8.459 -11.561 15 HG3 MET 3 2HG MET 3 8.091 7.257 -11.096 16 HE1 MET 3 1HE MET 3 9.554 10.605 -9.596 17 HE2 MET 3 2HE MET 3 7.838 10.197 -9.728 18 HE3 MET 3 3HE MET 3 9.021 8.944 -9.237 19 H LYS 4 H LYS 4 9.676 8.610 -15.839 20 HA LYS 4 HA LYS 4 8.208 7.761 -18.220 21 HB2 LYS 4 1HB LYS 4 10.249 9.341 -18.088 22 HB3 LYS 4 2HB LYS 4 11.226 7.901 -17.792 23 HG2 LYS 4 1HG LYS 4 11.457 8.403 -20.086 24 HG3 LYS 4 2HG LYS 4 10.386 7.006 -20.031 25 HD2 LYS 4 1HD LYS 4 8.431 8.493 -20.359 26 HD3 LYS 4 2HD LYS 4 9.492 9.910 -20.306 27 HE2 LYS 4 1HE LYS 4 8.995 9.399 -22.609 28 HE3 LYS 4 2HE LYS 4 10.715 9.073 -22.304 29 HZ1 LYS 4 1HZ LYS 4 9.666 7.296 -23.596 30 HZ2 LYS 4 2HZ LYS 4 8.554 7.017 -22.414 31 HZ3 LYS 4 3HZ LYS 4 10.150 6.710 -22.133 32 H TYR 5 H TYR 5 8.014 5.693 -18.989 33 HA TYR 5 HA TYR 5 9.887 3.639 -17.958 34 HB2 TYR 5 1HB TYR 5 8.225 2.050 -17.493 35 HB3 TYR 5 2HB TYR 5 7.653 3.527 -16.725 36 HD1 TYR 5 HD1 TYR 5 6.920 0.889 -19.075 37 HD2 TYR 5 HD2 TYR 5 5.779 4.886 -17.936 38 HE1 TYR 5 HE1 TYR 5 4.754 0.595 -20.260 39 HE2 TYR 5 HE2 TYR 5 3.587 4.575 -19.118 40 HH TYR 5 HH TYR 5 2.330 3.163 -20.523 41 H LEU 6 H LEU 6 9.466 1.569 -19.542 42 HA LEU 6 HA LEU 6 10.487 2.537 -21.952 43 HB2 LEU 6 1HB LEU 6 9.231 -0.169 -21.389 44 HB3 LEU 6 2HB LEU 6 10.274 0.209 -22.767 45 HG LEU 6 HG LEU 6 11.130 0.307 -19.861 46 HD11 LEU 6 1HD1 LEU 6 12.398 -1.718 -20.396 47 HD12 LEU 6 2HD1 LEU 6 11.687 -1.717 -22.038 48 HD13 LEU 6 3HD1 LEU 6 10.638 -1.952 -20.622 49 HD21 LEU 6 1HD2 LEU 6 13.455 0.406 -20.841 50 HD22 LEU 6 2HD2 LEU 6 12.479 1.855 -21.154 51 HD23 LEU 6 3HD2 LEU 6 12.707 0.654 -22.439 52 H ASN 7 H ASN 7 7.177 1.318 -21.400 53 HA ASN 7 HA ASN 7 5.272 1.532 -22.609 54 HB2 ASN 7 1HB ASN 7 5.863 3.909 -21.991 55 HB3 ASN 7 2HB ASN 7 6.480 4.099 -23.648 56 HD21 ASN 7 1HD2 ASN 7 3.380 5.003 -24.846 57 HD22 ASN 7 2HD2 ASN 7 5.126 5.152 -24.883 58 H VAL 8 H VAL 8 7.114 -0.146 -23.980 59 HA VAL 8 HA VAL 8 6.356 0.437 -26.809 60 HB VAL 8 HB VAL 8 8.307 -1.035 -27.440 61 HG11 VAL 8 1HG1 VAL 8 8.394 1.413 -27.698 62 HG12 VAL 8 2HG1 VAL 8 9.003 1.558 -26.033 63 HG13 VAL 8 3HG1 VAL 8 9.985 0.755 -27.259 64 HG21 VAL 8 1HG2 VAL 8 10.137 -1.330 -25.854 65 HG22 VAL 8 2HG2 VAL 8 9.224 -0.482 -24.595 66 HG23 VAL 8 3HG2 VAL 8 8.662 -2.057 -25.184 67 H LEU 9 H LEU 9 5.707 -1.476 -27.982 68 HA LEU 9 HA LEU 9 4.670 -3.548 -26.096 69 HB2 LEU 9 1HB LEU 9 2.768 -3.757 -27.757 70 HB3 LEU 9 2HB LEU 9 2.768 -2.354 -26.698 71 HG LEU 9 HG LEU 9 3.975 -1.978 -29.395 72 HD11 LEU 9 1HD1 LEU 9 0.992 -2.267 -28.925 73 HD12 LEU 9 2HD1 LEU 9 2.021 -3.345 -29.903 74 HD13 LEU 9 3HD1 LEU 9 1.765 -1.659 -30.415 75 HD21 LEU 9 1HD2 LEU 9 2.930 0.215 -29.143 76 HD22 LEU 9 2HD2 LEU 9 3.783 -0.179 -27.625 77 HD23 LEU 9 3HD2 LEU 9 2.010 -0.342 -27.723 78 H ALA 10 H ALA 10 4.346 -5.625 -26.834 79 HA ALA 10 HA ALA 10 5.989 -6.359 -29.211 80 HB1 ALA 10 1HB ALA 10 7.132 -6.483 -26.853 81 HB2 ALA 10 2HB ALA 10 6.094 -7.900 -26.625 82 HB3 ALA 10 3HB ALA 10 7.279 -7.850 -27.977 83 H LYS 11 H LYS 11 5.516 -8.218 -30.236 84 HA LYS 11 HA LYS 11 2.799 -9.357 -29.723 85 HB2 LYS 11 1HB LYS 11 3.376 -8.641 -32.043 86 HB3 LYS 11 2HB LYS 11 4.793 -9.695 -32.014 87 HG2 LYS 11 1HG LYS 11 3.285 -11.663 -31.739 88 HG3 LYS 11 2HG LYS 11 1.904 -10.579 -31.912 89 HD2 LYS 11 1HD LYS 11 2.666 -9.966 -34.175 90 HD3 LYS 11 2HD LYS 11 4.089 -11.019 -33.953 91 HE2 LYS 11 1HE LYS 11 2.539 -12.956 -33.565 92 HE3 LYS 11 2HE LYS 11 1.182 -11.881 -33.925 93 HZ1 LYS 11 1HZ LYS 11 3.362 -12.561 -35.806 94 HZ2 LYS 11 2HZ LYS 11 2.086 -11.552 -36.145 95 HZ3 LYS 11 3HZ LYS 11 1.823 -13.155 -35.859 96 H ALA 12 H ALA 12 2.551 -11.348 -28.861 97 HA ALA 12 HA ALA 12 4.894 -12.892 -28.062 98 HB1 ALA 12 1HB ALA 12 2.907 -12.911 -26.673 99 HB2 ALA 12 2HB ALA 12 1.909 -13.471 -28.030 100 HB3 ALA 12 3HB ALA 12 3.134 -14.545 -27.333 101 H LEU 13 H LEU 13 5.970 -14.320 -29.239 102 HA LEU 13 HA LEU 13 4.893 -15.038 -31.902 103 HB2 LEU 13 1HB LEU 13 7.542 -15.585 -30.581 104 HB3 LEU 13 2HB LEU 13 7.159 -15.962 -32.245 105 HG LEU 13 HG LEU 13 7.267 -13.146 -31.059 106 HD11 LEU 13 1HD1 LEU 13 9.236 -14.593 -32.859 107 HD12 LEU 13 2HD1 LEU 13 9.460 -14.326 -31.121 108 HD13 LEU 13 3HD1 LEU 13 9.399 -12.942 -32.216 109 HD21 LEU 13 1HD2 LEU 13 5.759 -13.198 -32.950 110 HD22 LEU 13 2HD2 LEU 13 6.924 -14.169 -33.907 111 HD23 LEU 13 3HD2 LEU 13 7.304 -12.480 -33.489 112 H TYR 14 H TYR 14 5.450 -16.420 -28.754 113 HA TYR 14 HA TYR 14 4.482 -19.072 -29.759 114 HB2 TYR 14 1HB TYR 14 6.480 -18.546 -27.521 115 HB3 TYR 14 2HB TYR 14 5.931 -20.136 -28.094 116 HD1 TYR 14 HD1 TYR 14 6.837 -21.055 -30.265 117 HD2 TYR 14 HD2 TYR 14 8.112 -17.228 -28.749 118 HE1 TYR 14 HE1 TYR 14 8.762 -21.025 -31.881 119 HE2 TYR 14 HE2 TYR 14 10.032 -17.229 -30.348 120 HH TYR 14 HH TYR 14 11.130 -18.400 -31.989 121 H ASP 15 H ASP 15 3.418 -20.310 -27.986 122 HA ASP 15 HA ASP 15 1.844 -18.482 -26.297 123 HB2 ASP 15 1HB ASP 15 0.465 -20.573 -25.946 124 HB3 ASP 15 2HB ASP 15 0.505 -19.964 -27.608 125 H ASN 16 H ASN 16 1.309 -19.300 -24.045 126 HA ASN 16 HA ASN 16 3.495 -20.891 -22.848 127 HB2 ASN 16 1HB ASN 16 4.092 -18.358 -22.926 128 HB3 ASN 16 2HB ASN 16 2.785 -18.147 -21.760 129 HD21 ASN 16 1HD2 ASN 16 4.884 -18.847 -19.104 130 HD22 ASN 16 2HD2 ASN 16 3.538 -17.935 -19.790 131 H VAL 17 H VAL 17 2.976 -21.555 -20.672 132 HA VAL 17 HA VAL 17 0.116 -21.156 -19.876 133 HB VAL 17 HB VAL 17 1.807 -23.694 -19.523 134 HG11 VAL 17 1HG1 VAL 17 -1.067 -23.076 -18.673 135 HG12 VAL 17 2HG1 VAL 17 -0.306 -24.681 -18.586 136 HG13 VAL 17 3HG1 VAL 17 0.325 -23.347 -17.593 137 HG21 VAL 17 1HG2 VAL 17 -0.643 -23.170 -21.295 138 HG22 VAL 17 2HG2 VAL 17 1.015 -23.492 -21.853 139 HG23 VAL 17 3HG2 VAL 17 0.109 -24.764 -21.028 140 H ALA 18 H ALA 18 0.330 -19.697 -18.275 141 HA ALA 18 HA ALA 18 2.775 -19.512 -16.743 142 HB1 ALA 18 1HB ALA 18 0.076 -18.138 -16.372 143 HB2 ALA 18 2HB ALA 18 1.588 -17.722 -15.542 144 HB3 ALA 18 3HB ALA 18 1.473 -17.506 -17.296 145 H GLU 19 H GLU 19 3.299 -20.538 -14.958 146 HA GLU 19 HA GLU 19 1.135 -22.098 -13.569 147 HB2 GLU 19 1HB GLU 19 2.884 -23.511 -12.732 148 HB3 GLU 19 2HB GLU 19 3.035 -23.371 -14.485 149 HG2 GLU 19 1HG GLU 19 4.897 -21.748 -14.197 150 HG3 GLU 19 2HG GLU 19 4.739 -21.880 -12.434 151 H SER 20 H SER 20 3.061 -19.322 -13.212 152 HA SER 20 HA SER 20 2.585 -19.328 -10.252 153 HB2 SER 20 1HB SER 20 4.963 -19.437 -10.854 154 HB3 SER 20 2HB SER 20 4.777 -17.996 -11.874 155 HG SER 20 HG SER 20 5.632 -17.540 -9.780 156 HA PRO 21 HA PRO 21 0.263 -15.657 -11.162 157 HB2 PRO 21 1HB PRO 21 0.410 -14.230 -8.839 158 HB3 PRO 21 2HB PRO 21 -0.554 -15.741 -8.985 159 HG2 PRO 21 1HG PRO 21 2.240 -15.386 -7.922 160 HG3 PRO 21 2HG PRO 21 0.844 -16.193 -7.154 161 HD2 PRO 21 1HD PRO 21 2.675 -17.635 -8.481 162 HD3 PRO 21 2HD PRO 21 0.924 -18.022 -8.621 163 H ASP 22 H ASP 22 3.613 -15.529 -10.255 164 HA ASP 22 HA ASP 22 4.029 -12.670 -10.784 165 HB2 ASP 22 1HB ASP 22 5.496 -14.107 -9.325 166 HB3 ASP 22 2HB ASP 22 5.998 -15.010 -10.762 167 H GLU 23 H GLU 23 3.646 -15.591 -12.624 168 HA GLU 23 HA GLU 23 5.081 -14.556 -14.991 169 HB2 GLU 23 1HB GLU 23 5.302 -16.915 -14.140 170 HB3 GLU 23 2HB GLU 23 3.611 -17.157 -14.535 171 HG2 GLU 23 1HG GLU 23 4.085 -16.701 -16.880 172 HG3 GLU 23 2HG GLU 23 5.785 -16.414 -16.483 173 H LEU 24 H LEU 24 4.080 -13.867 -16.846 174 HA LEU 24 HA LEU 24 1.235 -13.273 -16.535 175 HB2 LEU 24 1HB LEU 24 3.372 -12.139 -17.961 176 HB3 LEU 24 2HB LEU 24 2.265 -12.748 -19.183 177 HG LEU 24 HG LEU 24 1.549 -10.838 -16.924 178 HD11 LEU 24 1HD1 LEU 24 1.428 -9.163 -18.657 179 HD12 LEU 24 2HD1 LEU 24 1.834 -10.379 -19.900 180 HD13 LEU 24 3HD1 LEU 24 3.038 -9.925 -18.673 181 HD21 LEU 24 1HD2 LEU 24 -0.158 -11.881 -19.237 182 HD22 LEU 24 2HD2 LEU 24 -0.595 -10.507 -18.194 183 HD23 LEU 24 3HD2 LEU 24 -0.439 -12.119 -17.495 184 H SER 25 H SER 25 -0.440 -14.368 -17.379 185 HA SER 25 HA SER 25 -0.012 -16.740 -19.035 186 HB2 SER 25 1HB SER 25 -1.841 -16.730 -17.387 187 HB3 SER 25 2HB SER 25 -2.530 -15.274 -18.124 188 HG SER 25 HG SER 25 -3.029 -16.438 -19.937 189 H PHE 26 H PHE 26 0.553 -16.411 -21.113 190 HA PHE 26 HA PHE 26 -1.130 -14.583 -22.723 191 HB2 PHE 26 1HB PHE 26 0.734 -13.585 -23.849 192 HB3 PHE 26 2HB PHE 26 0.974 -13.340 -22.111 193 HD1 PHE 26 HD1 PHE 26 2.197 -15.116 -25.131 194 HD2 PHE 26 HD2 PHE 26 2.775 -14.446 -20.925 195 HE1 PHE 26 HE1 PHE 26 4.478 -16.091 -25.292 196 HE2 PHE 26 HE2 PHE 26 5.049 -15.420 -21.061 197 HZ PHE 26 HZ PHE 26 5.928 -16.233 -23.264 198 H ARG 27 H ARG 27 -0.874 -15.041 -25.058 199 HA ARG 27 HA ARG 27 0.167 -17.790 -25.578 200 HB2 ARG 27 1HB ARG 27 -1.839 -18.322 -26.916 201 HB3 ARG 27 2HB ARG 27 -2.221 -18.090 -25.214 202 HG2 ARG 27 1HG ARG 27 -2.454 -15.640 -26.795 203 HG3 ARG 27 2HG ARG 27 -3.539 -16.925 -27.335 204 HD2 ARG 27 1HD ARG 27 -4.698 -16.968 -25.320 205 HD3 ARG 27 2HD ARG 27 -3.304 -16.394 -24.396 206 HE ARG 27 HE ARG 27 -3.749 -14.149 -25.016 207 HH11 ARG 27 1HH1 ARG 27 -6.241 -16.300 -26.334 208 HH12 ARG 27 2HH1 ARG 27 -7.307 -14.974 -26.690 209 HH21 ARG 27 1HH2 ARG 27 -5.072 -12.566 -25.524 210 HH22 ARG 27 2HH2 ARG 27 -6.665 -12.858 -26.225 211 H LYS 28 H LYS 28 0.266 -18.163 -28.020 212 HA LYS 28 HA LYS 28 1.807 -16.060 -29.179 213 HB2 LYS 28 1HB LYS 28 1.746 -17.436 -31.234 214 HB3 LYS 28 2HB LYS 28 2.137 -18.373 -29.794 215 HG2 LYS 28 1HG LYS 28 -0.307 -19.110 -29.704 216 HG3 LYS 28 2HG LYS 28 -0.480 -18.371 -31.325 217 HD2 LYS 28 1HD LYS 28 1.340 -19.838 -32.156 218 HD3 LYS 28 2HD LYS 28 1.520 -20.536 -30.535 219 HE2 LYS 28 1HE LYS 28 -0.898 -21.238 -30.640 220 HE3 LYS 28 2HE LYS 28 -0.926 -20.728 -32.351 221 HZ1 LYS 28 1HZ LYS 28 -0.452 -23.087 -32.157 222 HZ2 LYS 28 2HZ LYS 28 0.864 -22.795 -31.179 223 HZ3 LYS 28 3HZ LYS 28 0.869 -22.333 -32.760 224 H GLY 29 H GLY 29 1.383 -14.517 -30.636 225 HA2 GLY 29 1HA GLY 29 0.053 -13.337 -32.164 226 HA3 GLY 29 2HA GLY 29 -1.371 -14.300 -31.738 227 H ASP 30 H ASP 30 -0.409 -13.625 -28.731 228 HA ASP 30 HA ASP 30 -2.253 -11.405 -28.524 229 HB2 ASP 30 1HB ASP 30 -1.344 -13.339 -26.830 230 HB3 ASP 30 2HB ASP 30 -0.405 -11.957 -26.261 231 H ILE 31 H ILE 31 -1.762 -9.292 -27.604 232 HA ILE 31 HA ILE 31 1.008 -8.349 -28.285 233 HB ILE 31 HB ILE 31 -1.546 -6.685 -28.551 234 HG12 ILE 31 1HG1 ILE 31 -1.640 -8.463 -30.227 235 HG13 ILE 31 2HG1 ILE 31 -1.412 -6.882 -30.972 236 HG21 ILE 31 1HG2 ILE 31 1.358 -6.206 -29.367 237 HG22 ILE 31 2HG2 ILE 31 0.018 -5.180 -29.896 238 HG23 ILE 31 3HG2 ILE 31 0.407 -5.307 -28.168 239 HD11 ILE 31 1HD1 ILE 31 -0.095 -8.612 -32.081 240 HD12 ILE 31 2HD1 ILE 31 0.968 -7.397 -31.353 241 HD13 ILE 31 3HD1 ILE 31 0.751 -8.981 -30.565 242 H MET 32 H MET 32 2.028 -7.435 -26.574 243 HA MET 32 HA MET 32 0.357 -6.382 -24.330 244 HB2 MET 32 1HB MET 32 1.731 -7.616 -22.722 245 HB3 MET 32 2HB MET 32 1.038 -8.731 -23.896 246 HG2 MET 32 1HG MET 32 3.253 -8.612 -25.160 247 HG3 MET 32 2HG MET 32 3.905 -7.768 -23.732 248 HE1 MET 32 1HE MET 32 1.506 -10.918 -24.411 249 HE2 MET 32 2HE MET 32 2.959 -10.969 -25.432 250 HE3 MET 32 3HE MET 32 2.755 -12.171 -24.136 251 H THR 33 H THR 33 1.463 -4.924 -22.896 252 HA THR 33 HA THR 33 3.525 -3.388 -24.377 253 HB THR 33 HB THR 33 2.051 -2.662 -21.798 254 HG1 THR 33 HG1 THR 33 0.497 -2.641 -23.288 255 HG21 THR 33 1HG2 THR 33 2.727 -0.357 -22.424 256 HG22 THR 33 2HG2 THR 33 3.653 -0.997 -23.788 257 HG23 THR 33 3HG2 THR 33 4.132 -1.392 -22.110 258 H VAL 34 H VAL 34 5.616 -3.364 -23.785 259 HA VAL 34 HA VAL 34 6.421 -5.027 -21.445 260 HB VAL 34 HB VAL 34 8.096 -3.610 -23.593 261 HG11 VAL 34 1HG1 VAL 34 8.953 -5.382 -21.265 262 HG12 VAL 34 2HG1 VAL 34 10.008 -4.906 -22.612 263 HG13 VAL 34 3HG1 VAL 34 9.371 -3.670 -21.512 264 HG21 VAL 34 1HG2 VAL 34 7.658 -6.580 -23.109 265 HG22 VAL 34 2HG2 VAL 34 6.814 -5.627 -24.353 266 HG23 VAL 34 3HG2 VAL 34 8.568 -5.839 -24.433 267 H LEU 35 H LEU 35 6.851 -4.178 -19.522 268 HA LEU 35 HA LEU 35 6.741 -1.231 -19.257 269 HB2 LEU 35 1HB LEU 35 6.793 -3.389 -17.148 270 HB3 LEU 35 2HB LEU 35 6.482 -1.693 -16.876 271 HG LEU 35 HG LEU 35 4.674 -3.650 -18.353 272 HD11 LEU 35 1HD1 LEU 35 3.168 -3.219 -16.414 273 HD12 LEU 35 2HD1 LEU 35 4.456 -2.247 -15.658 274 HD13 LEU 35 3HD1 LEU 35 4.699 -3.985 -15.941 275 HD21 LEU 35 1HD2 LEU 35 4.414 -1.470 -19.377 276 HD22 LEU 35 2HD2 LEU 35 4.307 -0.676 -17.777 277 HD23 LEU 35 3HD2 LEU 35 3.022 -1.767 -18.323 278 H GLU 36 H GLU 36 8.730 -4.031 -18.324 279 HA GLU 36 HA GLU 36 11.115 -2.250 -18.012 280 HB2 GLU 36 1HB GLU 36 9.639 -3.056 -15.863 281 HB3 GLU 36 2HB GLU 36 10.727 -4.451 -16.031 282 HG2 GLU 36 1HG GLU 36 11.727 -2.979 -14.495 283 HG3 GLU 36 2HG GLU 36 12.641 -2.817 -16.007 284 H ARG 37 H ARG 37 13.139 -3.662 -17.793 285 HA ARG 37 HA ARG 37 12.791 -6.338 -19.092 286 HB2 ARG 37 1HB ARG 37 14.904 -4.273 -19.752 287 HB3 ARG 37 2HB ARG 37 14.919 -5.954 -20.293 288 HG2 ARG 37 1HG ARG 37 12.603 -5.416 -21.335 289 HG3 ARG 37 2HG ARG 37 13.083 -3.731 -21.114 290 HD2 ARG 37 1HD ARG 37 14.584 -5.858 -22.647 291 HD3 ARG 37 2HD ARG 37 13.742 -4.442 -23.332 292 HE ARG 37 HE ARG 37 15.516 -3.260 -21.654 293 HH11 ARG 37 1HH1 ARG 37 16.069 -5.834 -24.016 294 HH12 ARG 37 2HH1 ARG 37 17.748 -5.380 -24.246 295 HH21 ARG 37 1HH2 ARG 37 17.652 -2.754 -22.029 296 HH22 ARG 37 2HH2 ARG 37 18.613 -3.696 -23.130 297 H ASP 38 H ASP 38 14.436 -7.807 -18.578 298 HA ASP 38 HA ASP 38 15.761 -8.925 -17.143 299 HB2 ASP 38 1HB ASP 38 17.111 -6.287 -16.631 300 HB3 ASP 38 2HB ASP 38 17.843 -7.882 -16.498 301 H THR 39 H THR 39 13.306 -8.077 -16.303 302 HA THR 39 HA THR 39 13.283 -6.667 -13.829 303 HB THR 39 HB THR 39 11.363 -6.843 -15.440 304 HG1 THR 39 HG1 THR 39 11.080 -7.585 -12.709 305 HG21 THR 39 1HG2 THR 39 9.931 -8.841 -15.399 306 HG22 THR 39 2HG2 THR 39 10.998 -9.654 -14.270 307 HG23 THR 39 3HG2 THR 39 11.544 -9.306 -15.934 308 H GLN 40 H GLN 40 14.118 -9.899 -14.433 309 HA GLN 40 HA GLN 40 13.375 -10.743 -11.668 310 HB2 GLN 40 1HB GLN 40 13.173 -11.962 -14.286 311 HB3 GLN 40 2HB GLN 40 14.274 -12.922 -13.290 312 HG2 GLN 40 1HG GLN 40 11.461 -12.109 -12.454 313 HG3 GLN 40 2HG GLN 40 11.900 -13.669 -13.165 314 HE21 GLN 40 1HE2 GLN 40 13.587 -14.857 -10.266 315 HE22 GLN 40 2HE2 GLN 40 13.576 -14.931 -12.015 316 H GLY 41 H GLY 41 15.817 -9.310 -13.209 317 HA2 GLY 41 1HA GLY 41 18.064 -9.133 -12.642 318 HA3 GLY 41 2HA GLY 41 17.916 -10.565 -11.582 319 H LEU 42 H LEU 42 16.431 -11.873 -13.860 320 HA LEU 42 HA LEU 42 18.705 -13.107 -15.225 321 HB2 LEU 42 1HB LEU 42 15.697 -13.423 -15.552 322 HB3 LEU 42 2HB LEU 42 16.911 -14.432 -16.337 323 HG LEU 42 HG LEU 42 16.445 -14.291 -13.320 324 HD11 LEU 42 1HD1 LEU 42 15.308 -16.467 -13.619 325 HD12 LEU 42 2HD1 LEU 42 15.546 -16.369 -15.376 326 HD13 LEU 42 3HD1 LEU 42 14.489 -15.209 -14.558 327 HD21 LEU 42 1HD2 LEU 42 18.726 -15.003 -13.913 328 HD22 LEU 42 2HD2 LEU 42 18.088 -16.203 -15.067 329 HD23 LEU 42 3HD2 LEU 42 17.797 -16.381 -13.310 330 H ASP 43 H ASP 43 19.519 -12.330 -17.045 331 HA ASP 43 HA ASP 43 18.505 -10.031 -18.383 332 HB2 ASP 43 1HB ASP 43 20.884 -10.863 -18.379 333 HB3 ASP 43 2HB ASP 43 20.388 -12.175 -19.464 334 H GLY 44 H GLY 44 17.145 -9.794 -20.056 335 HA2 GLY 44 1HA GLY 44 15.981 -10.460 -21.984 336 HA3 GLY 44 2HA GLY 44 16.444 -12.151 -21.695 337 H TRP 45 H TRP 45 15.183 -11.219 -18.768 338 HA TRP 45 HA TRP 45 12.455 -12.188 -19.595 339 HB2 TRP 45 1HB TRP 45 13.936 -12.037 -16.966 340 HB3 TRP 45 2HB TRP 45 12.177 -12.188 -17.012 341 HD1 TRP 45 HD1 TRP 45 15.338 -14.136 -17.995 342 HE1 TRP 45 HE1 TRP 45 14.769 -16.600 -18.264 343 HE3 TRP 45 HE3 TRP 45 10.269 -13.745 -17.511 344 HZ2 TRP 45 HZ2 TRP 45 12.399 -18.205 -18.234 345 HZ3 TRP 45 HZ3 TRP 45 8.875 -15.805 -17.619 346 HH2 TRP 45 HH2 TRP 45 9.955 -18.020 -17.984 347 H TRP 46 H TRP 46 10.853 -10.729 -19.873 348 HA TRP 46 HA TRP 46 11.435 -7.985 -18.916 349 HB2 TRP 46 1HB TRP 46 9.737 -8.906 -21.223 350 HB3 TRP 46 2HB TRP 46 10.073 -7.225 -20.801 351 HD1 TRP 46 HD1 TRP 46 13.347 -8.530 -20.280 352 HE1 TRP 46 HE1 TRP 46 14.868 -8.497 -22.301 353 HE3 TRP 46 HE3 TRP 46 9.744 -7.913 -23.828 354 HZ2 TRP 46 HZ2 TRP 46 14.564 -8.287 -25.149 355 HZ3 TRP 46 HZ3 TRP 46 10.423 -7.817 -26.248 356 HH2 TRP 46 HH2 TRP 46 12.822 -7.986 -26.874 357 H LEU 47 H LEU 47 9.873 -6.778 -17.914 358 HA LEU 47 HA LEU 47 7.572 -8.312 -16.808 359 HB2 LEU 47 1HB LEU 47 8.869 -6.718 -15.362 360 HB3 LEU 47 2HB LEU 47 8.465 -5.418 -16.469 361 HG LEU 47 HG LEU 47 6.065 -5.703 -15.917 362 HD11 LEU 47 1HD1 LEU 47 5.483 -6.980 -13.848 363 HD12 LEU 47 2HD1 LEU 47 7.127 -7.642 -13.825 364 HD13 LEU 47 3HD1 LEU 47 6.032 -8.014 -15.176 365 HD21 LEU 47 1HD2 LEU 47 6.268 -4.639 -13.712 366 HD22 LEU 47 2HD2 LEU 47 7.497 -4.014 -14.828 367 HD23 LEU 47 3HD2 LEU 47 7.941 -5.203 -13.583 368 H CYS 48 H CYS 48 5.710 -8.370 -17.965 369 HA CYS 48 HA CYS 48 5.253 -6.060 -19.841 370 HB2 CYS 48 1HB CYS 48 4.441 -8.968 -20.194 371 HB3 CYS 48 2HB CYS 48 4.126 -7.647 -21.338 372 HG CYS 48 HG CYS 48 7.018 -8.863 -20.274 373 H SER 49 H SER 49 2.954 -5.641 -20.266 374 HA SER 49 HA SER 49 1.178 -6.513 -18.031 375 HB2 SER 49 1HB SER 49 1.840 -4.155 -17.721 376 HB3 SER 49 2HB SER 49 1.240 -3.778 -19.350 377 HG SER 49 HG SER 49 -0.206 -3.414 -17.480 378 H LEU 50 H LEU 50 -0.684 -7.396 -18.609 379 HA LEU 50 HA LEU 50 -1.896 -7.003 -21.266 380 HB2 LEU 50 1HB LEU 50 -0.107 -8.630 -21.740 381 HB3 LEU 50 2HB LEU 50 -0.638 -9.630 -20.396 382 HG LEU 50 HG LEU 50 -2.757 -10.056 -21.578 383 HD11 LEU 50 1HD1 LEU 50 -2.884 -9.646 -24.015 384 HD12 LEU 50 2HD1 LEU 50 -1.374 -8.726 -23.939 385 HD13 LEU 50 3HD1 LEU 50 -2.819 -8.118 -23.128 386 HD21 LEU 50 1HD2 LEU 50 -0.894 -11.646 -21.613 387 HD22 LEU 50 2HD2 LEU 50 -0.242 -10.838 -23.043 388 HD23 LEU 50 3HD2 LEU 50 -1.801 -11.682 -23.136 389 H HIS 51 H HIS 51 -4.074 -7.628 -21.163 390 HA HIS 51 HA HIS 51 -6.112 -8.091 -20.201 391 HB2 HIS 51 1HB HIS 51 -4.578 -10.234 -18.693 392 HB3 HIS 51 2HB HIS 51 -6.344 -10.143 -18.862 393 HD1 HIS 51 HD1 HIS 51 -6.529 -9.576 -21.941 394 HD2 HIS 51 HD2 HIS 51 -4.041 -12.442 -20.182 395 HE1 HIS 51 HE1 HIS 51 -6.020 -11.308 -23.708 396 H GLY 52 H GLY 52 -4.406 -6.066 -18.839 397 HA2 GLY 52 1HA GLY 52 -4.954 -4.649 -17.098 398 HA3 GLY 52 2HA GLY 52 -6.188 -5.791 -16.561 399 H ARG 53 H ARG 53 -3.210 -7.379 -16.886 400 HA ARG 53 HA ARG 53 -2.396 -6.706 -14.087 401 HB2 ARG 53 1HB ARG 53 -2.076 -9.008 -13.539 402 HB3 ARG 53 2HB ARG 53 -3.733 -8.850 -14.115 403 HG2 ARG 53 1HG ARG 53 -2.946 -9.703 -16.366 404 HG3 ARG 53 2HG ARG 53 -1.349 -9.933 -15.666 405 HD2 ARG 53 1HD ARG 53 -2.414 -12.050 -15.612 406 HD3 ARG 53 2HD ARG 53 -2.434 -11.442 -13.937 407 HE ARG 53 HE ARG 53 -4.842 -10.647 -15.255 408 HH11 ARG 53 1HH1 ARG 53 -3.311 -13.616 -14.114 409 HH12 ARG 53 2HH1 ARG 53 -4.844 -14.428 -13.895 410 HH21 ARG 53 1HH2 ARG 53 -6.764 -11.757 -14.948 411 HH22 ARG 53 2HH2 ARG 53 -6.758 -13.390 -14.365 412 H GLN 54 H GLN 54 -0.092 -7.488 -13.727 413 HA GLN 54 HA GLN 54 1.422 -7.494 -16.261 414 HB2 GLN 54 1HB GLN 54 3.129 -6.090 -15.259 415 HB3 GLN 54 2HB GLN 54 1.567 -5.270 -15.250 416 HG2 GLN 54 1HG GLN 54 1.278 -5.913 -12.863 417 HG3 GLN 54 2HG GLN 54 2.904 -6.616 -12.898 418 HE21 GLN 54 1HE2 GLN 54 4.329 -3.588 -12.036 419 HE22 GLN 54 2HE2 GLN 54 4.302 -5.327 -11.901 420 H GLY 55 H GLY 55 3.421 -8.649 -16.194 421 HA2 GLY 55 1HA GLY 55 4.224 -10.165 -13.897 422 HA3 GLY 55 2HA GLY 55 3.209 -11.168 -14.958 423 H ILE 56 H ILE 56 5.788 -11.968 -14.614 424 HA ILE 56 HA ILE 56 7.497 -10.703 -16.571 425 HB ILE 56 HB ILE 56 9.203 -12.299 -15.922 426 HG12 ILE 56 1HG1 ILE 56 7.079 -13.826 -14.367 427 HG13 ILE 56 2HG1 ILE 56 7.733 -14.319 -15.920 428 HG21 ILE 56 1HG2 ILE 56 8.480 -10.405 -14.309 429 HG22 ILE 56 2HG2 ILE 56 7.613 -11.647 -13.372 430 HG23 ILE 56 3HG2 ILE 56 9.366 -11.737 -13.552 431 HD11 ILE 56 1HD1 ILE 56 9.218 -14.109 -13.280 432 HD12 ILE 56 2HD1 ILE 56 8.835 -15.585 -14.208 433 HD13 ILE 56 3HD1 ILE 56 10.009 -14.429 -14.852 434 H VAL 57 H VAL 57 8.341 -11.517 -18.476 435 HA VAL 57 HA VAL 57 7.015 -13.890 -19.691 436 HB VAL 57 HB VAL 57 7.195 -11.056 -20.871 437 HG11 VAL 57 1HG1 VAL 57 6.400 -13.672 -22.206 438 HG12 VAL 57 2HG1 VAL 57 5.979 -12.080 -22.844 439 HG13 VAL 57 3HG1 VAL 57 7.678 -12.537 -22.687 440 HG21 VAL 57 1HG2 VAL 57 5.270 -11.211 -19.436 441 HG22 VAL 57 2HG2 VAL 57 4.690 -11.324 -21.099 442 HG23 VAL 57 3HG2 VAL 57 4.807 -12.793 -20.097 443 HA PRO 58 HA PRO 58 11.347 -14.084 -20.872 444 HB2 PRO 58 1HB PRO 58 11.308 -16.101 -22.759 445 HB3 PRO 58 2HB PRO 58 11.180 -16.409 -20.990 446 HG2 PRO 58 1HG PRO 58 8.982 -16.217 -23.017 447 HG3 PRO 58 2HG PRO 58 9.248 -17.478 -21.776 448 HD2 PRO 58 1HD PRO 58 7.505 -15.429 -21.430 449 HD3 PRO 58 2HD PRO 58 8.452 -16.113 -20.066 450 H GLY 59 H GLY 59 12.086 -12.379 -22.063 451 HA2 GLY 59 1HA GLY 59 10.534 -11.154 -24.072 452 HA3 GLY 59 2HA GLY 59 12.218 -10.829 -23.716 453 H ASN 60 H ASN 60 12.979 -13.655 -24.417 454 HA ASN 60 HA ASN 60 13.504 -13.146 -27.218 455 HB2 ASN 60 1HB ASN 60 14.903 -14.524 -25.587 456 HB3 ASN 60 2HB ASN 60 13.733 -15.829 -25.846 457 HD21 ASN 60 1HD2 ASN 60 15.784 -16.894 -28.483 458 HD22 ASN 60 2HD2 ASN 60 15.079 -17.255 -26.920 459 H ARG 61 H ARG 61 10.714 -14.374 -25.643 460 HA ARG 61 HA ARG 61 9.833 -15.843 -28.105 461 HB2 ARG 61 1HB ARG 61 8.483 -15.471 -25.397 462 HB3 ARG 61 2HB ARG 61 7.781 -16.339 -26.763 463 HG2 ARG 61 1HG ARG 61 9.840 -17.858 -26.688 464 HG3 ARG 61 2HG ARG 61 10.218 -17.103 -25.135 465 HD2 ARG 61 1HD ARG 61 7.909 -17.727 -24.347 466 HD3 ARG 61 2HD ARG 61 7.689 -18.601 -25.857 467 HE ARG 61 HE ARG 61 10.072 -19.509 -24.599 468 HH11 ARG 61 1HH1 ARG 61 6.563 -19.799 -24.247 469 HH12 ARG 61 2HH1 ARG 61 6.689 -21.303 -23.413 470 HH21 ARG 61 1HH2 ARG 61 10.156 -21.449 -23.529 471 HH22 ARG 61 2HH2 ARG 61 8.676 -22.245 -23.042 472 H LEU 62 H LEU 62 10.142 -12.724 -27.351 473 HA LEU 62 HA LEU 62 7.450 -11.930 -28.390 474 HB2 LEU 62 1HB LEU 62 9.370 -10.371 -26.636 475 HB3 LEU 62 2HB LEU 62 7.861 -9.775 -27.280 476 HG LEU 62 HG LEU 62 8.124 -11.984 -25.221 477 HD11 LEU 62 1HD1 LEU 62 8.771 -9.799 -24.336 478 HD12 LEU 62 2HD1 LEU 62 7.193 -10.266 -23.682 479 HD13 LEU 62 3HD1 LEU 62 7.278 -9.062 -24.981 480 HD21 LEU 62 1HD2 LEU 62 5.707 -10.624 -26.484 481 HD22 LEU 62 2HD2 LEU 62 5.635 -11.601 -25.000 482 HD23 LEU 62 3HD2 LEU 62 6.133 -12.360 -26.518 483 H LYS 63 H LYS 63 7.327 -10.198 -29.817 484 HA LYS 63 HA LYS 63 9.919 -9.312 -31.046 485 HB2 LYS 63 1HB LYS 63 8.600 -10.900 -32.511 486 HB3 LYS 63 2HB LYS 63 7.266 -9.737 -32.486 487 HG2 LYS 63 1HG LYS 63 8.743 -8.060 -33.542 488 HG3 LYS 63 2HG LYS 63 10.049 -9.252 -33.593 489 HD2 LYS 63 1HD LYS 63 8.582 -10.744 -34.968 490 HD3 LYS 63 2HD LYS 63 7.334 -9.481 -34.973 491 HE2 LYS 63 1HE LYS 63 8.533 -9.282 -37.048 492 HE3 LYS 63 2HE LYS 63 9.049 -7.939 -36.019 493 HZ1 LYS 63 1HZ LYS 63 10.918 -9.043 -37.114 494 HZ2 LYS 63 2HZ LYS 63 10.542 -10.466 -36.372 495 HZ3 LYS 63 3HZ LYS 63 11.046 -9.186 -35.473 496 H ILE 64 H ILE 64 10.148 -7.205 -30.513 497 HA ILE 64 HA ILE 64 7.969 -5.538 -29.622 498 HB ILE 64 HB ILE 64 10.772 -4.768 -30.552 499 HG12 ILE 64 1HG1 ILE 64 10.604 -6.352 -28.537 500 HG13 ILE 64 2HG1 ILE 64 11.520 -4.859 -28.315 501 HG21 ILE 64 1HG2 ILE 64 9.493 -2.740 -30.614 502 HG22 ILE 64 2HG2 ILE 64 8.579 -3.171 -29.145 503 HG23 ILE 64 3HG2 ILE 64 10.278 -2.696 -29.027 504 HD11 ILE 64 1HD1 ILE 64 8.609 -5.034 -27.445 505 HD12 ILE 64 2HD1 ILE 64 9.929 -5.580 -26.392 506 HD13 ILE 64 3HD1 ILE 64 9.857 -3.873 -26.914 507 H LEU 65 H LEU 65 6.834 -3.957 -30.716 508 HA LEU 65 HA LEU 65 6.737 -4.243 -33.659 509 HB2 LEU 65 1HB LEU 65 5.000 -2.872 -31.592 510 HB3 LEU 65 2HB LEU 65 4.775 -2.581 -33.310 511 HG LEU 65 HG LEU 65 4.614 -5.180 -33.515 512 HD11 LEU 65 1HD1 LEU 65 5.173 -5.799 -31.228 513 HD12 LEU 65 2HD1 LEU 65 3.470 -6.191 -31.543 514 HD13 LEU 65 3HD1 LEU 65 3.885 -4.750 -30.589 515 HD21 LEU 65 1HD2 LEU 65 2.170 -4.995 -33.133 516 HD22 LEU 65 2HD2 LEU 65 2.836 -3.642 -34.064 517 HD23 LEU 65 3HD2 LEU 65 2.439 -3.432 -32.334 518 H VAL 66 H VAL 66 5.800 -1.554 -34.188 519 HA VAL 66 HA VAL 66 8.278 -0.307 -34.842 520 HB VAL 66 HB VAL 66 5.444 0.883 -34.751 521 HG11 VAL 66 1HG1 VAL 66 7.138 2.652 -34.910 522 HG12 VAL 66 2HG1 VAL 66 7.929 1.811 -36.269 523 HG13 VAL 66 3HG1 VAL 66 6.289 2.478 -36.467 524 HG21 VAL 66 1HG2 VAL 66 5.477 -1.100 -36.193 525 HG22 VAL 66 2HG2 VAL 66 5.437 0.340 -37.214 526 HG23 VAL 66 3HG2 VAL 66 6.964 -0.550 -36.993 527 H GLY 67 H GLY 67 9.403 1.400 -33.899 528 HA2 GLY 67 1HA GLY 67 9.426 3.284 -32.344 529 HA3 GLY 67 2HA GLY 67 8.411 2.343 -31.247 530 H MET 68 H MET 68 11.316 1.180 -33.018 531 HA MET 68 HA MET 68 12.922 1.314 -30.566 532 HB2 MET 68 1HB MET 68 11.573 -1.126 -31.470 533 HB3 MET 68 2HB MET 68 13.329 -1.306 -31.438 534 HG2 MET 68 1HG MET 68 11.672 -0.349 -29.129 535 HG3 MET 68 2HG MET 68 12.278 -1.993 -29.340 536 HE1 MET 68 1HE MET 68 13.162 -1.507 -26.749 537 HE2 MET 68 2HE MET 68 14.376 -0.261 -26.372 538 HE3 MET 68 3HE MET 68 12.710 0.207 -26.848 539 H TYR 69 H TYR 69 15.108 0.667 -30.899 540 HA TYR 69 HA TYR 69 17.111 0.781 -31.973 541 HB2 TYR 69 1HB TYR 69 16.060 -1.398 -32.767 542 HB3 TYR 69 2HB TYR 69 15.790 -0.589 -34.322 543 HD1 TYR 69 HD1 TYR 69 17.505 -0.643 -35.931 544 HD2 TYR 69 HD2 TYR 69 18.553 -1.279 -31.805 545 HE1 TYR 69 HE1 TYR 69 19.860 -1.181 -36.606 546 HE2 TYR 69 HE2 TYR 69 20.894 -1.774 -32.482 547 HH TYR 69 HH TYR 69 22.370 -1.968 -34.208 548 H ASP 70 H ASP 70 16.035 3.188 -32.107 549 HA ASP 70 HA ASP 70 15.715 4.322 -34.678 550 HB2 ASP 70 1HB ASP 70 16.819 5.651 -32.194 551 HB3 ASP 70 2HB ASP 70 16.011 6.438 -33.551 552 H LYS 71 H LYS 71 18.591 3.336 -33.004 553 HA LYS 71 HA LYS 71 20.263 5.043 -34.771 554 HB2 LYS 71 1HB LYS 71 20.844 3.576 -32.200 555 HB3 LYS 71 2HB LYS 71 22.143 4.088 -33.289 556 HG2 LYS 71 1HG LYS 71 21.318 6.414 -33.205 557 HG3 LYS 71 2HG LYS 71 20.094 5.906 -32.020 558 HD2 LYS 71 1HD LYS 71 21.827 5.256 -30.416 559 HD3 LYS 71 2HD LYS 71 23.093 5.553 -31.633 560 HE2 LYS 71 1HE LYS 71 22.957 7.449 -30.091 561 HE3 LYS 71 2HE LYS 71 22.465 7.943 -31.724 562 HZ1 LYS 71 1HZ LYS 71 20.950 8.816 -30.032 563 HZ2 LYS 71 2HZ LYS 71 20.589 7.268 -29.506 564 HZ3 LYS 71 3HZ LYS 71 20.172 7.742 -31.047 565 H LYS 72 H LYS 72 20.718 4.223 -36.615 566 HA LYS 72 HA LYS 72 20.719 1.475 -37.337 567 HB2 LYS 72 1HB LYS 72 21.737 2.197 -39.405 568 HB3 LYS 72 2HB LYS 72 20.524 3.371 -38.947 569 HG2 LYS 72 1HG LYS 72 23.301 4.014 -38.088 570 HG3 LYS 72 2HG LYS 72 23.017 3.992 -39.831 571 HD2 LYS 72 1HD LYS 72 21.180 5.606 -39.550 572 HD3 LYS 72 2HD LYS 72 21.463 5.624 -37.801 573 HE2 LYS 72 1HE LYS 72 22.551 7.562 -38.750 574 HE3 LYS 72 2HE LYS 72 23.796 6.427 -38.194 575 HZ1 LYS 72 1HZ LYS 72 24.069 5.701 -40.476 576 HZ2 LYS 72 2HZ LYS 72 24.301 7.331 -40.383 577 HZ3 LYS 72 3HZ LYS 72 22.895 6.739 -40.998 578 HA PRO 73 HA PRO 73 24.638 0.183 -35.808 579 HB2 PRO 73 1HB PRO 73 25.424 -1.786 -37.510 580 HB3 PRO 73 2HB PRO 73 23.956 -1.969 -36.469 581 HG2 PRO 73 1HG PRO 73 24.154 -1.074 -39.344 582 HG3 PRO 73 2HG PRO 73 23.138 -2.374 -38.638 583 HD2 PRO 73 1HD PRO 73 22.156 0.103 -39.090 584 HD3 PRO 73 2HD PRO 73 21.673 -0.834 -37.638 585 H ALA 74 H ALA 74 26.976 -0.272 -36.452 586 HA ALA 74 HA ALA 74 27.931 1.047 -38.895 587 HB1 ALA 74 1HB ALA 74 29.547 2.481 -37.624 588 HB2 ALA 74 2HB ALA 74 27.880 2.932 -37.199 589 HB3 ALA 74 3HB ALA 74 28.844 1.929 -36.089 590 H GLY 75 H GLY 75 30.334 0.457 -39.093 591 HA2 GLY 75 1HA GLY 75 31.580 -1.427 -37.376 592 HA3 GLY 75 2HA GLY 75 30.651 -2.315 -38.624 593 H GLU 76 H GLU 76 33.031 -2.889 -39.109 594 HA GLU 76 HA GLU 76 34.085 -0.967 -41.137 595 HB2 GLU 76 1HB GLU 76 36.297 -1.884 -40.767 596 HB3 GLU 76 2HB GLU 76 35.621 -1.304 -39.230 597 HG2 GLU 76 1HG GLU 76 35.017 -3.678 -38.658 598 HG3 GLU 76 2HG GLU 76 35.820 -4.182 -40.152 599 H PHE 77 H PHE 77 35.385 -2.324 -42.874 600 HA PHE 77 HA PHE 77 33.825 -4.802 -43.486 601 HB2 PHE 77 1HB PHE 77 34.733 -2.655 -45.459 602 HB3 PHE 77 2HB PHE 77 33.891 -4.145 -45.867 603 HD1 PHE 77 HD1 PHE 77 31.481 -4.437 -45.118 604 HD2 PHE 77 HD2 PHE 77 33.594 -0.705 -44.755 605 HE1 PHE 77 HE1 PHE 77 29.312 -3.243 -44.838 606 HE2 PHE 77 HE2 PHE 77 31.434 0.498 -44.471 607 HZ PHE 77 HZ PHE 77 29.291 -0.771 -44.526 608 H ILE 78 H ILE 78 34.942 -6.244 -45.005 609 HA ILE 78 HA ILE 78 37.882 -6.168 -44.539 610 HB ILE 78 HB ILE 78 36.041 -8.545 -45.136 611 HG12 ILE 78 1HG1 ILE 78 37.440 -7.878 -42.525 612 HG13 ILE 78 2HG1 ILE 78 35.764 -7.481 -42.845 613 HG21 ILE 78 1HG2 ILE 78 38.340 -8.870 -45.999 614 HG22 ILE 78 2HG2 ILE 78 39.008 -8.508 -44.395 615 HG23 ILE 78 3HG2 ILE 78 38.015 -9.969 -44.651 616 HD11 ILE 78 1HD1 ILE 78 35.246 -9.903 -43.149 617 HD12 ILE 78 2HD1 ILE 78 36.942 -10.265 -42.686 618 HD13 ILE 78 3HD1 ILE 78 35.848 -9.483 -41.527 619 H VAL 79 H VAL 79 39.190 -6.141 -46.312 620 HA VAL 79 HA VAL 79 37.916 -6.427 -48.999 621 HB VAL 79 HB VAL 79 39.653 -4.850 -49.834 622 HG11 VAL 79 1HG1 VAL 79 37.973 -3.655 -47.603 623 HG12 VAL 79 2HG1 VAL 79 38.631 -2.795 -49.014 624 HG13 VAL 79 3HG1 VAL 79 37.377 -4.051 -49.225 625 HG21 VAL 79 1HG2 VAL 79 40.301 -4.353 -46.885 626 HG22 VAL 79 2HG2 VAL 79 41.344 -5.212 -48.042 627 HG23 VAL 79 3HG2 VAL 79 41.001 -3.495 -48.285 628 H THR 80 H THR 80 39.717 -7.102 -50.645 629 HA THR 80 HA THR 80 40.928 -9.502 -49.638 630 HB THR 80 HB THR 80 42.157 -8.705 -52.099 631 HG1 THR 80 HG1 THR 80 40.427 -8.008 -53.288 632 HG21 THR 80 1HG2 THR 80 39.772 -10.514 -51.554 633 HG22 THR 80 2HG2 THR 80 41.476 -11.000 -51.497 634 HG23 THR 80 3HG2 THR 80 40.756 -10.499 -53.046 635 H ASP 81 H ASP 81 42.704 -9.700 -48.559 636 HA ASP 81 HA ASP 81 44.604 -9.234 -47.485 637 HB2 ASP 81 1HB ASP 81 45.540 -8.640 -50.308 638 HB3 ASP 81 2HB ASP 81 46.581 -9.119 -48.974 639 HXT ASP 81 H02 ASP 81 44.171 -5.844 -46.962 Start of MODEL 20 1 H2 GLY 1 2H0 GLY 1 2.503 11.497 -23.739 2 H GLY 1 1H0 GLY 1 1.248 10.594 -24.247 3 HA2 GLY 1 1HA GLY 1 1.671 11.442 -21.435 4 HA3 GLY 1 2HA GLY 1 0.356 10.394 -22.011 5 H SER 2 H SER 2 1.385 9.288 -20.114 6 HA SER 2 HA SER 2 2.466 7.480 -19.229 7 HB2 SER 2 1HB SER 2 2.664 6.597 -22.126 8 HB3 SER 2 2HB SER 2 2.767 5.553 -20.692 9 HG SER 2 HG SER 2 0.644 5.784 -21.805 10 H MET 3 H MET 3 4.237 9.767 -20.370 11 HA MET 3 HA MET 3 6.726 8.474 -21.067 12 HB2 MET 3 1HB MET 3 5.995 10.761 -21.793 13 HB3 MET 3 2HB MET 3 6.235 11.330 -20.141 14 HG2 MET 3 1HG MET 3 8.633 10.711 -20.293 15 HG3 MET 3 2HG MET 3 8.379 10.173 -21.964 16 HE1 MET 3 1HE MET 3 7.775 13.483 -23.936 17 HE2 MET 3 2HE MET 3 8.102 11.738 -24.031 18 HE3 MET 3 3HE MET 3 6.546 12.320 -23.390 19 H LYS 4 H LYS 4 6.903 6.984 -19.356 20 HA LYS 4 HA LYS 4 8.481 7.939 -17.088 21 HB2 LYS 4 1HB LYS 4 6.075 8.322 -16.367 22 HB3 LYS 4 2HB LYS 4 5.823 6.577 -16.487 23 HG2 LYS 4 1HG LYS 4 7.533 6.199 -14.766 24 HG3 LYS 4 2HG LYS 4 7.866 7.940 -14.705 25 HD2 LYS 4 1HD LYS 4 5.525 8.344 -13.980 26 HD3 LYS 4 2HD LYS 4 5.227 6.594 -14.010 27 HE2 LYS 4 1HE LYS 4 5.689 7.269 -11.723 28 HE3 LYS 4 2HE LYS 4 7.041 6.287 -12.321 29 HZ1 LYS 4 1HZ LYS 4 7.011 9.253 -12.178 30 HZ2 LYS 4 2HZ LYS 4 8.268 8.339 -12.733 31 HZ3 LYS 4 3HZ LYS 4 7.822 8.250 -11.147 32 H TYR 5 H TYR 5 6.719 5.385 -18.766 33 HA TYR 5 HA TYR 5 8.748 3.375 -17.854 34 HB2 TYR 5 1HB TYR 5 5.784 3.244 -18.373 35 HB3 TYR 5 2HB TYR 5 6.775 1.837 -18.774 36 HD1 TYR 5 HD1 TYR 5 7.970 0.574 -17.058 37 HD2 TYR 5 HD2 TYR 5 5.448 3.885 -15.994 38 HE1 TYR 5 HE1 TYR 5 7.963 -0.210 -14.719 39 HE2 TYR 5 HE2 TYR 5 5.452 3.105 -13.617 40 HH TYR 5 HH TYR 5 6.198 1.516 -12.129 41 H LEU 6 H LEU 6 9.015 1.629 -19.614 42 HA LEU 6 HA LEU 6 9.994 2.849 -21.980 43 HB2 LEU 6 1HB LEU 6 9.127 -0.024 -21.480 44 HB3 LEU 6 2HB LEU 6 10.062 0.510 -22.873 45 HG LEU 6 HG LEU 6 11.013 0.704 -19.995 46 HD11 LEU 6 1HD1 LEU 6 10.700 -1.628 -20.693 47 HD12 LEU 6 2HD1 LEU 6 12.422 -1.233 -20.541 48 HD13 LEU 6 3HD1 LEU 6 11.675 -1.335 -22.156 49 HD21 LEU 6 1HD2 LEU 6 12.118 2.336 -21.441 50 HD22 LEU 6 2HD2 LEU 6 12.468 1.072 -22.647 51 HD23 LEU 6 3HD2 LEU 6 13.242 1.025 -21.044 52 H ASN 7 H ASN 7 6.934 1.168 -21.349 53 HA ASN 7 HA ASN 7 4.952 1.105 -22.439 54 HB2 ASN 7 1HB ASN 7 5.378 3.648 -22.063 55 HB3 ASN 7 2HB ASN 7 5.663 3.710 -23.808 56 HD21 ASN 7 1HD2 ASN 7 1.893 2.504 -22.682 57 HD22 ASN 7 2HD2 ASN 7 3.295 1.816 -21.906 58 H VAL 8 H VAL 8 7.388 0.041 -23.886 59 HA VAL 8 HA VAL 8 6.614 0.308 -26.733 60 HB VAL 8 HB VAL 8 8.756 -1.372 -25.356 61 HG11 VAL 8 1HG1 VAL 8 8.209 -0.894 -28.304 62 HG12 VAL 8 2HG1 VAL 8 9.703 -1.618 -27.666 63 HG13 VAL 8 3HG1 VAL 8 8.151 -2.442 -27.421 64 HG21 VAL 8 1HG2 VAL 8 8.967 1.249 -26.892 65 HG22 VAL 8 2HG2 VAL 8 9.266 1.009 -25.158 66 HG23 VAL 8 3HG2 VAL 8 10.355 0.278 -26.347 67 H LEU 9 H LEU 9 5.399 -1.239 -27.774 68 HA LEU 9 HA LEU 9 4.432 -3.475 -26.082 69 HB2 LEU 9 1HB LEU 9 3.196 -3.553 -28.621 70 HB3 LEU 9 2HB LEU 9 2.478 -3.228 -27.070 71 HG LEU 9 HG LEU 9 3.702 -1.103 -28.831 72 HD11 LEU 9 1HD1 LEU 9 0.804 -2.004 -28.617 73 HD12 LEU 9 2HD1 LEU 9 1.880 -2.237 -30.011 74 HD13 LEU 9 3HD1 LEU 9 1.393 -0.601 -29.541 75 HD21 LEU 9 1HD2 LEU 9 3.378 -0.441 -26.414 76 HD22 LEU 9 2HD2 LEU 9 1.674 -0.919 -26.522 77 HD23 LEU 9 3HD2 LEU 9 2.281 0.455 -27.477 78 H ALA 10 H ALA 10 4.182 -5.598 -27.013 79 HA ALA 10 HA ALA 10 5.910 -6.156 -29.317 80 HB1 ALA 10 1HB ALA 10 7.235 -7.851 -28.104 81 HB2 ALA 10 2HB ALA 10 7.427 -6.268 -27.320 82 HB3 ALA 10 3HB ALA 10 6.356 -7.492 -26.598 83 H LYS 11 H LYS 11 5.532 -8.171 -30.267 84 HA LYS 11 HA LYS 11 2.852 -9.333 -29.647 85 HB2 LYS 11 1HB LYS 11 3.365 -8.595 -31.957 86 HB3 LYS 11 2HB LYS 11 4.771 -9.660 -31.993 87 HG2 LYS 11 1HG LYS 11 3.310 -11.625 -31.828 88 HG3 LYS 11 2HG LYS 11 1.883 -10.570 -31.756 89 HD2 LYS 11 1HD LYS 11 2.492 -9.645 -33.979 90 HD3 LYS 11 2HD LYS 11 3.875 -10.760 -34.045 91 HE2 LYS 11 1HE LYS 11 2.323 -12.683 -33.890 92 HE3 LYS 11 2HE LYS 11 0.946 -11.558 -33.834 93 HZ1 LYS 11 1HZ LYS 11 1.309 -12.395 -36.070 94 HZ2 LYS 11 2HZ LYS 11 2.852 -11.814 -36.093 95 HZ3 LYS 11 3HZ LYS 11 1.577 -10.769 -36.034 96 H ALA 12 H ALA 12 2.633 -11.369 -28.801 97 HA ALA 12 HA ALA 12 5.074 -12.820 -28.083 98 HB1 ALA 12 1HB ALA 12 3.418 -13.076 -26.478 99 HB2 ALA 12 2HB ALA 12 2.125 -13.242 -27.686 100 HB3 ALA 12 3HB ALA 12 3.264 -14.579 -27.406 101 H LEU 13 H LEU 13 6.002 -14.461 -29.071 102 HA LEU 13 HA LEU 13 4.974 -15.226 -31.751 103 HB2 LEU 13 1HB LEU 13 7.557 -15.871 -30.289 104 HB3 LEU 13 2HB LEU 13 7.201 -16.298 -31.960 105 HG LEU 13 HG LEU 13 7.393 -13.441 -30.923 106 HD11 LEU 13 1HD1 LEU 13 9.595 -13.400 -32.014 107 HD12 LEU 13 2HD1 LEU 13 9.434 -15.122 -32.432 108 HD13 LEU 13 3HD1 LEU 13 9.545 -14.619 -30.728 109 HD21 LEU 13 1HD2 LEU 13 7.604 -12.915 -33.368 110 HD22 LEU 13 2HD2 LEU 13 6.023 -13.588 -32.934 111 HD23 LEU 13 3HD2 LEU 13 7.237 -14.614 -33.737 112 H TYR 14 H TYR 14 5.176 -16.388 -28.502 113 HA TYR 14 HA TYR 14 4.286 -19.103 -29.383 114 HB2 TYR 14 1HB TYR 14 6.119 -18.381 -27.076 115 HB3 TYR 14 2HB TYR 14 5.492 -19.997 -27.413 116 HD1 TYR 14 HD1 TYR 14 7.887 -17.388 -28.521 117 HD2 TYR 14 HD2 TYR 14 6.386 -21.350 -29.259 118 HE1 TYR 14 HE1 TYR 14 9.848 -17.854 -29.985 119 HE2 TYR 14 HE2 TYR 14 8.342 -21.803 -30.743 120 HH TYR 14 HH TYR 14 10.266 -20.970 -31.668 121 H ASP 15 H ASP 15 2.977 -20.215 -27.776 122 HA ASP 15 HA ASP 15 1.428 -18.334 -26.068 123 HB2 ASP 15 1HB ASP 15 -0.272 -20.173 -26.021 124 HB3 ASP 15 2HB ASP 15 -0.016 -19.459 -27.611 125 H ASN 16 H ASN 16 1.008 -18.837 -23.931 126 HA ASN 16 HA ASN 16 2.531 -21.051 -22.676 127 HB2 ASN 16 1HB ASN 16 4.069 -19.043 -23.020 128 HB3 ASN 16 2HB ASN 16 2.991 -18.139 -21.947 129 HD21 ASN 16 1HD2 ASN 16 4.745 -19.199 -19.158 130 HD22 ASN 16 2HD2 ASN 16 3.849 -17.951 -20.008 131 H VAL 17 H VAL 17 1.989 -21.308 -20.408 132 HA VAL 17 HA VAL 17 -0.377 -19.716 -19.490 133 HB VAL 17 HB VAL 17 0.128 -22.709 -19.044 134 HG11 VAL 17 1HG1 VAL 17 -2.078 -22.668 -17.878 135 HG12 VAL 17 2HG1 VAL 17 -0.870 -21.667 -17.051 136 HG13 VAL 17 3HG1 VAL 17 -2.128 -20.898 -18.053 137 HG21 VAL 17 1HG2 VAL 17 -2.020 -23.017 -20.289 138 HG22 VAL 17 2HG2 VAL 17 -2.036 -21.273 -20.653 139 HG23 VAL 17 3HG2 VAL 17 -0.743 -22.311 -21.299 140 H ALA 18 H ALA 18 0.027 -18.815 -17.507 141 HA ALA 18 HA ALA 18 2.691 -18.852 -16.503 142 HB1 ALA 18 1HB ALA 18 0.071 -17.957 -15.222 143 HB2 ALA 18 2HB ALA 18 1.688 -17.584 -14.597 144 HB3 ALA 18 3HB ALA 18 1.186 -16.946 -16.174 145 H GLU 19 H GLU 19 3.706 -20.355 -15.350 146 HA GLU 19 HA GLU 19 2.097 -22.375 -13.843 147 HB2 GLU 19 1HB GLU 19 5.077 -22.174 -14.451 148 HB3 GLU 19 2HB GLU 19 4.307 -23.475 -13.533 149 HG2 GLU 19 1HG GLU 19 2.905 -23.980 -15.558 150 HG3 GLU 19 2HG GLU 19 3.876 -22.803 -16.459 151 H SER 20 H SER 20 3.752 -19.427 -13.489 152 HA SER 20 HA SER 20 3.931 -19.819 -10.528 153 HB2 SER 20 1HB SER 20 6.044 -19.096 -10.593 154 HB3 SER 20 2HB SER 20 5.967 -19.167 -12.370 155 HG SER 20 HG SER 20 6.480 -17.101 -11.945 156 HA PRO 21 HA PRO 21 1.110 -16.500 -10.385 157 HB2 PRO 21 1HB PRO 21 1.666 -15.179 -8.070 158 HB3 PRO 21 2HB PRO 21 1.009 -16.848 -8.083 159 HG2 PRO 21 1HG PRO 21 3.873 -15.957 -7.824 160 HG3 PRO 21 2HG PRO 21 2.942 -17.074 -6.774 161 HD2 PRO 21 1HD PRO 21 4.559 -18.000 -8.728 162 HD3 PRO 21 2HD PRO 21 2.987 -18.796 -8.370 163 H ASP 22 H ASP 22 4.524 -15.761 -10.302 164 HA ASP 22 HA ASP 22 4.207 -12.870 -10.706 165 HB2 ASP 22 1HB ASP 22 6.318 -14.782 -10.094 166 HB3 ASP 22 2HB ASP 22 6.797 -13.784 -11.474 167 H GLU 23 H GLU 23 4.090 -15.714 -12.602 168 HA GLU 23 HA GLU 23 5.258 -14.514 -15.009 169 HB2 GLU 23 1HB GLU 23 5.534 -16.906 -14.216 170 HB3 GLU 23 2HB GLU 23 3.852 -17.170 -14.671 171 HG2 GLU 23 1HG GLU 23 4.412 -16.572 -17.007 172 HG3 GLU 23 2HG GLU 23 6.100 -16.327 -16.523 173 H LEU 24 H LEU 24 4.136 -14.263 -17.013 174 HA LEU 24 HA LEU 24 1.242 -13.665 -16.622 175 HB2 LEU 24 1HB LEU 24 3.357 -12.279 -17.811 176 HB3 LEU 24 2HB LEU 24 2.426 -12.900 -19.172 177 HG LEU 24 HG LEU 24 1.299 -11.223 -16.908 178 HD11 LEU 24 1HD1 LEU 24 1.247 -9.413 -18.534 179 HD12 LEU 24 2HD1 LEU 24 1.962 -10.469 -19.776 180 HD13 LEU 24 3HD1 LEU 24 2.903 -10.008 -18.337 181 HD21 LEU 24 1HD2 LEU 24 -0.443 -12.615 -17.862 182 HD22 LEU 24 2HD2 LEU 24 0.072 -12.212 -19.515 183 HD23 LEU 24 3HD2 LEU 24 -0.646 -10.972 -18.466 184 H SER 25 H SER 25 -0.336 -14.741 -17.713 185 HA SER 25 HA SER 25 0.408 -16.948 -19.530 186 HB2 SER 25 1HB SER 25 -2.307 -15.890 -18.628 187 HB3 SER 25 2HB SER 25 -2.045 -17.333 -19.631 188 HG SER 25 HG SER 25 -2.300 -17.803 -17.379 189 H PHE 26 H PHE 26 0.959 -16.345 -21.551 190 HA PHE 26 HA PHE 26 -0.698 -14.259 -22.916 191 HB2 PHE 26 1HB PHE 26 1.358 -13.587 -24.129 192 HB3 PHE 26 2HB PHE 26 1.474 -13.279 -22.394 193 HD1 PHE 26 HD1 PHE 26 2.701 -15.409 -25.179 194 HD2 PHE 26 HD2 PHE 26 3.051 -14.468 -21.001 195 HE1 PHE 26 HE1 PHE 26 4.832 -16.695 -25.071 196 HE2 PHE 26 HE2 PHE 26 5.156 -15.775 -20.867 197 HZ PHE 26 HZ PHE 26 6.065 -16.884 -22.909 198 H ARG 27 H ARG 27 -0.645 -14.534 -25.338 199 HA ARG 27 HA ARG 27 -0.255 -17.417 -26.025 200 HB2 ARG 27 1HB ARG 27 -2.552 -15.622 -26.762 201 HB3 ARG 27 2HB ARG 27 -2.264 -17.206 -27.480 202 HG2 ARG 27 1HG ARG 27 -2.544 -18.307 -25.341 203 HG3 ARG 27 2HG ARG 27 -2.702 -16.750 -24.508 204 HD2 ARG 27 1HD ARG 27 -4.571 -17.642 -26.709 205 HD3 ARG 27 2HD ARG 27 -4.855 -17.975 -24.992 206 HE ARG 27 HE ARG 27 -5.080 -15.628 -24.557 207 HH11 ARG 27 1HH1 ARG 27 -4.875 -16.299 -28.025 208 HH12 ARG 27 2HH1 ARG 27 -5.523 -14.738 -28.445 209 HH21 ARG 27 1HH2 ARG 27 -5.860 -13.662 -25.188 210 HH22 ARG 27 2HH2 ARG 27 -6.074 -13.283 -26.870 211 H LYS 28 H LYS 28 0.156 -17.879 -28.194 212 HA LYS 28 HA LYS 28 1.883 -16.037 -29.530 213 HB2 LYS 28 1HB LYS 28 1.674 -17.588 -31.487 214 HB3 LYS 28 2HB LYS 28 2.113 -18.374 -29.977 215 HG2 LYS 28 1HG LYS 28 -0.406 -18.943 -29.738 216 HG3 LYS 28 2HG LYS 28 -0.511 -18.554 -31.463 217 HD2 LYS 28 1HD LYS 28 1.094 -20.281 -32.009 218 HD3 LYS 28 2HD LYS 28 1.525 -20.486 -30.303 219 HE2 LYS 28 1HE LYS 28 -1.078 -21.030 -30.064 220 HE3 LYS 28 2HE LYS 28 -0.896 -21.479 -31.774 221 HZ1 LYS 28 1HZ LYS 28 0.913 -22.976 -31.081 222 HZ2 LYS 28 2HZ LYS 28 -0.482 -23.356 -30.282 223 HZ3 LYS 28 3HZ LYS 28 0.713 -22.533 -29.497 224 H GLY 29 H GLY 29 1.518 -14.383 -30.819 225 HA2 GLY 29 1HA GLY 29 0.331 -13.152 -32.445 226 HA3 GLY 29 2HA GLY 29 -1.121 -14.100 -32.136 227 H ASP 30 H ASP 30 -0.357 -13.479 -29.078 228 HA ASP 30 HA ASP 30 -2.216 -11.237 -28.936 229 HB2 ASP 30 1HB ASP 30 -1.699 -13.322 -27.311 230 HB3 ASP 30 2HB ASP 30 -0.630 -12.133 -26.553 231 H ILE 31 H ILE 31 -1.738 -9.222 -27.794 232 HA ILE 31 HA ILE 31 1.095 -8.318 -28.254 233 HB ILE 31 HB ILE 31 -1.434 -6.611 -28.429 234 HG12 ILE 31 1HG1 ILE 31 -1.499 -8.213 -30.267 235 HG13 ILE 31 2HG1 ILE 31 -1.190 -6.582 -30.851 236 HG21 ILE 31 1HG2 ILE 31 0.499 -5.255 -27.863 237 HG22 ILE 31 2HG2 ILE 31 1.499 -6.031 -29.112 238 HG23 ILE 31 3HG2 ILE 31 0.144 -4.970 -29.577 239 HD11 ILE 31 1HD1 ILE 31 1.213 -7.136 -31.151 240 HD12 ILE 31 2HD1 ILE 31 0.880 -8.787 -30.573 241 HD13 ILE 31 3HD1 ILE 31 0.147 -8.211 -32.080 242 H MET 32 H MET 32 2.103 -7.472 -26.503 243 HA MET 32 HA MET 32 0.410 -6.486 -24.235 244 HB2 MET 32 1HB MET 32 1.913 -7.588 -22.645 245 HB3 MET 32 2HB MET 32 1.081 -8.742 -23.683 246 HG2 MET 32 1HG MET 32 3.409 -8.354 -25.089 247 HG3 MET 32 2HG MET 32 3.962 -8.199 -23.411 248 HE1 MET 32 1HE MET 32 1.152 -10.280 -25.304 249 HE2 MET 32 2HE MET 32 2.645 -10.532 -26.237 250 HE3 MET 32 3HE MET 32 1.916 -11.880 -25.337 251 H THR 33 H THR 33 1.637 -5.083 -22.737 252 HA THR 33 HA THR 33 3.618 -3.500 -24.311 253 HB THR 33 HB THR 33 2.078 -2.688 -21.813 254 HG1 THR 33 HG1 THR 33 0.720 -3.037 -23.635 255 HG21 THR 33 1HG2 THR 33 2.681 -0.402 -22.570 256 HG22 THR 33 2HG2 THR 33 3.683 -1.101 -23.858 257 HG23 THR 33 3HG2 THR 33 4.112 -1.366 -22.148 258 H VAL 34 H VAL 34 5.709 -3.474 -23.747 259 HA VAL 34 HA VAL 34 6.534 -4.940 -21.311 260 HB VAL 34 HB VAL 34 8.153 -3.568 -23.529 261 HG11 VAL 34 1HG1 VAL 34 10.079 -4.892 -22.550 262 HG12 VAL 34 2HG1 VAL 34 9.496 -3.567 -21.522 263 HG13 VAL 34 3HG1 VAL 34 9.043 -5.244 -21.148 264 HG21 VAL 34 1HG2 VAL 34 8.647 -5.817 -24.334 265 HG22 VAL 34 2HG2 VAL 34 7.759 -6.547 -22.979 266 HG23 VAL 34 3HG2 VAL 34 6.885 -5.633 -24.236 267 H LEU 35 H LEU 35 6.920 -3.978 -19.457 268 HA LEU 35 HA LEU 35 6.968 -1.005 -19.336 269 HB2 LEU 35 1HB LEU 35 6.800 -3.159 -17.198 270 HB3 LEU 35 2HB LEU 35 6.795 -1.434 -16.878 271 HG LEU 35 HG LEU 35 4.654 -2.928 -18.415 272 HD11 LEU 35 1HD1 LEU 35 3.286 -2.518 -16.403 273 HD12 LEU 35 2HD1 LEU 35 4.701 -1.801 -15.591 274 HD13 LEU 35 3HD1 LEU 35 4.706 -3.524 -16.043 275 HD21 LEU 35 1HD2 LEU 35 3.348 -0.819 -18.145 276 HD22 LEU 35 2HD2 LEU 35 4.778 -0.606 -19.168 277 HD23 LEU 35 3HD2 LEU 35 4.799 -0.030 -17.482 278 H GLU 36 H GLU 36 8.869 -3.899 -18.485 279 HA GLU 36 HA GLU 36 11.305 -2.221 -18.224 280 HB2 GLU 36 1HB GLU 36 9.999 -2.494 -16.007 281 HB3 GLU 36 2HB GLU 36 10.481 -4.190 -16.073 282 HG2 GLU 36 1HG GLU 36 12.835 -3.543 -15.992 283 HG3 GLU 36 2HG GLU 36 12.384 -1.830 -16.072 284 H ARG 37 H ARG 37 13.283 -3.699 -18.012 285 HA ARG 37 HA ARG 37 12.828 -6.436 -19.112 286 HB2 ARG 37 1HB ARG 37 14.890 -4.439 -20.131 287 HB3 ARG 37 2HB ARG 37 14.727 -6.122 -20.645 288 HG2 ARG 37 1HG ARG 37 12.420 -5.550 -21.493 289 HG3 ARG 37 2HG ARG 37 12.785 -3.850 -21.139 290 HD2 ARG 37 1HD ARG 37 14.821 -4.058 -22.581 291 HD3 ARG 37 2HD ARG 37 14.277 -5.688 -23.032 292 HE ARG 37 HE ARG 37 12.160 -3.835 -23.472 293 HH11 ARG 37 1HH1 ARG 37 15.284 -4.705 -24.859 294 HH12 ARG 37 2HH1 ARG 37 14.858 -4.111 -26.440 295 HH21 ARG 37 1HH2 ARG 37 11.679 -3.097 -25.513 296 HH22 ARG 37 2HH2 ARG 37 12.847 -3.216 -26.801 297 H ASP 38 H ASP 38 14.544 -7.869 -18.498 298 HA ASP 38 HA ASP 38 16.012 -8.757 -17.002 299 HB2 ASP 38 1HB ASP 38 17.490 -6.976 -18.146 300 HB3 ASP 38 2HB ASP 38 17.296 -6.039 -16.655 301 H THR 39 H THR 39 13.513 -7.808 -16.241 302 HA THR 39 HA THR 39 13.536 -6.163 -13.904 303 HB THR 39 HB THR 39 11.620 -6.491 -15.533 304 HG1 THR 39 HG1 THR 39 11.256 -5.594 -13.452 305 HG21 THR 39 1HG2 THR 39 11.161 -9.098 -14.016 306 HG22 THR 39 2HG2 THR 39 11.763 -8.997 -15.691 307 HG23 THR 39 3HG2 THR 39 10.138 -8.415 -15.288 308 H GLN 40 H GLN 40 14.245 -9.490 -14.320 309 HA GLN 40 HA GLN 40 13.690 -10.040 -11.438 310 HB2 GLN 40 1HB GLN 40 12.788 -11.384 -13.649 311 HB3 GLN 40 2HB GLN 40 14.260 -12.285 -13.295 312 HG2 GLN 40 1HG GLN 40 12.490 -13.403 -12.156 313 HG3 GLN 40 2HG GLN 40 13.417 -12.552 -10.912 314 HE21 GLN 40 1HE2 GLN 40 10.055 -11.779 -9.894 315 HE22 GLN 40 2HE2 GLN 40 11.316 -12.976 -9.737 316 H GLY 41 H GLY 41 16.208 -8.973 -13.174 317 HA2 GLY 41 1HA GLY 41 18.498 -9.124 -12.793 318 HA3 GLY 41 2HA GLY 41 18.196 -10.320 -11.508 319 H LEU 42 H LEU 42 16.675 -10.773 -14.536 320 HA LEU 42 HA LEU 42 18.692 -12.759 -15.442 321 HB2 LEU 42 1HB LEU 42 15.664 -13.078 -15.413 322 HB3 LEU 42 2HB LEU 42 16.793 -14.190 -16.177 323 HG LEU 42 HG LEU 42 16.640 -13.666 -13.189 324 HD11 LEU 42 1HD1 LEU 42 15.556 -15.975 -14.854 325 HD12 LEU 42 2HD1 LEU 42 14.584 -14.706 -14.072 326 HD13 LEU 42 3HD1 LEU 42 15.510 -15.848 -13.079 327 HD21 LEU 42 1HD2 LEU 42 18.124 -15.780 -14.807 328 HD22 LEU 42 2HD2 LEU 42 17.976 -15.756 -13.033 329 HD23 LEU 42 3HD2 LEU 42 18.853 -14.459 -13.861 330 H ASP 43 H ASP 43 19.392 -11.912 -17.352 331 HA ASP 43 HA ASP 43 17.837 -10.059 -18.897 332 HB2 ASP 43 1HB ASP 43 20.346 -10.275 -19.057 333 HB3 ASP 43 2HB ASP 43 20.107 -11.828 -19.876 334 H GLY 44 H GLY 44 16.813 -10.444 -20.868 335 HA2 GLY 44 1HA GLY 44 15.694 -11.807 -22.446 336 HA3 GLY 44 2HA GLY 44 16.132 -13.245 -21.512 337 H TRP 45 H TRP 45 15.039 -11.483 -19.040 338 HA TRP 45 HA TRP 45 12.188 -12.261 -19.564 339 HB2 TRP 45 1HB TRP 45 13.783 -11.950 -17.014 340 HB3 TRP 45 2HB TRP 45 12.014 -12.059 -17.040 341 HD1 TRP 45 HD1 TRP 45 15.136 -14.184 -17.703 342 HE1 TRP 45 HE1 TRP 45 14.516 -16.646 -17.832 343 HE3 TRP 45 HE3 TRP 45 10.055 -13.629 -17.611 344 HZ2 TRP 45 HZ2 TRP 45 12.110 -18.198 -17.905 345 HZ3 TRP 45 HZ3 TRP 45 8.616 -15.677 -17.701 346 HH2 TRP 45 HH2 TRP 45 9.649 -17.939 -17.854 347 H TRP 46 H TRP 46 10.653 -10.730 -19.747 348 HA TRP 46 HA TRP 46 11.421 -7.949 -18.969 349 HB2 TRP 46 1HB TRP 46 9.717 -8.866 -21.303 350 HB3 TRP 46 2HB TRP 46 10.094 -7.194 -20.891 351 HD1 TRP 46 HD1 TRP 46 13.348 -8.546 -20.390 352 HE1 TRP 46 HE1 TRP 46 14.850 -8.605 -22.430 353 HE3 TRP 46 HE3 TRP 46 9.718 -7.907 -23.923 354 HZ2 TRP 46 HZ2 TRP 46 14.528 -8.415 -25.259 355 HZ3 TRP 46 HZ3 TRP 46 10.382 -7.888 -26.333 356 HH2 TRP 46 HH2 TRP 46 12.778 -8.140 -26.985 357 H LEU 47 H LEU 47 9.875 -6.702 -17.961 358 HA LEU 47 HA LEU 47 7.581 -8.183 -16.823 359 HB2 LEU 47 1HB LEU 47 8.927 -6.586 -15.444 360 HB3 LEU 47 2HB LEU 47 8.477 -5.287 -16.536 361 HG LEU 47 HG LEU 47 6.090 -5.596 -15.875 362 HD11 LEU 47 1HD1 LEU 47 7.280 -7.530 -13.836 363 HD12 LEU 47 2HD1 LEU 47 6.124 -7.930 -15.129 364 HD13 LEU 47 3HD1 LEU 47 5.623 -6.886 -13.788 365 HD21 LEU 47 1HD2 LEU 47 7.523 -3.894 -14.826 366 HD22 LEU 47 2HD2 LEU 47 8.076 -5.082 -13.622 367 HD23 LEU 47 3HD2 LEU 47 6.374 -4.561 -13.646 368 H CYS 48 H CYS 48 5.704 -8.285 -17.942 369 HA CYS 48 HA CYS 48 5.095 -5.998 -19.777 370 HB2 CYS 48 1HB CYS 48 4.382 -8.918 -20.143 371 HB3 CYS 48 2HB CYS 48 4.034 -7.597 -21.268 372 HG CYS 48 HG CYS 48 6.952 -8.764 -20.263 373 H SER 49 H SER 49 2.763 -5.735 -20.241 374 HA SER 49 HA SER 49 1.047 -6.677 -17.978 375 HB2 SER 49 1HB SER 49 -0.229 -4.548 -18.287 376 HB3 SER 49 2HB SER 49 1.433 -4.312 -17.707 377 HG SER 49 HG SER 49 0.849 -2.884 -19.425 378 H LEU 50 H LEU 50 -0.585 -7.900 -18.531 379 HA LEU 50 HA LEU 50 -2.126 -7.548 -20.993 380 HB2 LEU 50 1HB LEU 50 -0.111 -8.835 -21.781 381 HB3 LEU 50 2HB LEU 50 -0.454 -10.057 -20.585 382 HG LEU 50 HG LEU 50 -2.576 -10.599 -21.776 383 HD11 LEU 50 1HD1 LEU 50 -1.494 -8.638 -23.822 384 HD12 LEU 50 2HD1 LEU 50 -3.004 -8.482 -22.909 385 HD13 LEU 50 3HD1 LEU 50 -2.829 -9.774 -24.111 386 HD21 LEU 50 1HD2 LEU 50 -1.492 -11.731 -23.657 387 HD22 LEU 50 2HD2 LEU 50 -0.562 -11.887 -22.150 388 HD23 LEU 50 3HD2 LEU 50 -0.036 -10.742 -23.403 389 H HIS 51 H HIS 51 -3.989 -9.180 -20.879 390 HA HIS 51 HA HIS 51 -5.549 -10.443 -19.784 391 HB2 HIS 51 1HB HIS 51 -3.128 -11.681 -19.525 392 HB3 HIS 51 2HB HIS 51 -3.622 -11.579 -17.835 393 HD1 HIS 51 HD1 HIS 51 -3.636 -13.989 -20.318 394 HD2 HIS 51 HD2 HIS 51 -6.676 -12.427 -17.917 395 HE1 HIS 51 HE1 HIS 51 -5.508 -15.702 -20.275 396 H GLY 52 H GLY 52 -4.652 -7.762 -18.421 397 HA2 GLY 52 1HA GLY 52 -5.681 -6.597 -16.683 398 HA3 GLY 52 2HA GLY 52 -6.431 -8.100 -16.129 399 H ARG 53 H ARG 53 -3.035 -8.380 -16.625 400 HA ARG 53 HA ARG 53 -2.426 -7.641 -13.809 401 HB2 ARG 53 1HB ARG 53 -1.337 -9.722 -13.347 402 HB3 ARG 53 2HB ARG 53 -2.974 -10.107 -13.880 403 HG2 ARG 53 1HG ARG 53 -2.187 -10.916 -16.005 404 HG3 ARG 53 2HG ARG 53 -0.596 -10.182 -15.775 405 HD2 ARG 53 1HD ARG 53 -0.275 -12.488 -15.403 406 HD3 ARG 53 2HD ARG 53 -0.235 -11.721 -13.806 407 HE ARG 53 HE ARG 53 -2.892 -12.547 -14.302 408 HH11 ARG 53 1HH1 ARG 53 0.270 -14.090 -13.773 409 HH12 ARG 53 2HH1 ARG 53 -0.457 -15.513 -13.088 410 HH21 ARG 53 1HH2 ARG 53 -3.717 -14.420 -13.433 411 HH22 ARG 53 2HH2 ARG 53 -2.657 -15.701 -12.912 412 H GLN 54 H GLN 54 -0.022 -7.689 -13.448 413 HA GLN 54 HA GLN 54 1.492 -7.311 -16.002 414 HB2 GLN 54 1HB GLN 54 2.130 -6.362 -13.183 415 HB3 GLN 54 2HB GLN 54 3.253 -6.297 -14.549 416 HG2 GLN 54 1HG GLN 54 2.437 -4.338 -15.154 417 HG3 GLN 54 2HG GLN 54 0.836 -5.049 -15.384 418 HE21 GLN 54 1HE2 GLN 54 1.602 -2.645 -12.232 419 HE22 GLN 54 2HE2 GLN 54 2.816 -3.029 -13.428 420 H GLY 55 H GLY 55 3.500 -8.572 -16.046 421 HA2 GLY 55 1HA GLY 55 4.163 -10.377 -13.926 422 HA3 GLY 55 2HA GLY 55 3.179 -11.222 -15.140 423 H ILE 56 H ILE 56 5.811 -11.979 -14.640 424 HA ILE 56 HA ILE 56 7.519 -10.646 -16.599 425 HB ILE 56 HB ILE 56 9.250 -12.221 -15.959 426 HG12 ILE 56 1HG1 ILE 56 7.171 -13.651 -14.260 427 HG13 ILE 56 2HG1 ILE 56 7.790 -14.258 -15.793 428 HG21 ILE 56 1HG2 ILE 56 8.623 -10.264 -14.453 429 HG22 ILE 56 2HG2 ILE 56 7.735 -11.418 -13.430 430 HG23 ILE 56 3HG2 ILE 56 9.489 -11.578 -13.649 431 HD11 ILE 56 1HD1 ILE 56 9.356 -13.879 -13.211 432 HD12 ILE 56 2HD1 ILE 56 8.949 -15.405 -14.026 433 HD13 ILE 56 3HD1 ILE 56 10.106 -14.284 -14.776 434 H VAL 57 H VAL 57 8.191 -11.334 -18.523 435 HA VAL 57 HA VAL 57 6.919 -13.775 -19.688 436 HB VAL 57 HB VAL 57 7.036 -10.970 -20.918 437 HG11 VAL 57 1HG1 VAL 57 6.121 -13.611 -22.087 438 HG12 VAL 57 2HG1 VAL 57 5.724 -12.034 -22.787 439 HG13 VAL 57 3HG1 VAL 57 7.417 -12.549 -22.674 440 HG21 VAL 57 1HG2 VAL 57 5.227 -11.117 -19.324 441 HG22 VAL 57 2HG2 VAL 57 4.550 -11.158 -20.964 442 HG23 VAL 57 3HG2 VAL 57 4.684 -12.662 -20.022 443 HA PRO 58 HA PRO 58 11.187 -13.808 -20.935 444 HB2 PRO 58 1HB PRO 58 11.239 -15.884 -22.718 445 HB3 PRO 58 2HB PRO 58 11.162 -16.132 -20.942 446 HG2 PRO 58 1HG PRO 58 8.936 -16.160 -22.954 447 HG3 PRO 58 2HG PRO 58 9.292 -17.332 -21.652 448 HD2 PRO 58 1HD PRO 58 7.427 -15.376 -21.417 449 HD3 PRO 58 2HD PRO 58 8.397 -15.949 -20.022 450 H GLY 59 H GLY 59 11.902 -12.249 -22.226 451 HA2 GLY 59 1HA GLY 59 10.405 -11.172 -24.419 452 HA3 GLY 59 2HA GLY 59 12.063 -10.769 -23.964 453 H ASN 60 H ASN 60 12.691 -13.761 -24.173 454 HA ASN 60 HA ASN 60 13.534 -13.763 -26.936 455 HB2 ASN 60 1HB ASN 60 14.633 -14.961 -24.966 456 HB3 ASN 60 2HB ASN 60 13.341 -16.165 -25.091 457 HD21 ASN 60 1HD2 ASN 60 15.264 -17.949 -27.363 458 HD22 ASN 60 2HD2 ASN 60 14.280 -17.930 -25.921 459 H ARG 61 H ARG 61 10.496 -14.259 -25.567 460 HA ARG 61 HA ARG 61 9.626 -15.919 -27.909 461 HB2 ARG 61 1HB ARG 61 8.308 -15.558 -25.186 462 HB3 ARG 61 2HB ARG 61 7.629 -16.462 -26.540 463 HG2 ARG 61 1HG ARG 61 9.697 -17.935 -26.458 464 HG3 ARG 61 2HG ARG 61 10.085 -17.153 -24.913 465 HD2 ARG 61 1HD ARG 61 7.809 -17.801 -24.075 466 HD3 ARG 61 2HD ARG 61 7.532 -18.677 -25.581 467 HE ARG 61 HE ARG 61 9.184 -19.501 -23.320 468 HH11 ARG 61 1HH1 ARG 61 8.483 -20.105 -26.738 469 HH12 ARG 61 2HH1 ARG 61 9.102 -21.732 -26.663 470 HH21 ARG 61 1HH2 ARG 61 9.958 -21.574 -23.315 471 HH22 ARG 61 2HH2 ARG 61 9.926 -22.542 -24.764 472 H LEU 62 H LEU 62 10.065 -12.843 -27.230 473 HA LEU 62 HA LEU 62 7.378 -11.982 -28.242 474 HB2 LEU 62 1HB LEU 62 9.349 -10.475 -26.487 475 HB3 LEU 62 2HB LEU 62 7.887 -9.798 -27.176 476 HG LEU 62 HG LEU 62 7.989 -11.968 -25.066 477 HD11 LEU 62 1HD1 LEU 62 7.003 -10.153 -23.626 478 HD12 LEU 62 2HD1 LEU 62 7.277 -9.002 -24.948 479 HD13 LEU 62 3HD1 LEU 62 8.653 -9.809 -24.162 480 HD21 LEU 62 1HD2 LEU 62 5.522 -11.466 -24.911 481 HD22 LEU 62 2HD2 LEU 62 6.031 -12.313 -26.371 482 HD23 LEU 62 3HD2 LEU 62 5.670 -10.569 -26.436 483 H LYS 63 H LYS 63 7.328 -10.394 -29.817 484 HA LYS 63 HA LYS 63 9.980 -9.636 -31.003 485 HB2 LYS 63 1HB LYS 63 8.800 -11.141 -32.523 486 HB3 LYS 63 2HB LYS 63 7.324 -10.181 -32.381 487 HG2 LYS 63 1HG LYS 63 8.362 -9.691 -34.503 488 HG3 LYS 63 2HG LYS 63 8.485 -8.265 -33.469 489 HD2 LYS 63 1HD LYS 63 10.853 -8.886 -32.933 490 HD3 LYS 63 2HD LYS 63 10.703 -10.279 -34.023 491 HE2 LYS 63 1HE LYS 63 11.793 -8.499 -35.239 492 HE3 LYS 63 2HE LYS 63 10.152 -8.679 -35.889 493 HZ1 LYS 63 1HZ LYS 63 11.093 -6.557 -34.034 494 HZ2 LYS 63 2HZ LYS 63 9.510 -6.766 -34.426 495 HZ3 LYS 63 3HZ LYS 63 10.605 -6.359 -35.594 496 H ILE 64 H ILE 64 10.378 -7.576 -30.720 497 HA ILE 64 HA ILE 64 8.581 -5.679 -29.634 498 HB ILE 64 HB ILE 64 11.118 -5.257 -31.304 499 HG12 ILE 64 1HG1 ILE 64 11.548 -6.600 -29.307 500 HG13 ILE 64 2HG1 ILE 64 12.265 -5.000 -29.149 501 HG21 ILE 64 1HG2 ILE 64 11.217 -3.030 -30.026 502 HG22 ILE 64 2HG2 ILE 64 10.005 -3.149 -31.309 503 HG23 ILE 64 3HG2 ILE 64 9.506 -3.302 -29.613 504 HD11 ILE 64 1HD1 ILE 64 11.290 -5.633 -27.015 505 HD12 ILE 64 2HD1 ILE 64 10.307 -4.317 -27.685 506 HD13 ILE 64 3HD1 ILE 64 9.727 -5.995 -27.766 507 H LEU 65 H LEU 65 7.153 -4.286 -30.448 508 HA LEU 65 HA LEU 65 6.423 -4.600 -33.293 509 HB2 LEU 65 1HB LEU 65 5.007 -4.330 -30.893 510 HB3 LEU 65 2HB LEU 65 4.828 -2.756 -31.655 511 HG LEU 65 HG LEU 65 4.027 -3.971 -33.741 512 HD11 LEU 65 1HD1 LEU 65 3.185 -6.286 -33.425 513 HD12 LEU 65 2HD1 LEU 65 3.927 -6.328 -31.809 514 HD13 LEU 65 3HD1 LEU 65 4.951 -6.206 -33.259 515 HD21 LEU 65 1HD2 LEU 65 2.478 -2.890 -32.176 516 HD22 LEU 65 2HD2 LEU 65 2.430 -4.365 -31.182 517 HD23 LEU 65 3HD2 LEU 65 1.773 -4.377 -32.836 518 H VAL 66 H VAL 66 5.230 -2.132 -33.768 519 HA VAL 66 HA VAL 66 7.431 -0.696 -34.800 520 HB VAL 66 HB VAL 66 5.749 1.031 -35.427 521 HG11 VAL 66 1HG1 VAL 66 4.397 -0.382 -36.878 522 HG12 VAL 66 2HG1 VAL 66 6.035 -1.062 -36.768 523 HG13 VAL 66 3HG1 VAL 66 4.699 -1.803 -35.857 524 HG21 VAL 66 1HG2 VAL 66 4.350 0.945 -33.350 525 HG22 VAL 66 2HG2 VAL 66 3.375 0.759 -34.821 526 HG23 VAL 66 3HG2 VAL 66 3.758 -0.662 -33.828 527 H GLY 67 H GLY 67 7.958 1.563 -34.540 528 HA2 GLY 67 1HA GLY 67 7.390 2.864 -31.993 529 HA3 GLY 67 2HA GLY 67 9.063 2.278 -32.157 530 H MET 68 H MET 68 8.917 4.931 -31.930 531 HA MET 68 HA MET 68 8.128 6.501 -34.098 532 HB2 MET 68 1HB MET 68 10.419 6.949 -32.158 533 HB3 MET 68 2HB MET 68 9.721 8.191 -33.204 534 HG2 MET 68 1HG MET 68 7.557 7.966 -32.065 535 HG3 MET 68 2HG MET 68 8.214 6.671 -31.048 536 HE1 MET 68 1HE MET 68 9.278 11.186 -30.723 537 HE2 MET 68 2HE MET 68 9.635 10.287 -32.215 538 HE3 MET 68 3HE MET 68 7.947 10.511 -31.692 539 H TYR 69 H TYR 69 11.181 4.718 -33.852 540 HA TYR 69 HA TYR 69 11.887 5.780 -36.550 541 HB2 TYR 69 1HB TYR 69 13.380 6.021 -34.030 542 HB3 TYR 69 2HB TYR 69 14.337 5.304 -35.325 543 HD1 TYR 69 HD1 TYR 69 13.143 8.388 -33.939 544 HD2 TYR 69 HD2 TYR 69 14.287 6.537 -37.654 545 HE1 TYR 69 HE1 TYR 69 13.507 10.642 -34.961 546 HE2 TYR 69 HE2 TYR 69 14.644 8.794 -38.663 547 HH TYR 69 HH TYR 69 14.566 11.055 -38.343 548 H ASP 70 H ASP 70 10.524 3.342 -35.609 549 HA ASP 70 HA ASP 70 12.376 1.118 -35.814 550 HB2 ASP 70 1HB ASP 70 10.109 1.024 -34.735 551 HB3 ASP 70 2HB ASP 70 9.386 1.167 -36.346 552 H LYS 71 H LYS 71 12.421 -0.434 -37.589 553 HA LYS 71 HA LYS 71 12.112 0.973 -40.225 554 HB2 LYS 71 1HB LYS 71 14.295 -0.902 -39.267 555 HB3 LYS 71 2HB LYS 71 14.114 -0.342 -40.942 556 HG2 LYS 71 1HG LYS 71 14.440 1.960 -40.273 557 HG3 LYS 71 2HG LYS 71 14.426 1.510 -38.562 558 HD2 LYS 71 1HD LYS 71 16.482 0.202 -38.872 559 HD3 LYS 71 2HD LYS 71 16.506 0.651 -40.593 560 HE2 LYS 71 1HE LYS 71 18.010 2.107 -39.282 561 HE3 LYS 71 2HE LYS 71 16.669 3.034 -39.984 562 HZ1 LYS 71 1HZ LYS 71 15.544 2.928 -37.819 563 HZ2 LYS 71 2HZ LYS 71 17.021 3.652 -37.678 564 HZ3 LYS 71 3HZ LYS 71 16.814 2.099 -37.167 565 H LYS 72 H LYS 72 10.539 0.150 -41.301 566 HA LYS 72 HA LYS 72 9.312 -2.348 -40.793 567 HB2 LYS 72 1HB LYS 72 9.303 -0.646 -43.315 568 HB3 LYS 72 2HB LYS 72 8.177 -1.967 -42.982 569 HG2 LYS 72 1HG LYS 72 7.308 -0.737 -41.022 570 HG3 LYS 72 2HG LYS 72 8.441 0.588 -41.357 571 HD2 LYS 72 1HD LYS 72 7.394 0.877 -43.600 572 HD3 LYS 72 2HD LYS 72 6.201 -0.371 -43.173 573 HE2 LYS 72 1HE LYS 72 5.451 0.997 -41.255 574 HE3 LYS 72 2HE LYS 72 6.661 2.233 -41.655 575 HZ1 LYS 72 1HZ LYS 72 5.528 2.567 -43.774 576 HZ2 LYS 72 2HZ LYS 72 4.484 2.816 -42.519 577 HZ3 LYS 72 3HZ LYS 72 4.400 1.423 -43.397 578 HA PRO 73 HA PRO 73 12.277 -4.832 -43.014 579 HB2 PRO 73 1HB PRO 73 11.066 -7.254 -42.937 580 HB3 PRO 73 2HB PRO 73 11.729 -6.507 -41.452 581 HG2 PRO 73 1HG PRO 73 8.898 -6.475 -42.484 582 HG3 PRO 73 2HG PRO 73 9.496 -6.954 -40.862 583 HD2 PRO 73 1HD PRO 73 8.531 -4.468 -41.352 584 HD3 PRO 73 2HD PRO 73 9.916 -4.733 -40.237 585 H ALA 74 H ALA 74 12.329 -6.210 -45.034 586 HA ALA 74 HA ALA 74 9.957 -5.998 -46.780 587 HB1 ALA 74 1HB ALA 74 12.707 -4.875 -47.530 588 HB2 ALA 74 2HB ALA 74 11.306 -5.009 -48.620 589 HB3 ALA 74 3HB ALA 74 11.244 -3.904 -47.227 590 H GLY 75 H GLY 75 10.194 -7.479 -48.620 591 HA2 GLY 75 1HA GLY 75 11.318 -9.292 -49.719 592 HA3 GLY 75 2HA GLY 75 12.371 -9.487 -48.305 593 H GLU 76 H GLU 76 9.109 -9.967 -49.589 594 HA GLU 76 HA GLU 76 7.388 -11.308 -49.018 595 HB2 GLU 76 1HB GLU 76 9.503 -13.140 -47.852 596 HB3 GLU 76 2HB GLU 76 7.887 -13.585 -48.414 597 HG2 GLU 76 1HG GLU 76 10.212 -12.589 -50.101 598 HG3 GLU 76 2HG GLU 76 9.497 -14.207 -50.110 599 H PHE 77 H PHE 77 8.100 -9.287 -47.025 600 HA PHE 77 HA PHE 77 6.868 -10.593 -44.639 601 HB2 PHE 77 1HB PHE 77 8.623 -8.118 -44.773 602 HB3 PHE 77 2HB PHE 77 7.813 -8.723 -43.323 603 HD1 PHE 77 HD1 PHE 77 10.892 -8.562 -44.828 604 HD2 PHE 77 HD2 PHE 77 8.277 -11.471 -43.054 605 HE1 PHE 77 HE1 PHE 77 12.851 -10.010 -44.350 606 HE2 PHE 77 HE2 PHE 77 10.230 -12.936 -42.566 607 HZ PHE 77 HZ PHE 77 12.527 -12.205 -43.214 608 H ILE 78 H ILE 78 5.003 -9.820 -43.890 609 HA ILE 78 HA ILE 78 3.733 -7.589 -45.403 610 HB ILE 78 HB ILE 78 2.484 -9.740 -43.613 611 HG12 ILE 78 1HG1 ILE 78 2.384 -9.453 -46.648 612 HG13 ILE 78 2HG1 ILE 78 3.460 -10.563 -45.799 613 HG21 ILE 78 1HG2 ILE 78 0.312 -8.902 -44.503 614 HG22 ILE 78 2HG2 ILE 78 1.174 -7.633 -43.634 615 HG23 ILE 78 3HG2 ILE 78 1.167 -7.636 -45.414 616 HD11 ILE 78 1HD1 ILE 78 0.421 -10.687 -45.867 617 HD12 ILE 78 2HD1 ILE 78 1.575 -11.830 -46.584 618 HD13 ILE 78 3HD1 ILE 78 1.437 -11.707 -44.816 619 H VAL 79 H VAL 79 3.385 -5.702 -44.371 620 HA VAL 79 HA VAL 79 4.188 -5.568 -41.500 621 HB VAL 79 HB VAL 79 4.889 -3.231 -41.999 622 HG11 VAL 79 1HG1 VAL 79 6.876 -3.792 -43.311 623 HG12 VAL 79 2HG1 VAL 79 6.486 -5.139 -42.223 624 HG13 VAL 79 3HG1 VAL 79 6.093 -5.248 -43.954 625 HG21 VAL 79 1HG2 VAL 79 3.295 -2.776 -43.884 626 HG22 VAL 79 2HG2 VAL 79 4.976 -2.405 -44.317 627 HG23 VAL 79 3HG2 VAL 79 4.222 -3.893 -44.916 628 H THR 80 H THR 80 1.392 -5.955 -42.735 629 HA THR 80 HA THR 80 -0.023 -3.497 -42.017 630 HB THR 80 HB THR 80 -2.066 -4.926 -42.352 631 HG1 THR 80 HG1 THR 80 -0.967 -6.892 -41.663 632 HG21 THR 80 1HG2 THR 80 -0.995 -3.791 -44.303 633 HG22 THR 80 2HG2 THR 80 -1.782 -5.323 -44.744 634 HG23 THR 80 3HG2 THR 80 -0.017 -5.253 -44.586 635 H ASP 81 H ASP 81 -1.418 -3.229 -40.248 636 HA ASP 81 HA ASP 81 -0.744 -4.800 -37.837 637 HB2 ASP 81 1HB ASP 81 -0.817 -2.319 -37.657 638 HB3 ASP 81 2HB ASP 81 -2.506 -2.324 -38.183 639 HXT ASP 81 H02 ASP 81 -4.524 -5.214 -38.657 Start of MODEL 21 1 H2 GLY 1 2H0 GLY 1 4.229 0.673 -15.519 2 H GLY 1 1H0 GLY 1 5.188 1.003 -16.793 3 HA2 GLY 1 1HA GLY 1 5.872 1.626 -13.971 4 HA3 GLY 1 2HA GLY 1 6.847 2.054 -15.400 5 H SER 2 H SER 2 6.691 4.208 -14.425 6 HA SER 2 HA SER 2 4.450 5.687 -15.672 7 HB2 SER 2 1HB SER 2 5.120 5.883 -12.698 8 HB3 SER 2 2HB SER 2 4.035 6.980 -13.585 9 HG SER 2 HG SER 2 3.444 4.324 -13.948 10 H MET 3 H MET 3 4.969 8.040 -15.639 11 HA MET 3 HA MET 3 6.383 9.733 -16.198 12 HB2 MET 3 1HB MET 3 6.536 9.484 -13.651 13 HB3 MET 3 2HB MET 3 8.134 8.786 -13.922 14 HG2 MET 3 1HG MET 3 8.371 11.135 -13.423 15 HG3 MET 3 2HG MET 3 8.791 10.883 -15.128 16 HE1 MET 3 1HE MET 3 8.075 13.823 -13.868 17 HE2 MET 3 2HE MET 3 8.557 13.516 -15.553 18 HE3 MET 3 3HE MET 3 7.086 14.457 -15.205 19 H LYS 4 H LYS 4 6.874 8.470 -18.175 20 HA LYS 4 HA LYS 4 8.317 7.948 -19.851 21 HB2 LYS 4 1HB LYS 4 9.325 10.122 -18.996 22 HB3 LYS 4 2HB LYS 4 10.553 9.134 -18.196 23 HG2 LYS 4 1HG LYS 4 11.116 8.162 -20.458 24 HG3 LYS 4 2HG LYS 4 10.006 9.336 -21.187 25 HD2 LYS 4 1HD LYS 4 11.327 11.189 -20.306 26 HD3 LYS 4 2HD LYS 4 12.375 10.064 -19.416 27 HE2 LYS 4 1HE LYS 4 12.083 10.147 -22.442 28 HE3 LYS 4 2HE LYS 4 13.405 10.898 -21.523 29 HZ1 LYS 4 1HZ LYS 4 12.778 7.996 -21.505 30 HZ2 LYS 4 2HZ LYS 4 14.034 8.712 -20.718 31 HZ3 LYS 4 3HZ LYS 4 14.001 8.696 -22.369 32 H TYR 5 H TYR 5 7.739 5.768 -18.707 33 HA TYR 5 HA TYR 5 10.207 4.208 -18.153 34 HB2 TYR 5 1HB TYR 5 8.677 2.344 -17.745 35 HB3 TYR 5 2HB TYR 5 8.210 3.741 -16.770 36 HD1 TYR 5 HD1 TYR 5 6.234 5.206 -17.594 37 HD2 TYR 5 HD2 TYR 5 7.113 1.309 -19.198 38 HE1 TYR 5 HE1 TYR 5 3.927 5.069 -18.535 39 HE2 TYR 5 HE2 TYR 5 4.805 1.190 -20.145 40 HH TYR 5 HH TYR 5 2.862 2.420 -20.609 41 H LEU 6 H LEU 6 9.911 1.923 -19.562 42 HA LEU 6 HA LEU 6 10.748 2.649 -22.125 43 HB2 LEU 6 1HB LEU 6 9.446 0.052 -21.238 44 HB3 LEU 6 2HB LEU 6 10.349 0.269 -22.735 45 HG LEU 6 HG LEU 6 11.524 0.534 -19.944 46 HD11 LEU 6 1HD1 LEU 6 12.516 -1.645 -20.387 47 HD12 LEU 6 2HD1 LEU 6 11.726 -1.708 -21.985 48 HD13 LEU 6 3HD1 LEU 6 10.748 -1.738 -20.503 49 HD21 LEU 6 1HD2 LEU 6 13.708 0.399 -21.135 50 HD22 LEU 6 2HD2 LEU 6 12.802 1.848 -21.577 51 HD23 LEU 6 3HD2 LEU 6 12.858 0.464 -22.691 52 H ASN 7 H ASN 7 7.520 1.414 -21.259 53 HA ASN 7 HA ASN 7 5.566 1.313 -22.415 54 HB2 ASN 7 1HB ASN 7 5.897 3.772 -21.812 55 HB3 ASN 7 2HB ASN 7 6.307 4.029 -23.515 56 HD21 ASN 7 1HD2 ASN 7 2.934 4.552 -24.176 57 HD22 ASN 7 2HD2 ASN 7 4.586 5.113 -24.273 58 H VAL 8 H VAL 8 7.342 -0.170 -23.851 59 HA VAL 8 HA VAL 8 6.587 0.463 -26.677 60 HB VAL 8 HB VAL 8 8.417 -1.101 -27.324 61 HG11 VAL 8 1HG1 VAL 8 9.436 1.182 -25.594 62 HG12 VAL 8 2HG1 VAL 8 10.287 0.417 -26.956 63 HG13 VAL 8 3HG1 VAL 8 8.809 1.350 -27.247 64 HG21 VAL 8 1HG2 VAL 8 8.580 -2.465 -25.305 65 HG22 VAL 8 2HG2 VAL 8 10.154 -1.746 -25.683 66 HG23 VAL 8 3HG2 VAL 8 9.168 -1.063 -24.369 67 H LEU 9 H LEU 9 6.181 -1.755 -27.862 68 HA LEU 9 HA LEU 9 4.959 -3.691 -25.965 69 HB2 LEU 9 1HB LEU 9 2.927 -3.788 -27.382 70 HB3 LEU 9 2HB LEU 9 3.112 -2.276 -26.511 71 HG LEU 9 HG LEU 9 4.219 -2.212 -29.248 72 HD11 LEU 9 1HD1 LEU 9 1.232 -2.542 -28.772 73 HD12 LEU 9 2HD1 LEU 9 2.290 -3.662 -29.663 74 HD13 LEU 9 3HD1 LEU 9 1.988 -2.033 -30.298 75 HD21 LEU 9 1HD2 LEU 9 3.148 -0.029 -29.216 76 HD22 LEU 9 2HD2 LEU 9 3.975 -0.284 -27.665 77 HD23 LEU 9 3HD2 LEU 9 2.213 -0.465 -27.760 78 H ALA 10 H ALA 10 4.287 -5.683 -27.075 79 HA ALA 10 HA ALA 10 5.897 -6.267 -29.498 80 HB1 ALA 10 1HB ALA 10 7.036 -8.127 -28.380 81 HB2 ALA 10 2HB ALA 10 7.368 -6.630 -27.489 82 HB3 ALA 10 3HB ALA 10 6.166 -7.781 -26.868 83 H LYS 11 H LYS 11 5.461 -8.475 -30.286 84 HA LYS 11 HA LYS 11 2.727 -9.424 -29.480 85 HB2 LYS 11 1HB LYS 11 2.855 -8.536 -31.824 86 HB3 LYS 11 2HB LYS 11 4.115 -9.734 -32.173 87 HG2 LYS 11 1HG LYS 11 2.509 -11.559 -31.686 88 HG3 LYS 11 2HG LYS 11 1.277 -10.370 -31.282 89 HD2 LYS 11 1HD LYS 11 0.750 -11.037 -33.454 90 HD3 LYS 11 2HD LYS 11 1.563 -9.474 -33.668 91 HE2 LYS 11 1HE LYS 11 3.651 -10.617 -34.258 92 HE3 LYS 11 2HE LYS 11 2.910 -12.195 -33.904 93 HZ1 LYS 11 1HZ LYS 11 1.353 -11.825 -35.701 94 HZ2 LYS 11 2HZ LYS 11 2.894 -11.695 -36.279 95 HZ3 LYS 11 3HZ LYS 11 1.988 -10.339 -36.030 96 H ALA 12 H ALA 12 2.582 -11.516 -28.846 97 HA ALA 12 HA ALA 12 5.058 -12.963 -28.359 98 HB1 ALA 12 1HB ALA 12 3.294 -13.258 -26.804 99 HB2 ALA 12 2HB ALA 12 2.124 -13.646 -28.084 100 HB3 ALA 12 3HB ALA 12 3.430 -14.784 -27.682 101 H LEU 13 H LEU 13 6.003 -14.507 -29.472 102 HA LEU 13 HA LEU 13 4.971 -15.120 -32.187 103 HB2 LEU 13 1HB LEU 13 7.529 -15.874 -30.730 104 HB3 LEU 13 2HB LEU 13 7.189 -16.242 -32.414 105 HG LEU 13 HG LEU 13 7.430 -13.421 -31.304 106 HD11 LEU 13 1HD1 LEU 13 9.661 -13.426 -32.356 107 HD12 LEU 13 2HD1 LEU 13 9.453 -15.139 -32.799 108 HD13 LEU 13 3HD1 LEU 13 9.544 -14.656 -31.084 109 HD21 LEU 13 1HD2 LEU 13 7.312 -14.523 -34.148 110 HD22 LEU 13 2HD2 LEU 13 7.689 -12.846 -33.729 111 HD23 LEU 13 3HD2 LEU 13 6.088 -13.503 -33.346 112 H TYR 14 H TYR 14 5.438 -16.532 -29.016 113 HA TYR 14 HA TYR 14 4.257 -19.106 -29.974 114 HB2 TYR 14 1HB TYR 14 6.315 -18.848 -27.761 115 HB3 TYR 14 2HB TYR 14 5.748 -20.325 -28.551 116 HD1 TYR 14 HD1 TYR 14 8.164 -17.626 -28.590 117 HD2 TYR 14 HD2 TYR 14 6.430 -20.707 -31.030 118 HE1 TYR 14 HE1 TYR 14 10.082 -17.449 -30.164 119 HE2 TYR 14 HE2 TYR 14 8.347 -20.517 -32.619 120 HH TYR 14 HH TYR 14 10.353 -19.490 -33.070 121 H ASP 15 H ASP 15 3.041 -20.226 -28.195 122 HA ASP 15 HA ASP 15 1.812 -18.208 -26.420 123 HB2 ASP 15 1HB ASP 15 0.255 -20.120 -25.843 124 HB3 ASP 15 2HB ASP 15 0.198 -19.564 -27.519 125 H ASN 16 H ASN 16 1.557 -18.525 -24.174 126 HA ASN 16 HA ASN 16 3.400 -20.411 -22.851 127 HB2 ASN 16 1HB ASN 16 4.664 -18.278 -23.507 128 HB3 ASN 16 2HB ASN 16 3.615 -17.410 -22.391 129 HD21 ASN 16 1HD2 ASN 16 5.101 -18.971 -19.468 130 HD22 ASN 16 2HD2 ASN 16 3.545 -18.473 -20.106 131 H VAL 17 H VAL 17 1.410 -21.272 -21.999 132 HA VAL 17 HA VAL 17 -0.342 -19.498 -20.437 133 HB VAL 17 HB VAL 17 -0.165 -22.560 -20.523 134 HG11 VAL 17 1HG1 VAL 17 -2.292 -20.715 -19.326 135 HG12 VAL 17 2HG1 VAL 17 -2.402 -22.488 -19.439 136 HG13 VAL 17 3HG1 VAL 17 -1.162 -21.745 -18.411 137 HG21 VAL 17 1HG2 VAL 17 -0.848 -21.657 -22.702 138 HG22 VAL 17 2HG2 VAL 17 -2.249 -22.395 -21.905 139 HG23 VAL 17 3HG2 VAL 17 -2.072 -20.622 -21.924 140 H ALA 18 H ALA 18 0.220 -18.832 -18.447 141 HA ALA 18 HA ALA 18 2.806 -19.507 -17.436 142 HB1 ALA 18 1HB ALA 18 1.916 -17.275 -17.119 143 HB2 ALA 18 2HB ALA 18 0.494 -17.916 -16.245 144 HB3 ALA 18 3HB ALA 18 2.108 -18.024 -15.522 145 H GLU 19 H GLU 19 3.452 -20.600 -15.665 146 HA GLU 19 HA GLU 19 1.368 -22.307 -14.330 147 HB2 GLU 19 1HB GLU 19 3.106 -23.937 -13.917 148 HB3 GLU 19 2HB GLU 19 3.007 -23.583 -15.641 149 HG2 GLU 19 1HG GLU 19 4.993 -22.073 -15.404 150 HG3 GLU 19 2HG GLU 19 5.118 -22.560 -13.708 151 H SER 20 H SER 20 3.721 -19.806 -13.956 152 HA SER 20 HA SER 20 3.645 -20.122 -10.976 153 HB2 SER 20 1HB SER 20 5.410 -18.425 -12.774 154 HB3 SER 20 2HB SER 20 5.501 -18.466 -11.002 155 HG SER 20 HG SER 20 5.808 -20.716 -12.716 156 HA PRO 21 HA PRO 21 0.833 -16.779 -10.938 157 HB2 PRO 21 1HB PRO 21 1.171 -15.613 -8.495 158 HB3 PRO 21 2HB PRO 21 0.499 -17.266 -8.682 159 HG2 PRO 21 1HG PRO 21 3.333 -16.443 -8.078 160 HG3 PRO 21 2HG PRO 21 2.293 -17.621 -7.216 161 HD2 PRO 21 1HD PRO 21 4.103 -18.414 -9.062 162 HD3 PRO 21 2HD PRO 21 2.509 -19.233 -8.900 163 H ASP 22 H ASP 22 4.223 -16.056 -10.392 164 HA ASP 22 HA ASP 22 3.944 -13.164 -10.665 165 HB2 ASP 22 1HB ASP 22 6.353 -15.019 -10.805 166 HB3 ASP 22 2HB ASP 22 6.434 -13.249 -10.742 167 H GLU 23 H GLU 23 3.979 -15.849 -12.734 168 HA GLU 23 HA GLU 23 5.290 -14.548 -15.016 169 HB2 GLU 23 1HB GLU 23 5.589 -16.944 -14.320 170 HB3 GLU 23 2HB GLU 23 3.900 -17.217 -14.731 171 HG2 GLU 23 1HG GLU 23 4.435 -16.523 -17.079 172 HG3 GLU 23 2HG GLU 23 6.143 -16.452 -16.591 173 H LEU 24 H LEU 24 4.252 -13.835 -16.882 174 HA LEU 24 HA LEU 24 1.336 -13.469 -16.573 175 HB2 LEU 24 1HB LEU 24 3.396 -11.944 -17.665 176 HB3 LEU 24 2HB LEU 24 2.511 -12.532 -19.071 177 HG LEU 24 HG LEU 24 1.322 -10.993 -16.747 178 HD11 LEU 24 1HD1 LEU 24 1.166 -9.161 -18.321 179 HD12 LEU 24 2HD1 LEU 24 1.864 -10.170 -19.614 180 HD13 LEU 24 3HD1 LEU 24 2.847 -9.713 -18.204 181 HD21 LEU 24 1HD2 LEU 24 0.064 -11.995 -19.330 182 HD22 LEU 24 2HD2 LEU 24 -0.681 -10.790 -18.248 183 HD23 LEU 24 3HD2 LEU 24 -0.388 -12.442 -17.667 184 H SER 25 H SER 25 -0.115 -14.781 -17.462 185 HA SER 25 HA SER 25 0.673 -16.795 -19.438 186 HB2 SER 25 1HB SER 25 -1.018 -17.318 -17.708 187 HB3 SER 25 2HB SER 25 -2.051 -16.009 -18.314 188 HG SER 25 HG SER 25 -2.253 -17.121 -20.257 189 H PHE 26 H PHE 26 0.765 -16.412 -21.564 190 HA PHE 26 HA PHE 26 -1.247 -14.600 -22.812 191 HB2 PHE 26 1HB PHE 26 0.468 -13.460 -24.139 192 HB3 PHE 26 2HB PHE 26 0.704 -13.159 -22.414 193 HD1 PHE 26 HD1 PHE 26 2.654 -13.975 -21.244 194 HD2 PHE 26 HD2 PHE 26 2.050 -14.923 -25.394 195 HE1 PHE 26 HE1 PHE 26 4.999 -14.756 -21.398 196 HE2 PHE 26 HE2 PHE 26 4.428 -15.680 -25.570 197 HZ PHE 26 HZ PHE 26 5.908 -15.590 -23.575 198 H ARG 27 H ARG 27 -1.084 -14.867 -25.305 199 HA ARG 27 HA ARG 27 -0.116 -17.625 -25.919 200 HB2 ARG 27 1HB ARG 27 -2.823 -16.465 -26.627 201 HB3 ARG 27 2HB ARG 27 -2.168 -17.971 -27.299 202 HG2 ARG 27 1HG ARG 27 -1.910 -18.825 -24.930 203 HG3 ARG 27 2HG ARG 27 -2.781 -17.392 -24.369 204 HD2 ARG 27 1HD ARG 27 -4.745 -18.068 -25.690 205 HD3 ARG 27 2HD ARG 27 -3.857 -19.506 -26.259 206 HE ARG 27 HE ARG 27 -3.788 -19.404 -23.406 207 HH11 ARG 27 1HH1 ARG 27 -6.066 -20.123 -25.995 208 HH12 ARG 27 2HH1 ARG 27 -7.018 -21.183 -24.991 209 HH21 ARG 27 1HH2 ARG 27 -5.029 -20.779 -22.186 210 HH22 ARG 27 2HH2 ARG 27 -6.427 -21.558 -22.871 211 H LYS 28 H LYS 28 0.028 -18.055 -28.305 212 HA LYS 28 HA LYS 28 1.735 -16.082 -29.441 213 HB2 LYS 28 1HB LYS 28 1.594 -17.488 -31.513 214 HB3 LYS 28 2HB LYS 28 2.023 -18.363 -30.055 215 HG2 LYS 28 1HG LYS 28 -0.389 -19.104 -29.869 216 HG3 LYS 28 2HG LYS 28 -0.637 -18.439 -31.495 217 HD2 LYS 28 1HD LYS 28 1.091 -19.931 -32.384 218 HD3 LYS 28 2HD LYS 28 1.481 -20.486 -30.744 219 HE2 LYS 28 1HE LYS 28 -0.964 -21.236 -30.571 220 HE3 LYS 28 2HE LYS 28 -1.044 -21.013 -32.332 221 HZ1 LYS 28 1HZ LYS 28 0.835 -22.777 -30.851 222 HZ2 LYS 28 2HZ LYS 28 0.836 -22.581 -32.496 223 HZ3 LYS 28 3HZ LYS 28 -0.455 -23.286 -31.757 224 H GLY 29 H GLY 29 1.446 -14.445 -30.785 225 HA2 GLY 29 1HA GLY 29 0.302 -13.146 -32.384 226 HA3 GLY 29 2HA GLY 29 -1.179 -14.073 -32.101 227 H ASP 30 H ASP 30 -0.399 -13.562 -29.045 228 HA ASP 30 HA ASP 30 -2.249 -11.350 -28.778 229 HB2 ASP 30 1HB ASP 30 -1.738 -13.450 -27.260 230 HB3 ASP 30 2HB ASP 30 -0.546 -12.372 -26.519 231 H ILE 31 H ILE 31 -1.806 -9.395 -27.540 232 HA ILE 31 HA ILE 31 0.922 -8.302 -28.167 233 HB ILE 31 HB ILE 31 -1.753 -6.806 -28.009 234 HG12 ILE 31 1HG1 ILE 31 -1.767 -8.305 -29.946 235 HG13 ILE 31 2HG1 ILE 31 -1.724 -6.613 -30.426 236 HG21 ILE 31 1HG2 ILE 31 0.086 -5.304 -27.470 237 HG22 ILE 31 2HG2 ILE 31 1.044 -5.885 -28.849 238 HG23 ILE 31 3HG2 ILE 31 -0.440 -4.934 -29.126 239 HD11 ILE 31 1HD1 ILE 31 0.624 -6.776 -31.020 240 HD12 ILE 31 2HD1 ILE 31 0.702 -8.431 -30.371 241 HD13 ILE 31 3HD1 ILE 31 -0.278 -8.090 -31.812 242 H MET 32 H MET 32 2.086 -7.588 -26.474 243 HA MET 32 HA MET 32 0.606 -6.702 -24.035 244 HB2 MET 32 1HB MET 32 2.334 -7.677 -22.619 245 HB3 MET 32 2HB MET 32 1.497 -8.908 -23.539 246 HG2 MET 32 1HG MET 32 4.216 -7.799 -24.288 247 HG3 MET 32 2HG MET 32 3.973 -9.248 -23.310 248 HE1 MET 32 1HE MET 32 3.109 -11.641 -24.323 249 HE2 MET 32 2HE MET 32 1.586 -10.754 -24.569 250 HE3 MET 32 3HE MET 32 2.266 -11.712 -25.892 251 H THR 33 H THR 33 1.483 -5.071 -22.850 252 HA THR 33 HA THR 33 3.439 -3.374 -24.300 253 HB THR 33 HB THR 33 2.040 -2.869 -21.635 254 HG1 THR 33 HG1 THR 33 0.606 -1.619 -22.945 255 HG21 THR 33 1HG2 THR 33 2.502 -0.494 -22.155 256 HG22 THR 33 2HG2 THR 33 3.331 -0.976 -23.646 257 HG23 THR 33 3HG2 THR 33 4.010 -1.423 -22.069 258 H VAL 34 H VAL 34 5.567 -3.265 -23.733 259 HA VAL 34 HA VAL 34 6.448 -4.917 -21.389 260 HB VAL 34 HB VAL 34 8.025 -3.667 -23.678 261 HG11 VAL 34 1HG1 VAL 34 8.976 -5.294 -21.290 262 HG12 VAL 34 2HG1 VAL 34 9.957 -5.018 -22.743 263 HG13 VAL 34 3HG1 VAL 34 9.463 -3.646 -21.732 264 HG21 VAL 34 1HG2 VAL 34 7.588 -6.609 -23.022 265 HG22 VAL 34 2HG2 VAL 34 6.647 -5.714 -24.241 266 HG23 VAL 34 3HG2 VAL 34 8.397 -5.934 -24.455 267 H LEU 35 H LEU 35 6.936 -3.987 -19.554 268 HA LEU 35 HA LEU 35 6.938 -1.020 -19.455 269 HB2 LEU 35 1HB LEU 35 6.783 -3.053 -17.214 270 HB3 LEU 35 2HB LEU 35 6.456 -1.332 -17.097 271 HG LEU 35 HG LEU 35 4.789 -3.380 -18.616 272 HD11 LEU 35 1HD1 LEU 35 4.638 -3.689 -16.229 273 HD12 LEU 35 2HD1 LEU 35 3.144 -2.927 -16.804 274 HD13 LEU 35 3HD1 LEU 35 4.373 -1.947 -15.973 275 HD21 LEU 35 1HD2 LEU 35 4.593 -1.192 -19.690 276 HD22 LEU 35 2HD2 LEU 35 4.268 -0.419 -18.117 277 HD23 LEU 35 3HD2 LEU 35 3.102 -1.577 -18.810 278 H GLU 36 H GLU 36 8.843 -3.857 -18.425 279 HA GLU 36 HA GLU 36 11.244 -2.143 -18.134 280 HB2 GLU 36 1HB GLU 36 10.073 -2.234 -15.913 281 HB3 GLU 36 2HB GLU 36 10.220 -3.991 -15.938 282 HG2 GLU 36 1HG GLU 36 11.916 -2.906 -14.499 283 HG3 GLU 36 2HG GLU 36 12.638 -3.850 -15.807 284 H ARG 37 H ARG 37 13.244 -3.515 -17.982 285 HA ARG 37 HA ARG 37 12.837 -6.320 -18.996 286 HB2 ARG 37 1HB ARG 37 14.898 -4.305 -19.969 287 HB3 ARG 37 2HB ARG 37 14.863 -6.021 -20.396 288 HG2 ARG 37 1HG ARG 37 12.564 -5.622 -21.371 289 HG3 ARG 37 2HG ARG 37 12.857 -3.892 -21.152 290 HD2 ARG 37 1HD ARG 37 15.163 -5.078 -22.395 291 HD3 ARG 37 2HD ARG 37 13.720 -5.576 -23.290 292 HE ARG 37 HE ARG 37 14.810 -2.860 -23.010 293 HH11 ARG 37 1HH1 ARG 37 12.069 -4.801 -24.086 294 HH12 ARG 37 2HH1 ARG 37 11.464 -3.543 -25.133 295 HH21 ARG 37 1HH2 ARG 37 13.972 -1.288 -24.340 296 HH22 ARG 37 2HH2 ARG 37 12.514 -1.573 -25.248 297 H ASP 38 H ASP 38 14.571 -7.748 -18.388 298 HA ASP 38 HA ASP 38 15.894 -8.694 -16.801 299 HB2 ASP 38 1HB ASP 38 17.519 -6.995 -17.823 300 HB3 ASP 38 2HB ASP 38 17.235 -6.015 -16.377 301 H THR 39 H THR 39 13.421 -7.906 -16.102 302 HA THR 39 HA THR 39 13.283 -6.153 -13.865 303 HB THR 39 HB THR 39 11.414 -6.595 -15.438 304 HG1 THR 39 HG1 THR 39 11.130 -7.006 -12.659 305 HG21 THR 39 1HG2 THR 39 11.718 -9.067 -15.698 306 HG22 THR 39 2HG2 THR 39 10.066 -8.644 -15.218 307 HG23 THR 39 3HG2 THR 39 11.186 -9.290 -14.011 308 H GLN 40 H GLN 40 14.455 -9.317 -13.935 309 HA GLN 40 HA GLN 40 13.866 -9.632 -11.032 310 HB2 GLN 40 1HB GLN 40 12.454 -10.993 -12.835 311 HB3 GLN 40 2HB GLN 40 13.870 -12.047 -12.817 312 HG2 GLN 40 1HG GLN 40 13.585 -12.423 -10.414 313 HG3 GLN 40 2HG GLN 40 12.274 -11.232 -10.353 314 HE21 GLN 40 1HE2 GLN 40 9.995 -13.834 -10.721 315 HE22 GLN 40 2HE2 GLN 40 10.565 -12.475 -9.785 316 H GLY 41 H GLY 41 16.327 -9.014 -12.996 317 HA2 GLY 41 1HA GLY 41 18.602 -9.363 -12.629 318 HA3 GLY 41 2HA GLY 41 18.222 -10.573 -11.380 319 H LEU 42 H LEU 42 16.534 -10.890 -14.314 320 HA LEU 42 HA LEU 42 18.424 -12.951 -15.352 321 HB2 LEU 42 1HB LEU 42 15.374 -12.968 -15.384 322 HB3 LEU 42 2HB LEU 42 16.409 -14.154 -16.176 323 HG LEU 42 HG LEU 42 16.235 -13.720 -13.171 324 HD11 LEU 42 1HD1 LEU 42 14.928 -15.810 -13.169 325 HD12 LEU 42 2HD1 LEU 42 14.993 -15.859 -14.954 326 HD13 LEU 42 3HD1 LEU 42 14.125 -14.543 -14.119 327 HD21 LEU 42 1HD2 LEU 42 17.569 -15.913 -14.831 328 HD22 LEU 42 2HD2 LEU 42 17.393 -15.915 -13.061 329 HD23 LEU 42 3HD2 LEU 42 18.393 -14.685 -13.840 330 H ASP 43 H ASP 43 19.293 -11.949 -17.106 331 HA ASP 43 HA ASP 43 17.948 -9.868 -18.534 332 HB2 ASP 43 1HB ASP 43 20.457 -10.273 -18.526 333 HB3 ASP 43 2HB ASP 43 20.168 -11.636 -19.617 334 H GLY 44 H GLY 44 16.898 -9.926 -20.469 335 HA2 GLY 44 1HA GLY 44 15.781 -10.943 -22.283 336 HA3 GLY 44 2HA GLY 44 16.195 -12.543 -21.644 337 H TRP 45 H TRP 45 15.074 -11.434 -18.876 338 HA TRP 45 HA TRP 45 12.248 -12.128 -19.563 339 HB2 TRP 45 1HB TRP 45 13.805 -11.994 -16.978 340 HB3 TRP 45 2HB TRP 45 12.042 -12.057 -16.999 341 HD1 TRP 45 HD1 TRP 45 15.076 -14.212 -17.966 342 HE1 TRP 45 HE1 TRP 45 14.382 -16.656 -18.114 343 HE3 TRP 45 HE3 TRP 45 10.036 -13.541 -17.403 344 HZ2 TRP 45 HZ2 TRP 45 11.943 -18.148 -18.019 345 HZ3 TRP 45 HZ3 TRP 45 8.546 -15.550 -17.432 346 HH2 TRP 45 HH2 TRP 45 9.501 -17.830 -17.746 347 H TRP 46 H TRP 46 10.675 -10.640 -19.654 348 HA TRP 46 HA TRP 46 11.433 -7.868 -18.794 349 HB2 TRP 46 1HB TRP 46 9.627 -8.765 -21.059 350 HB3 TRP 46 2HB TRP 46 10.055 -7.102 -20.669 351 HD1 TRP 46 HD1 TRP 46 13.301 -8.495 -20.307 352 HE1 TRP 46 HE1 TRP 46 14.702 -8.587 -22.425 353 HE3 TRP 46 HE3 TRP 46 9.504 -7.880 -23.669 354 HZ2 TRP 46 HZ2 TRP 46 14.242 -8.419 -25.237 355 HZ3 TRP 46 HZ3 TRP 46 10.049 -7.875 -26.106 356 HH2 TRP 46 HH2 TRP 46 12.405 -8.139 -26.875 357 H LEU 47 H LEU 47 9.844 -6.616 -17.796 358 HA LEU 47 HA LEU 47 7.560 -8.147 -16.683 359 HB2 LEU 47 1HB LEU 47 8.851 -6.572 -15.236 360 HB3 LEU 47 2HB LEU 47 8.421 -5.252 -16.314 361 HG LEU 47 HG LEU 47 6.007 -5.651 -15.749 362 HD11 LEU 47 1HD1 LEU 47 5.512 -6.950 -13.687 363 HD12 LEU 47 2HD1 LEU 47 7.199 -7.505 -13.646 364 HD13 LEU 47 3HD1 LEU 47 6.135 -7.979 -14.987 365 HD21 LEU 47 1HD2 LEU 47 7.897 -5.029 -13.445 366 HD22 LEU 47 2HD2 LEU 47 6.175 -4.597 -13.521 367 HD23 LEU 47 3HD2 LEU 47 7.318 -3.878 -14.678 368 H CYS 48 H CYS 48 5.840 -8.337 -17.999 369 HA CYS 48 HA CYS 48 5.224 -6.022 -19.790 370 HB2 CYS 48 1HB CYS 48 4.410 -8.934 -20.042 371 HB3 CYS 48 2HB CYS 48 4.073 -7.637 -21.200 372 HG CYS 48 HG CYS 48 6.983 -8.846 -20.223 373 H SER 49 H SER 49 2.855 -5.798 -20.253 374 HA SER 49 HA SER 49 1.148 -6.643 -17.958 375 HB2 SER 49 1HB SER 49 1.662 -4.261 -17.671 376 HB3 SER 49 2HB SER 49 1.140 -3.929 -19.336 377 HG SER 49 HG SER 49 -0.462 -3.550 -17.635 378 H LEU 50 H LEU 50 -0.686 -7.588 -18.548 379 HA LEU 50 HA LEU 50 -1.859 -7.236 -21.229 380 HB2 LEU 50 1HB LEU 50 -0.016 -8.819 -21.664 381 HB3 LEU 50 2HB LEU 50 -0.566 -9.845 -20.358 382 HG LEU 50 HG LEU 50 -2.671 -9.416 -22.333 383 HD11 LEU 50 1HD1 LEU 50 -0.105 -10.743 -23.225 384 HD12 LEU 50 2HD1 LEU 50 -0.732 -9.186 -23.818 385 HD13 LEU 50 3HD1 LEU 50 -1.640 -10.672 -24.121 386 HD21 LEU 50 1HD2 LEU 50 -2.629 -11.207 -20.587 387 HD22 LEU 50 2HD2 LEU 50 -1.233 -11.935 -21.409 388 HD23 LEU 50 3HD2 LEU 50 -2.804 -11.851 -22.237 389 H HIS 51 H HIS 51 -4.020 -7.793 -21.183 390 HA HIS 51 HA HIS 51 -6.067 -8.321 -20.306 391 HB2 HIS 51 1HB HIS 51 -4.754 -10.589 -20.467 392 HB3 HIS 51 2HB HIS 51 -4.833 -10.543 -18.710 393 HD1 HIS 51 HD1 HIS 51 -7.566 -9.991 -17.904 394 HD2 HIS 51 HD2 HIS 51 -6.805 -11.931 -21.513 395 HE1 HIS 51 HE1 HIS 51 -9.693 -11.220 -18.543 396 H GLY 52 H GLY 52 -4.487 -6.376 -18.796 397 HA2 GLY 52 1HA GLY 52 -5.090 -5.088 -16.963 398 HA3 GLY 52 2HA GLY 52 -6.212 -6.351 -16.458 399 H ARG 53 H ARG 53 -3.173 -7.815 -16.858 400 HA ARG 53 HA ARG 53 -2.422 -7.147 -14.040 401 HB2 ARG 53 1HB ARG 53 -1.991 -9.398 -13.494 402 HB3 ARG 53 2HB ARG 53 -3.577 -9.414 -14.273 403 HG2 ARG 53 1HG ARG 53 -2.388 -10.107 -16.419 404 HG3 ARG 53 2HG ARG 53 -0.903 -10.262 -15.463 405 HD2 ARG 53 1HD ARG 53 -1.810 -12.440 -15.579 406 HD3 ARG 53 2HD ARG 53 -2.200 -11.848 -13.954 407 HE ARG 53 HE ARG 53 -4.460 -11.791 -14.506 408 HH11 ARG 53 1HH1 ARG 53 -2.617 -12.482 -17.446 409 HH12 ARG 53 2HH1 ARG 53 -4.042 -12.926 -18.342 410 HH21 ARG 53 1HH2 ARG 53 -6.228 -12.353 -15.726 411 HH22 ARG 53 2HH2 ARG 53 -6.051 -12.835 -17.388 412 H GLN 54 H GLN 54 -0.137 -7.622 -13.586 413 HA GLN 54 HA GLN 54 1.541 -7.332 -16.038 414 HB2 GLN 54 1HB GLN 54 2.032 -6.392 -13.187 415 HB3 GLN 54 2HB GLN 54 3.188 -6.237 -14.524 416 HG2 GLN 54 1HG GLN 54 1.994 -4.533 -15.535 417 HG3 GLN 54 2HG GLN 54 0.452 -5.028 -14.818 418 HE21 GLN 54 1HE2 GLN 54 2.870 -2.411 -12.900 419 HE22 GLN 54 2HE2 GLN 54 3.372 -3.196 -14.375 420 H GLY 55 H GLY 55 3.487 -8.602 -16.029 421 HA2 GLY 55 1HA GLY 55 4.132 -10.332 -13.817 422 HA3 GLY 55 2HA GLY 55 3.209 -11.220 -15.044 423 H ILE 56 H ILE 56 5.803 -11.983 -14.481 424 HA ILE 56 HA ILE 56 7.601 -10.639 -16.351 425 HB ILE 56 HB ILE 56 9.290 -12.265 -15.689 426 HG12 ILE 56 1HG1 ILE 56 7.137 -13.695 -14.086 427 HG13 ILE 56 2HG1 ILE 56 7.753 -14.266 -15.636 428 HG21 ILE 56 1HG2 ILE 56 7.717 -11.517 -13.176 429 HG22 ILE 56 2HG2 ILE 56 9.478 -11.699 -13.350 430 HG23 ILE 56 3HG2 ILE 56 8.644 -10.342 -14.138 431 HD11 ILE 56 1HD1 ILE 56 10.054 -14.403 -14.595 432 HD12 ILE 56 2HD1 ILE 56 9.295 -14.029 -13.026 433 HD13 ILE 56 3HD1 ILE 56 8.848 -15.511 -13.902 434 H VAL 57 H VAL 57 8.380 -11.407 -18.266 435 HA VAL 57 HA VAL 57 7.016 -13.767 -19.481 436 HB VAL 57 HB VAL 57 7.157 -10.909 -20.550 437 HG11 VAL 57 1HG1 VAL 57 7.726 -12.168 -22.446 438 HG12 VAL 57 2HG1 VAL 57 6.608 -13.481 -22.034 439 HG13 VAL 57 3HG1 VAL 57 5.972 -11.923 -22.589 440 HG21 VAL 57 1HG2 VAL 57 4.685 -11.200 -20.801 441 HG22 VAL 57 2HG2 VAL 57 4.824 -12.780 -19.996 442 HG23 VAL 57 3HG2 VAL 57 5.244 -11.288 -19.122 443 HA PRO 58 HA PRO 58 11.263 -14.018 -20.869 444 HB2 PRO 58 1HB PRO 58 11.106 -16.092 -22.641 445 HB3 PRO 58 2HB PRO 58 11.077 -16.349 -20.868 446 HG2 PRO 58 1HG PRO 58 8.776 -16.228 -22.802 447 HG3 PRO 58 2HG PRO 58 9.096 -17.418 -21.509 448 HD2 PRO 58 1HD PRO 58 7.380 -15.327 -21.209 449 HD3 PRO 58 2HD PRO 58 8.352 -15.986 -19.853 450 H GLY 59 H GLY 59 11.845 -12.328 -22.125 451 HA2 GLY 59 1HA GLY 59 10.251 -11.274 -24.226 452 HA3 GLY 59 2HA GLY 59 11.927 -10.860 -23.865 453 H ASN 60 H ASN 60 12.550 -13.838 -24.213 454 HA ASN 60 HA ASN 60 13.419 -13.840 -26.926 455 HB2 ASN 60 1HB ASN 60 14.414 -15.327 -25.301 456 HB3 ASN 60 2HB ASN 60 12.850 -16.072 -24.940 457 HD21 ASN 60 1HD2 ASN 60 14.976 -17.243 -28.208 458 HD22 ASN 60 2HD2 ASN 60 15.424 -15.805 -27.320 459 H ARG 61 H ARG 61 10.314 -14.764 -25.455 460 HA ARG 61 HA ARG 61 9.451 -16.051 -27.972 461 HB2 ARG 61 1HB ARG 61 7.942 -15.533 -25.373 462 HB3 ARG 61 2HB ARG 61 7.345 -16.481 -26.736 463 HG2 ARG 61 1HG ARG 61 9.398 -17.981 -26.387 464 HG3 ARG 61 2HG ARG 61 9.580 -17.156 -24.826 465 HD2 ARG 61 1HD ARG 61 7.156 -17.772 -24.344 466 HD3 ARG 61 2HD ARG 61 7.204 -18.768 -25.808 467 HE ARG 61 HE ARG 61 9.371 -19.342 -23.956 468 HH11 ARG 61 1HH1 ARG 61 5.996 -20.162 -24.699 469 HH12 ARG 61 2HH1 ARG 61 6.088 -21.654 -23.812 470 HH21 ARG 61 1HH2 ARG 61 9.372 -21.257 -22.843 471 HH22 ARG 61 2HH2 ARG 61 7.951 -22.255 -22.791 472 H LEU 62 H LEU 62 9.878 -12.925 -27.284 473 HA LEU 62 HA LEU 62 7.248 -12.098 -28.462 474 HB2 LEU 62 1HB LEU 62 9.122 -10.466 -26.728 475 HB3 LEU 62 2HB LEU 62 7.549 -9.990 -27.323 476 HG LEU 62 HG LEU 62 8.142 -11.983 -25.139 477 HD11 LEU 62 1HD1 LEU 62 8.318 -9.578 -24.569 478 HD12 LEU 62 2HD1 LEU 62 6.926 -10.302 -23.764 479 HD13 LEU 62 3HD1 LEU 62 6.681 -9.296 -25.199 480 HD21 LEU 62 1HD2 LEU 62 5.631 -12.069 -24.863 481 HD22 LEU 62 2HD2 LEU 62 6.254 -12.901 -26.292 482 HD23 LEU 62 3HD2 LEU 62 5.500 -11.306 -26.463 483 H LYS 63 H LYS 63 7.237 -10.461 -30.026 484 HA LYS 63 HA LYS 63 9.939 -9.579 -31.001 485 HB2 LYS 63 1HB LYS 63 8.857 -11.204 -32.558 486 HB3 LYS 63 2HB LYS 63 7.489 -10.095 -32.732 487 HG2 LYS 63 1HG LYS 63 8.987 -8.386 -33.685 488 HG3 LYS 63 2HG LYS 63 10.383 -9.450 -33.427 489 HD2 LYS 63 1HD LYS 63 9.390 -11.120 -34.959 490 HD3 LYS 63 2HD LYS 63 8.031 -10.009 -35.266 491 HE2 LYS 63 1HE LYS 63 9.599 -8.314 -36.135 492 HE3 LYS 63 2HE LYS 63 10.973 -9.387 -35.782 493 HZ1 LYS 63 1HZ LYS 63 10.093 -10.953 -37.399 494 HZ2 LYS 63 2HZ LYS 63 10.330 -9.485 -38.109 495 HZ3 LYS 63 3HZ LYS 63 8.803 -9.974 -37.718 496 H ILE 64 H ILE 64 10.201 -7.470 -30.856 497 HA ILE 64 HA ILE 64 8.282 -5.714 -29.752 498 HB ILE 64 HB ILE 64 10.757 -5.025 -31.434 499 HG12 ILE 64 1HG1 ILE 64 11.356 -6.465 -29.545 500 HG13 ILE 64 2HG1 ILE 64 11.960 -4.829 -29.321 501 HG21 ILE 64 1HG2 ILE 64 9.406 -3.013 -31.211 502 HG22 ILE 64 2HG2 ILE 64 9.110 -3.311 -29.486 503 HG23 ILE 64 3HG2 ILE 64 10.739 -2.870 -30.056 504 HD11 ILE 64 1HD1 ILE 64 11.139 -5.692 -27.190 505 HD12 ILE 64 2HD1 ILE 64 10.078 -4.369 -27.701 506 HD13 ILE 64 3HD1 ILE 64 9.553 -6.058 -27.889 507 H LEU 65 H LEU 65 6.900 -4.208 -30.567 508 HA LEU 65 HA LEU 65 6.399 -4.302 -33.509 509 HB2 LEU 65 1HB LEU 65 4.711 -4.755 -31.176 510 HB3 LEU 65 2HB LEU 65 4.118 -3.383 -32.095 511 HG LEU 65 HG LEU 65 2.990 -5.480 -32.688 512 HD11 LEU 65 1HD1 LEU 65 4.680 -4.419 -34.995 513 HD12 LEU 65 2HD1 LEU 65 3.206 -3.643 -34.359 514 HD13 LEU 65 3HD1 LEU 65 3.115 -5.249 -35.109 515 HD21 LEU 65 1HD2 LEU 65 4.110 -7.256 -33.887 516 HD22 LEU 65 2HD2 LEU 65 4.930 -7.005 -32.336 517 HD23 LEU 65 3HD2 LEU 65 5.663 -6.392 -33.833 518 H VAL 66 H VAL 66 5.315 -2.343 -34.260 519 HA VAL 66 HA VAL 66 5.361 -0.137 -34.772 520 HB VAL 66 HB VAL 66 5.486 0.575 -31.825 521 HG11 VAL 66 1HG1 VAL 66 3.883 2.344 -32.535 522 HG12 VAL 66 2HG1 VAL 66 5.363 2.435 -33.508 523 HG13 VAL 66 3HG1 VAL 66 3.887 1.703 -34.195 524 HG21 VAL 66 1HG2 VAL 66 3.139 -0.685 -33.324 525 HG22 VAL 66 2HG2 VAL 66 3.896 -1.236 -31.805 526 HG23 VAL 66 3HG2 VAL 66 2.953 0.253 -31.832 527 H GLY 67 H GLY 67 7.850 -1.300 -34.991 528 HA2 GLY 67 1HA GLY 67 9.777 0.583 -33.811 529 HA3 GLY 67 2HA GLY 67 10.151 -0.825 -34.803 530 H MET 68 H MET 68 8.636 -0.314 -37.080 531 HA MET 68 HA MET 68 8.965 0.621 -39.140 532 HB2 MET 68 1HB MET 68 8.827 3.226 -37.580 533 HB3 MET 68 2HB MET 68 8.636 3.045 -39.332 534 HG2 MET 68 1HG MET 68 6.700 1.501 -38.878 535 HG3 MET 68 2HG MET 68 6.806 1.988 -37.176 536 HE1 MET 68 1HE MET 68 4.311 2.865 -37.168 537 HE2 MET 68 2HE MET 68 3.654 3.998 -38.370 538 HE3 MET 68 3HE MET 68 4.124 2.355 -38.865 539 H TYR 69 H TYR 69 10.444 3.446 -39.212 540 HA TYR 69 HA TYR 69 13.187 2.656 -38.625 541 HB2 TYR 69 1HB TYR 69 12.252 1.916 -41.110 542 HB3 TYR 69 2HB TYR 69 12.857 3.549 -41.436 543 HD1 TYR 69 HD1 TYR 69 15.278 4.033 -41.339 544 HD2 TYR 69 HD2 TYR 69 13.777 0.125 -40.329 545 HE1 TYR 69 HE1 TYR 69 17.599 3.121 -41.403 546 HE2 TYR 69 HE2 TYR 69 16.101 -0.780 -40.410 547 HH TYR 69 HH TYR 69 18.927 1.276 -41.164 548 H ASP 70 H ASP 70 14.505 4.494 -38.564 549 HA ASP 70 HA ASP 70 14.919 6.657 -38.005 550 HB2 ASP 70 1HB ASP 70 13.407 7.103 -40.588 551 HB3 ASP 70 2HB ASP 70 14.443 8.305 -39.801 552 H LYS 71 H LYS 71 13.262 9.024 -38.757 553 HA LYS 71 HA LYS 71 10.932 8.729 -36.941 554 HB2 LYS 71 1HB LYS 71 13.003 9.309 -35.579 555 HB3 LYS 71 2HB LYS 71 13.147 10.784 -36.541 556 HG2 LYS 71 1HG LYS 71 10.844 11.440 -35.690 557 HG3 LYS 71 2HG LYS 71 10.921 10.052 -34.597 558 HD2 LYS 71 1HD LYS 71 12.984 10.964 -33.581 559 HD3 LYS 71 2HD LYS 71 12.969 12.301 -34.747 560 HE2 LYS 71 1HE LYS 71 10.746 13.018 -33.835 561 HE3 LYS 71 2HE LYS 71 10.924 11.786 -32.562 562 HZ1 LYS 71 1HZ LYS 71 12.819 14.018 -33.074 563 HZ2 LYS 71 2HZ LYS 71 12.964 12.895 -31.868 564 HZ3 LYS 71 3HZ LYS 71 11.720 13.981 -31.849 565 H LYS 72 H LYS 72 9.342 10.301 -37.396 566 HA LYS 72 HA LYS 72 9.555 11.676 -39.966 567 HB2 LYS 72 1HB LYS 72 7.497 11.480 -37.758 568 HB3 LYS 72 2HB LYS 72 7.413 12.842 -38.873 569 HG2 LYS 72 1HG LYS 72 5.947 11.239 -39.757 570 HG3 LYS 72 2HG LYS 72 7.386 11.188 -40.786 571 HD2 LYS 72 1HD LYS 72 8.176 9.173 -39.561 572 HD3 LYS 72 2HD LYS 72 6.713 9.223 -38.556 573 HE2 LYS 72 1HE LYS 72 6.780 8.890 -41.585 574 HE3 LYS 72 2HE LYS 72 6.551 7.581 -40.415 575 HZ1 LYS 72 1HZ LYS 72 4.522 8.677 -39.667 576 HZ2 LYS 72 2HZ LYS 72 4.436 8.356 -41.284 577 HZ3 LYS 72 3HZ LYS 72 4.729 9.895 -40.769 578 HA PRO 73 HA PRO 73 11.545 15.176 -38.218 579 HB2 PRO 73 1HB PRO 73 10.895 17.219 -39.919 580 HB3 PRO 73 2HB PRO 73 11.978 15.868 -40.396 581 HG2 PRO 73 1HG PRO 73 9.023 16.187 -40.918 582 HG3 PRO 73 2HG PRO 73 10.336 15.779 -42.070 583 HD2 PRO 73 1HD PRO 73 8.774 13.867 -40.963 584 HD3 PRO 73 2HD PRO 73 10.527 13.592 -41.270 585 H ALA 74 H ALA 74 10.601 15.479 -36.229 586 HA ALA 74 HA ALA 74 8.791 17.747 -35.958 587 HB1 ALA 74 1HB ALA 74 7.085 16.453 -34.658 588 HB2 ALA 74 2HB ALA 74 7.146 15.940 -36.363 589 HB3 ALA 74 3HB ALA 74 7.915 14.942 -35.099 590 H GLY 75 H GLY 75 8.895 18.629 -33.895 591 HA2 GLY 75 1HA GLY 75 9.381 18.493 -31.538 592 HA3 GLY 75 2HA GLY 75 10.516 17.177 -31.866 593 H GLU 76 H GLU 76 12.617 17.630 -32.380 594 HA GLU 76 HA GLU 76 13.557 20.310 -31.758 595 HB2 GLU 76 1HB GLU 76 15.752 19.306 -31.903 596 HB3 GLU 76 2HB GLU 76 14.672 18.194 -31.052 597 HG2 GLU 76 1HG GLU 76 14.341 17.091 -33.412 598 HG3 GLU 76 2HG GLU 76 15.836 17.948 -33.830 599 H PHE 77 H PHE 77 15.145 21.436 -33.169 600 HA PHE 77 HA PHE 77 14.343 21.243 -36.037 601 HB2 PHE 77 1HB PHE 77 14.064 23.443 -34.731 602 HB3 PHE 77 2HB PHE 77 15.831 23.522 -34.710 603 HD1 PHE 77 HD1 PHE 77 12.832 23.448 -36.921 604 HD2 PHE 77 HD2 PHE 77 17.058 24.217 -36.667 605 HE1 PHE 77 HE1 PHE 77 12.775 24.462 -39.204 606 HE2 PHE 77 HE2 PHE 77 17.021 25.206 -38.952 607 HZ PHE 77 HZ PHE 77 14.870 25.339 -40.222 608 H ILE 78 H ILE 78 15.965 20.883 -37.555 609 HA ILE 78 HA ILE 78 18.278 19.509 -36.534 610 HB ILE 78 HB ILE 78 18.833 19.113 -38.911 611 HG12 ILE 78 1HG1 ILE 78 16.412 20.843 -39.585 612 HG13 ILE 78 2HG1 ILE 78 18.078 21.413 -39.703 613 HG21 ILE 78 1HG2 ILE 78 17.062 17.745 -37.694 614 HG22 ILE 78 2HG2 ILE 78 15.827 18.768 -38.461 615 HG23 ILE 78 3HG2 ILE 78 16.893 17.754 -39.460 616 HD11 ILE 78 1HD1 ILE 78 16.827 19.157 -41.324 617 HD12 ILE 78 2HD1 ILE 78 17.322 20.763 -41.903 618 HD13 ILE 78 3HD1 ILE 78 18.555 19.599 -41.371 619 H VAL 79 H VAL 79 20.467 19.913 -37.168 620 HA VAL 79 HA VAL 79 22.349 21.157 -37.112 621 HB VAL 79 HB VAL 79 20.959 23.148 -38.958 622 HG11 VAL 79 1HG1 VAL 79 23.874 22.237 -38.712 623 HG12 VAL 79 2HG1 VAL 79 23.238 23.410 -39.897 624 HG13 VAL 79 3HG1 VAL 79 23.221 23.803 -38.167 625 HG21 VAL 79 1HG2 VAL 79 21.811 21.661 -40.821 626 HG22 VAL 79 2HG2 VAL 79 22.202 20.429 -39.602 627 HG23 VAL 79 3HG2 VAL 79 20.517 20.925 -39.870 628 H THR 80 H THR 80 22.109 21.578 -34.883 629 HA THR 80 HA THR 80 21.984 24.494 -34.333 630 HB THR 80 HB THR 80 19.862 23.408 -33.453 631 HG1 THR 80 HG1 THR 80 21.525 24.126 -31.275 632 HG21 THR 80 1HG2 THR 80 20.003 21.922 -31.511 633 HG22 THR 80 2HG2 THR 80 21.776 21.895 -31.616 634 HG23 THR 80 3HG2 THR 80 20.789 21.173 -32.912 635 H ASP 81 H ASP 81 23.263 24.842 -32.164 636 HA ASP 81 HA ASP 81 25.807 23.459 -32.492 637 HB2 ASP 81 1HB ASP 81 26.685 25.032 -30.892 638 HB3 ASP 81 2HB ASP 81 25.606 25.942 -31.953 639 HXT ASP 81 H02 ASP 81 26.852 22.969 -30.653 Start of MODEL 22 1 H2 GLY 1 2H0 GLY 1 12.900 3.298 -22.719 2 H GLY 1 1H0 GLY 1 11.881 4.557 -22.516 3 HA2 GLY 1 1HA GLY 1 12.989 4.499 -20.461 4 HA3 GLY 1 2HA GLY 1 14.532 4.104 -21.256 5 H SER 2 H SER 2 13.677 6.105 -23.283 6 HA SER 2 HA SER 2 15.401 8.213 -22.463 7 HB2 SER 2 1HB SER 2 13.258 8.394 -24.605 8 HB3 SER 2 2HB SER 2 14.800 9.282 -24.527 9 HG SER 2 HG SER 2 15.054 7.539 -25.917 10 H MET 3 H MET 3 12.015 7.773 -21.879 11 HA MET 3 HA MET 3 11.781 10.607 -20.966 12 HB2 MET 3 1HB MET 3 9.635 8.517 -21.472 13 HB3 MET 3 2HB MET 3 9.345 10.139 -20.821 14 HG2 MET 3 1HG MET 3 10.289 11.124 -22.904 15 HG3 MET 3 2HG MET 3 10.525 9.485 -23.557 16 HE1 MET 3 1HE MET 3 8.114 12.453 -22.953 17 HE2 MET 3 2HE MET 3 6.496 11.722 -23.046 18 HE3 MET 3 3HE MET 3 7.522 11.416 -21.628 19 H LYS 4 H LYS 4 10.962 7.257 -19.987 20 HA LYS 4 HA LYS 4 12.247 7.544 -17.434 21 HB2 LYS 4 1HB LYS 4 10.083 8.853 -17.020 22 HB3 LYS 4 2HB LYS 4 9.206 7.344 -17.249 23 HG2 LYS 4 1HG LYS 4 10.492 6.346 -15.370 24 HG3 LYS 4 2HG LYS 4 11.364 7.871 -15.162 25 HD2 LYS 4 1HD LYS 4 9.247 9.018 -14.670 26 HD3 LYS 4 2HD LYS 4 8.362 7.496 -14.883 27 HE2 LYS 4 1HE LYS 4 9.668 6.480 -13.048 28 HE3 LYS 4 2HE LYS 4 10.543 8.002 -12.828 29 HZ1 LYS 4 1HZ LYS 4 7.624 7.618 -12.450 30 HZ2 LYS 4 2HZ LYS 4 8.414 9.054 -12.279 31 HZ3 LYS 4 3HZ LYS 4 8.736 7.808 -11.251 32 H TYR 5 H TYR 5 9.584 5.890 -19.149 33 HA TYR 5 HA TYR 5 10.686 3.275 -18.226 34 HB2 TYR 5 1HB TYR 5 7.968 4.404 -18.272 35 HB3 TYR 5 2HB TYR 5 8.080 2.830 -19.069 36 HD1 TYR 5 HD1 TYR 5 9.152 4.539 -15.875 37 HD2 TYR 5 HD2 TYR 5 7.940 0.873 -17.774 38 HE1 TYR 5 HE1 TYR 5 9.188 3.367 -13.656 39 HE2 TYR 5 HE2 TYR 5 8.002 -0.287 -15.549 40 HH TYR 5 HH TYR 5 8.660 -0.102 -13.339 41 H LEU 6 H LEU 6 10.187 1.485 -19.834 42 HA LEU 6 HA LEU 6 11.294 2.269 -22.357 43 HB2 LEU 6 1HB LEU 6 9.831 -0.280 -21.576 44 HB3 LEU 6 2HB LEU 6 10.826 -0.056 -23.024 45 HG LEU 6 HG LEU 6 11.841 0.069 -20.159 46 HD11 LEU 6 1HD1 LEU 6 12.104 -2.048 -22.293 47 HD12 LEU 6 2HD1 LEU 6 11.066 -2.141 -20.857 48 HD13 LEU 6 3HD1 LEU 6 12.836 -2.086 -20.675 49 HD21 LEU 6 1HD2 LEU 6 14.094 -0.085 -21.244 50 HD22 LEU 6 2HD2 LEU 6 13.264 1.439 -21.592 51 HD23 LEU 6 3HD2 LEU 6 13.319 0.158 -22.828 52 H ASN 7 H ASN 7 8.019 1.265 -21.407 53 HA ASN 7 HA ASN 7 6.005 1.444 -22.450 54 HB2 ASN 7 1HB ASN 7 6.678 3.827 -21.855 55 HB3 ASN 7 2HB ASN 7 7.060 4.048 -23.564 56 HD21 ASN 7 1HD2 ASN 7 3.767 5.060 -24.078 57 HD22 ASN 7 2HD2 ASN 7 5.475 5.392 -24.240 58 H VAL 8 H VAL 8 7.528 -0.239 -23.962 59 HA VAL 8 HA VAL 8 6.662 0.461 -26.735 60 HB VAL 8 HB VAL 8 8.367 -1.201 -27.499 61 HG11 VAL 8 1HG1 VAL 8 8.831 1.242 -27.544 62 HG12 VAL 8 2HG1 VAL 8 9.568 1.116 -25.939 63 HG13 VAL 8 3HG1 VAL 8 10.300 0.279 -27.321 64 HG21 VAL 8 1HG2 VAL 8 8.663 -2.480 -25.414 65 HG22 VAL 8 2HG2 VAL 8 10.224 -1.875 -26.006 66 HG23 VAL 8 3HG2 VAL 8 9.411 -1.067 -24.638 67 H LEU 9 H LEU 9 5.998 -1.659 -27.895 68 HA LEU 9 HA LEU 9 4.891 -3.597 -25.939 69 HB2 LEU 9 1HB LEU 9 2.826 -3.672 -27.442 70 HB3 LEU 9 2HB LEU 9 2.952 -2.366 -26.275 71 HG LEU 9 HG LEU 9 3.865 -1.803 -29.070 72 HD11 LEU 9 1HD1 LEU 9 0.950 -1.936 -28.202 73 HD12 LEU 9 2HD1 LEU 9 1.740 -3.033 -29.355 74 HD13 LEU 9 3HD1 LEU 9 1.562 -1.306 -29.748 75 HD21 LEU 9 1HD2 LEU 9 2.261 -0.211 -27.008 76 HD22 LEU 9 2HD2 LEU 9 2.928 0.410 -28.542 77 HD23 LEU 9 3HD2 LEU 9 4.014 -0.099 -27.230 78 H ALA 10 H ALA 10 4.226 -5.604 -26.943 79 HA ALA 10 HA ALA 10 5.766 -6.224 -29.422 80 HB1 ALA 10 1HB ALA 10 6.091 -7.738 -26.810 81 HB2 ALA 10 2HB ALA 10 7.014 -7.951 -28.311 82 HB3 ALA 10 3HB ALA 10 7.223 -6.481 -27.338 83 H LYS 11 H LYS 11 5.369 -8.434 -30.159 84 HA LYS 11 HA LYS 11 2.649 -9.413 -29.337 85 HB2 LYS 11 1HB LYS 11 2.757 -8.540 -31.653 86 HB3 LYS 11 2HB LYS 11 4.071 -9.664 -32.028 87 HG2 LYS 11 1HG LYS 11 1.550 -10.856 -30.951 88 HG3 LYS 11 2HG LYS 11 1.447 -10.144 -32.552 89 HD2 LYS 11 1HD LYS 11 3.646 -12.084 -31.862 90 HD3 LYS 11 2HD LYS 11 2.036 -12.644 -32.308 91 HE2 LYS 11 1HE LYS 11 2.221 -11.406 -34.435 92 HE3 LYS 11 2HE LYS 11 3.890 -10.968 -33.995 93 HZ1 LYS 11 1HZ LYS 11 3.832 -12.999 -35.347 94 HZ2 LYS 11 2HZ LYS 11 2.854 -13.742 -34.250 95 HZ3 LYS 11 3HZ LYS 11 4.390 -13.344 -33.840 96 H ALA 12 H ALA 12 2.535 -11.505 -28.638 97 HA ALA 12 HA ALA 12 5.043 -12.902 -28.140 98 HB1 ALA 12 1HB ALA 12 3.485 -14.728 -27.335 99 HB2 ALA 12 2HB ALA 12 3.284 -13.159 -26.537 100 HB3 ALA 12 3HB ALA 12 2.128 -13.666 -27.789 101 H LEU 13 H LEU 13 6.112 -14.238 -29.398 102 HA LEU 13 HA LEU 13 5.032 -14.944 -32.042 103 HB2 LEU 13 1HB LEU 13 7.602 -15.709 -30.601 104 HB3 LEU 13 2HB LEU 13 7.228 -16.105 -32.276 105 HG LEU 13 HG LEU 13 7.505 -13.272 -31.188 106 HD11 LEU 13 1HD1 LEU 13 9.621 -14.501 -31.006 107 HD12 LEU 13 2HD1 LEU 13 9.707 -13.270 -32.279 108 HD13 LEU 13 3HD1 LEU 13 9.504 -14.987 -32.710 109 HD21 LEU 13 1HD2 LEU 13 6.162 -13.288 -33.190 110 HD22 LEU 13 2HD2 LEU 13 7.262 -14.432 -34.004 111 HD23 LEU 13 3HD2 LEU 13 7.785 -12.766 -33.664 112 H TYR 14 H TYR 14 5.455 -16.422 -28.895 113 HA TYR 14 HA TYR 14 4.367 -18.984 -29.967 114 HB2 TYR 14 1HB TYR 14 6.286 -18.698 -27.656 115 HB3 TYR 14 2HB TYR 14 5.759 -20.195 -28.423 116 HD1 TYR 14 HD1 TYR 14 8.115 -17.388 -28.543 117 HD2 TYR 14 HD2 TYR 14 6.638 -20.774 -30.736 118 HE1 TYR 14 HE1 TYR 14 10.105 -17.267 -30.046 119 HE2 TYR 14 HE2 TYR 14 8.623 -20.651 -32.239 120 HH TYR 14 HH TYR 14 10.589 -19.591 -32.718 121 H ASP 15 H ASP 15 3.207 -20.232 -28.277 122 HA ASP 15 HA ASP 15 1.785 -18.424 -26.377 123 HB2 ASP 15 1HB ASP 15 0.263 -20.481 -26.185 124 HB3 ASP 15 2HB ASP 15 0.211 -19.612 -27.721 125 H ASN 16 H ASN 16 1.382 -19.277 -24.187 126 HA ASN 16 HA ASN 16 3.225 -21.404 -23.327 127 HB2 ASN 16 1HB ASN 16 4.348 -20.148 -21.755 128 HB3 ASN 16 2HB ASN 16 4.292 -19.027 -23.103 129 HD21 ASN 16 1HD2 ASN 16 3.197 -17.595 -19.674 130 HD22 ASN 16 2HD2 ASN 16 4.431 -18.794 -20.020 131 H VAL 17 H VAL 17 2.947 -21.765 -20.896 132 HA VAL 17 HA VAL 17 0.184 -21.204 -19.949 133 HB VAL 17 HB VAL 17 1.769 -23.819 -19.600 134 HG11 VAL 17 1HG1 VAL 17 -0.202 -24.609 -18.286 135 HG12 VAL 17 2HG1 VAL 17 0.602 -23.222 -17.515 136 HG13 VAL 17 3HG1 VAL 17 -0.917 -22.983 -18.414 137 HG21 VAL 17 1HG2 VAL 17 -0.896 -23.293 -21.002 138 HG22 VAL 17 2HG2 VAL 17 0.636 -23.747 -21.792 139 HG23 VAL 17 3HG2 VAL 17 -0.180 -24.896 -20.712 140 H ALA 18 H ALA 18 0.400 -20.361 -17.802 141 HA ALA 18 HA ALA 18 3.107 -19.515 -17.118 142 HB1 ALA 18 1HB ALA 18 0.432 -19.177 -15.680 143 HB2 ALA 18 2HB ALA 18 1.958 -18.393 -15.209 144 HB3 ALA 18 3HB ALA 18 1.205 -17.988 -16.762 145 H GLU 19 H GLU 19 4.482 -20.837 -16.107 146 HA GLU 19 HA GLU 19 3.473 -23.199 -14.640 147 HB2 GLU 19 1HB GLU 19 6.283 -22.148 -15.148 148 HB3 GLU 19 2HB GLU 19 5.908 -23.694 -14.385 149 HG2 GLU 19 1HG GLU 19 5.063 -22.930 -17.197 150 HG3 GLU 19 2HG GLU 19 6.554 -23.798 -16.802 151 H SER 20 H SER 20 4.134 -19.970 -14.017 152 HA SER 20 HA SER 20 4.375 -20.478 -11.093 153 HB2 SER 20 1HB SER 20 6.125 -18.731 -12.857 154 HB3 SER 20 2HB SER 20 6.056 -18.562 -11.090 155 HG SER 20 HG SER 20 6.476 -21.117 -12.161 156 HA PRO 21 HA PRO 21 1.242 -17.401 -11.134 157 HB2 PRO 21 1HB PRO 21 1.453 -16.188 -8.700 158 HB3 PRO 21 2HB PRO 21 0.935 -17.889 -8.867 159 HG2 PRO 21 1HG PRO 21 3.687 -16.809 -8.279 160 HG3 PRO 21 2HG PRO 21 2.746 -18.049 -7.385 161 HD2 PRO 21 1HD PRO 21 4.604 -18.774 -9.193 162 HD3 PRO 21 2HD PRO 21 3.055 -19.671 -9.059 163 H ASP 22 H ASP 22 4.549 -16.444 -10.751 164 HA ASP 22 HA ASP 22 4.077 -13.552 -10.973 165 HB2 ASP 22 1HB ASP 22 5.996 -14.701 -9.736 166 HB3 ASP 22 2HB ASP 22 6.627 -15.185 -11.316 167 H GLU 23 H GLU 23 4.417 -16.317 -13.042 168 HA GLU 23 HA GLU 23 5.417 -14.816 -15.332 169 HB2 GLU 23 1HB GLU 23 5.959 -17.234 -14.836 170 HB3 GLU 23 2HB GLU 23 4.288 -17.632 -15.239 171 HG2 GLU 23 1HG GLU 23 4.620 -16.756 -17.519 172 HG3 GLU 23 2HG GLU 23 6.279 -16.285 -17.096 173 H LEU 24 H LEU 24 4.230 -13.985 -16.991 174 HA LEU 24 HA LEU 24 1.319 -13.872 -16.601 175 HB2 LEU 24 1HB LEU 24 3.306 -12.334 -17.915 176 HB3 LEU 24 2HB LEU 24 2.205 -12.900 -19.174 177 HG LEU 24 HG LEU 24 1.384 -11.373 -16.679 178 HD11 LEU 24 1HD1 LEU 24 1.037 -9.487 -18.231 179 HD12 LEU 24 2HD1 LEU 24 1.684 -10.468 -19.568 180 HD13 LEU 24 3HD1 LEU 24 2.728 -10.013 -18.208 181 HD21 LEU 24 1HD2 LEU 24 -0.468 -12.727 -17.396 182 HD22 LEU 24 2HD2 LEU 24 -0.203 -12.294 -19.098 183 HD23 LEU 24 3HD2 LEU 24 -0.788 -11.069 -17.941 184 H SER 25 H SER 25 -0.203 -14.977 -17.746 185 HA SER 25 HA SER 25 0.730 -17.074 -19.624 186 HB2 SER 25 1HB SER 25 -1.740 -17.694 -19.588 187 HB3 SER 25 2HB SER 25 -0.911 -17.831 -18.026 188 HG SER 25 HG SER 25 -3.053 -16.681 -18.177 189 H PHE 26 H PHE 26 0.558 -16.853 -21.770 190 HA PHE 26 HA PHE 26 -1.214 -14.798 -22.960 191 HB2 PHE 26 1HB PHE 26 0.686 -13.851 -24.263 192 HB3 PHE 26 2HB PHE 26 0.805 -13.513 -22.531 193 HD1 PHE 26 HD1 PHE 26 2.614 -14.352 -21.197 194 HD2 PHE 26 HD2 PHE 26 2.201 -15.594 -25.305 195 HE1 PHE 26 HE1 PHE 26 4.875 -15.372 -21.115 196 HE2 PHE 26 HE2 PHE 26 4.486 -16.590 -25.237 197 HZ PHE 26 HZ PHE 26 5.822 -16.494 -23.139 198 H ARG 27 H ARG 27 -1.008 -15.015 -25.431 199 HA ARG 27 HA ARG 27 -0.278 -17.831 -26.136 200 HB2 ARG 27 1HB ARG 27 -2.753 -16.325 -27.064 201 HB3 ARG 27 2HB ARG 27 -2.230 -17.915 -27.628 202 HG2 ARG 27 1HG ARG 27 -2.378 -18.651 -25.159 203 HG3 ARG 27 2HG ARG 27 -3.276 -17.138 -24.892 204 HD2 ARG 27 1HD ARG 27 -4.013 -19.310 -26.887 205 HD3 ARG 27 2HD ARG 27 -4.767 -19.080 -25.292 206 HE ARG 27 HE ARG 27 -4.955 -16.637 -26.719 207 HH11 ARG 27 1HH1 ARG 27 -6.284 -19.903 -26.916 208 HH12 ARG 27 2HH1 ARG 27 -7.751 -19.359 -27.685 209 HH21 ARG 27 1HH2 ARG 27 -6.843 -16.024 -27.713 210 HH22 ARG 27 2HH2 ARG 27 -8.055 -17.203 -28.133 211 H LYS 28 H LYS 28 0.279 -18.122 -28.390 212 HA LYS 28 HA LYS 28 1.795 -15.993 -29.527 213 HB2 LYS 28 1HB LYS 28 1.683 -17.285 -31.663 214 HB3 LYS 28 2HB LYS 28 2.171 -18.251 -30.280 215 HG2 LYS 28 1HG LYS 28 -0.178 -19.125 -30.120 216 HG3 LYS 28 2HG LYS 28 -0.536 -18.293 -31.646 217 HD2 LYS 28 1HD LYS 28 1.052 -19.623 -32.836 218 HD3 LYS 28 2HD LYS 28 1.767 -20.238 -31.329 219 HE2 LYS 28 1HE LYS 28 -0.736 -21.082 -30.909 220 HE3 LYS 28 2HE LYS 28 -0.772 -21.061 -32.693 221 HZ1 LYS 28 1HZ LYS 28 0.010 -23.178 -31.833 222 HZ2 LYS 28 2HZ LYS 28 1.220 -22.453 -30.979 223 HZ3 LYS 28 3HZ LYS 28 1.245 -22.427 -32.634 224 H GLY 29 H GLY 29 1.276 -14.217 -30.591 225 HA2 GLY 29 1HA GLY 29 -0.112 -12.975 -32.138 226 HA3 GLY 29 2HA GLY 29 -1.497 -13.954 -31.669 227 H ASP 30 H ASP 30 -0.544 -13.591 -28.726 228 HA ASP 30 HA ASP 30 -2.302 -11.400 -28.150 229 HB2 ASP 30 1HB ASP 30 -1.554 -13.464 -26.718 230 HB3 ASP 30 2HB ASP 30 -0.170 -12.467 -26.272 231 H ILE 31 H ILE 31 -1.810 -9.376 -27.194 232 HA ILE 31 HA ILE 31 0.867 -8.279 -28.017 233 HB ILE 31 HB ILE 31 -1.796 -6.787 -27.799 234 HG12 ILE 31 1HG1 ILE 31 -1.922 -8.329 -29.693 235 HG13 ILE 31 2HG1 ILE 31 -1.828 -6.654 -30.234 236 HG21 ILE 31 1HG2 ILE 31 0.973 -5.913 -28.774 237 HG22 ILE 31 2HG2 ILE 31 -0.515 -4.973 -29.051 238 HG23 ILE 31 3HG2 ILE 31 0.043 -5.271 -27.394 239 HD11 ILE 31 1HD1 ILE 31 -0.487 -8.106 -31.661 240 HD12 ILE 31 2HD1 ILE 31 0.578 -6.981 -30.800 241 HD13 ILE 31 3HD1 ILE 31 0.446 -8.671 -30.261 242 H MET 32 H MET 32 2.072 -7.460 -26.407 243 HA MET 32 HA MET 32 0.684 -6.616 -23.916 244 HB2 MET 32 1HB MET 32 2.436 -7.660 -22.573 245 HB3 MET 32 2HB MET 32 1.487 -8.836 -23.461 246 HG2 MET 32 1HG MET 32 4.175 -7.879 -24.481 247 HG3 MET 32 2HG MET 32 4.023 -9.204 -23.331 248 HE1 MET 32 1HE MET 32 2.078 -11.947 -25.351 249 HE2 MET 32 2HE MET 32 3.092 -11.650 -23.918 250 HE3 MET 32 3HE MET 32 1.527 -10.828 -24.109 251 H THR 33 H THR 33 1.674 -5.070 -22.706 252 HA THR 33 HA THR 33 3.563 -3.382 -24.253 253 HB THR 33 HB THR 33 2.235 -2.817 -21.563 254 HG1 THR 33 HG1 THR 33 0.675 -3.040 -23.184 255 HG21 THR 33 1HG2 THR 33 4.202 -1.408 -22.005 256 HG22 THR 33 2HG2 THR 33 2.711 -0.457 -22.148 257 HG23 THR 33 3HG2 THR 33 3.580 -0.986 -23.619 258 H VAL 34 H VAL 34 5.714 -3.385 -23.821 259 HA VAL 34 HA VAL 34 6.630 -4.988 -21.475 260 HB VAL 34 HB VAL 34 8.143 -3.832 -23.854 261 HG11 VAL 34 1HG1 VAL 34 9.637 -3.798 -21.940 262 HG12 VAL 34 2HG1 VAL 34 9.136 -5.438 -21.462 263 HG13 VAL 34 3HG1 VAL 34 10.078 -5.179 -22.954 264 HG21 VAL 34 1HG2 VAL 34 6.700 -5.855 -24.329 265 HG22 VAL 34 2HG2 VAL 34 8.439 -6.138 -24.563 266 HG23 VAL 34 3HG2 VAL 34 7.641 -6.739 -23.095 267 H LEU 35 H LEU 35 6.847 -3.938 -19.682 268 HA LEU 35 HA LEU 35 7.036 -0.990 -19.710 269 HB2 LEU 35 1HB LEU 35 6.873 -2.987 -17.416 270 HB3 LEU 35 2HB LEU 35 6.700 -1.236 -17.276 271 HG LEU 35 HG LEU 35 4.793 -3.057 -18.800 272 HD11 LEU 35 1HD1 LEU 35 4.711 -3.530 -16.402 273 HD12 LEU 35 2HD1 LEU 35 3.254 -2.650 -16.906 274 HD13 LEU 35 3HD1 LEU 35 4.543 -1.789 -16.042 275 HD21 LEU 35 1HD2 LEU 35 3.287 -1.070 -18.761 276 HD22 LEU 35 2HD2 LEU 35 4.777 -0.761 -19.674 277 HD23 LEU 35 3HD2 LEU 35 4.590 -0.109 -18.028 278 H GLU 36 H GLU 36 8.883 -3.841 -18.624 279 HA GLU 36 HA GLU 36 11.322 -2.153 -18.408 280 HB2 GLU 36 1HB GLU 36 10.005 -2.304 -16.215 281 HB3 GLU 36 2HB GLU 36 10.417 -4.019 -16.185 282 HG2 GLU 36 1HG GLU 36 12.760 -3.515 -16.008 283 HG3 GLU 36 2HG GLU 36 12.456 -1.796 -16.321 284 H ARG 37 H ARG 37 13.292 -3.579 -18.229 285 HA ARG 37 HA ARG 37 12.812 -6.373 -19.216 286 HB2 ARG 37 1HB ARG 37 14.917 -4.384 -20.152 287 HB3 ARG 37 2HB ARG 37 14.997 -6.119 -20.463 288 HG2 ARG 37 1HG ARG 37 12.785 -5.929 -21.651 289 HG3 ARG 37 2HG ARG 37 12.959 -4.179 -21.539 290 HD2 ARG 37 1HD ARG 37 15.040 -6.007 -22.750 291 HD3 ARG 37 2HD ARG 37 13.791 -5.200 -23.706 292 HE ARG 37 HE ARG 37 16.102 -3.938 -22.345 293 HH11 ARG 37 1HH1 ARG 37 13.224 -3.478 -24.347 294 HH12 ARG 37 2HH1 ARG 37 13.720 -1.880 -24.850 295 HH21 ARG 37 1HH2 ARG 37 16.650 -1.896 -23.015 296 HH22 ARG 37 2HH2 ARG 37 15.620 -1.002 -24.102 297 H ASP 38 H ASP 38 14.312 -7.840 -18.459 298 HA ASP 38 HA ASP 38 15.648 -8.823 -16.947 299 HB2 ASP 38 1HB ASP 38 17.171 -6.206 -16.842 300 HB3 ASP 38 2HB ASP 38 17.805 -7.832 -16.548 301 H THR 39 H THR 39 13.289 -7.606 -16.158 302 HA THR 39 HA THR 39 13.483 -5.839 -13.938 303 HB THR 39 HB THR 39 11.499 -6.179 -15.489 304 HG1 THR 39 HG1 THR 39 11.184 -5.119 -13.502 305 HG21 THR 39 1HG2 THR 39 11.551 -8.723 -15.445 306 HG22 THR 39 2HG2 THR 39 9.954 -8.026 -15.128 307 HG23 THR 39 3HG2 THR 39 10.909 -8.644 -13.789 308 H GLN 40 H GLN 40 13.744 -9.272 -14.086 309 HA GLN 40 HA GLN 40 13.168 -9.557 -11.189 310 HB2 GLN 40 1HB GLN 40 12.315 -11.035 -13.274 311 HB3 GLN 40 2HB GLN 40 13.846 -11.863 -12.971 312 HG2 GLN 40 1HG GLN 40 12.125 -13.041 -11.769 313 HG3 GLN 40 2HG GLN 40 13.124 -12.192 -10.579 314 HE21 GLN 40 1HE2 GLN 40 9.840 -11.462 -9.346 315 HE22 GLN 40 2HE2 GLN 40 11.150 -12.633 -9.274 316 H GLY 41 H GLY 41 15.717 -8.614 -12.922 317 HA2 GLY 41 1HA GLY 41 17.999 -8.646 -12.456 318 HA3 GLY 41 2HA GLY 41 17.700 -9.768 -11.103 319 H LEU 42 H LEU 42 16.154 -10.670 -13.964 320 HA LEU 42 HA LEU 42 18.246 -12.708 -14.571 321 HB2 LEU 42 1HB LEU 42 15.231 -12.802 -14.976 322 HB3 LEU 42 2HB LEU 42 16.356 -14.055 -15.473 323 HG LEU 42 HG LEU 42 15.763 -13.267 -12.607 324 HD11 LEU 42 1HD1 LEU 42 13.867 -14.350 -13.770 325 HD12 LEU 42 2HD1 LEU 42 14.577 -15.422 -12.548 326 HD13 LEU 42 3HD1 LEU 42 14.931 -15.683 -14.267 327 HD21 LEU 42 1HD2 LEU 42 17.461 -15.495 -13.768 328 HD22 LEU 42 2HD2 LEU 42 16.986 -15.363 -12.055 329 HD23 LEU 42 3HD2 LEU 42 18.028 -14.125 -12.783 330 H ASP 43 H ASP 43 19.230 -12.393 -16.441 331 HA ASP 43 HA ASP 43 18.599 -10.350 -18.257 332 HB2 ASP 43 1HB ASP 43 20.184 -12.931 -18.622 333 HB3 ASP 43 2HB ASP 43 20.092 -11.657 -19.844 334 H GLY 44 H GLY 44 17.158 -10.138 -19.822 335 HA2 GLY 44 1HA GLY 44 15.980 -10.836 -21.725 336 HA3 GLY 44 2HA GLY 44 16.312 -12.521 -21.329 337 H TRP 45 H TRP 45 15.057 -11.256 -18.493 338 HA TRP 45 HA TRP 45 12.323 -12.176 -19.320 339 HB2 TRP 45 1HB TRP 45 13.740 -11.957 -16.662 340 HB3 TRP 45 2HB TRP 45 11.976 -12.144 -16.786 341 HD1 TRP 45 HD1 TRP 45 15.211 -14.069 -17.613 342 HE1 TRP 45 HE1 TRP 45 14.702 -16.537 -17.899 343 HE3 TRP 45 HE3 TRP 45 10.111 -13.764 -17.323 344 HZ2 TRP 45 HZ2 TRP 45 12.368 -18.200 -17.993 345 HZ3 TRP 45 HZ3 TRP 45 8.768 -15.865 -17.508 346 HH2 TRP 45 HH2 TRP 45 9.899 -18.055 -17.849 347 H TRP 46 H TRP 46 10.720 -10.723 -19.618 348 HA TRP 46 HA TRP 46 11.370 -7.924 -18.805 349 HB2 TRP 46 1HB TRP 46 9.671 -8.989 -21.077 350 HB3 TRP 46 2HB TRP 46 10.010 -7.291 -20.747 351 HD1 TRP 46 HD1 TRP 46 13.266 -8.765 -20.184 352 HE1 TRP 46 HE1 TRP 46 14.787 -8.738 -22.212 353 HE3 TRP 46 HE3 TRP 46 9.684 -7.878 -23.711 354 HZ2 TRP 46 HZ2 TRP 46 14.494 -8.352 -25.044 355 HZ3 TRP 46 HZ3 TRP 46 10.368 -7.688 -26.103 356 HH2 TRP 46 HH2 TRP 46 12.763 -7.906 -26.752 357 H LEU 47 H LEU 47 9.836 -6.636 -17.849 358 HA LEU 47 HA LEU 47 7.514 -8.046 -16.685 359 HB2 LEU 47 1HB LEU 47 8.763 -6.338 -15.347 360 HB3 LEU 47 2HB LEU 47 8.343 -5.112 -16.534 361 HG LEU 47 HG LEU 47 5.936 -5.437 -15.987 362 HD11 LEU 47 1HD1 LEU 47 5.360 -6.675 -13.884 363 HD12 LEU 47 2HD1 LEU 47 7.026 -7.292 -13.829 364 HD13 LEU 47 3HD1 LEU 47 5.947 -7.749 -15.163 365 HD21 LEU 47 1HD2 LEU 47 7.295 -3.687 -14.909 366 HD22 LEU 47 2HD2 LEU 47 7.745 -4.824 -13.621 367 HD23 LEU 47 3HD2 LEU 47 6.051 -4.305 -13.798 368 H CYS 48 H CYS 48 5.796 -8.344 -17.950 369 HA CYS 48 HA CYS 48 5.222 -6.224 -19.973 370 HB2 CYS 48 1HB CYS 48 4.542 -9.163 -20.014 371 HB3 CYS 48 2HB CYS 48 4.119 -7.979 -21.261 372 HG CYS 48 HG CYS 48 7.089 -8.945 -20.198 373 H SER 49 H SER 49 2.997 -5.824 -20.439 374 HA SER 49 HA SER 49 1.100 -6.613 -18.278 375 HB2 SER 49 1HB SER 49 1.903 -4.370 -17.734 376 HB3 SER 49 2HB SER 49 1.546 -3.813 -19.387 377 HG SER 49 HG SER 49 -0.116 -3.274 -17.930 378 H LEU 50 H LEU 50 -0.701 -7.416 -19.062 379 HA LEU 50 HA LEU 50 -1.778 -6.352 -21.618 380 HB2 LEU 50 1HB LEU 50 -2.160 -8.567 -22.540 381 HB3 LEU 50 2HB LEU 50 -0.463 -8.213 -22.357 382 HG LEU 50 HG LEU 50 -0.865 -9.627 -20.069 383 HD11 LEU 50 1HD1 LEU 50 -2.670 -10.910 -22.153 384 HD12 LEU 50 2HD1 LEU 50 -3.219 -10.161 -20.617 385 HD13 LEU 50 3HD1 LEU 50 -2.193 -11.602 -20.585 386 HD21 LEU 50 1HD2 LEU 50 -0.295 -10.676 -22.854 387 HD22 LEU 50 2HD2 LEU 50 0.126 -11.505 -21.337 388 HD23 LEU 50 3HD2 LEU 50 0.872 -9.933 -21.729 389 H HIS 51 H HIS 51 -3.959 -6.396 -21.756 390 HA HIS 51 HA HIS 51 -6.086 -6.291 -20.927 391 HB2 HIS 51 1HB HIS 51 -5.418 -9.145 -20.136 392 HB3 HIS 51 2HB HIS 51 -7.046 -8.463 -20.292 393 HD1 HIS 51 HD1 HIS 51 -4.194 -9.793 -22.356 394 HD2 HIS 51 HD2 HIS 51 -7.864 -7.906 -22.939 395 HE1 HIS 51 HE1 HIS 51 -4.740 -10.007 -24.812 396 H GLY 52 H GLY 52 -4.260 -5.160 -19.034 397 HA2 GLY 52 1HA GLY 52 -4.672 -4.147 -16.987 398 HA3 GLY 52 2HA GLY 52 -6.064 -5.210 -16.752 399 H ARG 53 H ARG 53 -3.376 -7.123 -17.490 400 HA ARG 53 HA ARG 53 -2.716 -7.438 -14.565 401 HB2 ARG 53 1HB ARG 53 -2.924 -9.548 -16.752 402 HB3 ARG 53 2HB ARG 53 -2.317 -9.836 -15.118 403 HG2 ARG 53 1HG ARG 53 -4.526 -9.184 -14.193 404 HG3 ARG 53 2HG ARG 53 -5.142 -8.943 -15.845 405 HD2 ARG 53 1HD ARG 53 -5.819 -11.139 -15.052 406 HD3 ARG 53 2HD ARG 53 -4.639 -11.309 -16.365 407 HE ARG 53 HE ARG 53 -3.187 -11.314 -13.951 408 HH11 ARG 53 1HH1 ARG 53 -5.521 -13.401 -15.573 409 HH12 ARG 53 2HH1 ARG 53 -4.891 -14.852 -14.829 410 HH21 ARG 53 1HH2 ARG 53 -2.414 -13.186 -13.046 411 HH22 ARG 53 2HH2 ARG 53 -3.143 -14.717 -13.425 412 H GLN 54 H GLN 54 -0.565 -7.772 -14.076 413 HA GLN 54 HA GLN 54 1.354 -7.494 -16.347 414 HB2 GLN 54 1HB GLN 54 1.678 -6.579 -13.455 415 HB3 GLN 54 2HB GLN 54 2.861 -6.380 -14.755 416 HG2 GLN 54 1HG GLN 54 1.969 -4.345 -15.004 417 HG3 GLN 54 2HG GLN 54 0.628 -5.160 -15.813 418 HE21 GLN 54 1HE2 GLN 54 -0.185 -2.957 -12.687 419 HE22 GLN 54 2HE2 GLN 54 1.188 -2.783 -13.753 420 H GLY 55 H GLY 55 3.236 -8.725 -16.239 421 HA2 GLY 55 1HA GLY 55 3.944 -10.346 -13.969 422 HA3 GLY 55 2HA GLY 55 3.072 -11.338 -15.149 423 H ILE 56 H ILE 56 5.672 -12.019 -14.639 424 HA ILE 56 HA ILE 56 7.389 -10.592 -16.550 425 HB ILE 56 HB ILE 56 9.191 -12.058 -15.862 426 HG12 ILE 56 1HG1 ILE 56 7.188 -13.630 -14.206 427 HG13 ILE 56 2HG1 ILE 56 7.829 -14.174 -15.755 428 HG21 ILE 56 1HG2 ILE 56 8.432 -10.169 -14.335 429 HG22 ILE 56 2HG2 ILE 56 7.608 -11.386 -13.328 430 HG23 ILE 56 3HG2 ILE 56 9.371 -11.427 -13.529 431 HD11 ILE 56 1HD1 ILE 56 9.045 -15.306 -14.023 432 HD12 ILE 56 2HD1 ILE 56 10.147 -14.090 -14.737 433 HD13 ILE 56 3HD1 ILE 56 9.369 -13.788 -13.164 434 H VAL 57 H VAL 57 8.264 -11.400 -18.420 435 HA VAL 57 HA VAL 57 7.055 -13.901 -19.547 436 HB VAL 57 HB VAL 57 7.111 -11.122 -20.853 437 HG11 VAL 57 1HG1 VAL 57 5.932 -12.286 -22.771 438 HG12 VAL 57 2HG1 VAL 57 7.649 -12.685 -22.590 439 HG13 VAL 57 3HG1 VAL 57 6.405 -13.827 -22.034 440 HG21 VAL 57 1HG2 VAL 57 5.217 -11.369 -19.334 441 HG22 VAL 57 2HG2 VAL 57 4.637 -11.429 -21.010 442 HG23 VAL 57 3HG2 VAL 57 4.792 -12.934 -20.066 443 HA PRO 58 HA PRO 58 11.364 -13.943 -20.716 444 HB2 PRO 58 1HB PRO 58 11.405 -16.022 -22.502 445 HB3 PRO 58 2HB PRO 58 11.301 -16.280 -20.728 446 HG2 PRO 58 1HG PRO 58 9.081 -16.263 -22.765 447 HG3 PRO 58 2HG PRO 58 9.416 -17.468 -21.477 448 HD2 PRO 58 1HD PRO 58 7.575 -15.481 -21.215 449 HD3 PRO 58 2HD PRO 58 8.553 -16.056 -19.829 450 H GLY 59 H GLY 59 12.088 -12.347 -22.012 451 HA2 GLY 59 1HA GLY 59 10.458 -11.194 -24.022 452 HA3 GLY 59 2HA GLY 59 12.157 -10.835 -23.722 453 H ASN 60 H ASN 60 12.824 -13.742 -24.270 454 HA ASN 60 HA ASN 60 13.496 -13.492 -27.025 455 HB2 ASN 60 1HB ASN 60 14.651 -15.007 -25.465 456 HB3 ASN 60 2HB ASN 60 13.180 -15.976 -25.289 457 HD21 ASN 60 1HD2 ASN 60 15.475 -16.293 -28.660 458 HD22 ASN 60 2HD2 ASN 60 15.649 -14.907 -27.600 459 H ARG 61 H ARG 61 10.533 -14.613 -25.461 460 HA ARG 61 HA ARG 61 9.593 -15.881 -27.955 461 HB2 ARG 61 1HB ARG 61 8.194 -15.368 -25.294 462 HB3 ARG 61 2HB ARG 61 7.514 -16.267 -26.659 463 HG2 ARG 61 1HG ARG 61 9.544 -17.833 -26.451 464 HG3 ARG 61 2HG ARG 61 9.811 -17.063 -24.862 465 HD2 ARG 61 1HD ARG 61 7.424 -17.644 -24.268 466 HD3 ARG 61 2HD ARG 61 7.296 -18.500 -25.808 467 HE ARG 61 HE ARG 61 9.536 -19.404 -24.197 468 HH11 ARG 61 1HH1 ARG 61 6.054 -19.842 -24.692 469 HH12 ARG 61 2HH1 ARG 61 6.060 -21.418 -23.949 470 HH21 ARG 61 1HH2 ARG 61 9.452 -21.433 -23.263 471 HH22 ARG 61 2HH2 ARG 61 7.943 -22.296 -23.155 472 H LEU 62 H LEU 62 10.003 -12.733 -27.298 473 HA LEU 62 HA LEU 62 7.332 -11.957 -28.420 474 HB2 LEU 62 1HB LEU 62 9.223 -10.305 -26.715 475 HB3 LEU 62 2HB LEU 62 7.633 -9.831 -27.285 476 HG LEU 62 HG LEU 62 8.215 -11.961 -25.213 477 HD11 LEU 62 1HD1 LEU 62 6.952 -9.186 -25.009 478 HD12 LEU 62 2HD1 LEU 62 8.566 -9.659 -24.414 479 HD13 LEU 62 3HD1 LEU 62 7.113 -10.351 -23.676 480 HD21 LEU 62 1HD2 LEU 62 5.700 -11.885 -24.898 481 HD22 LEU 62 2HD2 LEU 62 6.261 -12.663 -26.375 482 HD23 LEU 62 3HD2 LEU 62 5.614 -11.006 -26.444 483 H LYS 63 H LYS 63 7.206 -10.462 -30.071 484 HA LYS 63 HA LYS 63 9.836 -9.449 -31.117 485 HB2 LYS 63 1HB LYS 63 8.851 -11.001 -32.742 486 HB3 LYS 63 2HB LYS 63 7.333 -10.083 -32.729 487 HG2 LYS 63 1HG LYS 63 8.482 -8.104 -33.635 488 HG3 LYS 63 2HG LYS 63 10.037 -8.939 -33.572 489 HD2 LYS 63 1HD LYS 63 9.256 -10.543 -35.257 490 HD3 LYS 63 2HD LYS 63 7.662 -9.751 -35.298 491 HE2 LYS 63 1HE LYS 63 8.731 -7.625 -36.031 492 HE3 LYS 63 2HE LYS 63 10.325 -8.393 -35.969 493 HZ1 LYS 63 1HZ LYS 63 9.264 -8.231 -38.223 494 HZ2 LYS 63 2HZ LYS 63 8.156 -9.361 -37.753 495 HZ3 LYS 63 3HZ LYS 63 9.764 -9.743 -37.801 496 H ILE 64 H ILE 64 10.046 -7.371 -30.862 497 HA ILE 64 HA ILE 64 8.065 -5.688 -29.710 498 HB ILE 64 HB ILE 64 10.565 -4.920 -31.314 499 HG12 ILE 64 1HG1 ILE 64 11.149 -6.427 -29.468 500 HG13 ILE 64 2HG1 ILE 64 11.748 -4.800 -29.207 501 HG21 ILE 64 1HG2 ILE 64 8.831 -3.318 -29.388 502 HG22 ILE 64 2HG2 ILE 64 10.496 -2.849 -29.803 503 HG23 ILE 64 3HG2 ILE 64 9.262 -2.931 -31.065 504 HD11 ILE 64 1HD1 ILE 64 9.337 -6.042 -27.812 505 HD12 ILE 64 2HD1 ILE 64 10.921 -5.693 -27.095 506 HD13 ILE 64 3HD1 ILE 64 9.863 -4.355 -27.589 507 H LEU 65 H LEU 65 6.571 -4.305 -30.570 508 HA LEU 65 HA LEU 65 5.848 -4.726 -33.371 509 HB2 LEU 65 1HB LEU 65 4.515 -4.108 -30.935 510 HB3 LEU 65 2HB LEU 65 4.286 -2.720 -32.000 511 HG LEU 65 HG LEU 65 3.412 -4.278 -33.763 512 HD11 LEU 65 1HD1 LEU 65 2.714 -6.561 -33.068 513 HD12 LEU 65 2HD1 LEU 65 3.609 -6.340 -31.551 514 HD13 LEU 65 3HD1 LEU 65 4.477 -6.357 -33.092 515 HD21 LEU 65 1HD2 LEU 65 1.903 -3.064 -32.182 516 HD22 LEU 65 2HD2 LEU 65 1.952 -4.492 -31.113 517 HD23 LEU 65 3HD2 LEU 65 1.244 -4.626 -32.728 518 H VAL 66 H VAL 66 4.929 -2.535 -34.320 519 HA VAL 66 HA VAL 66 5.516 -0.702 -35.547 520 HB VAL 66 HB VAL 66 7.191 0.288 -33.196 521 HG11 VAL 66 1HG1 VAL 66 7.318 1.617 -35.299 522 HG12 VAL 66 2HG1 VAL 66 5.545 1.715 -35.352 523 HG13 VAL 66 3HG1 VAL 66 6.449 2.510 -34.038 524 HG21 VAL 66 1HG2 VAL 66 4.160 0.389 -33.568 525 HG22 VAL 66 2HG2 VAL 66 5.053 -0.383 -32.241 526 HG23 VAL 66 3HG2 VAL 66 5.066 1.378 -32.397 527 H GLY 67 H GLY 67 6.686 -2.675 -36.524 528 HA2 GLY 67 1HA GLY 67 9.322 -1.745 -37.354 529 HA3 GLY 67 2HA GLY 67 9.327 -3.283 -36.454 530 H MET 68 H MET 68 10.178 -3.737 -38.895 531 HA MET 68 HA MET 68 8.143 -3.926 -40.912 532 HB2 MET 68 1HB MET 68 10.781 -5.424 -40.593 533 HB3 MET 68 2HB MET 68 9.776 -5.446 -42.045 534 HG2 MET 68 1HG MET 68 10.051 -2.984 -42.249 535 HG3 MET 68 2HG MET 68 11.137 -2.996 -40.837 536 HE1 MET 68 1HE MET 68 13.115 -5.370 -41.059 537 HE2 MET 68 2HE MET 68 14.352 -4.751 -42.176 538 HE3 MET 68 3HE MET 68 13.675 -3.682 -40.926 539 H TYR 69 H TYR 69 6.625 -5.436 -41.261 540 HA TYR 69 HA TYR 69 6.571 -7.764 -39.403 541 HB2 TYR 69 1HB TYR 69 4.322 -6.497 -40.978 542 HB3 TYR 69 2HB TYR 69 4.176 -7.784 -39.776 543 HD1 TYR 69 HD1 TYR 69 3.628 -4.403 -40.285 544 HD2 TYR 69 HD2 TYR 69 5.358 -7.064 -37.384 545 HE1 TYR 69 HE1 TYR 69 3.226 -2.720 -38.497 546 HE2 TYR 69 HE2 TYR 69 4.958 -5.358 -35.597 547 HH TYR 69 HH TYR 69 3.333 -2.246 -36.308 548 H ASP 70 H ASP 70 6.812 -6.958 -42.740 549 HA ASP 70 HA ASP 70 6.664 -8.116 -44.687 550 HB2 ASP 70 1HB ASP 70 8.607 -9.191 -43.447 551 HB3 ASP 70 2HB ASP 70 7.512 -10.542 -43.115 552 H LYS 71 H LYS 71 4.151 -7.842 -43.780 553 HA LYS 71 HA LYS 71 2.829 -10.206 -44.898 554 HB2 LYS 71 1HB LYS 71 1.406 -10.645 -42.980 555 HB3 LYS 71 2HB LYS 71 3.088 -10.789 -42.476 556 HG2 LYS 71 1HG LYS 71 2.991 -8.514 -41.525 557 HG3 LYS 71 2HG LYS 71 1.284 -8.416 -41.982 558 HD2 LYS 71 1HD LYS 71 0.855 -10.442 -40.601 559 HD3 LYS 71 2HD LYS 71 2.541 -10.346 -40.025 560 HE2 LYS 71 1HE LYS 71 2.108 -8.067 -39.169 561 HE3 LYS 71 2HE LYS 71 0.443 -8.147 -39.772 562 HZ1 LYS 71 1HZ LYS 71 0.531 -8.676 -37.437 563 HZ2 LYS 71 2HZ LYS 71 1.591 -9.917 -37.697 564 HZ3 LYS 71 3HZ LYS 71 0.054 -10.008 -38.286 565 H LYS 72 H LYS 72 0.409 -9.778 -44.999 566 HA LYS 72 HA LYS 72 -0.102 -6.935 -45.668 567 HB2 LYS 72 1HB LYS 72 -1.893 -9.407 -45.691 568 HB3 LYS 72 2HB LYS 72 -2.350 -7.820 -46.316 569 HG2 LYS 72 1HG LYS 72 -0.089 -9.531 -47.431 570 HG3 LYS 72 2HG LYS 72 -1.720 -9.433 -48.103 571 HD2 LYS 72 1HD LYS 72 -1.377 -6.961 -48.440 572 HD3 LYS 72 2HD LYS 72 0.300 -7.148 -47.885 573 HE2 LYS 72 1HE LYS 72 0.708 -8.772 -49.723 574 HE3 LYS 72 2HE LYS 72 -0.963 -8.554 -50.285 575 HZ1 LYS 72 1HZ LYS 72 0.563 -7.202 -51.546 576 HZ2 LYS 72 2HZ LYS 72 1.114 -6.435 -50.193 577 HZ3 LYS 72 3HZ LYS 72 -0.444 -6.218 -50.691 578 HA PRO 73 HA PRO 73 -2.005 -6.234 -41.697 579 HB2 PRO 73 1HB PRO 73 -4.080 -4.542 -42.235 580 HB3 PRO 73 2HB PRO 73 -2.372 -4.005 -42.313 581 HG2 PRO 73 1HG PRO 73 -4.169 -4.914 -44.559 582 HG3 PRO 73 2HG PRO 73 -3.167 -3.438 -44.436 583 HD2 PRO 73 1HD PRO 73 -2.296 -5.614 -45.764 584 HD3 PRO 73 2HD PRO 73 -1.172 -4.608 -44.785 585 H ALA 74 H ALA 74 -3.912 -6.951 -40.494 586 HA ALA 74 HA ALA 74 -6.052 -8.310 -41.984 587 HB1 ALA 74 1HB ALA 74 -5.602 -10.502 -40.909 588 HB2 ALA 74 2HB ALA 74 -4.245 -10.018 -41.948 589 HB3 ALA 74 3HB ALA 74 -4.126 -9.849 -40.177 590 H GLY 75 H GLY 75 -6.692 -6.204 -40.618 591 HA2 GLY 75 1HA GLY 75 -8.453 -7.090 -38.610 592 HA3 GLY 75 2HA GLY 75 -7.010 -6.446 -37.800 593 H GLU 76 H GLU 76 -9.561 -5.260 -37.591 594 HA GLU 76 HA GLU 76 -9.789 -3.065 -39.492 595 HB2 GLU 76 1HB GLU 76 -11.118 -3.642 -36.814 596 HB3 GLU 76 2HB GLU 76 -11.576 -2.314 -37.894 597 HG2 GLU 76 1HG GLU 76 -13.132 -4.143 -38.211 598 HG3 GLU 76 2HG GLU 76 -12.139 -3.971 -39.668 599 H PHE 77 H PHE 77 -7.724 -2.097 -39.352 600 HA PHE 77 HA PHE 77 -6.112 -0.678 -38.614 601 HB2 PHE 77 1HB PHE 77 -8.475 0.631 -38.392 602 HB3 PHE 77 2HB PHE 77 -7.864 0.801 -36.740 603 HD1 PHE 77 HD1 PHE 77 -7.215 1.544 -40.323 604 HD2 PHE 77 HD2 PHE 77 -5.902 2.197 -36.278 605 HE1 PHE 77 HE1 PHE 77 -5.700 3.364 -41.114 606 HE2 PHE 77 HE2 PHE 77 -4.396 4.018 -37.057 607 HZ PHE 77 HZ PHE 77 -4.280 4.590 -39.484 608 H ILE 78 H ILE 78 -6.721 -3.100 -36.956 609 HA ILE 78 HA ILE 78 -5.892 -4.146 -35.144 610 HB ILE 78 HB ILE 78 -3.712 -2.037 -34.855 611 HG12 ILE 78 1HG1 ILE 78 -2.709 -4.021 -36.557 612 HG13 ILE 78 2HG1 ILE 78 -4.295 -3.683 -37.247 613 HG21 ILE 78 1HG2 ILE 78 -3.708 -3.947 -33.239 614 HG22 ILE 78 2HG2 ILE 78 -3.697 -5.099 -34.589 615 HG23 ILE 78 3HG2 ILE 78 -2.300 -4.009 -34.316 616 HD11 ILE 78 1HD1 ILE 78 -3.662 -1.240 -37.366 617 HD12 ILE 78 2HD1 ILE 78 -2.062 -1.645 -36.701 618 HD13 ILE 78 3HD1 ILE 78 -2.552 -2.284 -38.293 619 H VAL 79 H VAL 79 -8.073 -2.641 -34.519 620 HA VAL 79 HA VAL 79 -7.561 -1.264 -31.967 621 HB VAL 79 HB VAL 79 -10.039 -1.241 -31.743 622 HG11 VAL 79 1HG1 VAL 79 -8.914 0.547 -33.024 623 HG12 VAL 79 2HG1 VAL 79 -9.120 -0.385 -34.519 624 HG13 VAL 79 3HG1 VAL 79 -10.543 0.218 -33.645 625 HG21 VAL 79 1HG2 VAL 79 -10.561 -3.423 -32.806 626 HG22 VAL 79 2HG2 VAL 79 -11.478 -2.109 -33.545 627 HG23 VAL 79 3HG2 VAL 79 -10.073 -2.776 -34.389 628 H THR 80 H THR 80 -8.827 -2.174 -29.983 629 HA THR 80 HA THR 80 -8.966 -5.121 -30.004 630 HB THR 80 HB THR 80 -6.675 -4.751 -29.205 631 HG1 THR 80 HG1 THR 80 -6.912 -5.814 -27.248 632 HG21 THR 80 1HG2 THR 80 -6.218 -3.476 -27.127 633 HG22 THR 80 2HG2 THR 80 -7.912 -2.953 -27.079 634 HG23 THR 80 3HG2 THR 80 -6.858 -2.415 -28.408 635 H ASP 81 H ASP 81 -10.440 -5.945 -28.595 636 HA ASP 81 HA ASP 81 -12.429 -4.055 -27.579 637 HB2 ASP 81 1HB ASP 81 -12.344 -7.107 -27.563 638 HB3 ASP 81 2HB ASP 81 -13.731 -6.139 -27.078 639 HXT ASP 81 H02 ASP 81 -9.991 -5.631 -26.425 Start of MODEL 23 1 H2 GLY 1 2H0 GLY 1 -0.073 5.469 -14.245 2 H GLY 1 1H0 GLY 1 0.275 5.492 -12.650 3 HA2 GLY 1 1HA GLY 1 2.590 5.315 -12.947 4 HA3 GLY 1 2HA GLY 1 1.873 4.172 -14.117 5 H SER 2 H SER 2 1.300 7.353 -14.848 6 HA SER 2 HA SER 2 3.020 7.310 -17.214 7 HB2 SER 2 1HB SER 2 0.657 8.284 -17.054 8 HB3 SER 2 2HB SER 2 1.388 9.667 -16.195 9 HG SER 2 HG SER 2 1.383 10.206 -18.323 10 H MET 3 H MET 3 4.863 7.081 -15.426 11 HA MET 3 HA MET 3 5.967 9.846 -14.991 12 HB2 MET 3 1HB MET 3 5.166 8.393 -12.971 13 HB3 MET 3 2HB MET 3 6.622 7.455 -13.258 14 HG2 MET 3 1HG MET 3 8.007 9.427 -12.884 15 HG3 MET 3 2HG MET 3 6.566 10.443 -12.736 16 HE1 MET 3 1HE MET 3 7.476 11.393 -10.468 17 HE2 MET 3 2HE MET 3 7.953 10.394 -9.081 18 HE3 MET 3 3HE MET 3 8.920 10.371 -10.579 19 H LYS 4 H LYS 4 6.338 8.579 -17.357 20 HA LYS 4 HA LYS 4 7.917 7.968 -18.892 21 HB2 LYS 4 1HB LYS 4 8.999 9.941 -17.838 22 HB3 LYS 4 2HB LYS 4 9.966 8.849 -16.853 23 HG2 LYS 4 1HG LYS 4 10.960 7.872 -18.881 24 HG3 LYS 4 2HG LYS 4 9.946 8.944 -19.871 25 HD2 LYS 4 1HD LYS 4 11.014 10.906 -18.756 26 HD3 LYS 4 2HD LYS 4 12.054 9.802 -17.855 27 HE2 LYS 4 1HE LYS 4 12.994 8.930 -19.967 28 HE3 LYS 4 2HE LYS 4 11.943 10.044 -20.897 29 HZ1 LYS 4 1HZ LYS 4 14.061 10.819 -18.960 30 HZ2 LYS 4 2HZ LYS 4 13.073 11.881 -19.750 31 HZ3 LYS 4 3HZ LYS 4 14.154 10.959 -20.604 32 H TYR 5 H TYR 5 7.396 5.812 -18.892 33 HA TYR 5 HA TYR 5 9.504 4.002 -17.766 34 HB2 TYR 5 1HB TYR 5 7.771 2.267 -17.567 35 HB3 TYR 5 2HB TYR 5 7.362 3.659 -16.562 36 HD1 TYR 5 HD1 TYR 5 6.327 1.526 -19.327 37 HD2 TYR 5 HD2 TYR 5 5.545 5.278 -17.383 38 HE1 TYR 5 HE1 TYR 5 4.132 1.677 -20.489 39 HE2 TYR 5 HE2 TYR 5 3.351 5.411 -18.544 40 HH TYR 5 HH TYR 5 2.307 3.038 -20.951 41 H LEU 6 H LEU 6 9.273 1.846 -19.255 42 HA LEU 6 HA LEU 6 10.326 2.570 -21.718 43 HB2 LEU 6 1HB LEU 6 9.156 0.091 -20.542 44 HB3 LEU 6 2HB LEU 6 9.270 0.113 -22.292 45 HG LEU 6 HG LEU 6 11.668 0.503 -22.158 46 HD11 LEU 6 1HD1 LEU 6 12.900 0.146 -20.016 47 HD12 LEU 6 2HD1 LEU 6 11.348 0.147 -19.156 48 HD13 LEU 6 3HD1 LEU 6 11.902 1.615 -19.992 49 HD21 LEU 6 1HD2 LEU 6 10.650 -1.900 -20.631 50 HD22 LEU 6 2HD2 LEU 6 12.242 -1.752 -21.392 51 HD23 LEU 6 3HD2 LEU 6 10.784 -1.739 -22.407 52 H ASN 7 H ASN 7 6.970 1.461 -21.219 53 HA ASN 7 HA ASN 7 5.110 1.568 -22.533 54 HB2 ASN 7 1HB ASN 7 5.694 4.005 -21.929 55 HB3 ASN 7 2HB ASN 7 6.182 4.165 -23.614 56 HD21 ASN 7 1HD2 ASN 7 2.894 5.016 -24.391 57 HD22 ASN 7 2HD2 ASN 7 4.605 5.416 -24.453 58 H VAL 8 H VAL 8 7.046 -0.034 -23.824 59 HA VAL 8 HA VAL 8 6.404 0.542 -26.685 60 HB VAL 8 HB VAL 8 8.318 -0.955 -27.239 61 HG11 VAL 8 1HG1 VAL 8 8.597 1.498 -27.224 62 HG12 VAL 8 2HG1 VAL 8 9.120 1.426 -25.521 63 HG13 VAL 8 3HG1 VAL 8 10.096 0.651 -26.795 64 HG21 VAL 8 1HG2 VAL 8 8.473 -2.246 -25.169 65 HG22 VAL 8 2HG2 VAL 8 10.030 -1.483 -25.533 66 HG23 VAL 8 3HG2 VAL 8 8.968 -0.807 -24.272 67 H LEU 9 H LEU 9 5.990 -1.597 -27.897 68 HA LEU 9 HA LEU 9 4.813 -3.596 -26.036 69 HB2 LEU 9 1HB LEU 9 2.837 -3.736 -27.563 70 HB3 LEU 9 2HB LEU 9 2.920 -2.329 -26.523 71 HG LEU 9 HG LEU 9 3.938 -2.021 -29.331 72 HD11 LEU 9 1HD1 LEU 9 1.821 -3.297 -29.592 73 HD12 LEU 9 2HD1 LEU 9 1.657 -1.621 -30.146 74 HD13 LEU 9 3HD1 LEU 9 0.983 -2.096 -28.576 75 HD21 LEU 9 1HD2 LEU 9 2.242 -0.270 -27.467 76 HD22 LEU 9 2HD2 LEU 9 2.949 0.214 -29.032 77 HD23 LEU 9 3HD2 LEU 9 4.004 -0.158 -27.652 78 H ALA 10 H ALA 10 4.316 -5.624 -26.930 79 HA ALA 10 HA ALA 10 5.926 -6.299 -29.337 80 HB1 ALA 10 1HB ALA 10 7.333 -6.526 -27.283 81 HB2 ALA 10 2HB ALA 10 6.143 -7.672 -26.622 82 HB3 ALA 10 3HB ALA 10 7.057 -8.076 -28.099 83 H LYS 11 H LYS 11 5.378 -8.300 -30.301 84 HA LYS 11 HA LYS 11 2.687 -9.352 -29.473 85 HB2 LYS 11 1HB LYS 11 3.065 -8.610 -31.874 86 HB3 LYS 11 2HB LYS 11 4.278 -9.903 -32.021 87 HG2 LYS 11 1HG LYS 11 2.426 -11.569 -31.404 88 HG3 LYS 11 2HG LYS 11 1.298 -10.221 -31.483 89 HD2 LYS 11 1HD LYS 11 1.049 -11.126 -33.578 90 HD3 LYS 11 2HD LYS 11 2.229 -9.840 -33.862 91 HE2 LYS 11 1HE LYS 11 2.993 -11.817 -35.019 92 HE3 LYS 11 2HE LYS 11 4.060 -11.560 -33.638 93 HZ1 LYS 11 1HZ LYS 11 2.847 -13.263 -32.435 94 HZ2 LYS 11 2HZ LYS 11 3.362 -13.871 -33.877 95 HZ3 LYS 11 3HZ LYS 11 1.783 -13.454 -33.683 96 H ALA 12 H ALA 12 2.473 -11.429 -28.796 97 HA ALA 12 HA ALA 12 4.860 -12.909 -28.031 98 HB1 ALA 12 1HB ALA 12 3.158 -14.717 -27.491 99 HB2 ALA 12 2HB ALA 12 2.874 -13.153 -26.707 100 HB3 ALA 12 3HB ALA 12 1.903 -13.624 -28.116 101 H LEU 13 H LEU 13 5.970 -14.388 -29.150 102 HA LEU 13 HA LEU 13 5.110 -15.012 -31.918 103 HB2 LEU 13 1HB LEU 13 7.612 -15.701 -30.322 104 HB3 LEU 13 2HB LEU 13 7.370 -16.066 -32.024 105 HG LEU 13 HG LEU 13 7.460 -13.255 -30.899 106 HD11 LEU 13 1HD1 LEU 13 9.591 -14.432 -30.534 107 HD12 LEU 13 2HD1 LEU 13 9.756 -13.172 -31.780 108 HD13 LEU 13 3HD1 LEU 13 9.642 -14.892 -32.260 109 HD21 LEU 13 1HD2 LEU 13 6.277 -13.364 -33.023 110 HD22 LEU 13 2HD2 LEU 13 7.573 -14.368 -33.739 111 HD23 LEU 13 3HD2 LEU 13 7.892 -12.679 -33.301 112 H TYR 14 H TYR 14 5.611 -16.465 -28.771 113 HA TYR 14 HA TYR 14 4.461 -19.036 -29.742 114 HB2 TYR 14 1HB TYR 14 6.425 -18.661 -27.460 115 HB3 TYR 14 2HB TYR 14 5.850 -20.188 -28.143 116 HD1 TYR 14 HD1 TYR 14 8.185 -17.379 -28.524 117 HD2 TYR 14 HD2 TYR 14 6.715 -20.954 -30.411 118 HE1 TYR 14 HE1 TYR 14 10.160 -17.382 -30.064 119 HE2 TYR 14 HE2 TYR 14 8.675 -20.920 -31.953 120 HH TYR 14 HH TYR 14 11.258 -18.477 -31.719 121 H ASP 15 H ASP 15 3.401 -20.221 -27.819 122 HA ASP 15 HA ASP 15 1.927 -18.220 -26.153 123 HB2 ASP 15 1HB ASP 15 0.284 -20.108 -25.892 124 HB3 ASP 15 2HB ASP 15 0.472 -19.567 -27.557 125 H ASN 16 H ASN 16 1.414 -18.794 -23.960 126 HA ASN 16 HA ASN 16 3.089 -20.845 -22.650 127 HB2 ASN 16 1HB ASN 16 4.381 -18.604 -22.893 128 HB3 ASN 16 2HB ASN 16 3.216 -17.957 -21.732 129 HD21 ASN 16 1HD2 ASN 16 4.858 -19.287 -18.980 130 HD22 ASN 16 2HD2 ASN 16 3.658 -18.190 -19.625 131 H VAL 17 H VAL 17 2.014 -21.677 -20.905 132 HA VAL 17 HA VAL 17 -0.349 -20.153 -19.858 133 HB VAL 17 HB VAL 17 0.427 -23.116 -19.551 134 HG11 VAL 17 1HG1 VAL 17 -0.710 -22.222 -17.550 135 HG12 VAL 17 2HG1 VAL 17 -2.013 -21.588 -18.575 136 HG13 VAL 17 3HG1 VAL 17 -1.760 -23.340 -18.439 137 HG21 VAL 17 1HG2 VAL 17 -1.824 -21.820 -21.148 138 HG22 VAL 17 2HG2 VAL 17 -0.430 -22.645 -21.823 139 HG23 VAL 17 3HG2 VAL 17 -1.636 -23.574 -20.913 140 H ALA 18 H ALA 18 0.047 -19.207 -17.863 141 HA ALA 18 HA ALA 18 2.715 -19.384 -16.795 142 HB1 ALA 18 1HB ALA 18 0.185 -18.172 -15.642 143 HB2 ALA 18 2HB ALA 18 1.826 -17.895 -15.063 144 HB3 ALA 18 3HB ALA 18 1.370 -17.329 -16.672 145 H GLU 19 H GLU 19 3.444 -20.788 -15.322 146 HA GLU 19 HA GLU 19 1.467 -22.584 -13.967 147 HB2 GLU 19 1HB GLU 19 4.499 -22.782 -14.123 148 HB3 GLU 19 2HB GLU 19 3.384 -23.993 -13.482 149 HG2 GLU 19 1HG GLU 19 2.319 -24.010 -15.829 150 HG3 GLU 19 2HG GLU 19 3.757 -23.111 -16.339 151 H SER 20 H SER 20 3.209 -19.807 -13.538 152 HA SER 20 HA SER 20 3.189 -20.046 -10.550 153 HB2 SER 20 1HB SER 20 5.250 -18.801 -12.411 154 HB3 SER 20 2HB SER 20 5.210 -18.522 -10.649 155 HG SER 20 HG SER 20 5.295 -21.111 -11.847 156 HA PRO 21 HA PRO 21 0.699 -16.494 -10.909 157 HB2 PRO 21 1HB PRO 21 1.100 -15.118 -8.573 158 HB3 PRO 21 2HB PRO 21 0.285 -16.720 -8.633 159 HG2 PRO 21 1HG PRO 21 3.177 -16.116 -8.047 160 HG3 PRO 21 2HG PRO 21 2.027 -17.104 -7.096 161 HD2 PRO 21 1HD PRO 21 3.773 -18.205 -8.804 162 HD3 PRO 21 2HD PRO 21 2.109 -18.866 -8.632 163 H ASP 22 H ASP 22 4.122 -15.863 -10.244 164 HA ASP 22 HA ASP 22 4.016 -13.027 -10.823 165 HB2 ASP 22 1HB ASP 22 6.281 -15.085 -10.822 166 HB3 ASP 22 2HB ASP 22 6.517 -13.358 -11.131 167 H GLU 23 H GLU 23 3.979 -15.894 -12.702 168 HA GLU 23 HA GLU 23 5.229 -14.713 -15.070 169 HB2 GLU 23 1HB GLU 23 5.653 -17.054 -14.247 170 HB3 GLU 23 2HB GLU 23 3.972 -17.431 -14.599 171 HG2 GLU 23 1HG GLU 23 4.315 -17.046 -16.952 172 HG3 GLU 23 2HG GLU 23 5.982 -16.541 -16.643 173 H LEU 24 H LEU 24 4.146 -14.271 -17.014 174 HA LEU 24 HA LEU 24 1.216 -13.899 -16.628 175 HB2 LEU 24 1HB LEU 24 3.308 -12.502 -17.972 176 HB3 LEU 24 2HB LEU 24 2.137 -13.012 -19.178 177 HG LEU 24 HG LEU 24 1.496 -11.379 -16.699 178 HD11 LEU 24 1HD1 LEU 24 1.256 -9.505 -18.248 179 HD12 LEU 24 2HD1 LEU 24 1.693 -10.541 -19.622 180 HD13 LEU 24 3HD1 LEU 24 2.891 -10.174 -18.356 181 HD21 LEU 24 1HD2 LEU 24 -0.236 -12.199 -19.060 182 HD22 LEU 24 2HD2 LEU 24 -0.691 -10.965 -17.866 183 HD23 LEU 24 3HD2 LEU 24 -0.468 -12.663 -17.362 184 H SER 25 H SER 25 -0.317 -14.952 -17.731 185 HA SER 25 HA SER 25 0.476 -17.117 -19.583 186 HB2 SER 25 1HB SER 25 -2.263 -16.184 -18.609 187 HB3 SER 25 2HB SER 25 -1.977 -17.553 -19.688 188 HG SER 25 HG SER 25 -1.015 -17.271 -17.031 189 H PHE 26 H PHE 26 0.515 -16.821 -21.729 190 HA PHE 26 HA PHE 26 -1.145 -14.684 -22.938 191 HB2 PHE 26 1HB PHE 26 0.757 -13.657 -24.118 192 HB3 PHE 26 2HB PHE 26 0.900 -13.456 -22.380 193 HD1 PHE 26 HD1 PHE 26 2.282 -15.281 -25.324 194 HD2 PHE 26 HD2 PHE 26 2.682 -14.449 -21.119 195 HE1 PHE 26 HE1 PHE 26 4.581 -16.236 -25.343 196 HE2 PHE 26 HE2 PHE 26 4.960 -15.435 -21.132 197 HZ PHE 26 HZ PHE 26 5.927 -16.313 -23.252 198 H ARG 27 H ARG 27 -1.255 -14.995 -25.316 199 HA ARG 27 HA ARG 27 -0.233 -17.712 -26.040 200 HB2 ARG 27 1HB ARG 27 -2.938 -16.558 -26.810 201 HB3 ARG 27 2HB ARG 27 -2.244 -18.098 -27.348 202 HG2 ARG 27 1HG ARG 27 -2.029 -18.515 -24.730 203 HG3 ARG 27 2HG ARG 27 -3.368 -17.361 -24.684 204 HD2 ARG 27 1HD ARG 27 -3.302 -19.938 -26.303 205 HD3 ARG 27 2HD ARG 27 -4.087 -19.735 -24.728 206 HE ARG 27 HE ARG 27 -5.097 -17.739 -26.472 207 HH11 ARG 27 1HH1 ARG 27 -5.250 -21.251 -26.084 208 HH12 ARG 27 2HH1 ARG 27 -6.802 -21.368 -26.859 209 HH21 ARG 27 1HH2 ARG 27 -7.115 -17.978 -27.445 210 HH22 ARG 27 2HH2 ARG 27 -7.844 -19.536 -27.598 211 H LYS 28 H LYS 28 0.241 -18.079 -28.212 212 HA LYS 28 HA LYS 28 1.756 -15.997 -29.349 213 HB2 LYS 28 1HB LYS 28 1.868 -17.429 -31.375 214 HB3 LYS 28 2HB LYS 28 2.255 -18.268 -29.870 215 HG2 LYS 28 1HG LYS 28 -0.099 -19.192 -29.875 216 HG3 LYS 28 2HG LYS 28 -0.268 -18.534 -31.511 217 HD2 LYS 28 1HD LYS 28 1.694 -19.852 -32.240 218 HD3 LYS 28 2HD LYS 28 1.891 -20.464 -30.591 219 HE2 LYS 28 1HE LYS 28 0.771 -22.157 -31.823 220 HE3 LYS 28 2HE LYS 28 -0.431 -21.439 -30.747 221 HZ1 LYS 28 1HZ LYS 28 -1.199 -20.099 -32.647 222 HZ2 LYS 28 2HZ LYS 28 -1.314 -21.717 -32.971 223 HZ3 LYS 28 3HZ LYS 28 -0.095 -20.819 -33.640 224 H GLY 29 H GLY 29 1.328 -14.296 -30.507 225 HA2 GLY 29 1HA GLY 29 0.138 -13.212 -32.332 226 HA3 GLY 29 2HA GLY 29 -1.311 -14.118 -31.905 227 H ASP 30 H ASP 30 -0.666 -13.545 -28.935 228 HA ASP 30 HA ASP 30 -2.349 -11.227 -28.765 229 HB2 ASP 30 1HB ASP 30 -1.849 -13.293 -27.141 230 HB3 ASP 30 2HB ASP 30 -0.674 -12.157 -26.446 231 H ILE 31 H ILE 31 -1.866 -9.246 -27.584 232 HA ILE 31 HA ILE 31 0.909 -8.238 -28.222 233 HB ILE 31 HB ILE 31 -1.720 -6.643 -28.132 234 HG12 ILE 31 1HG1 ILE 31 -1.787 -8.242 -29.997 235 HG13 ILE 31 2HG1 ILE 31 -1.741 -6.563 -30.543 236 HG21 ILE 31 1HG2 ILE 31 -0.311 -4.911 -29.338 237 HG22 ILE 31 2HG2 ILE 31 0.188 -5.228 -27.666 238 HG23 ILE 31 3HG2 ILE 31 1.124 -5.923 -29.019 239 HD11 ILE 31 1HD1 ILE 31 0.719 -8.348 -30.449 240 HD12 ILE 31 2HD1 ILE 31 -0.361 -8.214 -31.837 241 HD13 ILE 31 3HD1 ILE 31 0.510 -6.778 -31.275 242 H MET 32 H MET 32 2.038 -7.454 -26.488 243 HA MET 32 HA MET 32 0.484 -6.527 -24.116 244 HB2 MET 32 1HB MET 32 2.146 -7.627 -22.643 245 HB3 MET 32 2HB MET 32 1.208 -8.756 -23.597 246 HG2 MET 32 1HG MET 32 3.318 -8.491 -25.238 247 HG3 MET 32 2HG MET 32 4.095 -8.147 -23.689 248 HE1 MET 32 1HE MET 32 2.369 -10.743 -26.048 249 HE2 MET 32 2HE MET 32 1.976 -12.084 -24.949 250 HE3 MET 32 3HE MET 32 1.088 -10.553 -24.832 251 H THR 33 H THR 33 1.505 -4.991 -22.787 252 HA THR 33 HA THR 33 3.473 -3.347 -24.300 253 HB THR 33 HB THR 33 2.034 -2.714 -21.672 254 HG1 THR 33 HG1 THR 33 0.434 -2.826 -23.127 255 HG21 THR 33 1HG2 THR 33 3.419 -0.944 -23.724 256 HG22 THR 33 2HG2 THR 33 4.013 -1.299 -22.108 257 HG23 THR 33 3HG2 THR 33 2.523 -0.369 -22.296 258 H VAL 34 H VAL 34 5.582 -3.321 -23.749 259 HA VAL 34 HA VAL 34 6.447 -4.903 -21.362 260 HB VAL 34 HB VAL 34 8.047 -3.653 -23.641 261 HG11 VAL 34 1HG1 VAL 34 8.966 -5.393 -21.316 262 HG12 VAL 34 2HG1 VAL 34 9.955 -5.004 -22.747 263 HG13 VAL 34 3HG1 VAL 34 9.440 -3.720 -21.645 264 HG21 VAL 34 1HG2 VAL 34 8.377 -5.876 -24.466 265 HG22 VAL 34 2HG2 VAL 34 7.562 -6.586 -23.057 266 HG23 VAL 34 3HG2 VAL 34 6.629 -5.650 -24.250 267 H LEU 35 H LEU 35 6.939 -3.963 -19.538 268 HA LEU 35 HA LEU 35 7.047 -0.984 -19.455 269 HB2 LEU 35 1HB LEU 35 6.698 -3.020 -17.231 270 HB3 LEU 35 2HB LEU 35 6.534 -1.286 -17.070 271 HG LEU 35 HG LEU 35 4.691 -3.057 -18.697 272 HD11 LEU 35 1HD1 LEU 35 4.541 -3.584 -16.316 273 HD12 LEU 35 2HD1 LEU 35 3.097 -2.708 -16.845 274 HD13 LEU 35 3HD1 LEU 35 4.347 -1.854 -15.916 275 HD21 LEU 35 1HD2 LEU 35 3.170 -1.086 -18.665 276 HD22 LEU 35 2HD2 LEU 35 4.679 -0.745 -19.530 277 HD23 LEU 35 3HD2 LEU 35 4.448 -0.122 -17.878 278 H GLU 36 H GLU 36 8.839 -3.881 -18.599 279 HA GLU 36 HA GLU 36 11.236 -2.225 -18.146 280 HB2 GLU 36 1HB GLU 36 9.679 -3.182 -15.975 281 HB3 GLU 36 2HB GLU 36 11.058 -4.269 -16.082 282 HG2 GLU 36 1HG GLU 36 11.242 -1.242 -15.908 283 HG3 GLU 36 2HG GLU 36 11.432 -2.351 -14.546 284 H ARG 37 H ARG 37 13.211 -3.663 -18.020 285 HA ARG 37 HA ARG 37 12.701 -6.354 -19.220 286 HB2 ARG 37 1HB ARG 37 14.702 -4.306 -20.202 287 HB3 ARG 37 2HB ARG 37 14.677 -6.004 -20.687 288 HG2 ARG 37 1HG ARG 37 12.392 -5.649 -21.619 289 HG3 ARG 37 2HG ARG 37 12.543 -3.939 -21.251 290 HD2 ARG 37 1HD ARG 37 14.461 -5.485 -23.055 291 HD3 ARG 37 2HD ARG 37 13.094 -4.514 -23.622 292 HE ARG 37 HE ARG 37 14.183 -2.523 -23.011 293 HH11 ARG 37 1HH1 ARG 37 16.243 -5.313 -22.204 294 HH12 ARG 37 2HH1 ARG 37 17.660 -4.318 -22.030 295 HH21 ARG 37 1HH2 ARG 37 16.055 -1.346 -22.759 296 HH22 ARG 37 2HH2 ARG 37 17.551 -2.131 -22.359 297 H ASP 38 H ASP 38 14.153 -7.898 -18.581 298 HA ASP 38 HA ASP 38 15.595 -8.938 -17.219 299 HB2 ASP 38 1HB ASP 38 17.267 -6.410 -17.211 300 HB3 ASP 38 2HB ASP 38 17.803 -8.084 -17.041 301 H THR 39 H THR 39 13.371 -7.634 -16.289 302 HA THR 39 HA THR 39 13.675 -5.925 -14.073 303 HB THR 39 HB THR 39 11.596 -6.244 -15.490 304 HG1 THR 39 HG1 THR 39 11.517 -6.426 -12.663 305 HG21 THR 39 1HG2 THR 39 10.041 -8.083 -14.970 306 HG22 THR 39 2HG2 THR 39 11.186 -8.768 -13.818 307 HG23 THR 39 3HG2 THR 39 11.582 -8.749 -15.556 308 H GLN 40 H GLN 40 14.146 -9.308 -14.175 309 HA GLN 40 HA GLN 40 13.596 -9.541 -11.244 310 HB2 GLN 40 1HB GLN 40 12.609 -11.055 -13.295 311 HB3 GLN 40 2HB GLN 40 14.069 -11.964 -12.911 312 HG2 GLN 40 1HG GLN 40 12.497 -13.012 -11.569 313 HG3 GLN 40 2HG GLN 40 13.186 -11.853 -10.443 314 HE21 GLN 40 1HE2 GLN 40 9.407 -11.824 -10.352 315 HE22 GLN 40 2HE2 GLN 40 10.583 -13.090 -10.250 316 H GLY 41 H GLY 41 16.042 -8.716 -13.178 317 HA2 GLY 41 1HA GLY 41 18.338 -8.759 -12.760 318 HA3 GLY 41 2HA GLY 41 18.097 -9.975 -11.484 319 H LEU 42 H LEU 42 16.264 -11.101 -13.852 320 HA LEU 42 HA LEU 42 18.357 -12.930 -14.881 321 HB2 LEU 42 1HB LEU 42 15.325 -13.029 -15.171 322 HB3 LEU 42 2HB LEU 42 16.454 -14.256 -15.705 323 HG LEU 42 HG LEU 42 15.953 -13.483 -12.830 324 HD11 LEU 42 1HD1 LEU 42 15.036 -15.902 -14.411 325 HD12 LEU 42 2HD1 LEU 42 13.991 -14.569 -13.866 326 HD13 LEU 42 3HD1 LEU 42 14.781 -15.638 -12.679 327 HD21 LEU 42 1HD2 LEU 42 17.183 -15.602 -12.332 328 HD22 LEU 42 2HD2 LEU 42 18.206 -14.355 -13.066 329 HD23 LEU 42 3HD2 LEU 42 17.619 -15.722 -14.050 330 H ASP 43 H ASP 43 19.299 -12.383 -16.703 331 HA ASP 43 HA ASP 43 18.425 -10.314 -18.440 332 HB2 ASP 43 1HB ASP 43 20.778 -11.215 -18.149 333 HB3 ASP 43 2HB ASP 43 20.298 -12.620 -19.128 334 H GLY 44 H GLY 44 17.084 -10.306 -20.129 335 HA2 GLY 44 1HA GLY 44 16.042 -11.211 -22.020 336 HA3 GLY 44 2HA GLY 44 16.391 -12.852 -21.442 337 H TRP 45 H TRP 45 15.064 -11.287 -18.797 338 HA TRP 45 HA TRP 45 12.330 -12.287 -19.544 339 HB2 TRP 45 1HB TRP 45 13.805 -12.003 -16.913 340 HB3 TRP 45 2HB TRP 45 12.029 -12.096 -16.967 341 HD1 TRP 45 HD1 TRP 45 15.131 -14.251 -17.751 342 HE1 TRP 45 HE1 TRP 45 14.473 -16.698 -17.877 343 HE3 TRP 45 HE3 TRP 45 10.069 -13.620 -17.463 344 HZ2 TRP 45 HZ2 TRP 45 12.029 -18.214 -17.869 345 HZ3 TRP 45 HZ3 TRP 45 8.592 -15.646 -17.483 346 HH2 TRP 45 HH2 TRP 45 9.580 -17.908 -17.697 347 H TRP 46 H TRP 46 10.729 -10.790 -19.867 348 HA TRP 46 HA TRP 46 11.420 -7.990 -19.058 349 HB2 TRP 46 1HB TRP 46 9.680 -9.049 -21.306 350 HB3 TRP 46 2HB TRP 46 9.909 -7.340 -20.919 351 HD1 TRP 46 HD1 TRP 46 13.234 -8.675 -20.447 352 HE1 TRP 46 HE1 TRP 46 14.733 -8.524 -22.483 353 HE3 TRP 46 HE3 TRP 46 9.580 -7.814 -23.903 354 HZ2 TRP 46 HZ2 TRP 46 14.396 -8.058 -25.293 355 HZ3 TRP 46 HZ3 TRP 46 10.236 -7.523 -26.301 356 HH2 TRP 46 HH2 TRP 46 12.636 -7.659 -26.980 357 H LEU 47 H LEU 47 9.885 -6.688 -18.102 358 HA LEU 47 HA LEU 47 7.625 -8.097 -16.794 359 HB2 LEU 47 1HB LEU 47 9.018 -6.357 -15.574 360 HB3 LEU 47 2HB LEU 47 8.460 -5.164 -16.711 361 HG LEU 47 HG LEU 47 6.117 -5.523 -15.924 362 HD11 LEU 47 1HD1 LEU 47 7.469 -7.400 -13.920 363 HD12 LEU 47 2HD1 LEU 47 6.162 -7.779 -15.064 364 HD13 LEU 47 3HD1 LEU 47 5.840 -6.713 -13.695 365 HD21 LEU 47 1HD2 LEU 47 8.182 -4.840 -13.791 366 HD22 LEU 47 2HD2 LEU 47 6.449 -4.406 -13.734 367 HD23 LEU 47 3HD2 LEU 47 7.497 -3.736 -15.005 368 H CYS 48 H CYS 48 5.808 -8.320 -17.964 369 HA CYS 48 HA CYS 48 5.219 -6.169 -19.971 370 HB2 CYS 48 1HB CYS 48 4.556 -9.134 -20.059 371 HB3 CYS 48 2HB CYS 48 4.123 -7.933 -21.293 372 HG CYS 48 HG CYS 48 7.099 -8.904 -20.258 373 H SER 49 H SER 49 2.962 -5.760 -20.347 374 HA SER 49 HA SER 49 1.203 -6.640 -18.093 375 HB2 SER 49 1HB SER 49 0.069 -4.404 -18.342 376 HB3 SER 49 2HB SER 49 1.714 -4.345 -17.671 377 HG SER 49 HG SER 49 2.499 -3.770 -19.695 378 H LEU 50 H LEU 50 -0.627 -7.516 -18.645 379 HA LEU 50 HA LEU 50 -1.740 -7.230 -21.372 380 HB2 LEU 50 1HB LEU 50 -0.010 -9.002 -21.554 381 HB3 LEU 50 2HB LEU 50 -0.737 -9.865 -20.198 382 HG LEU 50 HG LEU 50 -2.799 -10.211 -21.568 383 HD11 LEU 50 1HD1 LEU 50 -1.135 -9.061 -23.825 384 HD12 LEU 50 2HD1 LEU 50 -2.573 -8.306 -23.126 385 HD13 LEU 50 3HD1 LEU 50 -2.709 -9.843 -23.996 386 HD21 LEU 50 1HD2 LEU 50 -1.057 -11.912 -21.432 387 HD22 LEU 50 2HD2 LEU 50 -0.178 -11.167 -22.785 388 HD23 LEU 50 3HD2 LEU 50 -1.783 -11.906 -23.048 389 H HIS 51 H HIS 51 -3.925 -7.506 -21.316 390 HA HIS 51 HA HIS 51 -6.026 -7.768 -20.491 391 HB2 HIS 51 1HB HIS 51 -4.992 -10.135 -20.631 392 HB3 HIS 51 2HB HIS 51 -5.004 -10.108 -18.865 393 HD1 HIS 51 HD1 HIS 51 -7.293 -10.192 -21.899 394 HD2 HIS 51 HD2 HIS 51 -7.548 -10.341 -17.732 395 HE1 HIS 51 HE1 HIS 51 -9.663 -10.866 -21.326 396 H GLY 52 H GLY 52 -4.368 -5.953 -18.921 397 HA2 GLY 52 1HA GLY 52 -4.933 -4.595 -17.121 398 HA3 GLY 52 2HA GLY 52 -6.173 -5.769 -16.644 399 H ARG 53 H ARG 53 -3.201 -7.354 -17.038 400 HA ARG 53 HA ARG 53 -2.474 -6.986 -14.152 401 HB2 ARG 53 1HB ARG 53 -2.348 -9.593 -15.724 402 HB3 ARG 53 2HB ARG 53 -2.072 -9.368 -13.995 403 HG2 ARG 53 1HG ARG 53 -4.476 -8.747 -13.757 404 HG3 ARG 53 2HG ARG 53 -4.709 -9.090 -15.478 405 HD2 ARG 53 1HD ARG 53 -3.766 -11.408 -15.019 406 HD3 ARG 53 2HD ARG 53 -3.903 -11.003 -13.289 407 HE ARG 53 HE ARG 53 -6.379 -10.500 -14.636 408 HH11 ARG 53 1HH1 ARG 53 -4.436 -13.203 -13.459 409 HH12 ARG 53 2HH1 ARG 53 -5.828 -14.254 -13.304 410 HH21 ARG 53 1HH2 ARG 53 -8.099 -11.885 -14.396 411 HH22 ARG 53 2HH2 ARG 53 -7.859 -13.506 -13.839 412 H GLN 54 H GLN 54 -0.124 -7.632 -13.783 413 HA GLN 54 HA GLN 54 1.425 -7.530 -16.325 414 HB2 GLN 54 1HB GLN 54 3.003 -6.064 -15.513 415 HB3 GLN 54 2HB GLN 54 1.499 -5.358 -14.932 416 HG2 GLN 54 1HG GLN 54 3.157 -7.143 -13.123 417 HG3 GLN 54 2HG GLN 54 3.599 -5.461 -13.380 418 HE21 GLN 54 1HE2 GLN 54 1.634 -4.624 -10.672 419 HE22 GLN 54 2HE2 GLN 54 3.219 -4.681 -11.388 420 H GLY 55 H GLY 55 3.522 -8.663 -16.180 421 HA2 GLY 55 1HA GLY 55 4.177 -10.239 -13.883 422 HA3 GLY 55 2HA GLY 55 3.265 -11.218 -15.063 423 H ILE 56 H ILE 56 5.780 -12.060 -14.622 424 HA ILE 56 HA ILE 56 7.556 -10.718 -16.548 425 HB ILE 56 HB ILE 56 9.279 -12.308 -15.861 426 HG12 ILE 56 1HG1 ILE 56 7.150 -13.666 -14.155 427 HG13 ILE 56 2HG1 ILE 56 7.783 -14.325 -15.647 428 HG21 ILE 56 1HG2 ILE 56 7.754 -11.389 -13.360 429 HG22 ILE 56 2HG2 ILE 56 9.510 -11.633 -13.542 430 HG23 ILE 56 3HG2 ILE 56 8.713 -10.303 -14.404 431 HD11 ILE 56 1HD1 ILE 56 10.063 -14.430 -14.592 432 HD12 ILE 56 2HD1 ILE 56 9.363 -13.885 -13.074 433 HD13 ILE 56 3HD1 ILE 56 8.848 -15.435 -13.771 434 H VAL 57 H VAL 57 8.265 -11.475 -18.456 435 HA VAL 57 HA VAL 57 7.018 -13.961 -19.569 436 HB VAL 57 HB VAL 57 7.028 -11.150 -20.790 437 HG11 VAL 57 1HG1 VAL 57 6.465 -13.828 -22.062 438 HG12 VAL 57 2HG1 VAL 57 5.859 -12.314 -22.724 439 HG13 VAL 57 3HG1 VAL 57 7.605 -12.573 -22.597 440 HG21 VAL 57 1HG2 VAL 57 4.570 -11.484 -20.945 441 HG22 VAL 57 2HG2 VAL 57 4.754 -13.028 -20.091 442 HG23 VAL 57 3HG2 VAL 57 5.147 -11.510 -19.265 443 HA PRO 58 HA PRO 58 11.295 -14.048 -20.756 444 HB2 PRO 58 1HB PRO 58 11.301 -16.068 -22.625 445 HB3 PRO 58 2HB PRO 58 11.236 -16.364 -20.861 446 HG2 PRO 58 1HG PRO 58 8.994 -16.337 -22.843 447 HG3 PRO 58 2HG PRO 58 9.366 -17.520 -21.544 448 HD2 PRO 58 1HD PRO 58 7.514 -15.571 -21.248 449 HD3 PRO 58 2HD PRO 58 8.515 -16.145 -19.890 450 H GLY 59 H GLY 59 12.043 -12.440 -21.978 451 HA2 GLY 59 1HA GLY 59 10.449 -11.189 -23.971 452 HA3 GLY 59 2HA GLY 59 12.148 -10.851 -23.595 453 H ASN 60 H ASN 60 12.944 -13.670 -24.296 454 HA ASN 60 HA ASN 60 13.363 -13.141 -27.103 455 HB2 ASN 60 1HB ASN 60 14.656 -14.638 -25.267 456 HB3 ASN 60 2HB ASN 60 13.781 -15.921 -26.125 457 HD21 ASN 60 1HD2 ASN 60 15.448 -15.131 -29.260 458 HD22 ASN 60 2HD2 ASN 60 13.825 -15.406 -28.657 459 H ARG 61 H ARG 61 10.656 -14.431 -25.436 460 HA ARG 61 HA ARG 61 9.763 -15.979 -27.836 461 HB2 ARG 61 1HB ARG 61 8.506 -15.575 -25.086 462 HB3 ARG 61 2HB ARG 61 7.679 -16.361 -26.438 463 HG2 ARG 61 1HG ARG 61 9.629 -18.001 -26.556 464 HG3 ARG 61 2HG ARG 61 10.140 -17.360 -24.974 465 HD2 ARG 61 1HD ARG 61 7.938 -17.946 -24.024 466 HD3 ARG 61 2HD ARG 61 7.372 -18.458 -25.597 467 HE ARG 61 HE ARG 61 9.706 -19.948 -24.885 468 HH11 ARG 61 1HH1 ARG 61 6.274 -19.723 -24.075 469 HH12 ARG 61 2HH1 ARG 61 6.201 -21.375 -23.525 470 HH21 ARG 61 1HH2 ARG 61 9.506 -22.067 -24.228 471 HH22 ARG 61 2HH2 ARG 61 7.983 -22.659 -23.612 472 H LEU 62 H LEU 62 10.028 -12.813 -27.121 473 HA LEU 62 HA LEU 62 7.360 -12.098 -28.280 474 HB2 LEU 62 1HB LEU 62 9.213 -10.447 -26.515 475 HB3 LEU 62 2HB LEU 62 7.672 -9.926 -27.163 476 HG LEU 62 HG LEU 62 8.064 -12.082 -25.077 477 HD11 LEU 62 1HD1 LEU 62 6.966 -10.377 -23.615 478 HD12 LEU 62 2HD1 LEU 62 7.074 -9.227 -24.959 479 HD13 LEU 62 3HD1 LEU 62 8.554 -9.866 -24.235 480 HD21 LEU 62 1HD2 LEU 62 6.095 -12.612 -26.392 481 HD22 LEU 62 2HD2 LEU 62 5.543 -10.922 -26.322 482 HD23 LEU 62 3HD2 LEU 62 5.577 -11.918 -24.855 483 H LYS 63 H LYS 63 7.366 -10.110 -29.571 484 HA LYS 63 HA LYS 63 10.038 -9.377 -30.677 485 HB2 LYS 63 1HB LYS 63 8.860 -10.997 -32.211 486 HB3 LYS 63 2HB LYS 63 7.542 -9.843 -32.373 487 HG2 LYS 63 1HG LYS 63 9.163 -8.203 -33.308 488 HG3 LYS 63 2HG LYS 63 10.441 -9.415 -33.173 489 HD2 LYS 63 1HD LYS 63 9.101 -10.903 -34.668 490 HD3 LYS 63 2HD LYS 63 7.927 -9.597 -34.858 491 HE2 LYS 63 1HE LYS 63 9.442 -9.584 -36.754 492 HE3 LYS 63 2HE LYS 63 9.778 -8.153 -35.739 493 HZ1 LYS 63 1HZ LYS 63 11.811 -9.306 -36.412 494 HZ2 LYS 63 2HZ LYS 63 11.308 -10.683 -35.667 495 HZ3 LYS 63 3HZ LYS 63 11.633 -9.341 -34.775 496 H ILE 64 H ILE 64 10.293 -7.266 -30.321 497 HA ILE 64 HA ILE 64 8.212 -5.461 -29.558 498 HB ILE 64 HB ILE 64 11.000 -4.923 -30.692 499 HG12 ILE 64 1HG1 ILE 64 10.932 -6.142 -28.507 500 HG13 ILE 64 2HG1 ILE 64 11.716 -4.588 -28.441 501 HG21 ILE 64 1HG2 ILE 64 8.997 -2.998 -29.410 502 HG22 ILE 64 2HG2 ILE 64 10.715 -2.630 -29.651 503 HG23 ILE 64 3HG2 ILE 64 9.672 -2.913 -31.053 504 HD11 ILE 64 1HD1 ILE 64 10.265 -5.053 -26.450 505 HD12 ILE 64 2HD1 ILE 64 9.833 -3.553 -27.282 506 HD13 ILE 64 3HD1 ILE 64 8.842 -5.004 -27.503 507 H LEU 65 H LEU 65 6.914 -4.192 -30.681 508 HA LEU 65 HA LEU 65 6.772 -4.637 -33.590 509 HB2 LEU 65 1HB LEU 65 4.896 -3.349 -31.561 510 HB3 LEU 65 2HB LEU 65 4.532 -3.520 -33.276 511 HG LEU 65 HG LEU 65 5.128 -5.894 -31.480 512 HD11 LEU 65 1HD1 LEU 65 3.191 -4.730 -30.601 513 HD12 LEU 65 2HD1 LEU 65 2.694 -6.241 -31.379 514 HD13 LEU 65 3HD1 LEU 65 2.441 -4.695 -32.219 515 HD21 LEU 65 1HD2 LEU 65 3.943 -7.137 -33.269 516 HD22 LEU 65 2HD2 LEU 65 5.408 -6.342 -33.887 517 HD23 LEU 65 3HD2 LEU 65 3.802 -5.642 -34.218 518 H VAL 66 H VAL 66 7.028 -3.070 -35.013 519 HA VAL 66 HA VAL 66 7.902 -1.186 -35.960 520 HB VAL 66 HB VAL 66 6.771 0.511 -33.728 521 HG11 VAL 66 1HG1 VAL 66 7.847 1.620 -35.699 522 HG12 VAL 66 2HG1 VAL 66 6.739 0.769 -36.788 523 HG13 VAL 66 3HG1 VAL 66 6.116 1.970 -35.630 524 HG21 VAL 66 1HG2 VAL 66 4.996 -1.086 -33.984 525 HG22 VAL 66 2HG2 VAL 66 4.523 0.355 -34.896 526 HG23 VAL 66 3HG2 VAL 66 5.140 -1.058 -35.769 527 H GLY 67 H GLY 67 9.637 -2.613 -34.214 528 HA2 GLY 67 1HA GLY 67 11.054 -0.975 -32.434 529 HA3 GLY 67 2HA GLY 67 11.688 -2.413 -33.238 530 H MET 68 H MET 68 11.586 -1.397 -35.975 531 HA MET 68 HA MET 68 13.131 1.080 -36.029 532 HB2 MET 68 1HB MET 68 15.187 0.110 -36.946 533 HB3 MET 68 2HB MET 68 14.887 -0.556 -35.332 534 HG2 MET 68 1HG MET 68 13.978 -2.624 -36.331 535 HG3 MET 68 2HG MET 68 14.262 -1.955 -37.948 536 HE1 MET 68 1HE MET 68 17.520 -3.464 -38.796 537 HE2 MET 68 2HE MET 68 15.806 -3.965 -38.832 538 HE3 MET 68 3HE MET 68 16.268 -2.314 -39.309 539 H TYR 69 H TYR 69 13.776 1.618 -38.253 540 HA TYR 69 HA TYR 69 11.837 0.649 -40.265 541 HB2 TYR 69 1HB TYR 69 13.582 3.005 -39.854 542 HB3 TYR 69 2HB TYR 69 13.549 2.413 -41.513 543 HD1 TYR 69 HD1 TYR 69 11.463 3.822 -38.775 544 HD2 TYR 69 HD2 TYR 69 11.591 2.611 -42.897 545 HE1 TYR 69 HE1 TYR 69 9.292 4.990 -39.181 546 HE2 TYR 69 HE2 TYR 69 9.419 3.764 -43.298 547 HH TYR 69 HH TYR 69 7.747 5.053 -42.403 548 H ASP 70 H ASP 70 13.095 0.436 -42.542 549 HA ASP 70 HA ASP 70 14.409 -0.888 -43.818 550 HB2 ASP 70 1HB ASP 70 16.517 0.027 -41.860 551 HB3 ASP 70 2HB ASP 70 16.822 -0.585 -43.486 552 H LYS 71 H LYS 71 12.963 -2.460 -42.234 553 HA LYS 71 HA LYS 71 14.447 -4.304 -40.632 554 HB2 LYS 71 1HB LYS 71 12.510 -5.757 -40.760 555 HB3 LYS 71 2HB LYS 71 11.960 -4.083 -40.567 556 HG2 LYS 71 1HG LYS 71 11.444 -3.953 -42.981 557 HG3 LYS 71 2HG LYS 71 12.061 -5.612 -43.200 558 HD2 LYS 71 1HD LYS 71 10.336 -6.424 -41.592 559 HD3 LYS 71 2HD LYS 71 9.644 -4.788 -41.530 560 HE2 LYS 71 1HE LYS 71 9.307 -4.846 -43.990 561 HE3 LYS 71 2HE LYS 71 10.002 -6.482 -44.051 562 HZ1 LYS 71 1HZ LYS 71 8.177 -7.269 -42.708 563 HZ2 LYS 71 2HZ LYS 71 7.569 -6.505 -44.040 564 HZ3 LYS 71 3HZ LYS 71 7.537 -5.752 -42.566 565 H LYS 72 H LYS 72 15.122 -6.444 -41.174 566 HA LYS 72 HA LYS 72 16.600 -6.641 -43.582 567 HB2 LYS 72 1HB LYS 72 15.724 -8.750 -41.577 568 HB3 LYS 72 2HB LYS 72 16.880 -9.045 -42.892 569 HG2 LYS 72 1HG LYS 72 18.401 -7.348 -41.979 570 HG3 LYS 72 2HG LYS 72 17.255 -7.004 -40.670 571 HD2 LYS 72 1HD LYS 72 17.472 -9.267 -39.797 572 HD3 LYS 72 2HD LYS 72 18.488 -9.732 -41.181 573 HE2 LYS 72 1HE LYS 72 19.902 -9.329 -39.228 574 HE3 LYS 72 2HE LYS 72 20.233 -8.133 -40.491 575 HZ1 LYS 72 1HZ LYS 72 20.090 -7.149 -38.257 576 HZ2 LYS 72 2HZ LYS 72 18.517 -7.633 -38.130 577 HZ3 LYS 72 3HZ LYS 72 18.940 -6.518 -39.264 578 HA PRO 73 HA PRO 73 13.451 -8.051 -46.330 579 HB2 PRO 73 1HB PRO 73 14.875 -9.362 -48.241 580 HB3 PRO 73 2HB PRO 73 15.009 -7.576 -48.017 581 HG2 PRO 73 1HG PRO 73 16.787 -9.766 -46.943 582 HG3 PRO 73 2HG PRO 73 17.242 -8.291 -47.863 583 HD2 PRO 73 1HD PRO 73 17.387 -8.364 -45.168 584 HD3 PRO 73 2HD PRO 73 16.843 -6.877 -46.040 585 H ALA 74 H ALA 74 12.629 -10.096 -47.453 586 HA ALA 74 HA ALA 74 12.493 -12.260 -45.507 587 HB1 ALA 74 1HB ALA 74 10.926 -13.277 -47.138 588 HB2 ALA 74 2HB ALA 74 10.513 -11.572 -46.871 589 HB3 ALA 74 3HB ALA 74 11.362 -12.061 -48.356 590 H GLY 75 H GLY 75 12.796 -14.546 -46.266 591 HA2 GLY 75 1HA GLY 75 14.981 -14.874 -48.234 592 HA3 GLY 75 2HA GLY 75 15.191 -15.514 -46.591 593 H GLU 76 H GLU 76 15.231 -17.659 -47.227 594 HA GLU 76 HA GLU 76 14.389 -19.731 -47.538 595 HB2 GLU 76 1HB GLU 76 11.605 -18.513 -47.568 596 HB3 GLU 76 2HB GLU 76 12.033 -20.218 -47.333 597 HG2 GLU 76 1HG GLU 76 13.178 -19.682 -45.234 598 HG3 GLU 76 2HG GLU 76 12.796 -17.967 -45.440 599 H PHE 77 H PHE 77 12.346 -20.753 -49.083 600 HA PHE 77 HA PHE 77 12.126 -21.592 -51.174 601 HB2 PHE 77 1HB PHE 77 10.731 -19.414 -51.045 602 HB3 PHE 77 2HB PHE 77 11.913 -18.786 -52.197 603 HD1 PHE 77 HD1 PHE 77 9.160 -21.178 -51.663 604 HD2 PHE 77 HD2 PHE 77 12.061 -19.730 -54.490 605 HE1 PHE 77 HE1 PHE 77 7.935 -22.342 -53.492 606 HE2 PHE 77 HE2 PHE 77 10.848 -20.886 -56.337 607 HZ PHE 77 HZ PHE 77 8.776 -22.210 -55.841 608 H ILE 78 H ILE 78 14.307 -22.434 -51.315 609 HA ILE 78 HA ILE 78 16.236 -21.022 -52.966 610 HB ILE 78 HB ILE 78 17.457 -23.143 -53.058 611 HG12 ILE 78 1HG1 ILE 78 16.226 -24.918 -51.342 612 HG13 ILE 78 2HG1 ILE 78 14.841 -24.304 -52.261 613 HG21 ILE 78 1HG2 ILE 78 16.380 -22.690 -50.228 614 HG22 ILE 78 2HG2 ILE 78 17.952 -23.408 -50.677 615 HG23 ILE 78 3HG2 ILE 78 17.614 -21.701 -51.005 616 HD11 ILE 78 1HD1 ILE 78 17.355 -25.474 -53.542 617 HD12 ILE 78 2HD1 ILE 78 15.862 -26.385 -53.218 618 HD13 ILE 78 3HD1 ILE 78 15.852 -25.029 -54.365 619 H VAL 79 H VAL 79 16.829 -21.767 -55.141 620 HA VAL 79 HA VAL 79 14.527 -22.955 -56.653 621 HB VAL 79 HB VAL 79 15.073 -21.383 -58.511 622 HG11 VAL 79 1HG1 VAL 79 13.971 -19.421 -57.594 623 HG12 VAL 79 2HG1 VAL 79 13.271 -20.869 -56.849 624 HG13 VAL 79 3HG1 VAL 79 14.433 -19.882 -55.933 625 HG21 VAL 79 1HG2 VAL 79 17.439 -20.874 -57.905 626 HG22 VAL 79 2HG2 VAL 79 16.467 -19.403 -58.142 627 HG23 VAL 79 3HG2 VAL 79 16.854 -19.949 -56.505 628 H THR 80 H THR 80 15.252 -23.732 -58.843 629 HA THR 80 HA THR 80 17.792 -25.223 -58.553 630 HB THR 80 HB THR 80 16.976 -26.328 -60.667 631 HG1 THR 80 HG1 THR 80 15.616 -24.461 -61.221 632 HG21 THR 80 1HG2 THR 80 15.174 -27.599 -59.613 633 HG22 THR 80 2HG2 THR 80 14.973 -26.333 -58.383 634 HG23 THR 80 3HG2 THR 80 16.474 -27.302 -58.440 635 H ASP 81 H ASP 81 19.398 -25.131 -60.223 636 HA ASP 81 HA ASP 81 19.300 -22.676 -61.921 637 HB2 ASP 81 1HB ASP 81 20.946 -22.480 -60.080 638 HB3 ASP 81 2HB ASP 81 21.759 -23.951 -60.631 639 HXT ASP 81 H02 ASP 81 20.929 -25.797 -63.556 Start of MODEL 24 1 H2 GLY 1 2H0 GLY 1 3.381 11.474 -23.869 2 H GLY 1 1H0 GLY 1 4.399 10.207 -23.705 3 HA2 GLY 1 1HA GLY 1 5.811 12.084 -23.512 4 HA3 GLY 1 2HA GLY 1 4.629 12.894 -22.451 5 H SER 2 H SER 2 4.254 10.169 -21.297 6 HA SER 2 HA SER 2 6.037 10.502 -19.005 7 HB2 SER 2 1HB SER 2 4.009 8.327 -19.631 8 HB3 SER 2 2HB SER 2 4.783 8.608 -18.058 9 HG SER 2 HG SER 2 2.675 9.584 -18.294 10 H MET 3 H MET 3 7.852 10.150 -20.808 11 HA MET 3 HA MET 3 8.443 7.398 -21.512 12 HB2 MET 3 1HB MET 3 10.205 9.873 -21.586 13 HB3 MET 3 2HB MET 3 10.511 8.348 -22.426 14 HG2 MET 3 1HG MET 3 8.484 8.681 -23.793 15 HG3 MET 3 2HG MET 3 8.147 10.198 -22.938 16 HE1 MET 3 1HE MET 3 9.292 11.642 -26.380 17 HE2 MET 3 2HE MET 3 8.172 10.324 -25.990 18 HE3 MET 3 3HE MET 3 8.137 11.827 -25.039 19 H LYS 4 H LYS 4 8.127 7.378 -18.774 20 HA LYS 4 HA LYS 4 10.874 7.299 -17.623 21 HB2 LYS 4 1HB LYS 4 9.050 8.456 -16.366 22 HB3 LYS 4 2HB LYS 4 8.155 6.935 -16.297 23 HG2 LYS 4 1HG LYS 4 9.238 7.289 -14.174 24 HG3 LYS 4 2HG LYS 4 10.004 5.928 -14.982 25 HD2 LYS 4 1HD LYS 4 11.706 7.819 -15.839 26 HD3 LYS 4 2HD LYS 4 11.095 8.687 -14.423 27 HE2 LYS 4 1HE LYS 4 13.070 7.460 -13.760 28 HE3 LYS 4 2HE LYS 4 11.663 6.643 -13.043 29 HZ1 LYS 4 1HZ LYS 4 13.130 5.021 -14.053 30 HZ2 LYS 4 2HZ LYS 4 13.114 5.812 -15.498 31 HZ3 LYS 4 3HZ LYS 4 11.744 5.078 -14.952 32 H TYR 5 H TYR 5 8.324 5.315 -18.821 33 HA TYR 5 HA TYR 5 9.779 2.815 -18.026 34 HB2 TYR 5 1HB TYR 5 6.882 3.486 -18.544 35 HB3 TYR 5 2HB TYR 5 7.474 1.895 -19.024 36 HD1 TYR 5 HD1 TYR 5 8.964 0.675 -17.121 37 HD2 TYR 5 HD2 TYR 5 5.904 3.612 -16.389 38 HE1 TYR 5 HE1 TYR 5 8.649 -0.242 -14.855 39 HE2 TYR 5 HE2 TYR 5 5.605 2.693 -14.082 40 HH TYR 5 HH TYR 5 7.506 -0.103 -12.897 41 H LEU 6 H LEU 6 9.626 1.186 -19.932 42 HA LEU 6 HA LEU 6 10.809 2.412 -22.234 43 HB2 LEU 6 1HB LEU 6 9.512 -0.312 -21.884 44 HB3 LEU 6 2HB LEU 6 10.473 0.167 -23.282 45 HG LEU 6 HG LEU 6 11.545 -0.001 -20.448 46 HD11 LEU 6 1HD1 LEU 6 10.804 -2.185 -21.278 47 HD12 LEU 6 2HD1 LEU 6 12.577 -2.103 -21.191 48 HD13 LEU 6 3HD1 LEU 6 11.756 -1.959 -22.765 49 HD21 LEU 6 1HD2 LEU 6 12.852 1.529 -21.848 50 HD22 LEU 6 2HD2 LEU 6 12.957 0.298 -23.129 51 HD23 LEU 6 3HD2 LEU 6 13.760 0.033 -21.561 52 H ASN 7 H ASN 7 7.516 1.350 -21.510 53 HA ASN 7 HA ASN 7 5.509 1.619 -22.574 54 HB2 ASN 7 1HB ASN 7 6.832 4.076 -23.783 55 HB3 ASN 7 2HB ASN 7 5.098 3.748 -23.733 56 HD21 ASN 7 1HD2 ASN 7 6.256 5.998 -20.939 57 HD22 ASN 7 2HD2 ASN 7 6.608 5.970 -22.653 58 H VAL 8 H VAL 8 7.561 -0.001 -23.831 59 HA VAL 8 HA VAL 8 6.943 0.367 -26.721 60 HB VAL 8 HB VAL 8 9.382 0.156 -25.911 61 HG11 VAL 8 1HG1 VAL 8 10.253 -2.034 -25.366 62 HG12 VAL 8 2HG1 VAL 8 8.955 -1.633 -24.220 63 HG13 VAL 8 3HG1 VAL 8 8.645 -2.774 -25.550 64 HG21 VAL 8 1HG2 VAL 8 8.498 -1.978 -27.883 65 HG22 VAL 8 2HG2 VAL 8 8.629 -0.239 -28.253 66 HG23 VAL 8 3HG2 VAL 8 10.077 -1.163 -27.794 67 H LEU 9 H LEU 9 6.354 -1.773 -27.819 68 HA LEU 9 HA LEU 9 4.970 -3.625 -25.952 69 HB2 LEU 9 1HB LEU 9 2.983 -3.546 -27.512 70 HB3 LEU 9 2HB LEU 9 3.206 -2.128 -26.494 71 HG LEU 9 HG LEU 9 4.485 -1.919 -29.150 72 HD11 LEU 9 1HD1 LEU 9 2.457 -3.169 -29.746 73 HD12 LEU 9 2HD1 LEU 9 2.376 -1.492 -30.321 74 HD13 LEU 9 3HD1 LEU 9 1.466 -1.978 -28.880 75 HD21 LEU 9 1HD2 LEU 9 2.512 -0.118 -27.690 76 HD22 LEU 9 2HD2 LEU 9 3.620 0.334 -29.003 77 HD23 LEU 9 3HD2 LEU 9 4.269 -0.088 -27.399 78 H ALA 10 H ALA 10 4.287 -5.593 -27.040 79 HA ALA 10 HA ALA 10 5.795 -6.208 -29.507 80 HB1 ALA 10 1HB ALA 10 7.052 -7.998 -28.426 81 HB2 ALA 10 2HB ALA 10 7.396 -6.469 -27.593 82 HB3 ALA 10 3HB ALA 10 6.272 -7.646 -26.866 83 H LYS 11 H LYS 11 5.315 -8.314 -30.339 84 HA LYS 11 HA LYS 11 2.658 -9.365 -29.410 85 HB2 LYS 11 1HB LYS 11 2.721 -8.568 -31.766 86 HB3 LYS 11 2HB LYS 11 4.049 -9.687 -32.103 87 HG2 LYS 11 1HG LYS 11 2.643 -11.606 -31.771 88 HG3 LYS 11 2HG LYS 11 1.378 -10.622 -31.043 89 HD2 LYS 11 1HD LYS 11 0.576 -11.115 -33.165 90 HD3 LYS 11 2HD LYS 11 1.143 -9.440 -33.279 91 HE2 LYS 11 1HE LYS 11 3.220 -10.207 -34.347 92 HE3 LYS 11 2HE LYS 11 2.706 -11.903 -34.148 93 HZ1 LYS 11 1HZ LYS 11 0.776 -11.403 -35.532 94 HZ2 LYS 11 2HZ LYS 11 2.167 -11.098 -36.359 95 HZ3 LYS 11 3HZ LYS 11 1.273 -9.850 -35.738 96 H ALA 12 H ALA 12 2.578 -11.460 -28.689 97 HA ALA 12 HA ALA 12 5.105 -12.783 -28.161 98 HB1 ALA 12 1HB ALA 12 3.297 -13.033 -26.583 99 HB2 ALA 12 2HB ALA 12 2.213 -13.639 -27.849 100 HB3 ALA 12 3HB ALA 12 3.602 -14.617 -27.320 101 H LEU 13 H LEU 13 6.100 -14.364 -29.200 102 HA LEU 13 HA LEU 13 5.037 -15.152 -31.869 103 HB2 LEU 13 1HB LEU 13 7.720 -15.586 -30.512 104 HB3 LEU 13 2HB LEU 13 7.331 -16.087 -32.150 105 HG LEU 13 HG LEU 13 7.354 -13.197 -31.204 106 HD11 LEU 13 1HD1 LEU 13 9.431 -14.787 -32.762 107 HD12 LEU 13 2HD1 LEU 13 9.582 -14.236 -31.074 108 HD13 LEU 13 3HD1 LEU 13 9.509 -13.051 -32.387 109 HD21 LEU 13 1HD2 LEU 13 7.421 -12.751 -33.689 110 HD22 LEU 13 2HD2 LEU 13 5.907 -13.491 -33.142 111 HD23 LEU 13 3HD2 LEU 13 7.134 -14.484 -33.971 112 H TYR 14 H TYR 14 5.616 -16.346 -28.652 113 HA TYR 14 HA TYR 14 4.820 -19.098 -29.510 114 HB2 TYR 14 1HB TYR 14 6.726 -18.261 -27.292 115 HB3 TYR 14 2HB TYR 14 6.193 -19.914 -27.607 116 HD1 TYR 14 HD1 TYR 14 7.108 -21.210 -29.482 117 HD2 TYR 14 HD2 TYR 14 8.291 -17.112 -28.869 118 HE1 TYR 14 HE1 TYR 14 8.983 -21.491 -31.099 119 HE2 TYR 14 HE2 TYR 14 10.171 -17.415 -30.473 120 HH TYR 14 HH TYR 14 10.741 -20.501 -32.169 121 H ASP 15 H ASP 15 3.626 -20.252 -27.831 122 HA ASP 15 HA ASP 15 1.984 -18.383 -26.216 123 HB2 ASP 15 1HB ASP 15 0.348 -20.259 -26.146 124 HB3 ASP 15 2HB ASP 15 0.684 -19.701 -27.785 125 H ASN 16 H ASN 16 1.292 -19.143 -24.054 126 HA ASN 16 HA ASN 16 3.219 -20.992 -22.774 127 HB2 ASN 16 1HB ASN 16 4.187 -18.622 -22.936 128 HB3 ASN 16 2HB ASN 16 2.873 -18.116 -21.855 129 HD21 ASN 16 1HD2 ASN 16 4.810 -18.898 -19.100 130 HD22 ASN 16 2HD2 ASN 16 3.675 -17.830 -19.906 131 H VAL 17 H VAL 17 2.634 -21.487 -20.568 132 HA VAL 17 HA VAL 17 -0.080 -20.568 -19.720 133 HB VAL 17 HB VAL 17 1.065 -23.396 -19.397 134 HG11 VAL 17 1HG1 VAL 17 -1.124 -23.919 -18.338 135 HG12 VAL 17 2HG1 VAL 17 -0.240 -22.681 -17.426 136 HG13 VAL 17 3HG1 VAL 17 -1.590 -22.207 -18.475 137 HG21 VAL 17 1HG2 VAL 17 -1.294 -22.395 -21.069 138 HG22 VAL 17 2HG2 VAL 17 0.235 -23.084 -21.676 139 HG23 VAL 17 3HG2 VAL 17 -0.896 -24.106 -20.771 140 H ALA 18 H ALA 18 0.164 -19.583 -17.748 141 HA ALA 18 HA ALA 18 2.821 -19.327 -16.701 142 HB1 ALA 18 1HB ALA 18 1.243 -17.478 -16.522 143 HB2 ALA 18 2HB ALA 18 0.112 -18.488 -15.576 144 HB3 ALA 18 3HB ALA 18 1.683 -18.023 -14.891 145 H GLU 19 H GLU 19 3.876 -20.682 -15.408 146 HA GLU 19 HA GLU 19 2.262 -22.629 -13.793 147 HB2 GLU 19 1HB GLU 19 4.251 -23.966 -13.635 148 HB3 GLU 19 2HB GLU 19 3.939 -23.581 -15.333 149 HG2 GLU 19 1HG GLU 19 5.695 -21.827 -15.249 150 HG3 GLU 19 2HG GLU 19 6.040 -22.262 -13.569 151 H SER 20 H SER 20 4.086 -19.760 -13.628 152 HA SER 20 HA SER 20 4.323 -20.012 -10.651 153 HB2 SER 20 1HB SER 20 6.451 -19.513 -11.761 154 HB3 SER 20 2HB SER 20 5.697 -18.146 -12.608 155 HG SER 20 HG SER 20 6.914 -17.632 -10.633 156 HA PRO 21 HA PRO 21 1.121 -16.925 -10.589 157 HB2 PRO 21 1HB PRO 21 1.501 -15.732 -8.180 158 HB3 PRO 21 2HB PRO 21 0.890 -17.414 -8.318 159 HG2 PRO 21 1HG PRO 21 3.708 -16.470 -7.851 160 HG3 PRO 21 2HG PRO 21 2.744 -17.644 -6.896 161 HD2 PRO 21 1HD PRO 21 4.473 -18.478 -8.776 162 HD3 PRO 21 2HD PRO 21 2.884 -19.288 -8.565 163 H ASP 22 H ASP 22 4.509 -16.186 -10.350 164 HA ASP 22 HA ASP 22 4.244 -13.284 -10.489 165 HB2 ASP 22 1HB ASP 22 6.586 -15.134 -11.080 166 HB3 ASP 22 2HB ASP 22 6.686 -13.383 -10.854 167 H GLU 23 H GLU 23 3.955 -15.902 -12.639 168 HA GLU 23 HA GLU 23 5.085 -14.522 -14.975 169 HB2 GLU 23 1HB GLU 23 5.504 -16.915 -14.339 170 HB3 GLU 23 2HB GLU 23 3.811 -17.256 -14.709 171 HG2 GLU 23 1HG GLU 23 4.185 -16.586 -17.031 172 HG3 GLU 23 2HG GLU 23 5.875 -16.208 -16.644 173 H LEU 24 H LEU 24 3.975 -13.918 -16.810 174 HA LEU 24 HA LEU 24 1.091 -13.470 -16.407 175 HB2 LEU 24 1HB LEU 24 3.218 -12.232 -17.855 176 HB3 LEU 24 2HB LEU 24 2.014 -12.761 -19.031 177 HG LEU 24 HG LEU 24 1.475 -10.960 -16.647 178 HD11 LEU 24 1HD1 LEU 24 1.669 -10.372 -19.624 179 HD12 LEU 24 2HD1 LEU 24 2.878 -9.943 -18.385 180 HD13 LEU 24 3HD1 LEU 24 1.263 -9.204 -18.342 181 HD21 LEU 24 1HD2 LEU 24 -0.337 -11.885 -18.913 182 HD22 LEU 24 2HD2 LEU 24 -0.702 -10.519 -17.825 183 HD23 LEU 24 3HD2 LEU 24 -0.557 -12.154 -17.165 184 H SER 25 H SER 25 -0.536 -14.523 -17.445 185 HA SER 25 HA SER 25 0.141 -16.847 -19.138 186 HB2 SER 25 1HB SER 25 -2.534 -15.682 -18.245 187 HB3 SER 25 2HB SER 25 -2.322 -17.192 -19.161 188 HG SER 25 HG SER 25 -0.948 -16.806 -16.729 189 H PHE 26 H PHE 26 0.482 -16.529 -21.276 190 HA PHE 26 HA PHE 26 -1.192 -14.575 -22.757 191 HB2 PHE 26 1HB PHE 26 0.731 -13.517 -23.793 192 HB3 PHE 26 2HB PHE 26 0.858 -13.330 -22.040 193 HD1 PHE 26 HD1 PHE 26 2.283 -14.985 -25.037 194 HD2 PHE 26 HD2 PHE 26 2.610 -14.477 -20.784 195 HE1 PHE 26 HE1 PHE 26 4.542 -16.022 -25.093 196 HE2 PHE 26 HE2 PHE 26 4.854 -15.530 -20.817 197 HZ PHE 26 HZ PHE 26 5.830 -16.306 -22.976 198 H ARG 27 H ARG 27 -0.841 -14.900 -25.173 199 HA ARG 27 HA ARG 27 0.356 -17.542 -25.762 200 HB2 ARG 27 1HB ARG 27 -1.509 -18.309 -27.027 201 HB3 ARG 27 2HB ARG 27 -2.044 -17.901 -25.398 202 HG2 ARG 27 1HG ARG 27 -2.938 -15.746 -26.247 203 HG3 ARG 27 2HG ARG 27 -2.467 -16.238 -27.890 204 HD2 ARG 27 1HD ARG 27 -3.836 -18.301 -27.614 205 HD3 ARG 27 2HD ARG 27 -4.389 -17.696 -26.045 206 HE ARG 27 HE ARG 27 -5.212 -16.780 -28.713 207 HH11 ARG 27 1HH1 ARG 27 -5.197 -15.953 -25.276 208 HH12 ARG 27 2HH1 ARG 27 -6.501 -14.818 -25.453 209 HH21 ARG 27 1HH2 ARG 27 -6.890 -15.330 -28.843 210 HH22 ARG 27 2HH2 ARG 27 -7.446 -14.481 -27.430 211 H LYS 28 H LYS 28 0.621 -17.949 -28.107 212 HA LYS 28 HA LYS 28 2.002 -15.781 -29.306 213 HB2 LYS 28 1HB LYS 28 2.085 -17.218 -31.333 214 HB3 LYS 28 2HB LYS 28 2.582 -18.033 -29.863 215 HG2 LYS 28 1HG LYS 28 0.119 -18.918 -29.791 216 HG3 LYS 28 2HG LYS 28 0.119 -18.515 -31.520 217 HD2 LYS 28 1HD LYS 28 2.016 -19.978 -31.907 218 HD3 LYS 28 2HD LYS 28 2.274 -20.176 -30.166 219 HE2 LYS 28 1HE LYS 28 -0.143 -21.136 -30.111 220 HE3 LYS 28 2HE LYS 28 0.059 -21.340 -31.865 221 HZ1 LYS 28 1HZ LYS 28 2.009 -22.719 -31.398 222 HZ2 LYS 28 2HZ LYS 28 0.704 -23.329 -30.597 223 HZ3 LYS 28 3HZ LYS 28 1.848 -22.474 -29.769 224 H GLY 29 H GLY 29 1.516 -14.282 -30.744 225 HA2 GLY 29 1HA GLY 29 0.167 -13.237 -32.397 226 HA3 GLY 29 2HA GLY 29 -1.202 -14.256 -31.942 227 H ASP 30 H ASP 30 -0.457 -13.537 -28.987 228 HA ASP 30 HA ASP 30 -2.343 -11.332 -28.846 229 HB2 ASP 30 1HB ASP 30 -1.814 -13.404 -27.231 230 HB3 ASP 30 2HB ASP 30 -0.731 -12.220 -26.472 231 H ILE 31 H ILE 31 -1.926 -9.335 -27.667 232 HA ILE 31 HA ILE 31 0.811 -8.268 -28.307 233 HB ILE 31 HB ILE 31 -1.823 -6.717 -28.153 234 HG12 ILE 31 1HG1 ILE 31 -2.001 -8.320 -29.997 235 HG13 ILE 31 2HG1 ILE 31 -1.894 -6.659 -30.583 236 HG21 ILE 31 1HG2 ILE 31 0.085 -5.256 -27.785 237 HG22 ILE 31 2HG2 ILE 31 0.972 -5.952 -29.154 238 HG23 ILE 31 3HG2 ILE 31 -0.482 -4.960 -29.439 239 HD11 ILE 31 1HD1 ILE 31 -0.612 -8.200 -31.982 240 HD12 ILE 31 2HD1 ILE 31 0.459 -7.014 -31.205 241 HD13 ILE 31 3HD1 ILE 31 0.369 -8.675 -30.580 242 H MET 32 H MET 32 1.940 -7.374 -26.621 243 HA MET 32 HA MET 32 0.391 -6.534 -24.214 244 HB2 MET 32 1HB MET 32 1.920 -7.719 -22.739 245 HB3 MET 32 2HB MET 32 1.143 -8.849 -23.843 246 HG2 MET 32 1HG MET 32 3.236 -8.702 -25.302 247 HG3 MET 32 2HG MET 32 3.999 -7.838 -23.950 248 HE1 MET 32 1HE MET 32 2.861 -12.268 -24.166 249 HE2 MET 32 2HE MET 32 1.553 -11.066 -24.223 250 HE3 MET 32 3HE MET 32 2.809 -11.074 -25.484 251 H THR 33 H THR 33 1.439 -5.001 -22.908 252 HA THR 33 HA THR 33 3.438 -3.368 -24.370 253 HB THR 33 HB THR 33 2.450 -2.794 -21.567 254 HG1 THR 33 HG1 THR 33 0.975 -2.346 -23.961 255 HG21 THR 33 1HG2 THR 33 2.474 -0.465 -22.421 256 HG22 THR 33 2HG2 THR 33 3.007 -1.056 -24.012 257 HG23 THR 33 3HG2 THR 33 4.063 -1.248 -22.590 258 H VAL 34 H VAL 34 5.557 -3.028 -23.562 259 HA VAL 34 HA VAL 34 6.378 -4.865 -21.319 260 HB VAL 34 HB VAL 34 8.039 -3.787 -23.632 261 HG11 VAL 34 1HG1 VAL 34 9.864 -5.206 -22.669 262 HG12 VAL 34 2HG1 VAL 34 9.402 -3.863 -21.610 263 HG13 VAL 34 3HG1 VAL 34 8.834 -5.502 -21.249 264 HG21 VAL 34 1HG2 VAL 34 7.446 -6.700 -22.963 265 HG22 VAL 34 2HG2 VAL 34 6.488 -5.762 -24.135 266 HG23 VAL 34 3HG2 VAL 34 8.215 -6.047 -24.425 267 H LEU 35 H LEU 35 6.820 -3.843 -19.500 268 HA LEU 35 HA LEU 35 6.954 -0.893 -19.494 269 HB2 LEU 35 1HB LEU 35 7.032 -2.982 -17.289 270 HB3 LEU 35 2HB LEU 35 7.032 -1.250 -17.013 271 HG LEU 35 HG LEU 35 4.786 -2.754 -18.373 272 HD11 LEU 35 1HD1 LEU 35 5.042 -1.733 -15.522 273 HD12 LEU 35 2HD1 LEU 35 5.015 -3.438 -16.036 274 HD13 LEU 35 3HD1 LEU 35 3.580 -2.432 -16.241 275 HD21 LEU 35 1HD2 LEU 35 5.001 0.114 -17.364 276 HD22 LEU 35 2HD2 LEU 35 3.496 -0.661 -17.900 277 HD23 LEU 35 3HD2 LEU 35 4.816 -0.415 -19.053 278 H GLU 36 H GLU 36 8.966 -3.653 -18.455 279 HA GLU 36 HA GLU 36 11.430 -2.119 -18.933 280 HB2 GLU 36 1HB GLU 36 12.288 -2.551 -16.657 281 HB3 GLU 36 2HB GLU 36 10.921 -1.438 -16.668 282 HG2 GLU 36 1HG GLU 36 9.420 -3.270 -15.998 283 HG3 GLU 36 2HG GLU 36 10.809 -4.368 -15.913 284 H ARG 37 H ARG 37 13.348 -3.686 -18.347 285 HA ARG 37 HA ARG 37 12.552 -6.468 -19.018 286 HB2 ARG 37 1HB ARG 37 14.323 -6.541 -20.731 287 HB3 ARG 37 2HB ARG 37 13.016 -5.424 -21.132 288 HG2 ARG 37 1HG ARG 37 14.513 -3.553 -20.287 289 HG3 ARG 37 2HG ARG 37 15.826 -4.746 -20.224 290 HD2 ARG 37 1HD ARG 37 15.522 -5.232 -22.613 291 HD3 ARG 37 2HD ARG 37 14.114 -4.162 -22.672 292 HE ARG 37 HE ARG 37 15.506 -2.281 -22.621 293 HH11 ARG 37 1HH1 ARG 37 17.484 -5.203 -22.357 294 HH12 ARG 37 2HH1 ARG 37 18.942 -4.355 -22.780 295 HH21 ARG 37 1HH2 ARG 37 17.414 -1.266 -23.111 296 HH22 ARG 37 2HH2 ARG 37 18.905 -2.166 -23.185 297 H ASP 38 H ASP 38 14.091 -8.059 -18.585 298 HA ASP 38 HA ASP 38 15.521 -9.156 -17.223 299 HB2 ASP 38 1HB ASP 38 17.174 -6.621 -17.196 300 HB3 ASP 38 2HB ASP 38 17.731 -8.276 -16.904 301 H THR 39 H THR 39 13.291 -8.059 -16.227 302 HA THR 39 HA THR 39 13.618 -6.202 -14.110 303 HB THR 39 HB THR 39 11.564 -6.559 -15.529 304 HG1 THR 39 HG1 THR 39 11.556 -5.548 -13.361 305 HG21 THR 39 1HG2 THR 39 9.990 -8.354 -14.964 306 HG22 THR 39 2HG2 THR 39 11.072 -8.981 -13.723 307 HG23 THR 39 3HG2 THR 39 11.537 -9.083 -15.438 308 H GLN 40 H GLN 40 14.001 -9.628 -14.074 309 HA GLN 40 HA GLN 40 13.682 -9.657 -11.096 310 HB2 GLN 40 1HB GLN 40 12.325 -11.168 -12.734 311 HB3 GLN 40 2HB GLN 40 13.817 -12.096 -12.874 312 HG2 GLN 40 1HG GLN 40 13.787 -12.469 -10.416 313 HG3 GLN 40 2HG GLN 40 12.292 -11.534 -10.302 314 HE21 GLN 40 1HE2 GLN 40 11.756 -15.308 -10.590 315 HE22 GLN 40 2HE2 GLN 40 12.928 -14.394 -9.677 316 H GLY 41 H GLY 41 15.988 -9.059 -13.268 317 HA2 GLY 41 1HA GLY 41 18.311 -9.170 -13.021 318 HA3 GLY 41 2HA GLY 41 18.115 -10.281 -11.649 319 H LEU 42 H LEU 42 16.088 -11.488 -13.846 320 HA LEU 42 HA LEU 42 17.996 -13.516 -14.787 321 HB2 LEU 42 1HB LEU 42 14.988 -13.238 -15.140 322 HB3 LEU 42 2HB LEU 42 15.947 -14.614 -15.675 323 HG LEU 42 HG LEU 42 15.557 -13.793 -12.777 324 HD11 LEU 42 1HD1 LEU 42 13.466 -14.533 -13.832 325 HD12 LEU 42 2HD1 LEU 42 14.057 -15.749 -12.681 326 HD13 LEU 42 3HD1 LEU 42 14.274 -16.005 -14.431 327 HD21 LEU 42 1HD2 LEU 42 17.655 -15.019 -13.092 328 HD22 LEU 42 2HD2 LEU 42 16.801 -16.282 -14.022 329 HD23 LEU 42 3HD2 LEU 42 16.459 -16.052 -12.289 330 H ASP 43 H ASP 43 18.853 -13.448 -16.772 331 HA ASP 43 HA ASP 43 18.490 -11.206 -18.480 332 HB2 ASP 43 1HB ASP 43 20.535 -12.646 -18.376 333 HB3 ASP 43 2HB ASP 43 19.616 -13.969 -19.111 334 H GLY 44 H GLY 44 17.110 -10.781 -20.081 335 HA2 GLY 44 1HA GLY 44 15.722 -11.245 -21.876 336 HA3 GLY 44 2HA GLY 44 15.914 -12.975 -21.573 337 H TRP 45 H TRP 45 14.883 -11.630 -18.657 338 HA TRP 45 HA TRP 45 12.069 -12.379 -19.352 339 HB2 TRP 45 1HB TRP 45 13.616 -12.277 -16.766 340 HB3 TRP 45 2HB TRP 45 11.845 -12.375 -16.806 341 HD1 TRP 45 HD1 TRP 45 14.953 -14.435 -17.732 342 HE1 TRP 45 HE1 TRP 45 14.313 -16.870 -18.079 343 HE3 TRP 45 HE3 TRP 45 9.881 -13.871 -17.456 344 HZ2 TRP 45 HZ2 TRP 45 11.885 -18.402 -18.223 345 HZ3 TRP 45 HZ3 TRP 45 8.421 -15.880 -17.710 346 HH2 TRP 45 HH2 TRP 45 9.430 -18.129 -18.092 347 H TRP 46 H TRP 46 10.693 -10.793 -19.799 348 HA TRP 46 HA TRP 46 11.420 -8.074 -18.824 349 HB2 TRP 46 1HB TRP 46 9.716 -9.006 -21.154 350 HB3 TRP 46 2HB TRP 46 10.065 -7.326 -20.744 351 HD1 TRP 46 HD1 TRP 46 13.260 -9.086 -20.248 352 HE1 TRP 46 HE1 TRP 46 14.835 -8.893 -22.224 353 HE3 TRP 46 HE3 TRP 46 9.839 -7.472 -23.675 354 HZ2 TRP 46 HZ2 TRP 46 14.645 -8.112 -24.971 355 HZ3 TRP 46 HZ3 TRP 46 10.594 -7.039 -26.010 356 HH2 TRP 46 HH2 TRP 46 12.988 -7.342 -26.646 357 H LEU 47 H LEU 47 9.851 -6.706 -17.937 358 HA LEU 47 HA LEU 47 7.549 -8.142 -16.745 359 HB2 LEU 47 1HB LEU 47 8.906 -6.527 -15.382 360 HB3 LEU 47 2HB LEU 47 8.447 -5.251 -16.498 361 HG LEU 47 HG LEU 47 6.063 -5.574 -15.844 362 HD11 LEU 47 1HD1 LEU 47 5.583 -6.847 -13.761 363 HD12 LEU 47 2HD1 LEU 47 7.245 -7.482 -13.783 364 HD13 LEU 47 3HD1 LEU 47 6.105 -7.897 -15.085 365 HD21 LEU 47 1HD2 LEU 47 8.029 -5.029 -13.580 366 HD22 LEU 47 2HD2 LEU 47 6.320 -4.533 -13.619 367 HD23 LEU 47 3HD2 LEU 47 7.467 -3.859 -14.800 368 H CYS 48 H CYS 48 5.841 -8.376 -18.038 369 HA CYS 48 HA CYS 48 5.229 -6.138 -19.917 370 HB2 CYS 48 1HB CYS 48 4.442 -9.055 -20.104 371 HB3 CYS 48 2HB CYS 48 4.158 -7.803 -21.324 372 HG CYS 48 HG CYS 48 7.002 -9.003 -20.163 373 H SER 49 H SER 49 2.944 -5.771 -20.334 374 HA SER 49 HA SER 49 1.202 -6.529 -18.025 375 HB2 SER 49 1HB SER 49 0.153 -4.170 -19.000 376 HB3 SER 49 2HB SER 49 1.178 -4.327 -17.560 377 HG SER 49 HG SER 49 2.006 -2.774 -19.003 378 H LEU 50 H LEU 50 -0.675 -7.418 -18.505 379 HA LEU 50 HA LEU 50 -1.951 -7.130 -21.135 380 HB2 LEU 50 1HB LEU 50 -0.207 -8.854 -21.564 381 HB3 LEU 50 2HB LEU 50 -0.790 -9.779 -20.192 382 HG LEU 50 HG LEU 50 -2.940 -10.166 -21.381 383 HD11 LEU 50 1HD1 LEU 50 -3.030 -9.741 -23.823 384 HD12 LEU 50 2HD1 LEU 50 -1.507 -8.827 -23.699 385 HD13 LEU 50 3HD1 LEU 50 -2.968 -8.235 -22.885 386 HD21 LEU 50 1HD2 LEU 50 -1.160 -11.811 -21.450 387 HD22 LEU 50 2HD2 LEU 50 -0.410 -10.985 -22.835 388 HD23 LEU 50 3HD2 LEU 50 -2.003 -11.766 -23.011 389 H HIS 51 H HIS 51 -4.117 -7.564 -20.954 390 HA HIS 51 HA HIS 51 -6.136 -7.984 -20.003 391 HB2 HIS 51 1HB HIS 51 -4.995 -10.299 -20.179 392 HB3 HIS 51 2HB HIS 51 -4.870 -10.220 -18.425 393 HD1 HIS 51 HD1 HIS 51 -6.534 -12.386 -18.569 394 HD2 HIS 51 HD2 HIS 51 -8.147 -8.725 -19.707 395 HE1 HIS 51 HE1 HIS 51 -9.050 -12.655 -18.549 396 H GLY 52 H GLY 52 -4.556 -6.022 -18.560 397 HA2 GLY 52 1HA GLY 52 -5.026 -4.725 -16.695 398 HA3 GLY 52 2HA GLY 52 -6.197 -5.932 -16.167 399 H ARG 53 H ARG 53 -3.242 -7.445 -16.788 400 HA ARG 53 HA ARG 53 -2.359 -7.144 -13.941 401 HB2 ARG 53 1HB ARG 53 -2.477 -9.657 -15.663 402 HB3 ARG 53 2HB ARG 53 -1.659 -9.546 -14.100 403 HG2 ARG 53 1HG ARG 53 -3.900 -8.892 -13.097 404 HG3 ARG 53 2HG ARG 53 -4.626 -9.362 -14.650 405 HD2 ARG 53 1HD ARG 53 -3.640 -11.615 -14.422 406 HD3 ARG 53 2HD ARG 53 -2.912 -11.139 -12.874 407 HE ARG 53 HE ARG 53 -5.764 -10.699 -12.882 408 HH11 ARG 53 1HH1 ARG 53 -3.348 -13.246 -12.489 409 HH12 ARG 53 2HH1 ARG 53 -4.422 -14.250 -11.549 410 HH21 ARG 53 1HH2 ARG 53 -7.078 -12.032 -11.671 411 HH22 ARG 53 2HH2 ARG 53 -6.502 -13.571 -11.099 412 H GLN 54 H GLN 54 -0.023 -7.870 -13.742 413 HA GLN 54 HA GLN 54 1.462 -7.626 -16.278 414 HB2 GLN 54 1HB GLN 54 3.084 -6.090 -15.315 415 HB3 GLN 54 2HB GLN 54 1.477 -5.360 -15.287 416 HG2 GLN 54 1HG GLN 54 1.286 -5.982 -12.869 417 HG3 GLN 54 2HG GLN 54 2.953 -6.577 -12.928 418 HE21 GLN 54 1HE2 GLN 54 4.201 -3.436 -12.149 419 HE22 GLN 54 2HE2 GLN 54 4.280 -5.173 -11.987 420 H GLY 55 H GLY 55 3.494 -8.754 -16.168 421 HA2 GLY 55 1HA GLY 55 4.315 -10.152 -13.778 422 HA3 GLY 55 2HA GLY 55 3.329 -11.204 -14.816 423 H ILE 56 H ILE 56 5.816 -12.078 -14.500 424 HA ILE 56 HA ILE 56 7.637 -10.834 -16.414 425 HB ILE 56 HB ILE 56 9.226 -12.589 -15.831 426 HG12 ILE 56 1HG1 ILE 56 7.005 -13.905 -14.220 427 HG13 ILE 56 2HG1 ILE 56 7.578 -14.482 -15.785 428 HG21 ILE 56 1HG2 ILE 56 8.816 -10.668 -14.234 429 HG22 ILE 56 2HG2 ILE 56 7.772 -11.750 -13.276 430 HG23 ILE 56 3HG2 ILE 56 9.504 -12.114 -13.468 431 HD11 ILE 56 1HD1 ILE 56 8.597 -15.840 -14.119 432 HD12 ILE 56 2HD1 ILE 56 9.870 -14.765 -14.738 433 HD13 ILE 56 3HD1 ILE 56 9.108 -14.432 -13.167 434 H VAL 57 H VAL 57 8.321 -11.579 -18.362 435 HA VAL 57 HA VAL 57 6.938 -13.914 -19.605 436 HB VAL 57 HB VAL 57 7.023 -11.050 -20.682 437 HG11 VAL 57 1HG1 VAL 57 6.207 -13.604 -22.085 438 HG12 VAL 57 2HG1 VAL 57 5.798 -11.978 -22.661 439 HG13 VAL 57 3HG1 VAL 57 7.497 -12.466 -22.546 440 HG21 VAL 57 1HG2 VAL 57 4.695 -12.871 -19.972 441 HG22 VAL 57 2HG2 VAL 57 5.165 -11.353 -19.170 442 HG23 VAL 57 3HG2 VAL 57 4.532 -11.322 -20.827 443 HA PRO 58 HA PRO 58 11.187 -14.026 -21.016 444 HB2 PRO 58 1HB PRO 58 11.085 -15.968 -22.941 445 HB3 PRO 58 2HB PRO 58 11.023 -16.340 -21.188 446 HG2 PRO 58 1HG PRO 58 8.742 -16.081 -23.140 447 HG3 PRO 58 2HG PRO 58 9.073 -17.386 -21.957 448 HD2 PRO 58 1HD PRO 58 7.327 -15.370 -21.448 449 HD3 PRO 58 2HD PRO 58 8.350 -16.089 -20.163 450 H GLY 59 H GLY 59 11.738 -12.220 -22.079 451 HA2 GLY 59 1HA GLY 59 10.199 -11.060 -24.182 452 HA3 GLY 59 2HA GLY 59 11.813 -10.572 -23.659 453 H ASN 60 H ASN 60 12.873 -13.333 -24.258 454 HA ASN 60 HA ASN 60 13.569 -12.857 -27.022 455 HB2 ASN 60 1HB ASN 60 14.961 -14.047 -25.225 456 HB3 ASN 60 2HB ASN 60 13.938 -15.463 -25.518 457 HD21 ASN 60 1HD2 ASN 60 16.294 -16.428 -27.913 458 HD22 ASN 60 2HD2 ASN 60 15.484 -16.777 -26.408 459 H ARG 61 H ARG 61 10.705 -13.920 -25.755 460 HA ARG 61 HA ARG 61 10.110 -15.602 -28.172 461 HB2 ARG 61 1HB ARG 61 8.796 -15.600 -25.428 462 HB3 ARG 61 2HB ARG 61 8.237 -16.526 -26.815 463 HG2 ARG 61 1HG ARG 61 10.612 -17.533 -26.870 464 HG3 ARG 61 2HG ARG 61 10.777 -16.888 -25.224 465 HD2 ARG 61 1HD ARG 61 8.764 -18.150 -24.539 466 HD3 ARG 61 2HD ARG 61 8.599 -18.791 -26.178 467 HE ARG 61 HE ARG 61 10.484 -19.634 -24.119 468 HH11 ARG 61 1HH1 ARG 61 9.821 -19.704 -27.597 469 HH12 ARG 61 2HH1 ARG 61 10.832 -21.100 -27.847 470 HH21 ARG 61 1HH2 ARG 61 11.730 -21.426 -24.523 471 HH22 ARG 61 2HH2 ARG 61 11.894 -22.057 -26.135 472 H LEU 62 H LEU 62 10.095 -12.549 -27.409 473 HA LEU 62 HA LEU 62 7.318 -12.022 -28.429 474 HB2 LEU 62 1HB LEU 62 9.147 -10.213 -26.811 475 HB3 LEU 62 2HB LEU 62 7.533 -9.825 -27.375 476 HG LEU 62 HG LEU 62 8.221 -11.861 -25.237 477 HD11 LEU 62 1HD1 LEU 62 8.545 -9.486 -24.581 478 HD12 LEU 62 2HD1 LEU 62 7.192 -10.229 -23.712 479 HD13 LEU 62 3HD1 LEU 62 6.874 -9.129 -25.066 480 HD21 LEU 62 1HD2 LEU 62 5.549 -10.957 -26.370 481 HD22 LEU 62 2HD2 LEU 62 5.739 -11.854 -24.846 482 HD23 LEU 62 3HD2 LEU 62 6.242 -12.607 -26.367 483 H LYS 63 H LYS 63 7.120 -10.312 -29.969 484 HA LYS 63 HA LYS 63 9.713 -9.475 -31.237 485 HB2 LYS 63 1HB LYS 63 8.427 -11.069 -32.630 486 HB3 LYS 63 2HB LYS 63 7.041 -9.970 -32.603 487 HG2 LYS 63 1HG LYS 63 8.366 -8.259 -33.768 488 HG3 LYS 63 2HG LYS 63 9.786 -9.316 -33.730 489 HD2 LYS 63 1HD LYS 63 8.558 -10.989 -35.090 490 HD3 LYS 63 2HD LYS 63 7.164 -9.887 -35.160 491 HE2 LYS 63 1HE LYS 63 8.563 -8.179 -36.270 492 HE3 LYS 63 2HE LYS 63 9.965 -9.259 -36.177 493 HZ1 LYS 63 1HZ LYS 63 8.808 -10.816 -37.616 494 HZ2 LYS 63 2HZ LYS 63 8.917 -9.347 -38.351 495 HZ3 LYS 63 3HZ LYS 63 7.485 -9.840 -37.692 496 H ILE 64 H ILE 64 10.074 -7.405 -30.943 497 HA ILE 64 HA ILE 64 8.286 -5.540 -29.834 498 HB ILE 64 HB ILE 64 10.736 -5.082 -31.612 499 HG12 ILE 64 1HG1 ILE 64 11.230 -6.374 -29.574 500 HG13 ILE 64 2HG1 ILE 64 11.970 -4.782 -29.535 501 HG21 ILE 64 1HG2 ILE 64 10.828 -2.823 -30.435 502 HG22 ILE 64 2HG2 ILE 64 9.520 -3.017 -31.617 503 HG23 ILE 64 3HG2 ILE 64 9.164 -3.127 -29.874 504 HD11 ILE 64 1HD1 ILE 64 10.137 -3.989 -27.989 505 HD12 ILE 64 2HD1 ILE 64 9.497 -5.652 -27.972 506 HD13 ILE 64 3HD1 ILE 64 11.113 -5.309 -27.324 507 H LEU 65 H LEU 65 6.723 -4.282 -30.549 508 HA LEU 65 HA LEU 65 6.122 -4.375 -33.479 509 HB2 LEU 65 1HB LEU 65 4.615 -5.621 -31.967 510 HB3 LEU 65 2HB LEU 65 4.296 -4.150 -31.070 511 HG LEU 65 HG LEU 65 3.092 -3.194 -32.944 512 HD11 LEU 65 1HD1 LEU 65 3.808 -5.760 -34.431 513 HD12 LEU 65 2HD1 LEU 65 4.295 -4.106 -34.865 514 HD13 LEU 65 3HD1 LEU 65 2.590 -4.578 -34.972 515 HD21 LEU 65 1HD2 LEU 65 1.906 -4.654 -31.360 516 HD22 LEU 65 2HD2 LEU 65 2.256 -6.059 -32.390 517 HD23 LEU 65 3HD2 LEU 65 1.206 -4.750 -32.979 518 H VAL 66 H VAL 66 6.516 -2.544 -34.440 519 HA VAL 66 HA VAL 66 6.837 -0.376 -34.959 520 HB VAL 66 HB VAL 66 4.648 0.471 -33.045 521 HG11 VAL 66 1HG1 VAL 66 5.365 1.263 -35.922 522 HG12 VAL 66 2HG1 VAL 66 4.003 1.919 -34.983 523 HG13 VAL 66 3HG1 VAL 66 5.664 2.244 -34.466 524 HG21 VAL 66 1HG2 VAL 66 4.307 -1.115 -35.633 525 HG22 VAL 66 2HG2 VAL 66 3.752 -1.562 -34.004 526 HG23 VAL 66 3HG2 VAL 66 3.000 -0.207 -34.836 527 H GLY 67 H GLY 67 7.893 -1.406 -32.065 528 HA2 GLY 67 1HA GLY 67 8.484 1.124 -30.801 529 HA3 GLY 67 2HA GLY 67 9.069 -0.464 -30.336 530 H MET 68 H MET 68 9.597 1.374 -33.353 531 HA MET 68 HA MET 68 11.579 1.740 -34.508 532 HB2 MET 68 1HB MET 68 12.307 2.811 -31.766 533 HB3 MET 68 2HB MET 68 13.159 3.185 -33.269 534 HG2 MET 68 1HG MET 68 11.056 4.136 -34.187 535 HG3 MET 68 2HG MET 68 10.315 3.929 -32.582 536 HE1 MET 68 1HE MET 68 10.676 6.749 -34.186 537 HE2 MET 68 2HE MET 68 9.853 6.609 -32.617 538 HE3 MET 68 3HE MET 68 11.140 7.821 -32.842 539 H TYR 69 H TYR 69 11.645 -0.961 -33.726 540 HA TYR 69 HA TYR 69 13.755 -1.890 -32.228 541 HB2 TYR 69 1HB TYR 69 11.960 -3.242 -33.301 542 HB3 TYR 69 2HB TYR 69 12.779 -3.051 -34.859 543 HD1 TYR 69 HD1 TYR 69 13.128 -4.515 -31.440 544 HD2 TYR 69 HD2 TYR 69 14.659 -4.440 -35.458 545 HE1 TYR 69 HE1 TYR 69 14.513 -6.541 -30.956 546 HE2 TYR 69 HE2 TYR 69 16.055 -6.456 -34.959 547 HH TYR 69 HH TYR 69 16.735 -7.952 -33.358 548 H ASP 70 H ASP 70 13.984 -0.810 -35.606 549 HA ASP 70 HA ASP 70 16.952 -1.060 -35.404 550 HB2 ASP 70 1HB ASP 70 15.775 -2.643 -37.020 551 HB3 ASP 70 2HB ASP 70 15.298 -1.218 -37.951 552 H LYS 71 H LYS 71 15.808 1.125 -34.361 553 HA LYS 71 HA LYS 71 15.484 3.398 -34.494 554 HB2 LYS 71 1HB LYS 71 17.997 3.012 -34.808 555 HB3 LYS 71 2HB LYS 71 17.740 3.312 -36.525 556 HG2 LYS 71 1HG LYS 71 16.822 5.593 -35.896 557 HG3 LYS 71 2HG LYS 71 17.323 5.272 -34.229 558 HD2 LYS 71 1HD LYS 71 19.634 5.163 -34.864 559 HD3 LYS 71 2HD LYS 71 19.226 5.085 -36.588 560 HE2 LYS 71 1HE LYS 71 20.024 7.314 -36.038 561 HE3 LYS 71 2HE LYS 71 18.313 7.368 -36.500 562 HZ1 LYS 71 1HZ LYS 71 17.734 7.506 -34.169 563 HZ2 LYS 71 2HZ LYS 71 18.788 8.718 -34.539 564 HZ3 LYS 71 3HZ LYS 71 19.314 7.396 -33.707 565 H LYS 72 H LYS 72 13.631 2.244 -35.941 566 HA LYS 72 HA LYS 72 13.525 3.138 -38.671 567 HB2 LYS 72 1HB LYS 72 11.352 2.121 -36.813 568 HB3 LYS 72 2HB LYS 72 11.223 2.264 -38.577 569 HG2 LYS 72 1HG LYS 72 12.890 0.542 -38.913 570 HG3 LYS 72 2HG LYS 72 13.333 0.551 -37.196 571 HD2 LYS 72 1HD LYS 72 12.001 -1.341 -37.512 572 HD3 LYS 72 2HD LYS 72 11.011 -0.144 -36.653 573 HE2 LYS 72 1HE LYS 72 9.955 0.521 -38.813 574 HE3 LYS 72 2HE LYS 72 10.963 -0.662 -39.670 575 HZ1 LYS 72 1HZ LYS 72 9.859 -2.407 -38.399 576 HZ2 LYS 72 2HZ LYS 72 8.762 -1.518 -39.260 577 HZ3 LYS 72 3HZ LYS 72 8.909 -1.293 -37.631 578 HA PRO 73 HA PRO 73 11.977 7.167 -37.806 579 HB2 PRO 73 1HB PRO 73 10.686 7.840 -40.113 580 HB3 PRO 73 2HB PRO 73 12.472 7.656 -40.048 581 HG2 PRO 73 1HG PRO 73 10.402 5.645 -40.918 582 HG3 PRO 73 2HG PRO 73 11.867 6.201 -41.789 583 HD2 PRO 73 1HD PRO 73 11.879 3.926 -40.332 584 HD3 PRO 73 2HD PRO 73 13.305 5.015 -40.353 585 H ALA 74 H ALA 74 10.038 8.394 -37.433 586 HA ALA 74 HA ALA 74 7.402 7.213 -37.777 587 HB1 ALA 74 1HB ALA 74 8.224 6.061 -35.677 588 HB2 ALA 74 2HB ALA 74 8.519 7.663 -34.959 589 HB3 ALA 74 3HB ALA 74 6.868 7.162 -35.363 590 H GLY 75 H GLY 75 5.860 8.913 -36.598 591 HA2 GLY 75 1HA GLY 75 6.843 11.612 -37.275 592 HA3 GLY 75 2HA GLY 75 5.181 11.156 -36.837 593 H GLU 76 H GLU 76 5.763 13.273 -35.434 594 HA GLU 76 HA GLU 76 7.419 12.821 -33.129 595 HB2 GLU 76 1HB GLU 76 6.405 14.859 -32.217 596 HB3 GLU 76 2HB GLU 76 6.932 15.071 -33.876 597 HG2 GLU 76 1HG GLU 76 4.911 16.200 -33.869 598 HG3 GLU 76 2HG GLU 76 4.465 14.633 -34.546 599 H PHE 77 H PHE 77 4.001 12.192 -33.829 600 HA PHE 77 HA PHE 77 3.460 11.372 -31.092 601 HB2 PHE 77 1HB PHE 77 1.810 12.274 -32.928 602 HB3 PHE 77 2HB PHE 77 1.727 10.584 -33.426 603 HD1 PHE 77 HD1 PHE 77 1.067 8.833 -31.625 604 HD2 PHE 77 HD2 PHE 77 0.607 13.087 -31.084 605 HE1 PHE 77 HE1 PHE 77 -0.562 8.419 -29.775 606 HE2 PHE 77 HE2 PHE 77 -1.021 12.678 -29.244 607 HZ PHE 77 HZ PHE 77 -1.615 10.346 -28.584 608 H ILE 78 H ILE 78 4.915 9.821 -30.576 609 HA ILE 78 HA ILE 78 5.155 7.420 -32.297 610 HB ILE 78 HB ILE 78 6.992 6.764 -30.749 611 HG12 ILE 78 1HG1 ILE 78 6.548 9.441 -29.371 612 HG13 ILE 78 2HG1 ILE 78 5.952 7.916 -28.721 613 HG21 ILE 78 1HG2 ILE 78 8.601 8.492 -31.433 614 HG22 ILE 78 2HG2 ILE 78 7.429 8.262 -32.742 615 HG23 ILE 78 3HG2 ILE 78 7.291 9.670 -31.678 616 HD11 ILE 78 1HD1 ILE 78 8.303 7.057 -28.609 617 HD12 ILE 78 2HD1 ILE 78 8.874 8.655 -29.160 618 HD13 ILE 78 3HD1 ILE 78 8.023 8.503 -27.611 619 H VAL 79 H VAL 79 5.170 5.321 -31.197 620 HA VAL 79 HA VAL 79 4.228 3.630 -30.027 621 HB VAL 79 HB VAL 79 3.205 5.678 -28.002 622 HG11 VAL 79 1HG1 VAL 79 1.959 3.578 -27.847 623 HG12 VAL 79 2HG1 VAL 79 3.478 2.650 -27.845 624 HG13 VAL 79 3HG1 VAL 79 3.085 3.715 -26.489 625 HG21 VAL 79 1HG2 VAL 79 5.161 4.937 -26.641 626 HG22 VAL 79 2HG2 VAL 79 5.726 3.951 -28.010 627 HG23 VAL 79 3HG2 VAL 79 5.661 5.720 -28.149 628 H THR 80 H THR 80 2.552 2.418 -30.483 629 HA THR 80 HA THR 80 -0.072 3.710 -31.067 630 HB THR 80 HB THR 80 -0.305 2.124 -32.998 631 HG1 THR 80 HG1 THR 80 1.375 0.688 -32.126 632 HG21 THR 80 1HG2 THR 80 0.538 4.465 -33.397 633 HG22 THR 80 2HG2 THR 80 1.134 3.283 -34.584 634 HG23 THR 80 3HG2 THR 80 2.199 3.844 -33.283 635 H ASP 81 H ASP 81 -1.853 2.163 -30.820 636 HA ASP 81 HA ASP 81 -1.711 0.431 -28.579 637 HB2 ASP 81 1HB ASP 81 -3.866 1.329 -29.391 638 HB3 ASP 81 2HB ASP 81 -3.684 0.459 -30.922 639 HXT ASP 81 H02 ASP 81 -1.237 -2.144 -31.421 Start of MODEL 25 1 H2 GLY 1 2H0 GLY 1 14.220 15.922 -15.331 2 H GLY 1 1H0 GLY 1 13.848 16.731 -16.743 3 HA2 GLY 1 1HA GLY 1 12.788 17.429 -14.024 4 HA3 GLY 1 2HA GLY 1 12.368 18.264 -15.545 5 H SER 2 H SER 2 12.565 15.205 -16.465 6 HA SER 2 HA SER 2 10.057 14.160 -15.375 7 HB2 SER 2 1HB SER 2 9.365 15.789 -17.233 8 HB3 SER 2 2HB SER 2 10.224 14.729 -18.369 9 HG SER 2 HG SER 2 8.000 14.101 -16.715 10 H MET 3 H MET 3 9.816 11.907 -15.950 11 HA MET 3 HA MET 3 12.018 10.667 -17.514 12 HB2 MET 3 1HB MET 3 12.708 10.686 -15.094 13 HB3 MET 3 2HB MET 3 11.195 9.876 -14.672 14 HG2 MET 3 1HG MET 3 13.033 8.576 -16.666 15 HG3 MET 3 2HG MET 3 13.467 8.541 -14.943 16 HE1 MET 3 1HE MET 3 12.001 4.952 -15.443 17 HE2 MET 3 2HE MET 3 12.888 5.856 -16.691 18 HE3 MET 3 3HE MET 3 13.424 5.921 -14.989 19 H LYS 4 H LYS 4 11.259 8.534 -18.292 20 HA LYS 4 HA LYS 4 8.347 8.058 -17.909 21 HB2 LYS 4 1HB LYS 4 9.433 9.276 -20.204 22 HB3 LYS 4 2HB LYS 4 9.255 7.593 -20.666 23 HG2 LYS 4 1HG LYS 4 7.098 7.975 -21.090 24 HG3 LYS 4 2HG LYS 4 6.822 8.280 -19.382 25 HD2 LYS 4 1HD LYS 4 7.727 10.392 -21.369 26 HD3 LYS 4 2HD LYS 4 6.040 10.111 -20.886 27 HE2 LYS 4 1HE LYS 4 6.619 10.585 -18.531 28 HE3 LYS 4 2HE LYS 4 8.299 10.864 -19.002 29 HZ1 LYS 4 1HZ LYS 4 7.470 12.694 -20.430 30 HZ2 LYS 4 2HZ LYS 4 7.231 12.964 -18.833 31 HZ3 LYS 4 3HZ LYS 4 5.974 12.496 -19.793 32 H TYR 5 H TYR 5 7.764 5.892 -18.162 33 HA TYR 5 HA TYR 5 9.967 3.947 -17.978 34 HB2 TYR 5 1HB TYR 5 8.240 2.349 -17.454 35 HB3 TYR 5 2HB TYR 5 7.957 3.799 -16.500 36 HD1 TYR 5 HD1 TYR 5 6.083 5.414 -17.200 37 HD2 TYR 5 HD2 TYR 5 6.584 1.524 -18.971 38 HE1 TYR 5 HE1 TYR 5 3.746 5.508 -18.104 39 HE2 TYR 5 HE2 TYR 5 4.252 1.624 -19.851 40 HH TYR 5 HH TYR 5 2.373 2.889 -20.097 41 H LEU 6 H LEU 6 9.477 1.844 -19.400 42 HA LEU 6 HA LEU 6 10.183 2.558 -21.999 43 HB2 LEU 6 1HB LEU 6 9.170 0.077 -20.685 44 HB3 LEU 6 2HB LEU 6 9.173 0.108 -22.436 45 HG LEU 6 HG LEU 6 11.565 0.522 -22.457 46 HD11 LEU 6 1HD1 LEU 6 11.934 1.647 -20.312 47 HD12 LEU 6 2HD1 LEU 6 12.940 0.188 -20.423 48 HD13 LEU 6 3HD1 LEU 6 11.449 0.174 -19.444 49 HD21 LEU 6 1HD2 LEU 6 10.695 -1.888 -20.839 50 HD22 LEU 6 2HD2 LEU 6 12.225 -1.728 -21.721 51 HD23 LEU 6 3HD2 LEU 6 10.697 -1.750 -22.613 52 H ASN 7 H ASN 7 7.015 1.170 -21.120 53 HA ASN 7 HA ASN 7 5.006 1.185 -22.156 54 HB2 ASN 7 1HB ASN 7 5.549 3.711 -21.631 55 HB3 ASN 7 2HB ASN 7 5.589 3.863 -23.393 56 HD21 ASN 7 1HD2 ASN 7 2.177 4.613 -22.956 57 HD22 ASN 7 2HD2 ASN 7 3.767 5.255 -23.246 58 H VAL 8 H VAL 8 7.330 0.206 -23.808 59 HA VAL 8 HA VAL 8 6.284 0.631 -26.543 60 HB VAL 8 HB VAL 8 8.138 -0.834 -27.270 61 HG11 VAL 8 1HG1 VAL 8 9.995 0.690 -26.794 62 HG12 VAL 8 2HG1 VAL 8 8.503 1.609 -27.072 63 HG13 VAL 8 3HG1 VAL 8 9.101 1.383 -25.420 64 HG21 VAL 8 1HG2 VAL 8 9.905 -1.542 -25.659 65 HG22 VAL 8 2HG2 VAL 8 8.899 -0.954 -24.319 66 HG23 VAL 8 3HG2 VAL 8 8.338 -2.304 -25.328 67 H LEU 9 H LEU 9 6.073 -1.706 -27.714 68 HA LEU 9 HA LEU 9 4.712 -3.544 -25.812 69 HB2 LEU 9 1HB LEU 9 2.870 -3.766 -27.509 70 HB3 LEU 9 2HB LEU 9 2.885 -2.273 -26.592 71 HG LEU 9 HG LEU 9 4.297 -2.169 -29.206 72 HD11 LEU 9 1HD1 LEU 9 1.275 -2.399 -29.019 73 HD12 LEU 9 2HD1 LEU 9 2.369 -3.554 -29.811 74 HD13 LEU 9 3HD1 LEU 9 2.189 -1.914 -30.462 75 HD21 LEU 9 1HD2 LEU 9 2.206 -0.369 -27.926 76 HD22 LEU 9 2HD2 LEU 9 3.292 0.040 -29.279 77 HD23 LEU 9 3HD2 LEU 9 3.949 -0.222 -27.650 78 H ALA 10 H ALA 10 4.226 -5.648 -26.762 79 HA ALA 10 HA ALA 10 5.970 -6.320 -29.064 80 HB1 ALA 10 1HB ALA 10 6.197 -7.745 -26.393 81 HB2 ALA 10 2HB ALA 10 7.196 -7.964 -27.850 82 HB3 ALA 10 3HB ALA 10 7.311 -6.466 -26.917 83 H LYS 11 H LYS 11 5.385 -8.122 -30.168 84 HA LYS 11 HA LYS 11 2.765 -9.338 -29.464 85 HB2 LYS 11 1HB LYS 11 3.136 -8.383 -31.730 86 HB3 LYS 11 2HB LYS 11 4.466 -9.521 -31.971 87 HG2 LYS 11 1HG LYS 11 2.937 -11.411 -31.946 88 HG3 LYS 11 2HG LYS 11 1.589 -10.378 -31.437 89 HD2 LYS 11 1HD LYS 11 1.318 -10.786 -33.788 90 HD3 LYS 11 2HD LYS 11 1.857 -9.111 -33.614 91 HE2 LYS 11 1HE LYS 11 4.193 -9.806 -34.134 92 HE3 LYS 11 2HE LYS 11 3.630 -11.479 -34.347 93 HZ1 LYS 11 1HZ LYS 11 2.199 -10.703 -36.153 94 HZ2 LYS 11 2HZ LYS 11 3.772 -10.321 -36.453 95 HZ3 LYS 11 3HZ LYS 11 2.729 -9.150 -35.958 96 H ALA 12 H ALA 12 2.534 -11.423 -28.888 97 HA ALA 12 HA ALA 12 4.941 -12.907 -28.141 98 HB1 ALA 12 1HB ALA 12 3.268 -14.646 -27.504 99 HB2 ALA 12 2HB ALA 12 2.970 -13.051 -26.765 100 HB3 ALA 12 3HB ALA 12 1.993 -13.598 -28.156 101 H LEU 13 H LEU 13 6.000 -14.397 -29.233 102 HA LEU 13 HA LEU 13 5.140 -15.060 -32.000 103 HB2 LEU 13 1HB LEU 13 7.609 -15.727 -30.371 104 HB3 LEU 13 2HB LEU 13 7.385 -16.142 -32.063 105 HG LEU 13 HG LEU 13 7.476 -13.289 -31.024 106 HD11 LEU 13 1HD1 LEU 13 9.592 -14.494 -30.578 107 HD12 LEU 13 2HD1 LEU 13 9.791 -13.249 -31.813 108 HD13 LEU 13 3HD1 LEU 13 9.684 -14.960 -32.293 109 HD21 LEU 13 1HD2 LEU 13 7.699 -14.476 -33.830 110 HD22 LEU 13 2HD2 LEU 13 7.926 -12.763 -33.423 111 HD23 LEU 13 3HD2 LEU 13 6.343 -13.520 -33.187 112 H TYR 14 H TYR 14 5.482 -16.510 -28.823 113 HA TYR 14 HA TYR 14 4.384 -19.083 -29.867 114 HB2 TYR 14 1HB TYR 14 6.364 -18.839 -27.578 115 HB3 TYR 14 2HB TYR 14 5.849 -20.307 -28.426 116 HD1 TYR 14 HD1 TYR 14 8.162 -17.492 -28.390 117 HD2 TYR 14 HD2 TYR 14 6.681 -20.707 -30.817 118 HE1 TYR 14 HE1 TYR 14 10.112 -17.224 -29.905 119 HE2 TYR 14 HE2 TYR 14 8.627 -20.423 -32.356 120 HH TYR 14 HH TYR 14 10.560 -19.295 -32.784 121 H ASP 15 H ASP 15 3.216 -20.250 -28.012 122 HA ASP 15 HA ASP 15 1.908 -18.185 -26.312 123 HB2 ASP 15 1HB ASP 15 0.153 -19.831 -25.991 124 HB3 ASP 15 2HB ASP 15 0.425 -19.565 -27.717 125 H ASN 16 H ASN 16 1.370 -18.753 -24.089 126 HA ASN 16 HA ASN 16 3.201 -20.730 -22.841 127 HB2 ASN 16 1HB ASN 16 4.347 -18.443 -23.115 128 HB3 ASN 16 2HB ASN 16 3.169 -17.829 -21.939 129 HD21 ASN 16 1HD2 ASN 16 5.093 -18.902 -19.259 130 HD22 ASN 16 2HD2 ASN 16 3.909 -17.796 -19.940 131 H VAL 17 H VAL 17 2.559 -21.429 -20.833 132 HA VAL 17 HA VAL 17 0.031 -20.258 -19.723 133 HB VAL 17 HB VAL 17 1.130 -23.111 -19.483 134 HG11 VAL 17 1HG1 VAL 17 -1.392 -21.847 -18.317 135 HG12 VAL 17 2HG1 VAL 17 -1.014 -23.594 -18.281 136 HG13 VAL 17 3HG1 VAL 17 0.022 -22.450 -17.419 137 HG21 VAL 17 1HG2 VAL 17 0.136 -22.753 -21.699 138 HG22 VAL 17 2HG2 VAL 17 -0.948 -23.762 -20.722 139 HG23 VAL 17 3HG2 VAL 17 -1.323 -22.038 -20.961 140 H ALA 18 H ALA 18 0.342 -19.325 -17.777 141 HA ALA 18 HA ALA 18 3.039 -19.267 -16.679 142 HB1 ALA 18 1HB ALA 18 1.963 -17.708 -15.017 143 HB2 ALA 18 2HB ALA 18 1.792 -17.199 -16.706 144 HB3 ALA 18 3HB ALA 18 0.425 -17.954 -15.857 145 H GLU 19 H GLU 19 3.783 -20.506 -15.091 146 HA GLU 19 HA GLU 19 1.844 -22.315 -13.670 147 HB2 GLU 19 1HB GLU 19 4.894 -22.253 -13.838 148 HB3 GLU 19 2HB GLU 19 3.961 -23.420 -12.890 149 HG2 GLU 19 1HG GLU 19 3.635 -23.104 -15.891 150 HG3 GLU 19 2HG GLU 19 4.807 -24.193 -15.166 151 H SER 20 H SER 20 3.893 -19.524 -13.328 152 HA SER 20 HA SER 20 3.607 -19.570 -10.354 153 HB2 SER 20 1HB SER 20 5.886 -19.262 -11.242 154 HB3 SER 20 2HB SER 20 5.318 -17.897 -12.230 155 HG SER 20 HG SER 20 6.335 -17.206 -10.300 156 HA PRO 21 HA PRO 21 0.630 -16.301 -10.929 157 HB2 PRO 21 1HB PRO 21 0.716 -15.000 -8.562 158 HB3 PRO 21 2HB PRO 21 0.019 -16.639 -8.719 159 HG2 PRO 21 1HG PRO 21 2.788 -15.849 -7.840 160 HG3 PRO 21 2HG PRO 21 1.605 -16.912 -7.006 161 HD2 PRO 21 1HD PRO 21 3.570 -17.927 -8.552 162 HD3 PRO 21 2HD PRO 21 1.917 -18.665 -8.535 163 H ASP 22 H ASP 22 3.977 -15.784 -10.233 164 HA ASP 22 HA ASP 22 3.962 -12.868 -10.615 165 HB2 ASP 22 1HB ASP 22 5.606 -14.204 -9.192 166 HB3 ASP 22 2HB ASP 22 6.246 -14.882 -10.690 167 H GLU 23 H GLU 23 4.008 -15.723 -12.549 168 HA GLU 23 HA GLU 23 5.331 -14.480 -14.865 169 HB2 GLU 23 1HB GLU 23 5.726 -16.840 -14.101 170 HB3 GLU 23 2HB GLU 23 4.047 -17.195 -14.478 171 HG2 GLU 23 1HG GLU 23 4.497 -16.587 -16.840 172 HG3 GLU 23 2HG GLU 23 6.196 -16.350 -16.407 173 H LEU 24 H LEU 24 4.260 -13.991 -16.807 174 HA LEU 24 HA LEU 24 1.297 -13.774 -16.510 175 HB2 LEU 24 1HB LEU 24 3.194 -11.974 -17.319 176 HB3 LEU 24 2HB LEU 24 2.661 -12.596 -18.848 177 HG LEU 24 HG LEU 24 0.454 -11.871 -18.437 178 HD11 LEU 24 1HD1 LEU 24 1.161 -11.202 -15.648 179 HD12 LEU 24 2HD1 LEU 24 -0.210 -12.099 -16.278 180 HD13 LEU 24 3HD1 LEU 24 -0.137 -10.342 -16.493 181 HD21 LEU 24 1HD2 LEU 24 2.535 -9.817 -17.989 182 HD22 LEU 24 2HD2 LEU 24 0.841 -9.399 -18.310 183 HD23 LEU 24 3HD2 LEU 24 1.789 -10.316 -19.507 184 H SER 25 H SER 25 -0.080 -14.932 -17.734 185 HA SER 25 HA SER 25 1.055 -16.860 -19.666 186 HB2 SER 25 1HB SER 25 -0.662 -17.625 -18.042 187 HB3 SER 25 2HB SER 25 -1.812 -16.446 -18.710 188 HG SER 25 HG SER 25 -0.518 -18.418 -20.324 189 H PHE 26 H PHE 26 0.498 -16.838 -21.883 190 HA PHE 26 HA PHE 26 -1.208 -14.731 -22.968 191 HB2 PHE 26 1HB PHE 26 0.639 -13.748 -24.354 192 HB3 PHE 26 2HB PHE 26 0.776 -13.386 -22.642 193 HD1 PHE 26 HD1 PHE 26 2.544 -14.267 -21.276 194 HD2 PHE 26 HD2 PHE 26 2.250 -15.325 -25.426 195 HE1 PHE 26 HE1 PHE 26 4.851 -15.168 -21.199 196 HE2 PHE 26 HE2 PHE 26 4.576 -16.196 -25.373 197 HZ PHE 26 HZ PHE 26 5.892 -16.109 -23.268 198 H ARG 27 H ARG 27 -1.196 -14.937 -25.446 199 HA ARG 27 HA ARG 27 -0.396 -17.724 -26.181 200 HB2 ARG 27 1HB ARG 27 -2.855 -16.177 -27.095 201 HB3 ARG 27 2HB ARG 27 -2.376 -17.778 -27.669 202 HG2 ARG 27 1HG ARG 27 -3.154 -17.100 -24.804 203 HG3 ARG 27 2HG ARG 27 -4.192 -17.890 -25.990 204 HD2 ARG 27 1HD ARG 27 -2.622 -19.801 -26.113 205 HD3 ARG 27 2HD ARG 27 -1.563 -19.007 -24.939 206 HE ARG 27 HE ARG 27 -4.125 -19.198 -23.787 207 HH11 ARG 27 1HH1 ARG 27 -1.468 -21.352 -24.712 208 HH12 ARG 27 2HH1 ARG 27 -1.873 -22.508 -23.476 209 HH21 ARG 27 1HH2 ARG 27 -4.563 -20.740 -22.233 210 HH22 ARG 27 2HH2 ARG 27 -3.582 -22.172 -22.110 211 H LYS 28 H LYS 28 0.212 -18.056 -28.348 212 HA LYS 28 HA LYS 28 1.860 -16.021 -29.434 213 HB2 LYS 28 1HB LYS 28 1.967 -17.424 -31.467 214 HB3 LYS 28 2HB LYS 28 2.252 -18.334 -30.002 215 HG2 LYS 28 1HG LYS 28 -0.093 -19.174 -30.073 216 HG3 LYS 28 2HG LYS 28 -0.280 -18.352 -31.638 217 HD2 LYS 28 1HD LYS 28 1.585 -19.688 -32.565 218 HD3 LYS 28 2HD LYS 28 1.809 -20.482 -30.996 219 HE2 LYS 28 1HE LYS 28 0.544 -21.952 -32.461 220 HE3 LYS 28 2HE LYS 28 -0.481 -21.413 -31.114 221 HZ1 LYS 28 1HZ LYS 28 -1.688 -21.281 -33.182 222 HZ2 LYS 28 2HZ LYS 28 -0.508 -20.353 -33.885 223 HZ3 LYS 28 3HZ LYS 28 -1.433 -19.759 -32.637 224 H GLY 29 H GLY 29 1.512 -14.395 -30.822 225 HA2 GLY 29 1HA GLY 29 0.326 -13.212 -32.503 226 HA3 GLY 29 2HA GLY 29 -1.113 -14.192 -32.213 227 H ASP 30 H ASP 30 -0.416 -13.574 -29.142 228 HA ASP 30 HA ASP 30 -2.231 -11.303 -28.982 229 HB2 ASP 30 1HB ASP 30 -1.902 -13.362 -27.406 230 HB3 ASP 30 2HB ASP 30 -0.599 -12.414 -26.702 231 H ILE 31 H ILE 31 -1.660 -9.300 -27.745 232 HA ILE 31 HA ILE 31 1.241 -8.584 -28.057 233 HB ILE 31 HB ILE 31 -1.163 -6.875 -28.921 234 HG12 ILE 31 1HG1 ILE 31 0.645 -6.772 -30.945 235 HG13 ILE 31 2HG1 ILE 31 1.035 -8.369 -30.298 236 HG21 ILE 31 1HG2 ILE 31 0.487 -5.445 -27.726 237 HG22 ILE 31 2HG2 ILE 31 1.797 -6.111 -28.718 238 HG23 ILE 31 3HG2 ILE 31 0.538 -5.114 -29.474 239 HD11 ILE 31 1HD1 ILE 31 -0.535 -8.544 -32.141 240 HD12 ILE 31 2HD1 ILE 31 -1.305 -9.070 -30.630 241 HD13 ILE 31 3HD1 ILE 31 -1.675 -7.466 -31.308 242 H MET 32 H MET 32 2.123 -7.621 -26.356 243 HA MET 32 HA MET 32 0.344 -6.592 -24.183 244 HB2 MET 32 1HB MET 32 1.805 -7.703 -22.549 245 HB3 MET 32 2HB MET 32 1.101 -8.868 -23.660 246 HG2 MET 32 1HG MET 32 3.321 -8.599 -25.013 247 HG3 MET 32 2HG MET 32 3.951 -7.924 -23.501 248 HE1 MET 32 1HE MET 32 1.460 -11.016 -24.410 249 HE2 MET 32 2HE MET 32 2.809 -10.858 -25.556 250 HE3 MET 32 3HE MET 32 2.740 -12.242 -24.440 251 H THR 33 H THR 33 1.366 -5.027 -22.786 252 HA THR 33 HA THR 33 3.312 -3.345 -24.250 253 HB THR 33 HB THR 33 1.978 -2.920 -21.532 254 HG1 THR 33 HG1 THR 33 0.502 -1.675 -22.739 255 HG21 THR 33 1HG2 THR 33 2.455 -0.545 -21.896 256 HG22 THR 33 2HG2 THR 33 3.205 -0.911 -23.476 257 HG23 THR 33 3HG2 THR 33 3.973 -1.463 -21.969 258 H VAL 34 H VAL 34 5.479 -3.117 -23.662 259 HA VAL 34 HA VAL 34 6.400 -4.905 -21.423 260 HB VAL 34 HB VAL 34 7.932 -3.710 -23.786 261 HG11 VAL 34 1HG1 VAL 34 8.916 -5.383 -21.436 262 HG12 VAL 34 2HG1 VAL 34 9.854 -5.081 -22.911 263 HG13 VAL 34 3HG1 VAL 34 9.417 -3.727 -21.855 264 HG21 VAL 34 1HG2 VAL 34 6.476 -5.712 -24.268 265 HG22 VAL 34 2HG2 VAL 34 8.212 -6.016 -24.513 266 HG23 VAL 34 3HG2 VAL 34 7.411 -6.618 -23.051 267 H LEU 35 H LEU 35 7.043 -4.008 -19.611 268 HA LEU 35 HA LEU 35 7.137 -1.033 -19.498 269 HB2 LEU 35 1HB LEU 35 6.919 -3.117 -17.299 270 HB3 LEU 35 2HB LEU 35 6.752 -1.386 -17.087 271 HG LEU 35 HG LEU 35 4.854 -3.163 -18.658 272 HD11 LEU 35 1HD1 LEU 35 4.785 -3.676 -16.269 273 HD12 LEU 35 2HD1 LEU 35 3.319 -2.780 -16.712 274 HD13 LEU 35 3HD1 LEU 35 4.642 -1.951 -15.854 275 HD21 LEU 35 1HD2 LEU 35 3.330 -1.184 -18.549 276 HD22 LEU 35 2HD2 LEU 35 4.806 -0.864 -19.492 277 HD23 LEU 35 3HD2 LEU 35 4.656 -0.235 -17.834 278 H GLU 36 H GLU 36 8.996 -3.940 -18.693 279 HA GLU 36 HA GLU 36 11.426 -2.268 -18.411 280 HB2 GLU 36 1HB GLU 36 10.289 -2.459 -16.153 281 HB3 GLU 36 2HB GLU 36 10.542 -4.193 -16.226 282 HG2 GLU 36 1HG GLU 36 12.956 -3.876 -16.217 283 HG3 GLU 36 2HG GLU 36 12.759 -2.123 -16.356 284 H ARG 37 H ARG 37 13.373 -3.731 -18.391 285 HA ARG 37 HA ARG 37 12.800 -6.455 -19.479 286 HB2 ARG 37 1HB ARG 37 14.953 -4.513 -20.411 287 HB3 ARG 37 2HB ARG 37 14.766 -6.198 -20.914 288 HG2 ARG 37 1HG ARG 37 12.503 -5.550 -21.871 289 HG3 ARG 37 2HG ARG 37 12.989 -3.868 -21.601 290 HD2 ARG 37 1HD ARG 37 14.569 -5.905 -23.241 291 HD3 ARG 37 2HD ARG 37 13.519 -4.653 -23.908 292 HE ARG 37 HE ARG 37 15.087 -2.989 -23.344 293 HH11 ARG 37 1HH1 ARG 37 16.271 -6.143 -22.272 294 HH12 ARG 37 2HH1 ARG 37 17.873 -5.558 -21.968 295 HH21 ARG 37 1HH2 ARG 37 17.184 -2.316 -22.971 296 HH22 ARG 37 2HH2 ARG 37 18.392 -3.454 -22.414 297 H ASP 38 H ASP 38 14.364 -7.960 -18.885 298 HA ASP 38 HA ASP 38 15.834 -8.995 -17.523 299 HB2 ASP 38 1HB ASP 38 17.367 -6.382 -17.464 300 HB3 ASP 38 2HB ASP 38 17.998 -8.022 -17.257 301 H THR 39 H THR 39 13.539 -7.933 -16.583 302 HA THR 39 HA THR 39 13.737 -6.007 -14.524 303 HB THR 39 HB THR 39 11.774 -6.496 -16.002 304 HG1 THR 39 HG1 THR 39 11.687 -5.450 -13.802 305 HG21 THR 39 1HG2 THR 39 10.232 -8.315 -15.424 306 HG22 THR 39 2HG2 THR 39 11.318 -8.852 -14.127 307 HG23 THR 39 3HG2 THR 39 11.829 -8.988 -15.820 308 H GLN 40 H GLN 40 14.427 -9.323 -14.243 309 HA GLN 40 HA GLN 40 14.018 -9.129 -11.287 310 HB2 GLN 40 1HB GLN 40 12.496 -10.678 -12.759 311 HB3 GLN 40 2HB GLN 40 13.893 -11.760 -12.781 312 HG2 GLN 40 1HG GLN 40 13.811 -11.995 -10.381 313 HG3 GLN 40 2HG GLN 40 12.636 -10.675 -10.236 314 HE21 GLN 40 1HE2 GLN 40 9.859 -12.734 -10.531 315 HE22 GLN 40 2HE2 GLN 40 10.584 -11.226 -10.023 316 H GLY 41 H GLY 41 16.309 -8.725 -13.399 317 HA2 GLY 41 1HA GLY 41 18.627 -8.989 -13.164 318 HA3 GLY 41 2HA GLY 41 18.371 -10.126 -11.816 319 H LEU 42 H LEU 42 16.270 -11.167 -14.028 320 HA LEU 42 HA LEU 42 18.070 -13.244 -15.055 321 HB2 LEU 42 1HB LEU 42 15.088 -12.819 -15.341 322 HB3 LEU 42 2HB LEU 42 15.957 -14.220 -15.932 323 HG LEU 42 HG LEU 42 15.642 -13.445 -12.998 324 HD11 LEU 42 1HD1 LEU 42 14.059 -15.351 -12.944 325 HD12 LEU 42 2HD1 LEU 42 14.247 -15.555 -14.709 326 HD13 LEU 42 3HD1 LEU 42 13.512 -14.075 -14.046 327 HD21 LEU 42 1HD2 LEU 42 16.463 -15.742 -12.586 328 HD22 LEU 42 2HD2 LEU 42 17.689 -14.736 -13.371 329 HD23 LEU 42 3HD2 LEU 42 16.787 -15.941 -14.323 330 H ASP 43 H ASP 43 19.130 -12.834 -16.887 331 HA ASP 43 HA ASP 43 18.548 -10.672 -18.609 332 HB2 ASP 43 1HB ASP 43 20.120 -13.228 -19.045 333 HB3 ASP 43 2HB ASP 43 20.026 -11.919 -20.244 334 H GLY 44 H GLY 44 17.178 -10.378 -20.227 335 HA2 GLY 44 1HA GLY 44 15.954 -11.000 -22.102 336 HA3 GLY 44 2HA GLY 44 16.251 -12.700 -21.749 337 H TRP 45 H TRP 45 15.042 -11.346 -18.908 338 HA TRP 45 HA TRP 45 12.267 -12.216 -19.674 339 HB2 TRP 45 1HB TRP 45 13.747 -12.054 -17.057 340 HB3 TRP 45 2HB TRP 45 11.980 -12.092 -17.105 341 HD1 TRP 45 HD1 TRP 45 14.981 -14.289 -18.152 342 HE1 TRP 45 HE1 TRP 45 14.254 -16.726 -18.269 343 HE3 TRP 45 HE3 TRP 45 10.002 -13.571 -17.264 344 HZ2 TRP 45 HZ2 TRP 45 11.792 -18.206 -18.025 345 HZ3 TRP 45 HZ3 TRP 45 8.480 -15.558 -17.211 346 HH2 TRP 45 HH2 TRP 45 9.374 -17.849 -17.593 347 H TRP 46 H TRP 46 10.668 -10.708 -19.837 348 HA TRP 46 HA TRP 46 11.419 -7.943 -18.994 349 HB2 TRP 46 1HB TRP 46 9.625 -8.852 -21.271 350 HB3 TRP 46 2HB TRP 46 10.062 -7.187 -20.886 351 HD1 TRP 46 HD1 TRP 46 13.280 -8.630 -20.460 352 HE1 TRP 46 HE1 TRP 46 14.721 -8.767 -22.535 353 HE3 TRP 46 HE3 TRP 46 9.573 -7.940 -23.880 354 HZ2 TRP 46 HZ2 TRP 46 14.310 -8.616 -25.364 355 HZ3 TRP 46 HZ3 TRP 46 10.161 -7.981 -26.313 356 HH2 TRP 46 HH2 TRP 46 12.527 -8.314 -27.026 357 H LEU 47 H LEU 47 9.870 -6.675 -17.980 358 HA LEU 47 HA LEU 47 7.597 -8.174 -16.794 359 HB2 LEU 47 1HB LEU 47 8.901 -6.596 -15.390 360 HB3 LEU 47 2HB LEU 47 8.504 -5.284 -16.486 361 HG LEU 47 HG LEU 47 6.100 -5.536 -15.905 362 HD11 LEU 47 1HD1 LEU 47 6.002 -7.879 -15.235 363 HD12 LEU 47 2HD1 LEU 47 5.519 -6.873 -13.867 364 HD13 LEU 47 3HD1 LEU 47 7.147 -7.592 -13.901 365 HD21 LEU 47 1HD2 LEU 47 8.027 -5.147 -13.564 366 HD22 LEU 47 2HD2 LEU 47 6.336 -4.578 -13.626 367 HD23 LEU 47 3HD2 LEU 47 7.528 -3.921 -14.756 368 H CYS 48 H CYS 48 5.755 -8.309 -17.922 369 HA CYS 48 HA CYS 48 5.201 -6.111 -19.875 370 HB2 CYS 48 1HB CYS 48 4.458 -9.052 -20.057 371 HB3 CYS 48 2HB CYS 48 4.114 -7.801 -21.259 372 HG CYS 48 HG CYS 48 7.042 -8.919 -20.196 373 H SER 49 H SER 49 2.951 -5.675 -20.282 374 HA SER 49 HA SER 49 1.149 -6.508 -18.042 375 HB2 SER 49 1HB SER 49 0.119 -4.123 -18.757 376 HB3 SER 49 2HB SER 49 1.332 -4.303 -17.475 377 HG SER 49 HG SER 49 2.927 -3.743 -18.926 378 H LEU 50 H LEU 50 -0.701 -7.362 -18.605 379 HA LEU 50 HA LEU 50 -1.808 -7.017 -21.327 380 HB2 LEU 50 1HB LEU 50 -0.153 -8.863 -21.491 381 HB3 LEU 50 2HB LEU 50 -0.955 -9.692 -20.160 382 HG LEU 50 HG LEU 50 -2.973 -10.004 -21.557 383 HD11 LEU 50 1HD1 LEU 50 -2.812 -8.128 -23.105 384 HD12 LEU 50 2HD1 LEU 50 -2.781 -9.639 -24.030 385 HD13 LEU 50 3HD1 LEU 50 -1.277 -8.736 -23.746 386 HD21 LEU 50 1HD2 LEU 50 -1.209 -11.731 -21.435 387 HD22 LEU 50 2HD2 LEU 50 -0.367 -10.960 -22.795 388 HD23 LEU 50 3HD2 LEU 50 -1.957 -11.696 -23.053 389 H HIS 51 H HIS 51 -4.008 -7.186 -21.284 390 HA HIS 51 HA HIS 51 -6.117 -7.339 -20.468 391 HB2 HIS 51 1HB HIS 51 -5.117 -9.786 -20.527 392 HB3 HIS 51 2HB HIS 51 -5.423 -9.721 -18.796 393 HD1 HIS 51 HD1 HIS 51 -8.069 -8.865 -18.253 394 HD2 HIS 51 HD2 HIS 51 -7.244 -10.629 -21.932 395 HE1 HIS 51 HE1 HIS 51 -10.280 -9.648 -19.204 396 H GLY 52 H GLY 52 -4.317 -5.679 -18.828 397 HA2 GLY 52 1HA GLY 52 -4.787 -4.314 -17.006 398 HA3 GLY 52 2HA GLY 52 -6.149 -5.357 -16.581 399 H ARG 53 H ARG 53 -3.233 -7.090 -17.041 400 HA ARG 53 HA ARG 53 -2.578 -6.982 -14.125 401 HB2 ARG 53 1HB ARG 53 -2.696 -9.444 -15.924 402 HB3 ARG 53 2HB ARG 53 -2.187 -9.428 -14.233 403 HG2 ARG 53 1HG ARG 53 -4.468 -8.696 -13.581 404 HG3 ARG 53 2HG ARG 53 -4.963 -8.752 -15.284 405 HD2 ARG 53 1HD ARG 53 -4.407 -11.159 -15.354 406 HD3 ARG 53 2HD ARG 53 -3.967 -11.094 -13.630 407 HE ARG 53 HE ARG 53 -6.564 -10.048 -13.889 408 HH11 ARG 53 1HH1 ARG 53 -4.985 -13.167 -14.357 409 HH12 ARG 53 2HH1 ARG 53 -6.431 -14.069 -14.004 410 HH21 ARG 53 1HH2 ARG 53 -8.377 -11.257 -13.459 411 HH22 ARG 53 2HH2 ARG 53 -8.323 -12.999 -13.506 412 H GLN 54 H GLN 54 -0.233 -7.842 -13.835 413 HA GLN 54 HA GLN 54 1.309 -7.661 -16.343 414 HB2 GLN 54 1HB GLN 54 2.968 -6.171 -15.392 415 HB3 GLN 54 2HB GLN 54 1.383 -5.399 -15.388 416 HG2 GLN 54 1HG GLN 54 1.159 -5.938 -12.966 417 HG3 GLN 54 2HG GLN 54 2.789 -6.624 -12.994 418 HE21 GLN 54 1HE2 GLN 54 4.131 -3.533 -12.155 419 HE22 GLN 54 2HE2 GLN 54 4.017 -5.252 -11.862 420 H GLY 55 H GLY 55 3.070 -8.955 -16.441 421 HA2 GLY 55 1HA GLY 55 3.797 -10.506 -14.035 422 HA3 GLY 55 2HA GLY 55 3.143 -11.361 -15.369 423 H ILE 56 H ILE 56 5.762 -11.915 -14.452 424 HA ILE 56 HA ILE 56 7.567 -10.584 -16.353 425 HB ILE 56 HB ILE 56 9.288 -12.142 -15.601 426 HG12 ILE 56 1HG1 ILE 56 7.173 -13.512 -13.899 427 HG13 ILE 56 2HG1 ILE 56 7.783 -14.157 -15.416 428 HG21 ILE 56 1HG2 ILE 56 8.625 -10.126 -14.167 429 HG22 ILE 56 2HG2 ILE 56 7.683 -11.246 -13.144 430 HG23 ILE 56 3HG2 ILE 56 9.446 -11.428 -13.288 431 HD11 ILE 56 1HD1 ILE 56 8.925 -15.269 -13.626 432 HD12 ILE 56 2HD1 ILE 56 10.094 -14.183 -14.410 433 HD13 ILE 56 3HD1 ILE 56 9.352 -13.729 -12.863 434 H VAL 57 H VAL 57 8.347 -11.414 -18.273 435 HA VAL 57 HA VAL 57 7.024 -13.862 -19.358 436 HB VAL 57 HB VAL 57 7.090 -11.066 -20.585 437 HG11 VAL 57 1HG1 VAL 57 6.404 -13.704 -21.875 438 HG12 VAL 57 2HG1 VAL 57 5.878 -12.141 -22.533 439 HG13 VAL 57 3HG1 VAL 57 7.600 -12.513 -22.397 440 HG21 VAL 57 1HG2 VAL 57 4.618 -11.374 -20.742 441 HG22 VAL 57 2HG2 VAL 57 4.792 -12.899 -19.825 442 HG23 VAL 57 3HG2 VAL 57 5.222 -11.343 -19.076 443 HA PRO 58 HA PRO 58 11.247 -14.129 -20.761 444 HB2 PRO 58 1HB PRO 58 11.093 -16.184 -22.565 445 HB3 PRO 58 2HB PRO 58 11.061 -16.455 -20.791 446 HG2 PRO 58 1HG PRO 58 8.750 -16.292 -22.724 447 HG3 PRO 58 2HG PRO 58 9.075 -17.513 -21.464 448 HD2 PRO 58 1HD PRO 58 7.362 -15.458 -21.084 449 HD3 PRO 58 2HD PRO 58 8.370 -16.114 -19.752 450 H GLY 59 H GLY 59 11.907 -12.475 -22.038 451 HA2 GLY 59 1HA GLY 59 10.269 -11.409 -24.127 452 HA3 GLY 59 2HA GLY 59 11.927 -10.935 -23.724 453 H ASN 60 H ASN 60 12.627 -13.925 -24.105 454 HA ASN 60 HA ASN 60 13.375 -13.757 -26.896 455 HB2 ASN 60 1HB ASN 60 13.428 -16.033 -24.885 456 HB3 ASN 60 2HB ASN 60 13.998 -16.194 -26.553 457 HD21 ASN 60 1HD2 ASN 60 16.674 -15.059 -24.013 458 HD22 ASN 60 2HD2 ASN 60 15.341 -16.159 -23.768 459 H ARG 61 H ARG 61 10.388 -14.330 -25.494 460 HA ARG 61 HA ARG 61 9.500 -15.965 -27.844 461 HB2 ARG 61 1HB ARG 61 8.209 -15.561 -25.116 462 HB3 ARG 61 2HB ARG 61 7.443 -16.393 -26.479 463 HG2 ARG 61 1HG ARG 61 9.484 -17.951 -26.462 464 HG3 ARG 61 2HG ARG 61 9.837 -17.277 -24.860 465 HD2 ARG 61 1HD ARG 61 7.564 -17.944 -24.087 466 HD3 ARG 61 2HD ARG 61 7.234 -18.592 -25.704 467 HE ARG 61 HE ARG 61 9.605 -19.771 -24.591 468 HH11 ARG 61 1HH1 ARG 61 6.065 -19.999 -24.467 469 HH12 ARG 61 2HH1 ARG 61 6.114 -21.644 -23.927 470 HH21 ARG 61 1HH2 ARG 61 9.558 -21.891 -23.900 471 HH22 ARG 61 2HH2 ARG 61 8.026 -22.688 -23.627 472 H LEU 62 H LEU 62 9.957 -12.876 -27.226 473 HA LEU 62 HA LEU 62 7.281 -12.003 -28.265 474 HB2 LEU 62 1HB LEU 62 9.235 -10.518 -26.488 475 HB3 LEU 62 2HB LEU 62 7.729 -9.870 -27.108 476 HG LEU 62 HG LEU 62 7.995 -12.104 -25.064 477 HD11 LEU 62 1HD1 LEU 62 6.978 -10.376 -23.575 478 HD12 LEU 62 2HD1 LEU 62 7.117 -9.192 -24.885 479 HD13 LEU 62 3HD1 LEU 62 8.581 -9.919 -24.173 480 HD21 LEU 62 1HD2 LEU 62 5.538 -11.838 -24.825 481 HD22 LEU 62 2HD2 LEU 62 6.007 -12.485 -26.392 482 HD23 LEU 62 3HD2 LEU 62 5.524 -10.770 -26.257 483 H LYS 63 H LYS 63 7.235 -10.175 -29.664 484 HA LYS 63 HA LYS 63 9.875 -9.420 -30.876 485 HB2 LYS 63 1HB LYS 63 8.141 -10.952 -32.203 486 HB3 LYS 63 2HB LYS 63 7.323 -9.415 -32.469 487 HG2 LYS 63 1HG LYS 63 8.669 -9.696 -34.361 488 HG3 LYS 63 2HG LYS 63 9.576 -8.562 -33.362 489 HD2 LYS 63 1HD LYS 63 10.975 -10.436 -32.508 490 HD3 LYS 63 2HD LYS 63 10.035 -11.561 -33.512 491 HE2 LYS 63 1HE LYS 63 10.756 -10.338 -35.535 492 HE3 LYS 63 2HE LYS 63 11.759 -9.279 -34.511 493 HZ1 LYS 63 1HZ LYS 63 12.052 -12.225 -34.767 494 HZ2 LYS 63 2HZ LYS 63 12.977 -11.267 -33.802 495 HZ3 LYS 63 3HZ LYS 63 13.057 -11.083 -35.437 496 H ILE 64 H ILE 64 10.242 -7.306 -30.455 497 HA ILE 64 HA ILE 64 8.267 -5.579 -29.318 498 HB ILE 64 HB ILE 64 10.989 -4.972 -30.606 499 HG12 ILE 64 1HG1 ILE 64 10.986 -6.416 -28.552 500 HG13 ILE 64 2HG1 ILE 64 11.886 -4.913 -28.401 501 HG21 ILE 64 1HG2 ILE 64 10.857 -2.782 -29.279 502 HG22 ILE 64 2HG2 ILE 64 9.774 -2.876 -30.683 503 HG23 ILE 64 3HG2 ILE 64 9.124 -3.113 -29.046 504 HD11 ILE 64 1HD1 ILE 64 10.148 -3.898 -27.009 505 HD12 ILE 64 2HD1 ILE 64 9.069 -5.290 -27.264 506 HD13 ILE 64 3HD1 ILE 64 10.559 -5.486 -26.332 507 H LEU 65 H LEU 65 6.998 -3.998 -30.129 508 HA LEU 65 HA LEU 65 6.987 -3.600 -33.084 509 HB2 LEU 65 1HB LEU 65 4.642 -3.572 -31.150 510 HB3 LEU 65 2HB LEU 65 4.548 -3.171 -32.861 511 HG LEU 65 HG LEU 65 5.199 -5.918 -31.723 512 HD11 LEU 65 1HD1 LEU 65 2.684 -4.713 -32.951 513 HD12 LEU 65 2HD1 LEU 65 2.881 -5.278 -31.277 514 HD13 LEU 65 3HD1 LEU 65 2.898 -6.439 -32.621 515 HD21 LEU 65 1HD2 LEU 65 6.233 -5.605 -33.933 516 HD22 LEU 65 2HD2 LEU 65 4.705 -4.986 -34.588 517 HD23 LEU 65 3HD2 LEU 65 4.831 -6.689 -34.075 518 H VAL 66 H VAL 66 6.541 -1.445 -33.717 519 HA VAL 66 HA VAL 66 6.642 0.630 -31.587 520 HB VAL 66 HB VAL 66 8.319 1.864 -33.001 521 HG11 VAL 66 1HG1 VAL 66 9.030 0.504 -31.013 522 HG12 VAL 66 2HG1 VAL 66 9.349 -0.862 -32.104 523 HG13 VAL 66 3HG1 VAL 66 10.305 0.635 -32.251 524 HG21 VAL 66 1HG2 VAL 66 9.619 0.703 -34.729 525 HG22 VAL 66 2HG2 VAL 66 8.652 -0.774 -34.498 526 HG23 VAL 66 3HG2 VAL 66 7.902 0.693 -35.169 527 H GLY 67 H GLY 67 6.220 2.833 -32.642 528 HA2 GLY 67 1HA GLY 67 5.374 3.481 -35.089 529 HA3 GLY 67 2HA GLY 67 3.982 2.517 -34.555 530 H MET 68 H MET 68 3.250 3.181 -32.194 531 HA MET 68 HA MET 68 2.527 6.007 -32.434 532 HB2 MET 68 1HB MET 68 1.812 3.901 -30.361 533 HB3 MET 68 2HB MET 68 1.140 5.539 -30.427 534 HG2 MET 68 1HG MET 68 0.841 3.471 -32.637 535 HG3 MET 68 2HG MET 68 -0.361 3.796 -31.374 536 HE1 MET 68 1HE MET 68 0.123 6.033 -35.302 537 HE2 MET 68 2HE MET 68 1.550 5.285 -34.542 538 HE3 MET 68 3HE MET 68 0.133 4.287 -34.959 539 H TYR 69 H TYR 69 4.689 6.911 -32.168 540 HA TYR 69 HA TYR 69 6.040 6.584 -29.596 541 HB2 TYR 69 1HB TYR 69 7.481 8.438 -30.426 542 HB3 TYR 69 2HB TYR 69 7.357 7.079 -31.558 543 HD1 TYR 69 HD1 TYR 69 6.294 10.602 -30.941 544 HD2 TYR 69 HD2 TYR 69 6.362 7.342 -33.759 545 HE1 TYR 69 HE1 TYR 69 5.547 12.144 -32.754 546 HE2 TYR 69 HE2 TYR 69 5.608 8.900 -35.550 547 HH TYR 69 HH TYR 69 4.958 12.354 -34.952 548 H ASP 70 H ASP 70 3.598 8.748 -30.941 549 HA ASP 70 HA ASP 70 3.765 10.557 -28.618 550 HB2 ASP 70 1HB ASP 70 3.116 11.427 -30.874 551 HB3 ASP 70 2HB ASP 70 1.654 10.421 -30.802 552 H LYS 71 H LYS 71 3.475 9.133 -26.943 553 HA LYS 71 HA LYS 71 0.649 8.223 -26.654 554 HB2 LYS 71 1HB LYS 71 2.321 6.339 -27.215 555 HB3 LYS 71 2HB LYS 71 3.055 6.665 -25.638 556 HG2 LYS 71 1HG LYS 71 1.583 4.829 -25.336 557 HG3 LYS 71 2HG LYS 71 0.772 6.225 -24.604 558 HD2 LYS 71 1HD LYS 71 -0.569 6.477 -26.707 559 HD3 LYS 71 2HD LYS 71 0.244 5.039 -27.359 560 HE2 LYS 71 1HE LYS 71 -0.628 3.702 -25.456 561 HE3 LYS 71 2HE LYS 71 -1.459 5.147 -24.838 562 HZ1 LYS 71 1HZ LYS 71 -2.720 5.233 -26.930 563 HZ2 LYS 71 2HZ LYS 71 -2.971 3.793 -26.135 564 HZ3 LYS 71 3HZ LYS 71 -1.977 3.857 -27.455 565 H LYS 72 H LYS 72 -0.234 9.170 -24.926 566 HA LYS 72 HA LYS 72 1.371 10.722 -23.081 567 HB2 LYS 72 1HB LYS 72 -1.534 9.831 -22.906 568 HB3 LYS 72 2HB LYS 72 -0.785 11.042 -21.863 569 HG2 LYS 72 1HG LYS 72 -1.095 11.325 -24.880 570 HG3 LYS 72 2HG LYS 72 -2.198 12.009 -23.669 571 HD2 LYS 72 1HD LYS 72 -0.306 13.338 -22.740 572 HD3 LYS 72 2HD LYS 72 0.771 12.655 -23.972 573 HE2 LYS 72 1HE LYS 72 0.069 14.857 -24.690 574 HE3 LYS 72 2HE LYS 72 -0.662 13.641 -25.748 575 HZ1 LYS 72 1HZ LYS 72 -2.719 13.885 -24.482 576 HZ2 LYS 72 2HZ LYS 72 -2.257 15.337 -25.085 577 HZ3 LYS 72 3HZ LYS 72 -2.016 15.008 -23.489 578 HA PRO 73 HA PRO 73 2.259 7.258 -20.542 579 HB2 PRO 73 1HB PRO 73 3.226 8.407 -18.279 580 HB3 PRO 73 2HB PRO 73 4.104 8.496 -19.835 581 HG2 PRO 73 1HG PRO 73 2.238 10.508 -18.584 582 HG3 PRO 73 2HG PRO 73 3.896 10.757 -19.210 583 HD2 PRO 73 1HD PRO 73 1.707 11.324 -20.689 584 HD3 PRO 73 2HD PRO 73 3.186 10.645 -21.438 585 H ALA 74 H ALA 74 -0.074 9.640 -19.464 586 HA ALA 74 HA ALA 74 -1.795 9.615 -17.974 587 HB1 ALA 74 1HB ALA 74 -2.529 7.768 -19.511 588 HB2 ALA 74 2HB ALA 74 -1.749 6.591 -18.423 589 HB3 ALA 74 3HB ALA 74 -3.117 7.566 -17.846 590 H GLY 75 H GLY 75 0.696 9.748 -16.789 591 HA2 GLY 75 1HA GLY 75 0.465 7.995 -14.378 592 HA3 GLY 75 2HA GLY 75 1.999 8.541 -15.074 593 H GLU 76 H GLU 76 -1.048 10.314 -14.515 594 HA GLU 76 HA GLU 76 0.367 12.615 -13.499 595 HB2 GLU 76 1HB GLU 76 -2.566 11.822 -13.564 596 HB3 GLU 76 2HB GLU 76 -1.983 13.386 -12.952 597 HG2 GLU 76 1HG GLU 76 -2.686 13.712 -15.228 598 HG3 GLU 76 2HG GLU 76 -0.922 13.832 -15.183 599 H PHE 77 H PHE 77 -0.711 9.690 -12.042 600 HA PHE 77 HA PHE 77 -0.089 10.840 -9.343 601 HB2 PHE 77 1HB PHE 77 -2.378 9.959 -9.372 602 HB3 PHE 77 2HB PHE 77 -1.817 8.424 -10.054 603 HD1 PHE 77 HD1 PHE 77 -1.897 10.561 -7.012 604 HD2 PHE 77 HD2 PHE 77 -0.677 6.776 -8.657 605 HE1 PHE 77 HE1 PHE 77 -1.505 9.690 -4.713 606 HE2 PHE 77 HE2 PHE 77 -0.280 5.898 -6.352 607 HZ PHE 77 HZ PHE 77 -0.683 7.363 -4.380 608 H ILE 78 H ILE 78 1.727 10.059 -8.462 609 HA ILE 78 HA ILE 78 2.891 7.537 -9.543 610 HB ILE 78 HB ILE 78 5.154 8.564 -9.368 611 HG12 ILE 78 1HG1 ILE 78 3.763 11.251 -9.016 612 HG13 ILE 78 2HG1 ILE 78 4.425 10.322 -7.659 613 HG21 ILE 78 1HG2 ILE 78 3.845 8.560 -11.548 614 HG22 ILE 78 2HG2 ILE 78 3.354 10.226 -11.193 615 HG23 ILE 78 3HG2 ILE 78 5.073 9.845 -11.439 616 HD11 ILE 78 1HD1 ILE 78 6.682 10.432 -8.684 617 HD12 ILE 78 2HD1 ILE 78 6.025 11.411 -10.020 618 HD13 ILE 78 3HD1 ILE 78 6.011 12.045 -8.364 619 H VAL 79 H VAL 79 4.688 6.801 -7.994 620 HA VAL 79 HA VAL 79 3.865 7.332 -5.163 621 HB VAL 79 HB VAL 79 4.866 5.091 -4.655 622 HG11 VAL 79 1HG1 VAL 79 2.712 4.932 -6.814 623 HG12 VAL 79 2HG1 VAL 79 3.065 3.713 -5.572 624 HG13 VAL 79 3HG1 VAL 79 2.413 5.299 -5.097 625 HG21 VAL 79 1HG2 VAL 79 5.435 3.508 -6.464 626 HG22 VAL 79 2HG2 VAL 79 5.090 4.755 -7.693 627 HG23 VAL 79 3HG2 VAL 79 6.450 4.956 -6.568 628 H THR 80 H THR 80 5.810 7.124 -3.646 629 HA THR 80 HA THR 80 8.413 7.611 -4.873 630 HB THR 80 HB THR 80 7.403 9.928 -4.839 631 HG1 THR 80 HG1 THR 80 9.165 10.840 -3.762 632 HG21 THR 80 1HG2 THR 80 6.990 11.056 -2.713 633 HG22 THR 80 2HG2 THR 80 7.368 9.574 -1.809 634 HG23 THR 80 3HG2 THR 80 5.924 9.644 -2.861 635 H ASP 81 H ASP 81 10.089 7.367 -3.351 636 HA ASP 81 HA ASP 81 9.308 6.184 -0.713 637 HB2 ASP 81 1HB ASP 81 11.201 4.999 -2.812 638 HB3 ASP 81 2HB ASP 81 11.216 4.522 -1.116 639 HXT ASP 81 H02 ASP 81 12.588 8.195 -1.131 Start of MODEL 26 1 H2 GLY 1 2H0 GLY 1 12.035 11.875 -11.720 2 H GLY 1 1H0 GLY 1 13.649 11.958 -11.349 3 HA2 GLY 1 1HA GLY 1 14.155 9.999 -12.641 4 HA3 GLY 1 2HA GLY 1 12.830 9.621 -11.506 5 H SER 2 H SER 2 11.761 8.072 -12.442 6 HA SER 2 HA SER 2 11.281 7.774 -15.238 7 HB2 SER 2 1HB SER 2 9.733 5.905 -14.407 8 HB3 SER 2 2HB SER 2 11.456 5.811 -13.856 9 HG SER 2 HG SER 2 9.209 6.835 -12.420 10 H MET 3 H MET 3 10.291 9.867 -15.774 11 HA MET 3 HA MET 3 7.684 10.587 -14.685 12 HB2 MET 3 1HB MET 3 9.175 11.501 -17.180 13 HB3 MET 3 2HB MET 3 7.639 12.176 -16.632 14 HG2 MET 3 1HG MET 3 10.167 12.093 -15.035 15 HG3 MET 3 2HG MET 3 9.614 13.507 -15.971 16 HE1 MET 3 1HE MET 3 7.579 15.035 -15.275 17 HE2 MET 3 2HE MET 3 6.440 13.669 -15.370 18 HE3 MET 3 3HE MET 3 6.530 14.680 -13.927 19 H LYS 4 H LYS 4 8.778 8.303 -17.035 20 HA LYS 4 HA LYS 4 6.073 7.449 -17.648 21 HB2 LYS 4 1HB LYS 4 6.241 7.664 -20.097 22 HB3 LYS 4 2HB LYS 4 6.145 9.211 -19.298 23 HG2 LYS 4 1HG LYS 4 8.581 9.488 -19.506 24 HG3 LYS 4 2HG LYS 4 8.659 7.933 -20.338 25 HD2 LYS 4 1HD LYS 4 7.236 8.767 -22.146 26 HD3 LYS 4 2HD LYS 4 7.020 10.298 -21.255 27 HE2 LYS 4 1HE LYS 4 8.608 10.578 -23.056 28 HE3 LYS 4 2HE LYS 4 9.417 10.742 -21.464 29 HZ1 LYS 4 1HZ LYS 4 9.464 8.331 -23.199 30 HZ2 LYS 4 2HZ LYS 4 10.140 8.421 -21.689 31 HZ3 LYS 4 3HZ LYS 4 10.729 9.346 -22.875 32 H TYR 5 H TYR 5 5.973 5.459 -18.683 33 HA TYR 5 HA TYR 5 8.201 3.693 -18.151 34 HB2 TYR 5 1HB TYR 5 5.373 3.402 -19.179 35 HB3 TYR 5 2HB TYR 5 6.508 2.062 -19.334 36 HD1 TYR 5 HD1 TYR 5 7.511 0.940 -17.390 37 HD2 TYR 5 HD2 TYR 5 4.472 3.946 -16.913 38 HE1 TYR 5 HE1 TYR 5 7.127 0.169 -15.005 39 HE2 TYR 5 HE2 TYR 5 4.119 3.224 -14.554 40 HH TYR 5 HH TYR 5 6.073 0.686 -13.019 41 H LEU 6 H LEU 6 8.490 1.919 -19.947 42 HA LEU 6 HA LEU 6 9.989 3.159 -22.010 43 HB2 LEU 6 1HB LEU 6 8.962 0.332 -21.827 44 HB3 LEU 6 2HB LEU 6 10.238 0.866 -22.961 45 HG LEU 6 HG LEU 6 10.477 0.999 -19.926 46 HD11 LEU 6 1HD1 LEU 6 11.882 -1.022 -20.163 47 HD12 LEU 6 2HD1 LEU 6 11.580 -1.053 -21.915 48 HD13 LEU 6 3HD1 LEU 6 10.259 -1.308 -20.756 49 HD21 LEU 6 1HD2 LEU 6 12.931 1.255 -20.466 50 HD22 LEU 6 2HD2 LEU 6 11.930 2.598 -21.085 51 HD23 LEU 6 3HD2 LEU 6 12.496 1.348 -22.216 52 H ASN 7 H ASN 7 6.723 1.965 -21.980 53 HA ASN 7 HA ASN 7 5.047 1.905 -23.567 54 HB2 ASN 7 1HB ASN 7 6.516 4.254 -24.803 55 HB3 ASN 7 2HB ASN 7 4.839 3.798 -25.061 56 HD21 ASN 7 1HD2 ASN 7 4.811 6.500 -22.625 57 HD22 ASN 7 2HD2 ASN 7 5.327 6.285 -24.322 58 H VAL 8 H VAL 8 7.306 0.178 -24.044 59 HA VAL 8 HA VAL 8 7.380 0.017 -27.037 60 HB VAL 8 HB VAL 8 8.962 -1.495 -24.896 61 HG11 VAL 8 1HG1 VAL 8 8.707 -2.886 -26.902 62 HG12 VAL 8 2HG1 VAL 8 9.148 -1.519 -27.943 63 HG13 VAL 8 3HG1 VAL 8 10.343 -2.258 -26.877 64 HG21 VAL 8 1HG2 VAL 8 9.716 0.878 -25.059 65 HG22 VAL 8 2HG2 VAL 8 10.949 -0.184 -25.781 66 HG23 VAL 8 3HG2 VAL 8 9.832 0.742 -26.807 67 H LEU 9 H LEU 9 6.272 -1.735 -28.000 68 HA LEU 9 HA LEU 9 5.061 -3.690 -26.066 69 HB2 LEU 9 1HB LEU 9 2.980 -3.648 -27.528 70 HB3 LEU 9 2HB LEU 9 3.245 -2.244 -26.515 71 HG LEU 9 HG LEU 9 4.301 -2.023 -29.272 72 HD11 LEU 9 1HD1 LEU 9 2.180 -3.255 -29.571 73 HD12 LEU 9 2HD1 LEU 9 2.082 -1.655 -30.264 74 HD13 LEU 9 3HD1 LEU 9 1.306 -2.020 -28.713 75 HD21 LEU 9 1HD2 LEU 9 4.376 -0.081 -27.807 76 HD22 LEU 9 2HD2 LEU 9 2.624 -0.191 -27.464 77 HD23 LEU 9 3HD2 LEU 9 3.170 0.243 -29.109 78 H ALA 10 H ALA 10 4.306 -5.679 -27.150 79 HA ALA 10 HA ALA 10 5.736 -6.311 -29.684 80 HB1 ALA 10 1HB ALA 10 6.484 -7.639 -27.074 81 HB2 ALA 10 2HB ALA 10 7.132 -8.082 -28.665 82 HB3 ALA 10 3HB ALA 10 7.490 -6.493 -27.938 83 H LYS 11 H LYS 11 5.294 -8.322 -30.591 84 HA LYS 11 HA LYS 11 2.676 -9.520 -29.744 85 HB2 LYS 11 1HB LYS 11 3.177 -8.920 -32.166 86 HB3 LYS 11 2HB LYS 11 4.486 -10.151 -32.126 87 HG2 LYS 11 1HG LYS 11 2.529 -11.750 -31.375 88 HG3 LYS 11 2HG LYS 11 1.523 -10.535 -32.148 89 HD2 LYS 11 1HD LYS 11 3.852 -11.943 -33.470 90 HD3 LYS 11 2HD LYS 11 2.164 -12.408 -33.637 91 HE2 LYS 11 1HE LYS 11 1.674 -10.161 -34.605 92 HE3 LYS 11 2HE LYS 11 3.381 -9.771 -34.486 93 HZ1 LYS 11 1HZ LYS 11 2.901 -10.510 -36.704 94 HZ2 LYS 11 2HZ LYS 11 2.163 -11.880 -36.171 95 HZ3 LYS 11 3HZ LYS 11 3.787 -11.704 -35.976 96 H ALA 12 H ALA 12 2.509 -11.508 -28.804 97 HA ALA 12 HA ALA 12 4.906 -12.960 -28.038 98 HB1 ALA 12 1HB ALA 12 3.234 -14.726 -27.336 99 HB2 ALA 12 2HB ALA 12 3.001 -13.083 -26.623 100 HB3 ALA 12 3HB ALA 12 1.951 -13.624 -27.955 101 H LEU 13 H LEU 13 6.028 -14.388 -29.232 102 HA LEU 13 HA LEU 13 4.960 -15.112 -31.886 103 HB2 LEU 13 1HB LEU 13 7.529 -15.743 -30.384 104 HB3 LEU 13 2HB LEU 13 7.177 -16.300 -32.011 105 HG LEU 13 HG LEU 13 7.290 -13.344 -31.287 106 HD11 LEU 13 1HD1 LEU 13 9.554 -13.428 -32.303 107 HD12 LEU 13 2HD1 LEU 13 9.462 -15.199 -32.302 108 HD13 LEU 13 3HD1 LEU 13 9.444 -14.303 -30.769 109 HD21 LEU 13 1HD2 LEU 13 6.104 -13.893 -33.398 110 HD22 LEU 13 2HD2 LEU 13 7.470 -14.900 -33.922 111 HD23 LEU 13 3HD2 LEU 13 7.657 -13.124 -33.719 112 H TYR 14 H TYR 14 5.355 -16.471 -28.693 113 HA TYR 14 HA TYR 14 4.391 -19.109 -29.660 114 HB2 TYR 14 1HB TYR 14 6.302 -18.588 -27.343 115 HB3 TYR 14 2HB TYR 14 5.707 -20.186 -27.922 116 HD1 TYR 14 HD1 TYR 14 7.968 -17.336 -28.691 117 HD2 TYR 14 HD2 TYR 14 6.661 -21.232 -29.886 118 HE1 TYR 14 HE1 TYR 14 9.878 -17.514 -30.216 119 HE2 TYR 14 HE2 TYR 14 8.551 -21.390 -31.425 120 HH TYR 14 HH TYR 14 10.938 -18.748 -31.794 121 H ASP 15 H ASP 15 3.150 -20.325 -27.943 122 HA ASP 15 HA ASP 15 1.521 -18.405 -26.352 123 HB2 ASP 15 1HB ASP 15 -0.074 -20.321 -26.193 124 HB3 ASP 15 2HB ASP 15 0.232 -19.809 -27.881 125 H ASN 16 H ASN 16 0.979 -19.083 -24.084 126 HA ASN 16 HA ASN 16 3.055 -20.890 -22.917 127 HB2 ASN 16 1HB ASN 16 3.788 -18.421 -23.050 128 HB3 ASN 16 2HB ASN 16 2.514 -18.106 -21.836 129 HD21 ASN 16 1HD2 ASN 16 4.775 -18.929 -19.281 130 HD22 ASN 16 2HD2 ASN 16 3.534 -17.829 -19.926 131 H VAL 17 H VAL 17 2.732 -21.439 -20.719 132 HA VAL 17 HA VAL 17 -0.020 -20.998 -19.671 133 HB VAL 17 HB VAL 17 1.632 -23.577 -19.507 134 HG11 VAL 17 1HG1 VAL 17 0.562 -23.207 -17.404 135 HG12 VAL 17 2HG1 VAL 17 -0.976 -22.739 -18.180 136 HG13 VAL 17 3HG1 VAL 17 -0.404 -24.460 -18.303 137 HG21 VAL 17 1HG2 VAL 17 0.485 -23.313 -21.703 138 HG22 VAL 17 2HG2 VAL 17 -0.236 -24.589 -20.728 139 HG23 VAL 17 3HG2 VAL 17 -1.081 -23.032 -20.812 140 H ALA 18 H ALA 18 0.290 -19.802 -17.830 141 HA ALA 18 HA ALA 18 2.963 -19.357 -16.860 142 HB1 ALA 18 1HB ALA 18 1.808 -17.873 -15.204 143 HB2 ALA 18 2HB ALA 18 1.398 -17.534 -16.884 144 HB3 ALA 18 3HB ALA 18 0.260 -18.436 -15.890 145 H GLU 19 H GLU 19 3.988 -20.763 -15.605 146 HA GLU 19 HA GLU 19 2.430 -22.717 -14.094 147 HB2 GLU 19 1HB GLU 19 4.491 -23.803 -13.608 148 HB3 GLU 19 2HB GLU 19 4.515 -23.383 -15.332 149 HG2 GLU 19 1HG GLU 19 6.089 -21.654 -14.952 150 HG3 GLU 19 2HG GLU 19 5.871 -21.688 -13.182 151 H SER 20 H SER 20 3.756 -19.652 -13.610 152 HA SER 20 HA SER 20 3.437 -19.935 -10.634 153 HB2 SER 20 1HB SER 20 5.325 -18.215 -12.252 154 HB3 SER 20 2HB SER 20 5.091 -18.061 -10.465 155 HG SER 20 HG SER 20 5.846 -20.487 -11.796 156 HA PRO 21 HA PRO 21 0.452 -16.715 -11.169 157 HB2 PRO 21 1HB PRO 21 0.471 -15.389 -8.796 158 HB3 PRO 21 2HB PRO 21 -0.118 -17.080 -8.907 159 HG2 PRO 21 1HG PRO 21 2.640 -16.094 -8.119 160 HG3 PRO 21 2HG PRO 21 1.554 -17.216 -7.221 161 HD2 PRO 21 1HD PRO 21 3.541 -18.105 -8.795 162 HD3 PRO 21 2HD PRO 21 1.964 -18.989 -8.723 163 H ASP 22 H ASP 22 3.777 -16.034 -10.494 164 HA ASP 22 HA ASP 22 3.601 -13.113 -10.885 165 HB2 ASP 22 1HB ASP 22 5.214 -14.303 -9.367 166 HB3 ASP 22 2HB ASP 22 5.986 -15.024 -10.844 167 H GLU 23 H GLU 23 3.796 -15.940 -12.797 168 HA GLU 23 HA GLU 23 5.158 -14.645 -15.082 169 HB2 GLU 23 1HB GLU 23 5.585 -17.011 -14.327 170 HB3 GLU 23 2HB GLU 23 3.919 -17.406 -14.847 171 HG2 GLU 23 1HG GLU 23 4.492 -16.608 -17.133 172 HG3 GLU 23 2HG GLU 23 6.114 -16.316 -16.625 173 H LEU 24 H LEU 24 4.028 -14.027 -16.953 174 HA LEU 24 HA LEU 24 1.157 -13.804 -16.579 175 HB2 LEU 24 1HB LEU 24 3.184 -12.411 -18.114 176 HB3 LEU 24 2HB LEU 24 1.851 -12.923 -19.176 177 HG LEU 24 HG LEU 24 1.477 -11.375 -16.581 178 HD11 LEU 24 1HD1 LEU 24 2.805 -10.063 -18.134 179 HD12 LEU 24 2HD1 LEU 24 1.148 -9.393 -18.145 180 HD13 LEU 24 3HD1 LEU 24 1.723 -10.405 -19.493 181 HD21 LEU 24 1HD2 LEU 24 -0.475 -12.000 -18.883 182 HD22 LEU 24 2HD2 LEU 24 -0.799 -10.837 -17.595 183 HD23 LEU 24 3HD2 LEU 24 -0.592 -12.550 -17.190 184 H SER 25 H SER 25 -0.442 -14.872 -17.526 185 HA SER 25 HA SER 25 0.247 -17.169 -19.233 186 HB2 SER 25 1HB SER 25 -2.253 -17.545 -19.131 187 HB3 SER 25 2HB SER 25 -1.425 -17.528 -17.540 188 HG SER 25 HG SER 25 -2.779 -15.334 -18.753 189 H PHE 26 H PHE 26 0.669 -16.610 -21.386 190 HA PHE 26 HA PHE 26 -1.294 -14.807 -22.729 191 HB2 PHE 26 1HB PHE 26 0.557 -13.862 -24.033 192 HB3 PHE 26 2HB PHE 26 0.730 -13.530 -22.302 193 HD1 PHE 26 HD1 PHE 26 2.094 -15.501 -25.137 194 HD2 PHE 26 HD2 PHE 26 2.551 -14.417 -20.995 195 HE1 PHE 26 HE1 PHE 26 4.399 -16.407 -25.151 196 HE2 PHE 26 HE2 PHE 26 4.869 -15.380 -20.976 197 HZ PHE 26 HZ PHE 26 5.784 -16.353 -23.097 198 H ARG 27 H ARG 27 -1.234 -14.993 -25.162 199 HA ARG 27 HA ARG 27 -0.633 -17.811 -25.968 200 HB2 ARG 27 1HB ARG 27 -3.021 -16.152 -26.793 201 HB3 ARG 27 2HB ARG 27 -2.638 -17.720 -27.433 202 HG2 ARG 27 1HG ARG 27 -2.656 -18.250 -24.732 203 HG3 ARG 27 2HG ARG 27 -3.934 -17.030 -24.874 204 HD2 ARG 27 1HD ARG 27 -4.526 -18.614 -27.029 205 HD3 ARG 27 2HD ARG 27 -3.758 -19.808 -25.954 206 HE ARG 27 HE ARG 27 -5.480 -19.535 -24.367 207 HH11 ARG 27 1HH1 ARG 27 -6.037 -17.504 -27.213 208 HH12 ARG 27 2HH1 ARG 27 -7.706 -17.212 -26.824 209 HH21 ARG 27 1HH2 ARG 27 -7.619 -19.120 -23.917 210 HH22 ARG 27 2HH2 ARG 27 -8.615 -18.167 -24.984 211 H LYS 28 H LYS 28 -0.154 -18.099 -28.256 212 HA LYS 28 HA LYS 28 1.601 -16.112 -29.263 213 HB2 LYS 28 1HB LYS 28 1.657 -17.495 -31.290 214 HB3 LYS 28 2HB LYS 28 1.793 -18.493 -29.812 215 HG2 LYS 28 1HG LYS 28 -0.689 -18.993 -30.103 216 HG3 LYS 28 2HG LYS 28 -0.615 -18.213 -31.678 217 HD2 LYS 28 1HD LYS 28 1.187 -20.501 -30.811 218 HD3 LYS 28 2HD LYS 28 -0.364 -20.721 -31.631 219 HE2 LYS 28 1HE LYS 28 0.447 -19.337 -33.537 220 HE3 LYS 28 2HE LYS 28 2.068 -19.315 -32.771 221 HZ1 LYS 28 1HZ LYS 28 1.845 -21.192 -34.332 222 HZ2 LYS 28 2HZ LYS 28 0.585 -21.768 -33.524 223 HZ3 LYS 28 3HZ LYS 28 2.036 -21.725 -32.799 224 H GLY 29 H GLY 29 1.314 -14.421 -30.593 225 HA2 GLY 29 1HA GLY 29 0.197 -13.198 -32.302 226 HA3 GLY 29 2HA GLY 29 -1.276 -14.148 -32.021 227 H ASP 30 H ASP 30 -0.536 -13.539 -28.926 228 HA ASP 30 HA ASP 30 -2.348 -11.245 -28.758 229 HB2 ASP 30 1HB ASP 30 -1.747 -13.266 -27.096 230 HB3 ASP 30 2HB ASP 30 -0.577 -12.072 -26.458 231 H ILE 31 H ILE 31 -1.725 -9.193 -27.601 232 HA ILE 31 HA ILE 31 1.099 -8.351 -28.333 233 HB ILE 31 HB ILE 31 -1.426 -6.603 -28.527 234 HG12 ILE 31 1HG1 ILE 31 -1.558 -8.270 -30.309 235 HG13 ILE 31 2HG1 ILE 31 -1.221 -6.668 -30.934 236 HG21 ILE 31 1HG2 ILE 31 0.491 -5.205 -28.048 237 HG22 ILE 31 2HG2 ILE 31 1.514 -6.070 -29.207 238 HG23 ILE 31 3HG2 ILE 31 0.186 -5.001 -29.790 239 HD11 ILE 31 1HD1 ILE 31 0.828 -8.875 -30.593 240 HD12 ILE 31 2HD1 ILE 31 0.077 -8.394 -32.138 241 HD13 ILE 31 3HD1 ILE 31 1.179 -7.261 -31.287 242 H MET 32 H MET 32 2.207 -7.567 -26.582 243 HA MET 32 HA MET 32 0.587 -6.460 -24.330 244 HB2 MET 32 1HB MET 32 2.001 -7.608 -22.742 245 HB3 MET 32 2HB MET 32 1.134 -8.746 -23.796 246 HG2 MET 32 1HG MET 32 3.315 -8.809 -25.154 247 HG3 MET 32 2HG MET 32 4.091 -8.007 -23.806 248 HE1 MET 32 1HE MET 32 2.522 -12.301 -24.094 249 HE2 MET 32 2HE MET 32 1.410 -10.971 -24.435 250 HE3 MET 32 3HE MET 32 2.896 -11.150 -25.442 251 H THR 33 H THR 33 1.608 -4.985 -22.896 252 HA THR 33 HA THR 33 3.669 -3.390 -24.327 253 HB THR 33 HB THR 33 2.105 -2.809 -21.741 254 HG1 THR 33 HG1 THR 33 1.487 -1.461 -24.059 255 HG21 THR 33 1HG2 THR 33 2.687 -0.402 -22.312 256 HG22 THR 33 2HG2 THR 33 3.728 -0.970 -23.635 257 HG23 THR 33 3HG2 THR 33 4.094 -1.361 -21.910 258 H VAL 34 H VAL 34 5.766 -3.263 -23.675 259 HA VAL 34 HA VAL 34 6.628 -4.857 -21.336 260 HB VAL 34 HB VAL 34 8.171 -3.403 -23.554 261 HG11 VAL 34 1HG1 VAL 34 9.188 -5.191 -21.298 262 HG12 VAL 34 2HG1 VAL 34 10.171 -4.730 -22.710 263 HG13 VAL 34 3HG1 VAL 34 9.608 -3.492 -21.587 264 HG21 VAL 34 1HG2 VAL 34 8.743 -5.633 -24.388 265 HG22 VAL 34 2HG2 VAL 34 7.717 -6.380 -23.097 266 HG23 VAL 34 3HG2 VAL 34 6.970 -5.392 -24.381 267 H LEU 35 H LEU 35 7.122 -3.995 -19.491 268 HA LEU 35 HA LEU 35 7.103 -1.031 -19.185 269 HB2 LEU 35 1HB LEU 35 6.741 -3.181 -17.103 270 HB3 LEU 35 2HB LEU 35 6.548 -1.453 -16.862 271 HG LEU 35 HG LEU 35 4.781 -3.216 -18.623 272 HD11 LEU 35 1HD1 LEU 35 4.285 -1.961 -15.888 273 HD12 LEU 35 2HD1 LEU 35 4.453 -3.700 -16.259 274 HD13 LEU 35 3HD1 LEU 35 3.069 -2.789 -16.890 275 HD21 LEU 35 1HD2 LEU 35 4.397 -0.293 -17.836 276 HD22 LEU 35 2HD2 LEU 35 3.264 -1.262 -18.754 277 HD23 LEU 35 3HD2 LEU 35 4.818 -0.909 -19.462 278 H GLU 36 H GLU 36 8.846 -3.956 -18.360 279 HA GLU 36 HA GLU 36 11.252 -2.304 -17.814 280 HB2 GLU 36 1HB GLU 36 9.920 -2.839 -15.694 281 HB3 GLU 36 2HB GLU 36 10.241 -4.547 -16.017 282 HG2 GLU 36 1HG GLU 36 12.675 -4.103 -15.859 283 HG3 GLU 36 2HG GLU 36 12.357 -2.445 -15.408 284 H ARG 37 H ARG 37 13.245 -3.731 -17.800 285 HA ARG 37 HA ARG 37 12.914 -6.341 -19.147 286 HB2 ARG 37 1HB ARG 37 14.981 -4.209 -19.886 287 HB3 ARG 37 2HB ARG 37 14.929 -5.858 -20.471 288 HG2 ARG 37 1HG ARG 37 12.666 -5.346 -21.488 289 HG3 ARG 37 2HG ARG 37 13.042 -3.637 -21.166 290 HD2 ARG 37 1HD ARG 37 15.206 -3.954 -22.443 291 HD3 ARG 37 2HD ARG 37 14.662 -5.591 -22.825 292 HE ARG 37 HE ARG 37 13.065 -4.762 -24.308 293 HH11 ARG 37 1HH1 ARG 37 14.671 -2.058 -22.650 294 HH12 ARG 37 2HH1 ARG 37 14.072 -0.889 -23.790 295 HH21 ARG 37 1HH2 ARG 37 12.392 -3.222 -25.706 296 HH22 ARG 37 2HH2 ARG 37 12.816 -1.545 -25.512 297 H ASP 38 H ASP 38 14.462 -7.833 -18.346 298 HA ASP 38 HA ASP 38 15.878 -8.724 -16.856 299 HB2 ASP 38 1HB ASP 38 17.295 -6.659 -17.823 300 HB3 ASP 38 2HB ASP 38 17.167 -6.120 -16.139 301 H THR 39 H THR 39 13.334 -7.971 -16.218 302 HA THR 39 HA THR 39 13.063 -6.344 -13.882 303 HB THR 39 HB THR 39 11.290 -6.764 -15.594 304 HG1 THR 39 HG1 THR 39 10.674 -6.065 -13.482 305 HG21 THR 39 1HG2 THR 39 11.758 -9.264 -15.850 306 HG22 THR 39 2HG2 THR 39 10.061 -8.868 -15.646 307 HG23 THR 39 3HG2 THR 39 10.982 -9.459 -14.273 308 H GLN 40 H GLN 40 13.929 -9.704 -14.116 309 HA GLN 40 HA GLN 40 13.269 -9.985 -11.201 310 HB2 GLN 40 1HB GLN 40 12.082 -11.418 -13.040 311 HB3 GLN 40 2HB GLN 40 13.596 -12.343 -13.024 312 HG2 GLN 40 1HG GLN 40 13.273 -12.714 -10.562 313 HG3 GLN 40 2HG GLN 40 11.740 -11.797 -10.634 314 HE21 GLN 40 1HE2 GLN 40 10.049 -14.748 -11.347 315 HE22 GLN 40 2HE2 GLN 40 10.129 -13.245 -10.423 316 H GLY 41 H GLY 41 15.684 -9.125 -13.068 317 HA2 GLY 41 1HA GLY 41 17.951 -9.080 -12.595 318 HA3 GLY 41 2HA GLY 41 17.732 -10.348 -11.352 319 H LEU 42 H LEU 42 16.134 -11.531 -13.830 320 HA LEU 42 HA LEU 42 18.387 -13.183 -14.810 321 HB2 LEU 42 1HB LEU 42 15.381 -13.243 -15.344 322 HB3 LEU 42 2HB LEU 42 16.557 -14.383 -16.059 323 HG LEU 42 HG LEU 42 15.973 -14.179 -13.068 324 HD11 LEU 42 1HD1 LEU 42 14.894 -16.045 -15.235 325 HD12 LEU 42 2HD1 LEU 42 13.961 -14.811 -14.306 326 HD13 LEU 42 3HD1 LEU 42 14.621 -16.232 -13.486 327 HD21 LEU 42 1HD2 LEU 42 17.466 -16.268 -14.739 328 HD22 LEU 42 2HD2 LEU 42 16.962 -16.505 -13.067 329 HD23 LEU 42 3HD2 LEU 42 18.132 -15.219 -13.457 330 H ASP 43 H ASP 43 19.143 -13.008 -16.886 331 HA ASP 43 HA ASP 43 18.563 -10.590 -18.287 332 HB2 ASP 43 1HB ASP 43 20.120 -11.273 -19.919 333 HB3 ASP 43 2HB ASP 43 20.749 -11.915 -18.381 334 H GLY 44 H GLY 44 17.517 -10.359 -20.315 335 HA2 GLY 44 1HA GLY 44 16.087 -10.890 -22.068 336 HA3 GLY 44 2HA GLY 44 16.326 -12.586 -21.671 337 H TRP 45 H TRP 45 15.214 -11.340 -18.782 338 HA TRP 45 HA TRP 45 12.438 -12.105 -19.557 339 HB2 TRP 45 1HB TRP 45 13.980 -11.976 -16.982 340 HB3 TRP 45 2HB TRP 45 12.187 -12.052 -16.987 341 HD1 TRP 45 HD1 TRP 45 15.226 -14.143 -18.049 342 HE1 TRP 45 HE1 TRP 45 14.505 -16.558 -18.352 343 HE3 TRP 45 HE3 TRP 45 10.247 -13.451 -17.459 344 HZ2 TRP 45 HZ2 TRP 45 12.051 -18.014 -18.444 345 HZ3 TRP 45 HZ3 TRP 45 8.697 -15.425 -17.670 346 HH2 TRP 45 HH2 TRP 45 9.623 -17.674 -18.171 347 H TRP 46 H TRP 46 10.737 -10.702 -19.560 348 HA TRP 46 HA TRP 46 11.421 -7.909 -18.684 349 HB2 TRP 46 1HB TRP 46 9.766 -8.801 -21.089 350 HB3 TRP 46 2HB TRP 46 10.113 -7.137 -20.619 351 HD1 TRP 46 HD1 TRP 46 13.421 -8.353 -20.200 352 HE1 TRP 46 HE1 TRP 46 14.842 -8.277 -22.309 353 HE3 TRP 46 HE3 TRP 46 9.628 -7.797 -23.547 354 HZ2 TRP 46 HZ2 TRP 46 14.385 -8.061 -25.140 355 HZ3 TRP 46 HZ3 TRP 46 10.169 -7.663 -26.009 356 HH2 TRP 46 HH2 TRP 46 12.550 -7.784 -26.779 357 H LEU 47 H LEU 47 9.813 -6.729 -17.697 358 HA LEU 47 HA LEU 47 7.471 -8.246 -16.770 359 HB2 LEU 47 1HB LEU 47 8.721 -6.611 -15.278 360 HB3 LEU 47 2HB LEU 47 8.220 -5.349 -16.381 361 HG LEU 47 HG LEU 47 5.804 -5.962 -15.831 362 HD11 LEU 47 1HD1 LEU 47 6.213 -8.253 -14.938 363 HD12 LEU 47 2HD1 LEU 47 5.437 -7.243 -13.735 364 HD13 LEU 47 3HD1 LEU 47 7.176 -7.535 -13.598 365 HD21 LEU 47 1HD2 LEU 47 5.818 -4.774 -13.725 366 HD22 LEU 47 2HD2 LEU 47 6.951 -4.022 -14.857 367 HD23 LEU 47 3HD2 LEU 47 7.553 -5.043 -13.538 368 H CYS 48 H CYS 48 5.656 -8.336 -17.981 369 HA CYS 48 HA CYS 48 5.112 -6.030 -19.814 370 HB2 CYS 48 1HB CYS 48 4.309 -8.932 -20.169 371 HB3 CYS 48 2HB CYS 48 3.937 -7.600 -21.273 372 HG CYS 48 HG CYS 48 6.860 -8.853 -20.411 373 H SER 49 H SER 49 2.773 -5.655 -20.210 374 HA SER 49 HA SER 49 1.078 -6.514 -17.892 375 HB2 SER 49 1HB SER 49 -0.090 -4.376 -18.087 376 HB3 SER 49 2HB SER 49 1.645 -4.090 -17.786 377 HG SER 49 HG SER 49 0.583 -4.229 -20.416 378 H LEU 50 H LEU 50 -0.624 -7.651 -18.373 379 HA LEU 50 HA LEU 50 -2.023 -7.304 -20.969 380 HB2 LEU 50 1HB LEU 50 -0.137 -9.017 -21.324 381 HB3 LEU 50 2HB LEU 50 -0.860 -9.971 -20.064 382 HG LEU 50 HG LEU 50 -2.942 -10.177 -21.490 383 HD11 LEU 50 1HD1 LEU 50 -1.227 -8.810 -23.567 384 HD12 LEU 50 2HD1 LEU 50 -2.712 -8.203 -22.894 385 HD13 LEU 50 3HD1 LEU 50 -2.713 -9.651 -23.915 386 HD21 LEU 50 1HD2 LEU 50 -1.292 -11.964 -21.449 387 HD22 LEU 50 2HD2 LEU 50 -0.327 -11.160 -22.696 388 HD23 LEU 50 3HD2 LEU 50 -1.952 -11.789 -23.080 389 H HIS 51 H HIS 51 -4.139 -8.014 -20.799 390 HA HIS 51 HA HIS 51 -6.139 -8.532 -19.813 391 HB2 HIS 51 1HB HIS 51 -4.602 -10.705 -19.377 392 HB3 HIS 51 2HB HIS 51 -4.916 -10.247 -17.692 393 HD1 HIS 51 HD1 HIS 51 -6.479 -11.864 -20.617 394 HD2 HIS 51 HD2 HIS 51 -7.728 -10.294 -17.022 395 HE1 HIS 51 HE1 HIS 51 -8.815 -12.713 -20.247 396 H GLY 52 H GLY 52 -4.110 -6.485 -18.346 397 HA2 GLY 52 1HA GLY 52 -4.817 -4.864 -16.776 398 HA3 GLY 52 2HA GLY 52 -6.082 -5.978 -16.182 399 H ARG 53 H ARG 53 -3.110 -7.581 -16.558 400 HA ARG 53 HA ARG 53 -2.358 -7.121 -13.712 401 HB2 ARG 53 1HB ARG 53 -2.222 -9.721 -15.308 402 HB3 ARG 53 2HB ARG 53 -1.650 -9.495 -13.638 403 HG2 ARG 53 1HG ARG 53 -4.025 -8.908 -13.007 404 HG3 ARG 53 2HG ARG 53 -4.513 -9.478 -14.640 405 HD2 ARG 53 1HD ARG 53 -3.400 -11.679 -14.105 406 HD3 ARG 53 2HD ARG 53 -3.044 -11.083 -12.502 407 HE ARG 53 HE ARG 53 -5.848 -10.837 -13.117 408 HH11 ARG 53 1HH1 ARG 53 -3.421 -13.158 -12.118 409 HH12 ARG 53 2HH1 ARG 53 -4.593 -14.192 -11.330 410 HH21 ARG 53 1HH2 ARG 53 -7.309 -12.152 -12.120 411 HH22 ARG 53 2HH2 ARG 53 -6.762 -13.638 -11.332 412 H GLN 54 H GLN 54 0.038 -7.692 -13.404 413 HA GLN 54 HA GLN 54 1.558 -7.280 -15.963 414 HB2 GLN 54 1HB GLN 54 2.282 -6.412 -13.122 415 HB3 GLN 54 2HB GLN 54 3.372 -6.289 -14.548 416 HG2 GLN 54 1HG GLN 54 2.585 -4.175 -14.456 417 HG3 GLN 54 2HG GLN 54 1.382 -4.899 -15.562 418 HE21 GLN 54 1HE2 GLN 54 0.338 -3.744 -11.769 419 HE22 GLN 54 2HE2 GLN 54 2.004 -4.024 -12.174 420 H GLY 55 H GLY 55 3.597 -8.593 -15.951 421 HA2 GLY 55 1HA GLY 55 4.227 -10.363 -13.840 422 HA3 GLY 55 2HA GLY 55 3.219 -11.212 -15.027 423 H ILE 56 H ILE 56 5.842 -12.069 -14.507 424 HA ILE 56 HA ILE 56 7.679 -10.754 -16.382 425 HB ILE 56 HB ILE 56 9.303 -12.498 -15.724 426 HG12 ILE 56 1HG1 ILE 56 7.094 -13.747 -14.041 427 HG13 ILE 56 2HG1 ILE 56 7.524 -14.404 -15.611 428 HG21 ILE 56 1HG2 ILE 56 9.397 -12.011 -13.305 429 HG22 ILE 56 2HG2 ILE 56 8.807 -10.547 -14.176 430 HG23 ILE 56 3HG2 ILE 56 7.674 -11.611 -13.244 431 HD11 ILE 56 1HD1 ILE 56 8.635 -15.690 -13.998 432 HD12 ILE 56 2HD1 ILE 56 9.884 -14.673 -14.764 433 HD13 ILE 56 3HD1 ILE 56 9.238 -14.265 -13.151 434 H VAL 57 H VAL 57 8.325 -11.349 -18.332 435 HA VAL 57 HA VAL 57 7.120 -13.775 -19.563 436 HB VAL 57 HB VAL 57 6.997 -10.956 -20.738 437 HG11 VAL 57 1HG1 VAL 57 5.825 -11.959 -22.671 438 HG12 VAL 57 2HG1 VAL 57 7.496 -12.461 -22.518 439 HG13 VAL 57 3HG1 VAL 57 6.213 -13.574 -22.020 440 HG21 VAL 57 1HG2 VAL 57 4.837 -12.918 -19.943 441 HG22 VAL 57 2HG2 VAL 57 5.245 -11.393 -19.154 442 HG23 VAL 57 3HG2 VAL 57 4.573 -11.392 -20.788 443 HA PRO 58 HA PRO 58 11.345 -13.867 -20.971 444 HB2 PRO 58 1HB PRO 58 11.285 -15.840 -22.856 445 HB3 PRO 58 2HB PRO 58 11.180 -16.170 -21.079 446 HG2 PRO 58 1HG PRO 58 8.915 -15.946 -23.056 447 HG3 PRO 58 2HG PRO 58 9.194 -17.239 -21.858 448 HD2 PRO 58 1HD PRO 58 7.510 -15.216 -21.449 449 HD3 PRO 58 2HD PRO 58 8.490 -15.886 -20.116 450 H GLY 59 H GLY 59 12.089 -12.174 -22.064 451 HA2 GLY 59 1HA GLY 59 10.541 -10.875 -24.107 452 HA3 GLY 59 2HA GLY 59 12.198 -10.552 -23.677 453 H ASN 60 H ASN 60 13.023 -13.382 -24.372 454 HA ASN 60 HA ASN 60 13.724 -12.932 -27.107 455 HB2 ASN 60 1HB ASN 60 14.946 -14.412 -25.468 456 HB3 ASN 60 2HB ASN 60 13.637 -15.581 -25.644 457 HD21 ASN 60 1HD2 ASN 60 15.268 -17.099 -28.290 458 HD22 ASN 60 2HD2 ASN 60 14.370 -17.243 -26.828 459 H ARG 61 H ARG 61 10.863 -14.272 -25.627 460 HA ARG 61 HA ARG 61 10.011 -15.640 -28.138 461 HB2 ARG 61 1HB ARG 61 8.722 -15.382 -25.418 462 HB3 ARG 61 2HB ARG 61 8.105 -16.365 -26.738 463 HG2 ARG 61 1HG ARG 61 10.393 -17.626 -26.670 464 HG3 ARG 61 2HG ARG 61 10.702 -16.749 -25.142 465 HD2 ARG 61 1HD ARG 61 8.437 -17.684 -24.325 466 HD3 ARG 61 2HD ARG 61 8.572 -18.821 -25.699 467 HE ARG 61 HE ARG 61 11.025 -18.881 -24.277 468 HH11 ARG 61 1HH1 ARG 61 7.713 -19.897 -23.740 469 HH12 ARG 61 2HH1 ARG 61 8.165 -21.110 -22.591 470 HH21 ARG 61 1HH2 ARG 61 11.537 -20.445 -22.803 471 HH22 ARG 61 2HH2 ARG 61 10.303 -21.419 -22.068 472 H LEU 62 H LEU 62 10.195 -12.543 -27.448 473 HA LEU 62 HA LEU 62 7.428 -11.939 -28.412 474 HB2 LEU 62 1HB LEU 62 9.347 -10.230 -26.766 475 HB3 LEU 62 2HB LEU 62 7.837 -9.699 -27.373 476 HG LEU 62 HG LEU 62 8.072 -11.911 -25.330 477 HD11 LEU 62 1HD1 LEU 62 7.382 -8.955 -25.034 478 HD12 LEU 62 2HD1 LEU 62 8.824 -9.752 -24.430 479 HD13 LEU 62 3HD1 LEU 62 7.263 -10.151 -23.742 480 HD21 LEU 62 1HD2 LEU 62 5.658 -11.509 -25.070 481 HD22 LEU 62 2HD2 LEU 62 6.070 -12.022 -26.692 482 HD23 LEU 62 3HD2 LEU 62 5.728 -10.320 -26.398 483 H LYS 63 H LYS 63 7.138 -10.491 -30.038 484 HA LYS 63 HA LYS 63 9.647 -9.663 -31.533 485 HB2 LYS 63 1HB LYS 63 8.166 -11.275 -32.694 486 HB3 LYS 63 2HB LYS 63 6.830 -10.131 -32.629 487 HG2 LYS 63 1HG LYS 63 8.297 -8.516 -33.998 488 HG3 LYS 63 2HG LYS 63 9.467 -9.838 -34.160 489 HD2 LYS 63 1HD LYS 63 7.645 -11.253 -35.204 490 HD3 LYS 63 2HD LYS 63 6.564 -9.842 -35.135 491 HE2 LYS 63 1HE LYS 63 7.483 -9.947 -37.345 492 HE3 LYS 63 2HE LYS 63 8.217 -8.547 -36.510 493 HZ1 LYS 63 1HZ LYS 63 9.790 -9.967 -37.798 494 HZ2 LYS 63 2HZ LYS 63 9.522 -11.217 -36.783 495 HZ3 LYS 63 3HZ LYS 63 10.224 -9.840 -36.219 496 H ILE 64 H ILE 64 10.086 -7.566 -31.296 497 HA ILE 64 HA ILE 64 8.434 -5.715 -30.007 498 HB ILE 64 HB ILE 64 10.760 -5.125 -31.931 499 HG12 ILE 64 1HG1 ILE 64 11.555 -6.530 -30.148 500 HG13 ILE 64 2HG1 ILE 64 12.102 -4.872 -29.850 501 HG21 ILE 64 1HG2 ILE 64 9.519 -3.053 -31.638 502 HG22 ILE 64 2HG2 ILE 64 9.308 -3.350 -29.902 503 HG23 ILE 64 3HG2 ILE 64 10.927 -2.949 -30.566 504 HD11 ILE 64 1HD1 ILE 64 10.187 -4.641 -28.153 505 HD12 ILE 64 2HD1 ILE 64 9.845 -6.360 -28.402 506 HD13 ILE 64 3HD1 ILE 64 11.387 -5.854 -27.719 507 H LEU 65 H LEU 65 6.965 -4.215 -30.629 508 HA LEU 65 HA LEU 65 6.160 -4.203 -33.524 509 HB2 LEU 65 1HB LEU 65 4.690 -4.761 -31.065 510 HB3 LEU 65 2HB LEU 65 4.094 -3.245 -31.741 511 HG LEU 65 HG LEU 65 2.729 -5.107 -32.460 512 HD11 LEU 65 1HD1 LEU 65 2.918 -3.259 -34.031 513 HD12 LEU 65 2HD1 LEU 65 2.776 -4.830 -34.912 514 HD13 LEU 65 3HD1 LEU 65 4.342 -4.024 -34.776 515 HD21 LEU 65 1HD2 LEU 65 5.108 -6.270 -33.911 516 HD22 LEU 65 2HD2 LEU 65 3.476 -6.946 -33.781 517 HD23 LEU 65 3HD2 LEU 65 4.529 -6.845 -32.330 518 H VAL 66 H VAL 66 4.934 -2.032 -33.903 519 HA VAL 66 HA VAL 66 6.724 0.168 -33.136 520 HB VAL 66 HB VAL 66 5.253 1.514 -34.660 521 HG11 VAL 66 1HG1 VAL 66 6.207 -1.137 -35.872 522 HG12 VAL 66 2HG1 VAL 66 5.977 0.403 -36.712 523 HG13 VAL 66 3HG1 VAL 66 7.226 0.251 -35.522 524 HG21 VAL 66 1HG2 VAL 66 3.079 0.426 -34.268 525 HG22 VAL 66 2HG2 VAL 66 3.527 0.353 -36.003 526 HG23 VAL 66 3HG2 VAL 66 3.664 -1.091 -34.991 527 H GLY 67 H GLY 67 5.778 2.292 -32.319 528 HA2 GLY 67 1HA GLY 67 4.455 1.698 -29.818 529 HA3 GLY 67 2HA GLY 67 4.933 3.293 -30.425 530 H MET 68 H MET 68 2.476 2.404 -29.060 531 HA MET 68 HA MET 68 0.588 3.486 -31.063 532 HB2 MET 68 1HB MET 68 0.576 0.799 -30.444 533 HB3 MET 68 2HB MET 68 -0.495 1.449 -29.169 534 HG2 MET 68 1HG MET 68 -1.913 0.936 -31.042 535 HG3 MET 68 2HG MET 68 -1.724 2.670 -31.009 536 HE1 MET 68 1HE MET 68 -1.792 3.564 -33.468 537 HE2 MET 68 2HE MET 68 -1.496 2.486 -34.846 538 HE3 MET 68 3HE MET 68 -2.711 2.031 -33.648 539 H TYR 69 H TYR 69 -1.388 4.311 -29.955 540 HA TYR 69 HA TYR 69 -0.701 5.995 -27.782 541 HB2 TYR 69 1HB TYR 69 -3.330 6.253 -27.900 542 HB3 TYR 69 2HB TYR 69 -2.280 6.946 -29.159 543 HD1 TYR 69 HD1 TYR 69 -2.507 6.344 -31.408 544 HD2 TYR 69 HD2 TYR 69 -4.394 3.971 -28.390 545 HE1 TYR 69 HE1 TYR 69 -3.782 5.123 -33.140 546 HE2 TYR 69 HE2 TYR 69 -5.584 2.729 -30.131 547 HH TYR 69 HH TYR 69 -6.114 2.499 -32.393 548 H ASP 70 H ASP 70 -1.228 5.911 -25.594 549 HA ASP 70 HA ASP 70 -2.813 3.530 -24.701 550 HB2 ASP 70 1HB ASP 70 -1.308 3.067 -22.878 551 HB3 ASP 70 2HB ASP 70 -0.436 2.964 -24.424 552 H LYS 71 H LYS 71 -3.550 3.787 -22.416 553 HA LYS 71 HA LYS 71 -4.662 6.496 -22.120 554 HB2 LYS 71 1HB LYS 71 -6.111 4.401 -21.939 555 HB3 LYS 71 2HB LYS 71 -5.224 4.040 -20.434 556 HG2 LYS 71 1HG LYS 71 -6.025 6.190 -19.469 557 HG3 LYS 71 2HG LYS 71 -6.965 6.470 -20.971 558 HD2 LYS 71 1HD LYS 71 -8.170 4.345 -20.574 559 HD3 LYS 71 2HD LYS 71 -7.238 4.076 -19.080 560 HE2 LYS 71 1HE LYS 71 -9.329 5.005 -18.364 561 HE3 LYS 71 2HE LYS 71 -8.160 6.324 -18.258 562 HZ1 LYS 71 1HZ LYS 71 -10.256 7.029 -19.271 563 HZ2 LYS 71 2HZ LYS 71 -10.063 5.920 -20.483 564 HZ3 LYS 71 3HZ LYS 71 -9.004 7.196 -20.349 565 H LYS 72 H LYS 72 -4.168 7.834 -20.434 566 HA LYS 72 HA LYS 72 -1.686 7.723 -19.130 567 HB2 LYS 72 1HB LYS 72 -4.233 9.139 -18.234 568 HB3 LYS 72 2HB LYS 72 -2.648 9.383 -17.483 569 HG2 LYS 72 1HG LYS 72 -1.773 10.344 -19.516 570 HG3 LYS 72 2HG LYS 72 -3.209 9.881 -20.424 571 HD2 LYS 72 1HD LYS 72 -3.318 12.282 -19.902 572 HD3 LYS 72 2HD LYS 72 -4.608 11.402 -19.014 573 HE2 LYS 72 1HE LYS 72 -3.218 11.431 -17.010 574 HE3 LYS 72 2HE LYS 72 -1.940 12.222 -17.864 575 HZ1 LYS 72 1HZ LYS 72 -3.243 13.787 -16.608 576 HZ2 LYS 72 2HZ LYS 72 -4.637 13.342 -17.412 577 HZ3 LYS 72 3HZ LYS 72 -3.401 14.118 -18.208 578 HA PRO 73 HA PRO 73 -2.449 4.718 -15.896 579 HB2 PRO 73 1HB PRO 73 -0.162 4.999 -14.492 580 HB3 PRO 73 2HB PRO 73 -0.162 4.343 -16.149 581 HG2 PRO 73 1HG PRO 73 0.386 7.196 -15.279 582 HG3 PRO 73 2HG PRO 73 1.380 6.133 -16.320 583 HD2 PRO 73 1HD PRO 73 -0.344 7.959 -17.300 584 HD3 PRO 73 2HD PRO 73 -0.056 6.376 -18.125 585 H ALA 74 H ALA 74 -2.384 4.623 -13.392 586 HA ALA 74 HA ALA 74 -2.382 7.142 -11.994 587 HB1 ALA 74 1HB ALA 74 -4.752 6.909 -11.121 588 HB2 ALA 74 2HB ALA 74 -4.691 7.237 -12.866 589 HB3 ALA 74 3HB ALA 74 -5.006 5.620 -12.260 590 H GLY 75 H GLY 75 -2.825 6.592 -9.528 591 HA2 GLY 75 1HA GLY 75 -2.918 4.942 -7.826 592 HA3 GLY 75 2HA GLY 75 -2.355 3.716 -9.000 593 H GLU 76 H GLU 76 -1.406 5.376 -6.307 594 HA GLU 76 HA GLU 76 1.356 5.833 -7.211 595 HB2 GLU 76 1HB GLU 76 -0.235 6.228 -4.660 596 HB3 GLU 76 2HB GLU 76 1.540 6.281 -4.588 597 HG2 GLU 76 1HG GLU 76 1.512 8.407 -5.246 598 HG3 GLU 76 2HG GLU 76 0.782 7.928 -6.783 599 H PHE 77 H PHE 77 -0.367 3.305 -5.572 600 HA PHE 77 HA PHE 77 0.187 1.268 -4.717 601 HB2 PHE 77 1HB PHE 77 2.682 1.608 -6.487 602 HB3 PHE 77 2HB PHE 77 2.032 0.077 -5.786 603 HD1 PHE 77 HD1 PHE 77 -0.253 -0.689 -6.531 604 HD2 PHE 77 HD2 PHE 77 1.827 2.485 -8.529 605 HE1 PHE 77 HE1 PHE 77 -1.711 -0.977 -8.543 606 HE2 PHE 77 HE2 PHE 77 0.372 2.173 -10.557 607 HZ PHE 77 HZ PHE 77 -1.394 0.447 -10.555 608 H ILE 78 H ILE 78 2.581 0.038 -4.024 609 HA ILE 78 HA ILE 78 4.211 1.859 -2.402 610 HB ILE 78 HB ILE 78 2.497 1.152 -0.736 611 HG12 ILE 78 1HG1 ILE 78 5.105 -0.308 -0.294 612 HG13 ILE 78 2HG1 ILE 78 4.898 1.398 -0.103 613 HG21 ILE 78 1HG2 ILE 78 3.268 -1.737 -1.368 614 HG22 ILE 78 2HG2 ILE 78 2.121 -1.241 -0.138 615 HG23 ILE 78 3HG2 ILE 78 1.784 -0.957 -1.864 616 HD11 ILE 78 1HD1 ILE 78 4.854 0.318 2.096 617 HD12 ILE 78 2HD1 ILE 78 3.248 1.017 1.755 618 HD13 ILE 78 3HD1 ILE 78 3.525 -0.725 1.579 619 H VAL 79 H VAL 79 6.290 1.059 -2.427 620 HA VAL 79 HA VAL 79 6.846 -0.882 -4.509 621 HB VAL 79 HB VAL 79 9.241 -0.441 -3.819 622 HG11 VAL 79 1HG1 VAL 79 9.247 1.896 -4.658 623 HG12 VAL 79 2HG1 VAL 79 8.125 0.875 -5.592 624 HG13 VAL 79 3HG1 VAL 79 7.478 1.992 -4.349 625 HG21 VAL 79 1HG2 VAL 79 8.025 1.607 -1.906 626 HG22 VAL 79 2HG2 VAL 79 8.787 0.107 -1.367 627 HG23 VAL 79 3HG2 VAL 79 9.751 1.314 -2.191 628 H THR 80 H THR 80 8.139 -2.735 -4.287 629 HA THR 80 HA THR 80 7.625 -4.277 -1.825 630 HB THR 80 HB THR 80 9.070 -5.041 -4.389 631 HG1 THR 80 HG1 THR 80 6.779 -4.739 -4.572 632 HG21 THR 80 1HG2 THR 80 9.862 -6.412 -2.538 633 HG22 THR 80 2HG2 THR 80 8.775 -7.364 -3.586 634 HG23 THR 80 3HG2 THR 80 8.182 -6.721 -1.992 635 H ASP 81 H ASP 81 8.947 -4.025 -0.166 636 HA ASP 81 HA ASP 81 11.212 -2.352 -0.327 637 HB2 ASP 81 1HB ASP 81 9.557 -2.845 1.589 638 HB3 ASP 81 2HB ASP 81 10.587 -4.153 2.021 639 HXT ASP 81 H02 ASP 81 11.201 -5.429 0.812 Start of MODEL 27 1 H2 GLY 1 2H0 GLY 1 1.537 9.641 -15.280 2 H GLY 1 1H0 GLY 1 0.810 11.030 -15.806 3 HA2 GLY 1 1HA GLY 1 1.356 10.261 -18.178 4 HA3 GLY 1 2HA GLY 1 2.704 10.876 -17.191 5 H SER 2 H SER 2 3.505 9.564 -19.215 6 HA SER 2 HA SER 2 3.636 6.727 -19.057 7 HB2 SER 2 1HB SER 2 5.801 8.448 -20.261 8 HB3 SER 2 2HB SER 2 5.127 6.918 -20.870 9 HG SER 2 HG SER 2 3.322 7.978 -21.525 10 H MET 3 H MET 3 5.235 9.080 -17.184 11 HA MET 3 HA MET 3 6.976 9.063 -15.715 12 HB2 MET 3 1HB MET 3 5.044 7.473 -14.909 13 HB3 MET 3 2HB MET 3 6.283 6.225 -15.050 14 HG2 MET 3 1HG MET 3 7.729 7.445 -13.485 15 HG3 MET 3 2HG MET 3 6.567 8.785 -13.420 16 HE1 MET 3 1HE MET 3 6.546 8.637 -10.718 17 HE2 MET 3 2HE MET 3 6.267 7.122 -9.839 18 HE3 MET 3 3HE MET 3 7.737 7.314 -10.823 19 H LYS 4 H LYS 4 7.916 8.303 -18.307 20 HA LYS 4 HA LYS 4 9.832 7.636 -19.333 21 HB2 LYS 4 1HB LYS 4 10.986 7.393 -16.535 22 HB3 LYS 4 2HB LYS 4 11.901 7.492 -18.039 23 HG2 LYS 4 1HG LYS 4 11.020 9.768 -18.431 24 HG3 LYS 4 2HG LYS 4 10.125 9.678 -16.895 25 HD2 LYS 4 1HD LYS 4 12.257 9.319 -15.680 26 HD3 LYS 4 2HD LYS 4 13.149 9.457 -17.203 27 HE2 LYS 4 1HE LYS 4 11.411 11.641 -15.988 28 HE3 LYS 4 2HE LYS 4 13.181 11.561 -15.864 29 HZ1 LYS 4 1HZ LYS 4 11.628 11.819 -18.380 30 HZ2 LYS 4 2HZ LYS 4 13.274 11.715 -18.286 31 HZ3 LYS 4 3HZ LYS 4 12.496 13.021 -17.655 32 H TYR 5 H TYR 5 7.938 5.429 -18.099 33 HA TYR 5 HA TYR 5 9.641 3.071 -17.979 34 HB2 TYR 5 1HB TYR 5 6.702 3.653 -18.288 35 HB3 TYR 5 2HB TYR 5 7.290 2.070 -18.784 36 HD1 TYR 5 HD1 TYR 5 8.096 0.452 -17.197 37 HD2 TYR 5 HD2 TYR 5 6.798 4.319 -15.872 38 HE1 TYR 5 HE1 TYR 5 8.006 -0.397 -14.884 39 HE2 TYR 5 HE2 TYR 5 6.728 3.478 -13.519 40 HH TYR 5 HH TYR 5 7.059 1.677 -12.126 41 H LEU 6 H LEU 6 9.516 1.342 -19.728 42 HA LEU 6 HA LEU 6 10.431 2.468 -22.200 43 HB2 LEU 6 1HB LEU 6 9.441 -0.334 -21.579 44 HB3 LEU 6 2HB LEU 6 10.318 0.129 -23.036 45 HG LEU 6 HG LEU 6 11.449 0.358 -20.224 46 HD11 LEU 6 1HD1 LEU 6 12.686 -1.662 -20.715 47 HD12 LEU 6 2HD1 LEU 6 11.917 -1.775 -22.327 48 HD13 LEU 6 3HD1 LEU 6 10.940 -1.960 -20.845 49 HD21 LEU 6 1HD2 LEU 6 12.565 1.867 -21.808 50 HD22 LEU 6 2HD2 LEU 6 12.785 0.523 -22.958 51 HD23 LEU 6 3HD2 LEU 6 13.629 0.506 -21.390 52 H ASN 7 H ASN 7 7.333 0.987 -21.261 53 HA ASN 7 HA ASN 7 5.258 0.991 -22.244 54 HB2 ASN 7 1HB ASN 7 6.212 3.744 -23.081 55 HB3 ASN 7 2HB ASN 7 4.532 3.189 -23.176 56 HD21 ASN 7 1HD2 ASN 7 5.827 4.758 -19.798 57 HD22 ASN 7 2HD2 ASN 7 6.667 4.872 -21.333 58 H VAL 8 H VAL 8 7.136 -0.379 -23.874 59 HA VAL 8 HA VAL 8 6.138 0.350 -26.605 60 HB VAL 8 HB VAL 8 8.594 0.643 -26.355 61 HG11 VAL 8 1HG1 VAL 8 8.684 -2.354 -25.803 62 HG12 VAL 8 2HG1 VAL 8 10.081 -1.282 -26.026 63 HG13 VAL 8 3HG1 VAL 8 9.024 -1.074 -24.618 64 HG21 VAL 8 1HG2 VAL 8 7.862 -1.696 -28.156 65 HG22 VAL 8 2HG2 VAL 8 7.635 0.030 -28.543 66 HG23 VAL 8 3HG2 VAL 8 9.269 -0.623 -28.330 67 H LEU 9 H LEU 9 5.268 -1.309 -27.841 68 HA LEU 9 HA LEU 9 4.451 -3.611 -26.150 69 HB2 LEU 9 1HB LEU 9 2.873 -3.827 -28.320 70 HB3 LEU 9 2HB LEU 9 2.437 -2.995 -26.843 71 HG LEU 9 HG LEU 9 3.707 -1.441 -29.098 72 HD11 LEU 9 1HD1 LEU 9 1.451 -1.062 -30.011 73 HD12 LEU 9 2HD1 LEU 9 0.781 -2.244 -28.851 74 HD13 LEU 9 3HD1 LEU 9 1.918 -2.772 -30.114 75 HD21 LEU 9 1HD2 LEU 9 1.555 -0.721 -27.054 76 HD22 LEU 9 2HD2 LEU 9 2.422 0.395 -28.133 77 HD23 LEU 9 3HD2 LEU 9 3.282 -0.420 -26.800 78 H ALA 10 H ALA 10 4.258 -5.692 -26.957 79 HA ALA 10 HA ALA 10 5.931 -6.293 -29.351 80 HB1 ALA 10 1HB ALA 10 7.260 -6.486 -27.201 81 HB2 ALA 10 2HB ALA 10 6.132 -7.755 -26.694 82 HB3 ALA 10 3HB ALA 10 7.145 -7.983 -28.138 83 H LYS 11 H LYS 11 5.344 -8.164 -30.447 84 HA LYS 11 HA LYS 11 2.683 -9.304 -29.682 85 HB2 LYS 11 1HB LYS 11 3.070 -8.473 -32.045 86 HB3 LYS 11 2HB LYS 11 4.324 -9.711 -32.214 87 HG2 LYS 11 1HG LYS 11 2.539 -11.450 -31.669 88 HG3 LYS 11 2HG LYS 11 1.346 -10.160 -31.734 89 HD2 LYS 11 1HD LYS 11 1.222 -11.106 -33.858 90 HD3 LYS 11 2HD LYS 11 2.263 -9.693 -34.103 91 HE2 LYS 11 1HE LYS 11 3.263 -11.557 -35.259 92 HE3 LYS 11 2HE LYS 11 4.268 -11.205 -33.840 93 HZ1 LYS 11 1HZ LYS 11 2.226 -13.360 -34.006 94 HZ2 LYS 11 2HZ LYS 11 3.175 -13.060 -32.694 95 HZ3 LYS 11 3HZ LYS 11 3.858 -13.588 -34.100 96 H ALA 12 H ALA 12 2.529 -11.387 -28.949 97 HA ALA 12 HA ALA 12 4.980 -12.822 -28.334 98 HB1 ALA 12 1HB ALA 12 2.039 -13.516 -28.171 99 HB2 ALA 12 2HB ALA 12 3.342 -14.611 -27.650 100 HB3 ALA 12 3HB ALA 12 3.129 -13.044 -26.851 101 H LEU 13 H LEU 13 5.940 -14.430 -29.343 102 HA LEU 13 HA LEU 13 5.027 -15.102 -32.094 103 HB2 LEU 13 1HB LEU 13 7.575 -15.754 -30.565 104 HB3 LEU 13 2HB LEU 13 7.280 -16.143 -32.258 105 HG LEU 13 HG LEU 13 7.428 -13.315 -31.144 106 HD11 LEU 13 1HD1 LEU 13 9.657 -13.237 -32.163 107 HD12 LEU 13 2HD1 LEU 13 9.501 -14.943 -32.658 108 HD13 LEU 13 3HD1 LEU 13 9.565 -14.506 -30.931 109 HD21 LEU 13 1HD2 LEU 13 7.334 -14.397 -33.993 110 HD22 LEU 13 2HD2 LEU 13 7.710 -12.719 -33.563 111 HD23 LEU 13 3HD2 LEU 13 6.112 -13.381 -33.184 112 H TYR 14 H TYR 14 5.591 -16.448 -28.905 113 HA TYR 14 HA TYR 14 4.401 -19.049 -29.780 114 HB2 TYR 14 1HB TYR 14 6.416 -18.683 -27.552 115 HB3 TYR 14 2HB TYR 14 5.845 -20.206 -28.245 116 HD1 TYR 14 HD1 TYR 14 6.686 -20.942 -30.507 117 HD2 TYR 14 HD2 TYR 14 8.169 -17.398 -28.593 118 HE1 TYR 14 HE1 TYR 14 8.635 -20.890 -32.076 119 HE2 TYR 14 HE2 TYR 14 10.116 -17.357 -30.125 120 HH TYR 14 HH TYR 14 11.194 -18.426 -31.868 121 H ASP 15 H ASP 15 3.298 -20.120 -27.846 122 HA ASP 15 HA ASP 15 1.993 -18.039 -26.162 123 HB2 ASP 15 1HB ASP 15 0.469 -19.890 -25.529 124 HB3 ASP 15 2HB ASP 15 0.494 -19.596 -27.276 125 H ASN 16 H ASN 16 1.660 -18.623 -23.865 126 HA ASN 16 HA ASN 16 3.718 -20.359 -22.673 127 HB2 ASN 16 1HB ASN 16 4.685 -18.002 -23.097 128 HB3 ASN 16 2HB ASN 16 3.572 -17.451 -21.842 129 HD21 ASN 16 1HD2 ASN 16 5.410 -18.916 -19.180 130 HD22 ASN 16 2HD2 ASN 16 3.835 -18.331 -19.679 131 H VAL 17 H VAL 17 2.429 -21.551 -21.377 132 HA VAL 17 HA VAL 17 0.071 -20.404 -20.052 133 HB VAL 17 HB VAL 17 1.488 -23.093 -19.698 134 HG11 VAL 17 1HG1 VAL 17 -0.600 -23.810 -18.540 135 HG12 VAL 17 2HG1 VAL 17 0.232 -22.514 -17.674 136 HG13 VAL 17 3HG1 VAL 17 -1.215 -22.143 -18.644 137 HG21 VAL 17 1HG2 VAL 17 -1.042 -22.384 -21.245 138 HG22 VAL 17 2HG2 VAL 17 0.510 -22.872 -21.949 139 HG23 VAL 17 3HG2 VAL 17 -0.423 -24.033 -20.984 140 H ALA 18 H ALA 18 0.158 -19.492 -18.018 141 HA ALA 18 HA ALA 18 2.786 -19.089 -16.826 142 HB1 ALA 18 1HB ALA 18 -0.028 -18.383 -15.877 143 HB2 ALA 18 2HB ALA 18 1.472 -17.900 -15.055 144 HB3 ALA 18 3HB ALA 18 1.128 -17.294 -16.684 145 H GLU 19 H GLU 19 3.743 -20.690 -15.702 146 HA GLU 19 HA GLU 19 2.008 -22.745 -14.389 147 HB2 GLU 19 1HB GLU 19 5.025 -22.680 -14.711 148 HB3 GLU 19 2HB GLU 19 4.031 -24.057 -14.211 149 HG2 GLU 19 1HG GLU 19 2.853 -23.778 -16.488 150 HG3 GLU 19 2HG GLU 19 4.227 -22.747 -16.928 151 H SER 20 H SER 20 3.470 -19.848 -13.803 152 HA SER 20 HA SER 20 3.482 -20.288 -10.855 153 HB2 SER 20 1HB SER 20 5.497 -18.847 -12.600 154 HB3 SER 20 2HB SER 20 5.388 -18.588 -10.840 155 HG SER 20 HG SER 20 5.742 -21.125 -12.076 156 HA PRO 21 HA PRO 21 0.672 -17.046 -11.295 157 HB2 PRO 21 1HB PRO 21 0.687 -15.684 -8.924 158 HB3 PRO 21 2HB PRO 21 0.077 -17.368 -9.073 159 HG2 PRO 21 1HG PRO 21 2.803 -16.434 -8.192 160 HG3 PRO 21 2HG PRO 21 1.691 -17.581 -7.380 161 HD2 PRO 21 1HD PRO 21 3.720 -18.454 -8.938 162 HD3 PRO 21 2HD PRO 21 2.129 -19.287 -8.940 163 H ASP 22 H ASP 22 3.926 -16.028 -10.347 164 HA ASP 22 HA ASP 22 3.491 -13.211 -10.907 165 HB2 ASP 22 1HB ASP 22 6.027 -14.879 -10.656 166 HB3 ASP 22 2HB ASP 22 5.970 -13.109 -10.708 167 H GLU 23 H GLU 23 4.001 -16.013 -12.790 168 HA GLU 23 HA GLU 23 5.362 -14.697 -15.029 169 HB2 GLU 23 1HB GLU 23 5.595 -17.135 -14.361 170 HB3 GLU 23 2HB GLU 23 3.926 -17.367 -14.890 171 HG2 GLU 23 1HG GLU 23 4.531 -16.734 -17.163 172 HG3 GLU 23 2HG GLU 23 6.197 -16.411 -16.639 173 H LEU 24 H LEU 24 4.305 -13.967 -16.924 174 HA LEU 24 HA LEU 24 1.400 -13.560 -16.563 175 HB2 LEU 24 1HB LEU 24 3.471 -12.110 -17.789 176 HB3 LEU 24 2HB LEU 24 2.453 -12.679 -19.113 177 HG LEU 24 HG LEU 24 1.519 -11.073 -16.717 178 HD11 LEU 24 1HD1 LEU 24 1.837 -10.306 -19.634 179 HD12 LEU 24 2HD1 LEU 24 2.935 -9.840 -18.307 180 HD13 LEU 24 3HD1 LEU 24 1.257 -9.258 -18.310 181 HD21 LEU 24 1HD2 LEU 24 -0.602 -10.818 -18.018 182 HD22 LEU 24 2HD2 LEU 24 -0.322 -12.458 -17.438 183 HD23 LEU 24 3HD2 LEU 24 -0.016 -12.065 -19.146 184 H SER 25 H SER 25 -0.144 -14.735 -17.532 185 HA SER 25 HA SER 25 0.597 -16.906 -19.348 186 HB2 SER 25 1HB SER 25 -2.182 -16.685 -19.291 187 HB3 SER 25 2HB SER 25 -1.197 -17.726 -18.237 188 HG SER 25 HG SER 25 -2.562 -16.394 -17.006 189 H PHE 26 H PHE 26 0.882 -16.481 -21.475 190 HA PHE 26 HA PHE 26 -1.030 -14.602 -22.777 191 HB2 PHE 26 1HB PHE 26 0.722 -13.435 -23.975 192 HB3 PHE 26 2HB PHE 26 0.966 -13.252 -22.240 193 HD1 PHE 26 HD1 PHE 26 2.874 -14.188 -21.118 194 HD2 PHE 26 HD2 PHE 26 2.270 -14.828 -25.326 195 HE1 PHE 26 HE1 PHE 26 5.204 -14.985 -21.328 196 HE2 PHE 26 HE2 PHE 26 4.626 -15.601 -25.557 197 HZ PHE 26 HZ PHE 26 6.105 -15.680 -23.547 198 H ARG 27 H ARG 27 -0.833 -14.776 -25.225 199 HA ARG 27 HA ARG 27 0.008 -17.551 -25.928 200 HB2 ARG 27 1HB ARG 27 -2.593 -16.202 -26.674 201 HB3 ARG 27 2HB ARG 27 -2.018 -17.743 -27.330 202 HG2 ARG 27 1HG ARG 27 -1.972 -18.680 -25.021 203 HG3 ARG 27 2HG ARG 27 -2.669 -17.164 -24.419 204 HD2 ARG 27 1HD ARG 27 -3.945 -18.942 -26.504 205 HD3 ARG 27 2HD ARG 27 -4.332 -18.968 -24.772 206 HE ARG 27 HE ARG 27 -4.582 -16.293 -25.705 207 HH11 ARG 27 1HH1 ARG 27 -6.274 -19.377 -26.014 208 HH12 ARG 27 2HH1 ARG 27 -7.813 -18.611 -26.299 209 HH21 ARG 27 1HH2 ARG 27 -6.573 -15.389 -26.078 210 HH22 ARG 27 2HH2 ARG 27 -7.977 -16.394 -26.330 211 H LYS 28 H LYS 28 0.466 -17.953 -28.103 212 HA LYS 28 HA LYS 28 1.932 -15.952 -29.444 213 HB2 LYS 28 1HB LYS 28 1.568 -17.461 -31.505 214 HB3 LYS 28 2HB LYS 28 2.401 -18.130 -30.123 215 HG2 LYS 28 1HG LYS 28 1.041 -19.882 -30.214 216 HG3 LYS 28 2HG LYS 28 -0.265 -18.840 -29.647 217 HD2 LYS 28 1HD LYS 28 -0.832 -18.282 -31.982 218 HD3 LYS 28 2HD LYS 28 0.478 -19.343 -32.549 219 HE2 LYS 28 1HE LYS 28 -0.606 -21.273 -31.437 220 HE3 LYS 28 2HE LYS 28 -1.897 -20.212 -30.840 221 HZ1 LYS 28 1HZ LYS 28 -2.573 -21.394 -32.829 222 HZ2 LYS 28 2HZ LYS 28 -1.323 -20.761 -33.692 223 HZ3 LYS 28 3HZ LYS 28 -2.524 -19.774 -33.131 224 H GLY 29 H GLY 29 1.476 -14.308 -30.706 225 HA2 GLY 29 1HA GLY 29 0.231 -13.198 -32.404 226 HA3 GLY 29 2HA GLY 29 -1.198 -14.143 -31.991 227 H ASP 30 H ASP 30 -0.540 -13.517 -29.010 228 HA ASP 30 HA ASP 30 -2.299 -11.233 -28.863 229 HB2 ASP 30 1HB ASP 30 -1.788 -13.289 -27.236 230 HB3 ASP 30 2HB ASP 30 -0.653 -12.130 -26.521 231 H ILE 31 H ILE 31 -1.797 -9.269 -27.615 232 HA ILE 31 HA ILE 31 0.967 -8.264 -28.238 233 HB ILE 31 HB ILE 31 -1.632 -6.645 -28.140 234 HG12 ILE 31 1HG1 ILE 31 -1.734 -8.204 -30.034 235 HG13 ILE 31 2HG1 ILE 31 -1.622 -6.524 -30.552 236 HG21 ILE 31 1HG2 ILE 31 0.288 -5.234 -27.645 237 HG22 ILE 31 2HG2 ILE 31 1.216 -5.913 -29.008 238 HG23 ILE 31 3HG2 ILE 31 -0.202 -4.887 -29.314 239 HD11 ILE 31 1HD1 ILE 31 -0.261 -8.065 -31.939 240 HD12 ILE 31 2HD1 ILE 31 0.714 -6.803 -31.157 241 HD13 ILE 31 3HD1 ILE 31 0.709 -8.454 -30.500 242 H MET 32 H MET 32 2.075 -7.500 -26.475 243 HA MET 32 HA MET 32 0.462 -6.537 -24.148 244 HB2 MET 32 1HB MET 32 1.971 -7.683 -22.586 245 HB3 MET 32 2HB MET 32 1.063 -8.813 -23.588 246 HG2 MET 32 1HG MET 32 3.366 -8.520 -25.064 247 HG3 MET 32 2HG MET 32 3.975 -8.355 -23.409 248 HE1 MET 32 1HE MET 32 1.003 -10.494 -25.107 249 HE2 MET 32 2HE MET 32 2.439 -10.588 -26.159 250 HE3 MET 32 3HE MET 32 1.873 -12.032 -25.286 251 H THR 33 H THR 33 1.434 -4.961 -22.895 252 HA THR 33 HA THR 33 3.516 -3.444 -24.327 253 HB THR 33 HB THR 33 2.078 -2.778 -21.721 254 HG1 THR 33 HG1 THR 33 0.780 -1.477 -23.123 255 HG21 THR 33 1HG2 THR 33 3.619 -1.062 -23.722 256 HG22 THR 33 2HG2 THR 33 4.137 -1.463 -22.060 257 HG23 THR 33 3HG2 THR 33 2.707 -0.444 -22.320 258 H VAL 34 H VAL 34 5.613 -3.466 -23.797 259 HA VAL 34 HA VAL 34 6.490 -4.992 -21.393 260 HB VAL 34 HB VAL 34 8.056 -3.694 -23.688 261 HG11 VAL 34 1HG1 VAL 34 9.003 -5.317 -21.295 262 HG12 VAL 34 2HG1 VAL 34 9.998 -5.025 -22.737 263 HG13 VAL 34 3HG1 VAL 34 9.469 -3.658 -21.730 264 HG21 VAL 34 1HG2 VAL 34 8.487 -5.952 -24.468 265 HG22 VAL 34 2HG2 VAL 34 7.644 -6.650 -23.067 266 HG23 VAL 34 3HG2 VAL 34 6.735 -5.748 -24.298 267 H LEU 35 H LEU 35 6.929 -3.981 -19.576 268 HA LEU 35 HA LEU 35 6.943 -1.009 -19.558 269 HB2 LEU 35 1HB LEU 35 6.805 -3.080 -17.338 270 HB3 LEU 35 2HB LEU 35 6.758 -1.338 -17.090 271 HG LEU 35 HG LEU 35 4.687 -2.894 -18.658 272 HD11 LEU 35 1HD1 LEU 35 4.632 -1.838 -15.816 273 HD12 LEU 35 2HD1 LEU 35 4.692 -3.543 -16.303 274 HD13 LEU 35 3HD1 LEU 35 3.254 -2.566 -16.677 275 HD21 LEU 35 1HD2 LEU 35 4.740 -0.013 -17.651 276 HD22 LEU 35 2HD2 LEU 35 3.320 -0.820 -18.369 277 HD23 LEU 35 3HD2 LEU 35 4.770 -0.547 -19.350 278 H GLU 36 H GLU 36 8.894 -3.821 -18.493 279 HA GLU 36 HA GLU 36 11.323 -2.132 -18.530 280 HB2 GLU 36 1HB GLU 36 10.235 -1.961 -16.246 281 HB3 GLU 36 2HB GLU 36 10.468 -3.697 -16.053 282 HG2 GLU 36 1HG GLU 36 12.200 -2.232 -14.924 283 HG3 GLU 36 2HG GLU 36 12.858 -3.453 -16.018 284 H ARG 37 H ARG 37 13.330 -3.554 -18.192 285 HA ARG 37 HA ARG 37 12.792 -6.410 -18.979 286 HB2 ARG 37 1HB ARG 37 14.961 -4.607 -20.082 287 HB3 ARG 37 2HB ARG 37 14.701 -6.308 -20.501 288 HG2 ARG 37 1HG ARG 37 12.420 -5.646 -21.398 289 HG3 ARG 37 2HG ARG 37 12.898 -3.963 -21.154 290 HD2 ARG 37 1HD ARG 37 14.337 -5.983 -22.885 291 HD3 ARG 37 2HD ARG 37 13.300 -4.662 -23.469 292 HE ARG 37 HE ARG 37 15.222 -3.442 -21.865 293 HH11 ARG 37 1HH1 ARG 37 15.339 -5.441 -24.773 294 HH12 ARG 37 2HH1 ARG 37 16.825 -4.711 -25.326 295 HH21 ARG 37 1HH2 ARG 37 17.107 -2.563 -22.626 296 HH22 ARG 37 2HH2 ARG 37 17.804 -3.105 -24.127 297 H ASP 38 H ASP 38 14.416 -7.896 -18.297 298 HA ASP 38 HA ASP 38 15.754 -8.817 -16.694 299 HB2 ASP 38 1HB ASP 38 17.435 -7.287 -17.902 300 HB3 ASP 38 2HB ASP 38 17.283 -6.216 -16.501 301 H THR 39 H THR 39 13.368 -7.782 -16.018 302 HA THR 39 HA THR 39 13.359 -5.819 -13.963 303 HB THR 39 HB THR 39 11.442 -6.202 -15.418 304 HG1 THR 39 HG1 THR 39 11.038 -6.831 -12.677 305 HG21 THR 39 1HG2 THR 39 11.410 -9.013 -14.236 306 HG22 THR 39 2HG2 THR 39 11.595 -8.551 -15.944 307 HG23 THR 39 3HG2 THR 39 10.050 -8.315 -15.115 308 H GLN 40 H GLN 40 14.153 -9.129 -13.749 309 HA GLN 40 HA GLN 40 13.665 -9.074 -10.801 310 HB2 GLN 40 1HB GLN 40 12.485 -10.791 -12.772 311 HB3 GLN 40 2HB GLN 40 13.622 -11.758 -11.839 312 HG2 GLN 40 1HG GLN 40 11.832 -12.051 -10.502 313 HG3 GLN 40 2HG GLN 40 12.397 -10.541 -9.783 314 HE21 GLN 40 1HE2 GLN 40 8.706 -10.424 -10.526 315 HE22 GLN 40 2HE2 GLN 40 9.734 -11.545 -9.668 316 H GLY 41 H GLY 41 16.073 -8.807 -12.927 317 HA2 GLY 41 1HA GLY 41 18.342 -9.277 -12.670 318 HA3 GLY 41 2HA GLY 41 17.979 -10.309 -11.267 319 H LEU 42 H LEU 42 15.991 -10.810 -13.975 320 HA LEU 42 HA LEU 42 17.452 -13.305 -14.700 321 HB2 LEU 42 1HB LEU 42 14.547 -12.491 -15.066 322 HB3 LEU 42 2HB LEU 42 15.257 -13.968 -15.701 323 HG LEU 42 HG LEU 42 15.010 -13.317 -12.742 324 HD11 LEU 42 1HD1 LEU 42 13.103 -14.906 -12.799 325 HD12 LEU 42 2HD1 LEU 42 13.263 -15.039 -14.562 326 HD13 LEU 42 3HD1 LEU 42 12.795 -13.490 -13.819 327 HD21 LEU 42 1HD2 LEU 42 15.395 -15.779 -12.501 328 HD22 LEU 42 2HD2 LEU 42 16.785 -14.925 -13.196 329 HD23 LEU 42 3HD2 LEU 42 15.710 -15.878 -14.248 330 H ASP 43 H ASP 43 18.707 -12.893 -16.418 331 HA ASP 43 HA ASP 43 18.283 -10.743 -18.232 332 HB2 ASP 43 1HB ASP 43 20.472 -11.924 -17.862 333 HB3 ASP 43 2HB ASP 43 19.818 -13.323 -18.734 334 H GLY 44 H GLY 44 17.373 -10.662 -20.217 335 HA2 GLY 44 1HA GLY 44 16.149 -11.372 -22.063 336 HA3 GLY 44 2HA GLY 44 16.224 -13.031 -21.458 337 H TRP 45 H TRP 45 15.014 -11.724 -18.791 338 HA TRP 45 HA TRP 45 12.227 -12.203 -19.731 339 HB2 TRP 45 1HB TRP 45 13.514 -12.059 -17.001 340 HB3 TRP 45 2HB TRP 45 11.766 -12.132 -17.235 341 HD1 TRP 45 HD1 TRP 45 14.901 -14.253 -18.118 342 HE1 TRP 45 HE1 TRP 45 14.278 -16.710 -18.214 343 HE3 TRP 45 HE3 TRP 45 9.873 -13.723 -17.363 344 HZ2 TRP 45 HZ2 TRP 45 11.887 -18.276 -18.006 345 HZ3 TRP 45 HZ3 TRP 45 8.438 -15.785 -17.306 346 HH2 TRP 45 HH2 TRP 45 9.451 -18.034 -17.631 347 H TRP 46 H TRP 46 10.631 -10.703 -19.736 348 HA TRP 46 HA TRP 46 11.463 -7.922 -18.965 349 HB2 TRP 46 1HB TRP 46 9.631 -8.822 -21.216 350 HB3 TRP 46 2HB TRP 46 10.089 -7.158 -20.845 351 HD1 TRP 46 HD1 TRP 46 13.314 -8.601 -20.474 352 HE1 TRP 46 HE1 TRP 46 14.710 -8.761 -22.574 353 HE3 TRP 46 HE3 TRP 46 9.540 -7.970 -23.860 354 HZ2 TRP 46 HZ2 TRP 46 14.270 -8.641 -25.396 355 HZ3 TRP 46 HZ3 TRP 46 10.095 -8.027 -26.300 356 HH2 TRP 46 HH2 TRP 46 12.452 -8.352 -27.050 357 H LEU 47 H LEU 47 9.881 -6.628 -17.990 358 HA LEU 47 HA LEU 47 7.617 -8.106 -16.770 359 HB2 LEU 47 1HB LEU 47 8.943 -6.445 -15.436 360 HB3 LEU 47 2HB LEU 47 8.462 -5.189 -16.564 361 HG LEU 47 HG LEU 47 6.082 -5.559 -15.878 362 HD11 LEU 47 1HD1 LEU 47 6.200 -7.863 -15.056 363 HD12 LEU 47 2HD1 LEU 47 5.693 -6.790 -13.737 364 HD13 LEU 47 3HD1 LEU 47 7.364 -7.385 -13.799 365 HD21 LEU 47 1HD2 LEU 47 8.041 -4.909 -13.634 366 HD22 LEU 47 2HD2 LEU 47 6.330 -4.409 -13.713 367 HD23 LEU 47 3HD2 LEU 47 7.490 -3.783 -14.900 368 H CYS 48 H CYS 48 5.792 -8.298 -17.940 369 HA CYS 48 HA CYS 48 5.174 -6.074 -19.848 370 HB2 CYS 48 1HB CYS 48 4.420 -9.010 -20.021 371 HB3 CYS 48 2HB CYS 48 4.017 -7.755 -21.204 372 HG CYS 48 HG CYS 48 6.980 -8.852 -20.262 373 H SER 49 H SER 49 2.830 -5.808 -20.251 374 HA SER 49 HA SER 49 1.174 -6.577 -17.876 375 HB2 SER 49 1HB SER 49 1.767 -4.190 -17.756 376 HB3 SER 49 2HB SER 49 1.138 -3.947 -19.400 377 HG SER 49 HG SER 49 -0.403 -3.388 -17.812 378 H LEU 50 H LEU 50 -0.610 -7.643 -18.354 379 HA LEU 50 HA LEU 50 -2.065 -7.319 -20.881 380 HB2 LEU 50 1HB LEU 50 -0.161 -8.813 -21.506 381 HB3 LEU 50 2HB LEU 50 -0.623 -9.908 -20.222 382 HG LEU 50 HG LEU 50 -2.753 -10.385 -21.395 383 HD11 LEU 50 1HD1 LEU 50 -2.947 -9.710 -23.794 384 HD12 LEU 50 2HD1 LEU 50 -1.566 -8.623 -23.566 385 HD13 LEU 50 3HD1 LEU 50 -3.076 -8.339 -22.676 386 HD21 LEU 50 1HD2 LEU 50 -1.740 -11.694 -23.228 387 HD22 LEU 50 2HD2 LEU 50 -0.846 -11.831 -21.699 388 HD23 LEU 50 3HD2 LEU 50 -0.218 -10.794 -23.000 389 H HIS 51 H HIS 51 -4.148 -8.401 -20.668 390 HA HIS 51 HA HIS 51 -5.979 -9.166 -19.527 391 HB2 HIS 51 1HB HIS 51 -4.286 -11.163 -19.455 392 HB3 HIS 51 2HB HIS 51 -4.173 -10.776 -17.739 393 HD1 HIS 51 HD1 HIS 51 -6.617 -12.097 -20.311 394 HD2 HIS 51 HD2 HIS 51 -6.372 -11.469 -16.201 395 HE1 HIS 51 HE1 HIS 51 -8.582 -13.304 -19.264 396 H GLY 52 H GLY 52 -4.577 -6.742 -18.498 397 HA2 GLY 52 1HA GLY 52 -5.203 -5.239 -16.862 398 HA3 GLY 52 2HA GLY 52 -6.184 -6.491 -16.099 399 H ARG 53 H ARG 53 -3.080 -7.765 -16.469 400 HA ARG 53 HA ARG 53 -2.189 -6.630 -13.860 401 HB2 ARG 53 1HB ARG 53 -1.695 -8.754 -12.942 402 HB3 ARG 53 2HB ARG 53 -3.374 -8.815 -13.482 403 HG2 ARG 53 1HG ARG 53 -2.682 -10.111 -15.479 404 HG3 ARG 53 2HG ARG 53 -0.984 -10.016 -14.947 405 HD2 ARG 53 1HD ARG 53 -1.634 -11.128 -12.807 406 HD3 ARG 53 2HD ARG 53 -3.281 -11.294 -13.422 407 HE ARG 53 HE ARG 53 -2.594 -13.007 -14.858 408 HH11 ARG 53 1HH1 ARG 53 0.263 -11.715 -13.201 409 HH12 ARG 53 2HH1 ARG 53 1.202 -13.146 -13.559 410 HH21 ARG 53 1HH2 ARG 53 -1.298 -14.756 -15.288 411 HH22 ARG 53 2HH2 ARG 53 0.366 -14.793 -14.731 412 H GLN 54 H GLN 54 0.093 -7.176 -13.387 413 HA GLN 54 HA GLN 54 1.657 -7.144 -15.924 414 HB2 GLN 54 1HB GLN 54 2.459 -6.347 -13.107 415 HB3 GLN 54 2HB GLN 54 3.463 -6.209 -14.563 416 HG2 GLN 54 1HG GLN 54 1.960 -4.547 -15.496 417 HG3 GLN 54 2HG GLN 54 0.834 -4.753 -14.156 418 HE21 GLN 54 1HE2 GLN 54 2.311 -1.984 -12.669 419 HE22 GLN 54 2HE2 GLN 54 0.894 -2.688 -13.403 420 H GLY 55 H GLY 55 3.627 -8.485 -15.920 421 HA2 GLY 55 1HA GLY 55 4.123 -10.390 -13.834 422 HA3 GLY 55 2HA GLY 55 3.176 -11.154 -15.128 423 H ILE 56 H ILE 56 5.782 -12.005 -14.532 424 HA ILE 56 HA ILE 56 7.580 -10.649 -16.421 425 HB ILE 56 HB ILE 56 9.270 -12.286 -15.751 426 HG12 ILE 56 1HG1 ILE 56 7.127 -13.583 -14.028 427 HG13 ILE 56 2HG1 ILE 56 7.722 -14.256 -15.548 428 HG21 ILE 56 1HG2 ILE 56 7.766 -11.330 -13.265 429 HG22 ILE 56 2HG2 ILE 56 9.515 -11.592 -13.436 430 HG23 ILE 56 3HG2 ILE 56 8.740 -10.258 -14.301 431 HD11 ILE 56 1HD1 ILE 56 8.811 -15.409 -13.752 432 HD12 ILE 56 2HD1 ILE 56 10.025 -14.370 -14.536 433 HD13 ILE 56 3HD1 ILE 56 9.301 -13.888 -12.981 434 H VAL 57 H VAL 57 8.380 -11.443 -18.308 435 HA VAL 57 HA VAL 57 7.023 -13.834 -19.487 436 HB VAL 57 HB VAL 57 7.230 -10.998 -20.608 437 HG11 VAL 57 1HG1 VAL 57 6.071 -12.072 -22.664 438 HG12 VAL 57 2HG1 VAL 57 7.827 -12.228 -22.486 439 HG13 VAL 57 3HG1 VAL 57 6.771 -13.583 -22.076 440 HG21 VAL 57 1HG2 VAL 57 5.253 -11.359 -19.232 441 HG22 VAL 57 2HG2 VAL 57 4.757 -11.263 -20.936 442 HG23 VAL 57 3HG2 VAL 57 4.862 -12.846 -20.128 443 HA PRO 58 HA PRO 58 11.306 -14.225 -20.806 444 HB2 PRO 58 1HB PRO 58 11.074 -16.299 -22.587 445 HB3 PRO 58 2HB PRO 58 11.038 -16.539 -20.814 446 HG2 PRO 58 1HG PRO 58 8.740 -16.335 -22.743 447 HG3 PRO 58 2HG PRO 58 9.016 -17.538 -21.449 448 HD2 PRO 58 1HD PRO 58 7.385 -15.412 -21.140 449 HD3 PRO 58 2HD PRO 58 8.357 -16.076 -19.792 450 H GLY 59 H GLY 59 11.854 -12.463 -21.994 451 HA2 GLY 59 1HA GLY 59 10.264 -11.329 -24.008 452 HA3 GLY 59 2HA GLY 59 11.956 -10.951 -23.686 453 H ASN 60 H ASN 60 12.717 -13.818 -24.367 454 HA ASN 60 HA ASN 60 13.221 -13.368 -27.158 455 HB2 ASN 60 1HB ASN 60 14.332 -14.968 -25.291 456 HB3 ASN 60 2HB ASN 60 13.302 -16.158 -26.101 457 HD21 ASN 60 1HD2 ASN 60 15.043 -15.677 -29.282 458 HD22 ASN 60 2HD2 ASN 60 13.398 -15.703 -28.680 459 H ARG 61 H ARG 61 10.421 -14.599 -25.491 460 HA ARG 61 HA ARG 61 9.468 -16.030 -27.910 461 HB2 ARG 61 1HB ARG 61 8.089 -15.506 -25.251 462 HB3 ARG 61 2HB ARG 61 7.439 -16.478 -26.570 463 HG2 ARG 61 1HG ARG 61 9.542 -17.941 -26.310 464 HG3 ARG 61 2HG ARG 61 9.751 -17.113 -24.748 465 HD2 ARG 61 1HD ARG 61 7.333 -17.765 -24.224 466 HD3 ARG 61 2HD ARG 61 7.381 -18.790 -25.672 467 HE ARG 61 HE ARG 61 9.576 -19.286 -23.829 468 HH11 ARG 61 1HH1 ARG 61 6.199 -20.176 -24.486 469 HH12 ARG 61 2HH1 ARG 61 6.351 -21.653 -23.582 470 HH21 ARG 61 1HH2 ARG 61 9.639 -21.171 -22.688 471 HH22 ARG 61 2HH2 ARG 61 8.237 -22.197 -22.578 472 H LEU 62 H LEU 62 9.804 -12.878 -27.186 473 HA LEU 62 HA LEU 62 7.168 -12.102 -28.385 474 HB2 LEU 62 1HB LEU 62 9.011 -10.466 -26.616 475 HB3 LEU 62 2HB LEU 62 7.473 -9.959 -27.270 476 HG LEU 62 HG LEU 62 7.883 -12.044 -25.115 477 HD11 LEU 62 1HD1 LEU 62 8.316 -9.790 -24.322 478 HD12 LEU 62 2HD1 LEU 62 6.720 -10.266 -23.730 479 HD13 LEU 62 3HD1 LEU 62 6.851 -9.167 -25.112 480 HD21 LEU 62 1HD2 LEU 62 5.333 -10.952 -26.381 481 HD22 LEU 62 2HD2 LEU 62 5.397 -11.912 -24.890 482 HD23 LEU 62 3HD2 LEU 62 5.919 -12.636 -26.414 483 H LYS 63 H LYS 63 7.211 -10.316 -29.852 484 HA LYS 63 HA LYS 63 9.937 -9.536 -30.817 485 HB2 LYS 63 1HB LYS 63 8.846 -11.068 -32.453 486 HB3 LYS 63 2HB LYS 63 7.475 -9.951 -32.556 487 HG2 LYS 63 1HG LYS 63 8.983 -8.186 -33.414 488 HG3 LYS 63 2HG LYS 63 10.353 -9.301 -33.291 489 HD2 LYS 63 1HD LYS 63 9.299 -10.796 -34.936 490 HD3 LYS 63 2HD LYS 63 7.886 -9.722 -35.016 491 HE2 LYS 63 1HE LYS 63 9.328 -9.264 -36.920 492 HE3 LYS 63 2HE LYS 63 9.354 -7.873 -35.818 493 HZ1 LYS 63 1HZ LYS 63 11.438 -9.977 -35.960 494 HZ2 LYS 63 2HZ LYS 63 11.464 -8.677 -34.947 495 HZ3 LYS 63 3HZ LYS 63 11.574 -8.455 -36.579 496 H ILE 64 H ILE 64 10.225 -7.477 -30.376 497 HA ILE 64 HA ILE 64 8.217 -5.642 -29.537 498 HB ILE 64 HB ILE 64 10.992 -5.183 -30.765 499 HG12 ILE 64 1HG1 ILE 64 10.931 -6.489 -28.615 500 HG13 ILE 64 2HG1 ILE 64 11.841 -4.987 -28.538 501 HG21 ILE 64 1HG2 ILE 64 9.113 -3.213 -29.385 502 HG22 ILE 64 2HG2 ILE 64 10.860 -2.910 -29.596 503 HG23 ILE 64 3HG2 ILE 64 9.809 -3.090 -31.014 504 HD11 ILE 64 1HD1 ILE 64 10.434 -5.448 -26.483 505 HD12 ILE 64 2HD1 ILE 64 10.085 -3.888 -27.254 506 HD13 ILE 64 3HD1 ILE 64 8.989 -5.257 -27.481 507 H LEU 65 H LEU 65 6.946 -4.201 -30.647 508 HA LEU 65 HA LEU 65 6.427 -4.657 -33.429 509 HB2 LEU 65 1HB LEU 65 4.741 -3.789 -31.811 510 HB3 LEU 65 2HB LEU 65 5.704 -2.324 -31.614 511 HG LEU 65 HG LEU 65 5.323 -1.760 -34.007 512 HD11 LEU 65 1HD1 LEU 65 3.502 -4.203 -33.942 513 HD12 LEU 65 2HD1 LEU 65 4.932 -3.955 -34.980 514 HD13 LEU 65 3HD1 LEU 65 3.487 -2.958 -35.213 515 HD21 LEU 65 1HD2 LEU 65 2.786 -2.257 -32.405 516 HD22 LEU 65 2HD2 LEU 65 2.990 -1.085 -33.726 517 HD23 LEU 65 3HD2 LEU 65 3.887 -0.870 -32.200 518 H VAL 66 H VAL 66 7.615 -4.013 -35.039 519 HA VAL 66 HA VAL 66 9.732 -2.030 -34.658 520 HB VAL 66 HB VAL 66 10.405 -2.629 -36.991 521 HG11 VAL 66 1HG1 VAL 66 11.109 -4.927 -36.518 522 HG12 VAL 66 2HG1 VAL 66 11.246 -3.938 -35.053 523 HG13 VAL 66 3HG1 VAL 66 9.886 -5.073 -35.227 524 HG21 VAL 66 1HG2 VAL 66 8.045 -4.579 -36.901 525 HG22 VAL 66 2HG2 VAL 66 8.146 -3.124 -37.915 526 HG23 VAL 66 3HG2 VAL 66 9.270 -4.466 -38.179 527 H GLY 67 H GLY 67 10.000 -0.151 -35.949 528 HA2 GLY 67 1HA GLY 67 7.398 1.000 -36.839 529 HA3 GLY 67 2HA GLY 67 8.791 1.924 -36.245 530 H MET 68 H MET 68 7.780 2.789 -38.544 531 HA MET 68 HA MET 68 9.069 1.485 -40.834 532 HB2 MET 68 1HB MET 68 7.568 4.117 -40.588 533 HB3 MET 68 2HB MET 68 8.067 3.357 -42.102 534 HG2 MET 68 1HG MET 68 6.625 1.398 -41.561 535 HG3 MET 68 2HG MET 68 6.088 2.227 -40.089 536 HE1 MET 68 1HE MET 68 2.807 2.744 -42.028 537 HE2 MET 68 2HE MET 68 3.779 1.264 -41.865 538 HE3 MET 68 3HE MET 68 3.573 2.348 -40.472 539 H TYR 69 H TYR 69 10.555 2.780 -42.248 540 HA TYR 69 HA TYR 69 12.688 3.921 -40.621 541 HB2 TYR 69 1HB TYR 69 12.456 3.603 -43.639 542 HB3 TYR 69 2HB TYR 69 13.933 3.962 -42.734 543 HD1 TYR 69 HD1 TYR 69 12.161 1.367 -44.299 544 HD2 TYR 69 HD2 TYR 69 14.437 2.183 -40.742 545 HE1 TYR 69 HE1 TYR 69 12.652 -1.075 -44.045 546 HE2 TYR 69 HE2 TYR 69 14.911 -0.252 -40.489 547 HH TYR 69 HH TYR 69 13.728 -2.680 -42.814 548 H ASP 70 H ASP 70 10.375 5.551 -40.538 549 HA ASP 70 HA ASP 70 10.410 7.673 -42.463 550 HB2 ASP 70 1HB ASP 70 9.390 7.657 -39.595 551 HB3 ASP 70 2HB ASP 70 8.957 8.839 -40.846 552 H LYS 71 H LYS 71 12.189 7.156 -39.461 553 HA LYS 71 HA LYS 71 13.555 9.779 -39.907 554 HB2 LYS 71 1HB LYS 71 11.861 9.078 -37.720 555 HB3 LYS 71 2HB LYS 71 13.523 9.110 -37.109 556 HG2 LYS 71 1HG LYS 71 13.813 11.383 -38.004 557 HG3 LYS 71 2HG LYS 71 12.158 11.342 -38.642 558 HD2 LYS 71 1HD LYS 71 11.273 11.085 -36.353 559 HD3 LYS 71 2HD LYS 71 12.927 11.095 -35.708 560 HE2 LYS 71 1HE LYS 71 11.973 13.310 -35.432 561 HE3 LYS 71 2HE LYS 71 13.250 13.381 -36.662 562 HZ1 LYS 71 1HZ LYS 71 10.336 13.277 -37.218 563 HZ2 LYS 71 2HZ LYS 71 11.518 13.302 -38.370 564 HZ3 LYS 71 3HZ LYS 71 11.300 14.602 -37.375 565 H LYS 72 H LYS 72 15.717 9.875 -39.336 566 HA LYS 72 HA LYS 72 17.010 7.237 -38.769 567 HB2 LYS 72 1HB LYS 72 18.091 9.529 -40.469 568 HB3 LYS 72 2HB LYS 72 18.905 8.001 -40.143 569 HG2 LYS 72 1HG LYS 72 18.028 7.360 -42.137 570 HG3 LYS 72 2HG LYS 72 16.554 7.074 -41.199 571 HD2 LYS 72 1HD LYS 72 16.436 9.810 -41.827 572 HD3 LYS 72 2HD LYS 72 17.105 9.080 -43.293 573 HE2 LYS 72 1HE LYS 72 14.556 8.196 -41.869 574 HE3 LYS 72 2HE LYS 72 14.610 9.216 -43.311 575 HZ1 LYS 72 1HZ LYS 72 15.712 6.481 -43.217 576 HZ2 LYS 72 2HZ LYS 72 15.482 7.420 -44.558 577 HZ3 LYS 72 3HZ LYS 72 14.181 6.832 -43.725 578 HA PRO 73 HA PRO 73 18.491 9.543 -35.344 579 HB2 PRO 73 1HB PRO 73 20.722 8.222 -34.549 580 HB3 PRO 73 2HB PRO 73 19.095 7.466 -34.452 581 HG2 PRO 73 1HG PRO 73 21.193 7.173 -36.597 582 HG3 PRO 73 2HG PRO 73 20.308 5.895 -35.704 583 HD2 PRO 73 1HD PRO 73 19.530 6.744 -38.164 584 HD3 PRO 73 2HD PRO 73 18.341 6.256 -36.910 585 H ALA 74 H ALA 74 20.566 9.232 -38.137 586 HA ALA 74 HA ALA 74 21.755 11.857 -37.720 587 HB1 ALA 74 1HB ALA 74 23.531 9.355 -37.787 588 HB2 ALA 74 2HB ALA 74 24.097 11.045 -37.814 589 HB3 ALA 74 3HB ALA 74 23.301 10.401 -36.357 590 H GLY 75 H GLY 75 23.118 12.304 -39.772 591 HA2 GLY 75 1HA GLY 75 22.882 10.380 -41.952 592 HA3 GLY 75 2HA GLY 75 21.751 11.730 -42.129 593 H GLU 76 H GLU 76 24.751 12.368 -40.526 594 HA GLU 76 HA GLU 76 25.468 14.246 -42.664 595 HB2 GLU 76 1HB GLU 76 26.609 13.684 -39.896 596 HB3 GLU 76 2HB GLU 76 27.163 14.979 -40.959 597 HG2 GLU 76 1HG GLU 76 25.682 15.979 -39.354 598 HG3 GLU 76 2HG GLU 76 24.837 15.958 -40.900 599 H PHE 77 H PHE 77 27.788 14.462 -43.311 600 HA PHE 77 HA PHE 77 29.264 11.872 -43.334 601 HB2 PHE 77 1HB PHE 77 28.000 12.030 -45.445 602 HB3 PHE 77 2HB PHE 77 28.664 13.639 -45.741 603 HD1 PHE 77 HD1 PHE 77 30.750 13.930 -46.814 604 HD2 PHE 77 HD2 PHE 77 29.640 10.041 -45.343 605 HE1 PHE 77 HE1 PHE 77 32.719 12.935 -47.974 606 HE2 PHE 77 HE2 PHE 77 31.607 9.045 -46.481 607 HZ PHE 77 HZ PHE 77 33.162 10.488 -47.792 608 H ILE 78 H ILE 78 31.497 12.104 -43.312 609 HA ILE 78 HA ILE 78 32.558 14.891 -43.271 610 HB ILE 78 HB ILE 78 32.309 14.049 -40.933 611 HG12 ILE 78 1HG1 ILE 78 35.231 14.128 -41.757 612 HG13 ILE 78 2HG1 ILE 78 34.196 15.555 -41.671 613 HG21 ILE 78 1HG2 ILE 78 33.578 12.120 -40.099 614 HG22 ILE 78 2HG2 ILE 78 32.525 11.589 -41.418 615 HG23 ILE 78 3HG2 ILE 78 34.265 11.823 -41.710 616 HD11 ILE 78 1HD1 ILE 78 35.528 15.402 -39.653 617 HD12 ILE 78 2HD1 ILE 78 33.830 15.113 -39.235 618 HD13 ILE 78 3HD1 ILE 78 34.976 13.747 -39.344 619 H VAL 79 H VAL 79 34.471 15.170 -44.343 620 HA VAL 79 HA VAL 79 35.275 12.946 -46.091 621 HB VAL 79 HB VAL 79 36.301 15.827 -45.955 622 HG11 VAL 79 1HG1 VAL 79 37.938 14.389 -47.041 623 HG12 VAL 79 2HG1 VAL 79 36.679 13.648 -48.059 624 HG13 VAL 79 3HG1 VAL 79 37.128 15.364 -48.275 625 HG21 VAL 79 1HG2 VAL 79 34.877 16.202 -47.962 626 HG22 VAL 79 2HG2 VAL 79 34.230 14.555 -47.808 627 HG23 VAL 79 3HG2 VAL 79 33.901 15.771 -46.546 628 H THR 80 H THR 80 36.717 15.000 -43.537 629 HA THR 80 HA THR 80 38.624 12.876 -42.906 630 HB THR 80 HB THR 80 39.735 15.622 -43.698 631 HG1 THR 80 HG1 THR 80 39.232 13.324 -45.177 632 HG21 THR 80 1HG2 THR 80 41.072 12.958 -43.066 633 HG22 THR 80 2HG2 THR 80 41.092 14.412 -42.040 634 HG23 THR 80 3HG2 THR 80 41.902 14.427 -43.625 635 H ASP 81 H ASP 81 38.154 16.422 -42.463 636 HA ASP 81 HA ASP 81 37.933 16.043 -39.517 637 HB2 ASP 81 1HB ASP 81 40.290 16.704 -40.037 638 HB3 ASP 81 2HB ASP 81 39.692 18.124 -40.904 639 HXT ASP 81 H02 ASP 81 35.877 18.688 -39.420 Start of MODEL 28 1 H2 GLY 1 2H0 GLY 1 14.829 12.844 -20.767 2 H GLY 1 1H0 GLY 1 15.111 14.369 -21.288 3 HA2 GLY 1 1HA GLY 1 12.824 14.861 -21.638 4 HA3 GLY 1 2HA GLY 1 13.113 13.247 -22.341 5 H SER 2 H SER 2 13.259 13.587 -19.028 6 HA SER 2 HA SER 2 12.066 12.749 -17.235 7 HB2 SER 2 1HB SER 2 9.657 13.633 -18.863 8 HB3 SER 2 2HB SER 2 9.693 13.334 -17.112 9 HG SER 2 HG SER 2 9.955 15.580 -17.781 10 H MET 3 H MET 3 12.656 10.900 -19.468 11 HA MET 3 HA MET 3 10.440 9.086 -19.784 12 HB2 MET 3 1HB MET 3 13.442 8.671 -20.078 13 HB3 MET 3 2HB MET 3 12.202 7.521 -20.600 14 HG2 MET 3 1HG MET 3 11.323 9.157 -22.199 15 HG3 MET 3 2HG MET 3 12.524 10.348 -21.665 16 HE1 MET 3 1HE MET 3 13.808 9.265 -25.258 17 HE2 MET 3 2HE MET 3 12.112 9.411 -24.740 18 HE3 MET 3 3HE MET 3 13.304 10.636 -24.241 19 H LYS 4 H LYS 4 9.979 7.207 -18.686 20 HA LYS 4 HA LYS 4 11.571 6.630 -16.219 21 HB2 LYS 4 1HB LYS 4 8.560 6.957 -16.438 22 HB3 LYS 4 2HB LYS 4 9.370 6.173 -15.077 23 HG2 LYS 4 1HG LYS 4 10.585 8.272 -14.582 24 HG3 LYS 4 2HG LYS 4 9.785 9.054 -15.955 25 HD2 LYS 4 1HD LYS 4 8.579 9.722 -14.019 26 HD3 LYS 4 2HD LYS 4 7.566 8.526 -14.850 27 HE2 LYS 4 1HE LYS 4 8.379 6.768 -13.280 28 HE3 LYS 4 2HE LYS 4 9.376 7.982 -12.452 29 HZ1 LYS 4 1HZ LYS 4 7.275 7.620 -11.316 30 HZ2 LYS 4 2HZ LYS 4 6.418 8.039 -12.661 31 HZ3 LYS 4 3HZ LYS 4 7.340 9.167 -11.887 32 H TYR 5 H TYR 5 9.217 5.477 -18.617 33 HA TYR 5 HA TYR 5 10.112 2.698 -18.084 34 HB2 TYR 5 1HB TYR 5 7.357 3.854 -17.842 35 HB3 TYR 5 2HB TYR 5 7.517 2.280 -18.640 36 HD1 TYR 5 HD1 TYR 5 8.508 0.378 -17.469 37 HD2 TYR 5 HD2 TYR 5 7.759 4.042 -15.398 38 HE1 TYR 5 HE1 TYR 5 8.812 -0.803 -15.350 39 HE2 TYR 5 HE2 TYR 5 8.063 2.842 -13.211 40 HH TYR 5 HH TYR 5 9.050 -0.616 -13.110 41 H LEU 6 H LEU 6 9.730 1.290 -19.937 42 HA LEU 6 HA LEU 6 10.473 2.652 -22.361 43 HB2 LEU 6 1HB LEU 6 9.498 -0.192 -21.910 44 HB3 LEU 6 2HB LEU 6 10.273 0.390 -23.379 45 HG LEU 6 HG LEU 6 11.640 0.393 -20.668 46 HD11 LEU 6 1HD1 LEU 6 11.738 -1.701 -22.869 47 HD12 LEU 6 2HD1 LEU 6 10.997 -1.887 -21.257 48 HD13 LEU 6 3HD1 LEU 6 12.752 -1.668 -21.405 49 HD21 LEU 6 1HD2 LEU 6 13.700 0.519 -22.031 50 HD22 LEU 6 2HD2 LEU 6 12.642 1.913 -22.317 51 HD23 LEU 6 3HD2 LEU 6 12.715 0.596 -23.512 52 H ASN 7 H ASN 7 7.497 1.040 -21.294 53 HA ASN 7 HA ASN 7 5.360 1.039 -22.062 54 HB2 ASN 7 1HB ASN 7 6.040 3.778 -23.172 55 HB3 ASN 7 2HB ASN 7 4.423 3.149 -22.837 56 HD21 ASN 7 1HD2 ASN 7 6.102 5.227 -20.043 57 HD22 ASN 7 2HD2 ASN 7 6.309 5.370 -21.771 58 H VAL 8 H VAL 8 7.461 -0.002 -23.899 59 HA VAL 8 HA VAL 8 6.277 0.509 -26.574 60 HB VAL 8 HB VAL 8 8.056 -1.000 -27.419 61 HG11 VAL 8 1HG1 VAL 8 9.977 0.427 -26.954 62 HG12 VAL 8 2HG1 VAL 8 8.518 1.417 -27.163 63 HG13 VAL 8 3HG1 VAL 8 9.166 1.118 -25.537 64 HG21 VAL 8 1HG2 VAL 8 8.890 -1.251 -24.490 65 HG22 VAL 8 2HG2 VAL 8 8.295 -2.547 -25.550 66 HG23 VAL 8 3HG2 VAL 8 9.862 -1.789 -25.878 67 H LEU 9 H LEU 9 5.924 -1.752 -27.819 68 HA LEU 9 HA LEU 9 4.655 -3.645 -25.896 69 HB2 LEU 9 1HB LEU 9 3.020 -3.884 -28.027 70 HB3 LEU 9 2HB LEU 9 2.643 -2.964 -26.588 71 HG LEU 9 HG LEU 9 3.928 -1.562 -28.923 72 HD11 LEU 9 1HD1 LEU 9 2.099 -2.920 -29.857 73 HD12 LEU 9 2HD1 LEU 9 1.697 -1.191 -29.877 74 HD13 LEU 9 3HD1 LEU 9 0.979 -2.257 -28.644 75 HD21 LEU 9 1HD2 LEU 9 2.596 0.334 -28.083 76 HD22 LEU 9 2HD2 LEU 9 3.545 -0.350 -26.749 77 HD23 LEU 9 3HD2 LEU 9 1.814 -0.716 -26.877 78 H ALA 10 H ALA 10 4.314 -5.777 -26.797 79 HA ALA 10 HA ALA 10 6.055 -6.374 -29.135 80 HB1 ALA 10 1HB ALA 10 7.454 -6.563 -27.081 81 HB2 ALA 10 2HB ALA 10 6.292 -7.741 -26.429 82 HB3 ALA 10 3HB ALA 10 7.222 -8.123 -27.899 83 H LYS 11 H LYS 11 5.426 -8.138 -30.297 84 HA LYS 11 HA LYS 11 2.780 -9.276 -29.586 85 HB2 LYS 11 1HB LYS 11 3.197 -8.262 -31.844 86 HB3 LYS 11 2HB LYS 11 4.406 -9.514 -32.153 87 HG2 LYS 11 1HG LYS 11 2.733 -11.236 -32.161 88 HG3 LYS 11 2HG LYS 11 1.522 -10.146 -31.465 89 HD2 LYS 11 1HD LYS 11 1.661 -8.737 -33.524 90 HD3 LYS 11 2HD LYS 11 2.722 -9.968 -34.247 91 HE2 LYS 11 1HE LYS 11 0.958 -11.653 -34.008 92 HE3 LYS 11 2HE LYS 11 -0.071 -10.486 -33.161 93 HZ1 LYS 11 1HZ LYS 11 0.780 -10.270 -35.982 94 HZ2 LYS 11 2HZ LYS 11 -0.162 -9.178 -35.181 95 HZ3 LYS 11 3HZ LYS 11 -0.721 -10.705 -35.451 96 H ALA 12 H ALA 12 2.495 -11.353 -29.043 97 HA ALA 12 HA ALA 12 4.853 -12.884 -28.322 98 HB1 ALA 12 1HB ALA 12 1.897 -13.577 -28.337 99 HB2 ALA 12 2HB ALA 12 3.175 -14.576 -27.608 100 HB3 ALA 12 3HB ALA 12 2.831 -12.960 -26.961 101 H LEU 13 H LEU 13 5.868 -14.435 -29.367 102 HA LEU 13 HA LEU 13 4.964 -15.169 -32.103 103 HB2 LEU 13 1HB LEU 13 7.460 -15.856 -30.505 104 HB3 LEU 13 2HB LEU 13 7.196 -16.263 -32.198 105 HG LEU 13 HG LEU 13 7.362 -13.418 -31.133 106 HD11 LEU 13 1HD1 LEU 13 9.488 -15.118 -32.494 107 HD12 LEU 13 2HD1 LEU 13 9.479 -14.624 -30.784 108 HD13 LEU 13 3HD1 LEU 13 9.640 -13.399 -32.055 109 HD21 LEU 13 1HD2 LEU 13 7.743 -12.875 -33.544 110 HD22 LEU 13 2HD2 LEU 13 6.137 -13.556 -33.241 111 HD23 LEU 13 3HD2 LEU 13 7.413 -14.570 -33.957 112 H TYR 14 H TYR 14 5.414 -16.421 -28.860 113 HA TYR 14 HA TYR 14 4.384 -19.091 -29.728 114 HB2 TYR 14 1HB TYR 14 6.082 -18.377 -27.328 115 HB3 TYR 14 2HB TYR 14 5.518 -19.993 -27.747 116 HD1 TYR 14 HD1 TYR 14 7.812 -17.248 -28.724 117 HD2 TYR 14 HD2 TYR 14 6.697 -21.335 -29.404 118 HE1 TYR 14 HE1 TYR 14 9.915 -17.591 -29.988 119 HE2 TYR 14 HE2 TYR 14 8.804 -21.682 -30.704 120 HH TYR 14 HH TYR 14 10.744 -20.735 -31.474 121 H ASP 15 H ASP 15 3.092 -20.176 -28.105 122 HA ASP 15 HA ASP 15 1.449 -18.299 -26.497 123 HB2 ASP 15 1HB ASP 15 -0.013 -20.374 -26.263 124 HB3 ASP 15 2HB ASP 15 0.079 -19.695 -27.893 125 H ASN 16 H ASN 16 1.184 -18.750 -24.271 126 HA ASN 16 HA ASN 16 3.191 -20.597 -23.070 127 HB2 ASN 16 1HB ASN 16 4.207 -18.297 -23.556 128 HB3 ASN 16 2HB ASN 16 3.069 -17.647 -22.368 129 HD21 ASN 16 1HD2 ASN 16 5.172 -18.410 -19.706 130 HD22 ASN 16 2HD2 ASN 16 3.842 -17.467 -20.364 131 H VAL 17 H VAL 17 2.431 -21.509 -21.266 132 HA VAL 17 HA VAL 17 0.112 -20.228 -19.868 133 HB VAL 17 HB VAL 17 1.214 -23.088 -19.702 134 HG11 VAL 17 1HG1 VAL 17 0.285 -22.370 -17.544 135 HG12 VAL 17 2HG1 VAL 17 -1.204 -21.805 -18.343 136 HG13 VAL 17 3HG1 VAL 17 -0.806 -23.540 -18.308 137 HG21 VAL 17 1HG2 VAL 17 0.021 -22.727 -21.820 138 HG22 VAL 17 2HG2 VAL 17 -0.952 -23.749 -20.745 139 HG23 VAL 17 3HG2 VAL 17 -1.366 -22.029 -20.947 140 H ALA 18 H ALA 18 0.603 -19.390 -17.859 141 HA ALA 18 HA ALA 18 3.376 -19.024 -17.210 142 HB1 ALA 18 1HB ALA 18 0.824 -18.561 -15.601 143 HB2 ALA 18 2HB ALA 18 2.438 -18.029 -15.101 144 HB3 ALA 18 3HB ALA 18 1.714 -17.355 -16.569 145 H GLU 19 H GLU 19 4.725 -20.321 -16.144 146 HA GLU 19 HA GLU 19 3.587 -22.727 -14.783 147 HB2 GLU 19 1HB GLU 19 6.457 -22.014 -15.509 148 HB3 GLU 19 2HB GLU 19 5.898 -23.556 -14.840 149 HG2 GLU 19 1HG GLU 19 4.415 -23.781 -16.886 150 HG3 GLU 19 2HG GLU 19 5.264 -22.381 -17.562 151 H SER 20 H SER 20 4.529 -19.592 -14.160 152 HA SER 20 HA SER 20 5.011 -20.230 -11.285 153 HB2 SER 20 1HB SER 20 6.956 -19.132 -11.292 154 HB3 SER 20 2HB SER 20 6.864 -19.096 -13.073 155 HG SER 20 HG SER 20 7.096 -17.011 -12.342 156 HA PRO 21 HA PRO 21 1.694 -17.460 -10.794 157 HB2 PRO 21 1HB PRO 21 2.119 -16.233 -8.399 158 HB3 PRO 21 2HB PRO 21 1.743 -17.982 -8.528 159 HG2 PRO 21 1HG PRO 21 4.433 -16.658 -8.269 160 HG3 PRO 21 2HG PRO 21 3.730 -17.983 -7.285 161 HD2 PRO 21 1HD PRO 21 5.395 -18.498 -9.340 162 HD3 PRO 21 2HD PRO 21 3.975 -19.553 -9.013 163 H ASP 22 H ASP 22 4.941 -16.124 -10.558 164 HA ASP 22 HA ASP 22 4.072 -13.344 -10.799 165 HB2 ASP 22 1HB ASP 22 6.783 -14.700 -11.037 166 HB3 ASP 22 2HB ASP 22 6.529 -12.947 -11.019 167 H GLU 23 H GLU 23 4.596 -16.000 -12.904 168 HA GLU 23 HA GLU 23 5.471 -14.415 -15.182 169 HB2 GLU 23 1HB GLU 23 6.120 -16.807 -14.713 170 HB3 GLU 23 2HB GLU 23 4.466 -17.268 -15.122 171 HG2 GLU 23 1HG GLU 23 4.786 -16.300 -17.378 172 HG3 GLU 23 2HG GLU 23 6.447 -15.878 -16.950 173 H LEU 24 H LEU 24 4.315 -13.943 -17.039 174 HA LEU 24 HA LEU 24 1.378 -13.779 -16.629 175 HB2 LEU 24 1HB LEU 24 3.364 -12.140 -17.794 176 HB3 LEU 24 2HB LEU 24 2.371 -12.710 -19.133 177 HG LEU 24 HG LEU 24 1.292 -11.331 -16.663 178 HD11 LEU 24 1HD1 LEU 24 1.118 -9.347 -18.060 179 HD12 LEU 24 2HD1 LEU 24 1.827 -10.225 -19.436 180 HD13 LEU 24 3HD1 LEU 24 2.804 -9.900 -17.983 181 HD21 LEU 24 1HD2 LEU 24 -0.725 -10.981 -18.106 182 HD22 LEU 24 2HD2 LEU 24 -0.421 -12.684 -17.732 183 HD23 LEU 24 3HD2 LEU 24 0.010 -12.040 -19.330 184 H SER 25 H SER 25 -0.053 -15.000 -17.759 185 HA SER 25 HA SER 25 0.962 -16.966 -19.725 186 HB2 SER 25 1HB SER 25 -1.855 -16.354 -18.726 187 HB3 SER 25 2HB SER 25 -1.422 -17.673 -19.834 188 HG SER 25 HG SER 25 -0.249 -17.381 -17.268 189 H PHE 26 H PHE 26 0.517 -16.809 -21.945 190 HA PHE 26 HA PHE 26 -1.197 -14.668 -22.977 191 HB2 PHE 26 1HB PHE 26 0.627 -13.617 -24.322 192 HB3 PHE 26 2HB PHE 26 0.760 -13.312 -22.589 193 HD1 PHE 26 HD1 PHE 26 2.245 -15.188 -25.434 194 HD2 PHE 26 HD2 PHE 26 2.602 -14.094 -21.280 195 HE1 PHE 26 HE1 PHE 26 4.608 -15.976 -25.431 196 HE2 PHE 26 HE2 PHE 26 4.935 -14.914 -21.258 197 HZ PHE 26 HZ PHE 26 5.964 -15.829 -23.335 198 H ARG 27 H ARG 27 -1.139 -14.801 -25.475 199 HA ARG 27 HA ARG 27 -0.419 -17.602 -26.234 200 HB2 ARG 27 1HB ARG 27 -2.972 -16.129 -26.932 201 HB3 ARG 27 2HB ARG 27 -2.474 -17.702 -27.584 202 HG2 ARG 27 1HG ARG 27 -2.346 -18.525 -25.175 203 HG3 ARG 27 2HG ARG 27 -3.165 -17.023 -24.707 204 HD2 ARG 27 1HD ARG 27 -5.034 -17.610 -26.222 205 HD3 ARG 27 2HD ARG 27 -4.205 -19.135 -26.612 206 HE ARG 27 HE ARG 27 -4.436 -18.909 -23.786 207 HH11 ARG 27 1HH1 ARG 27 -6.537 -19.464 -26.568 208 HH12 ARG 27 2HH1 ARG 27 -7.681 -20.391 -25.635 209 HH21 ARG 27 1HH2 ARG 27 -5.940 -20.093 -22.661 210 HH22 ARG 27 2HH2 ARG 27 -7.355 -20.723 -23.458 211 H LYS 28 H LYS 28 -0.036 -17.967 -28.461 212 HA LYS 28 HA LYS 28 1.660 -16.016 -29.593 213 HB2 LYS 28 1HB LYS 28 1.793 -17.459 -31.518 214 HB3 LYS 28 2HB LYS 28 1.733 -18.457 -30.067 215 HG2 LYS 28 1HG LYS 28 -0.912 -18.412 -30.692 216 HG3 LYS 28 2HG LYS 28 -0.217 -18.227 -32.305 217 HD2 LYS 28 1HD LYS 28 0.338 -20.478 -30.330 218 HD3 LYS 28 2HD LYS 28 -0.665 -20.579 -31.775 219 HE2 LYS 28 1HE LYS 28 1.206 -21.450 -32.701 220 HE3 LYS 28 2HE LYS 28 1.662 -19.748 -32.915 221 HZ1 LYS 28 1HZ LYS 28 2.392 -21.289 -30.484 222 HZ2 LYS 28 2HZ LYS 28 3.050 -19.870 -31.028 223 HZ3 LYS 28 3HZ LYS 28 3.353 -21.275 -31.834 224 H GLY 29 H GLY 29 1.394 -14.393 -30.985 225 HA2 GLY 29 1HA GLY 29 0.274 -13.098 -32.587 226 HA3 GLY 29 2HA GLY 29 -1.199 -14.036 -32.348 227 H ASP 30 H ASP 30 -0.450 -13.394 -29.253 228 HA ASP 30 HA ASP 30 -2.279 -11.104 -29.126 229 HB2 ASP 30 1HB ASP 30 -2.024 -13.176 -27.521 230 HB3 ASP 30 2HB ASP 30 -0.705 -12.237 -26.803 231 H ILE 31 H ILE 31 -1.631 -9.149 -27.777 232 HA ILE 31 HA ILE 31 1.281 -8.500 -28.111 233 HB ILE 31 HB ILE 31 -1.087 -6.722 -28.913 234 HG12 ILE 31 1HG1 ILE 31 0.693 -6.595 -30.957 235 HG13 ILE 31 2HG1 ILE 31 1.086 -8.199 -30.347 236 HG21 ILE 31 1HG2 ILE 31 0.562 -5.334 -27.700 237 HG22 ILE 31 2HG2 ILE 31 1.888 -6.010 -28.680 238 HG23 ILE 31 3HG2 ILE 31 0.643 -4.981 -29.434 239 HD11 ILE 31 1HD1 ILE 31 -0.515 -8.232 -32.203 240 HD12 ILE 31 2HD1 ILE 31 -1.166 -8.960 -30.725 241 HD13 ILE 31 3HD1 ILE 31 -1.674 -7.320 -31.206 242 H MET 32 H MET 32 2.189 -7.629 -26.380 243 HA MET 32 HA MET 32 0.403 -6.624 -24.192 244 HB2 MET 32 1HB MET 32 1.835 -7.770 -22.578 245 HB3 MET 32 2HB MET 32 1.149 -8.918 -23.727 246 HG2 MET 32 1HG MET 32 3.404 -8.590 -25.023 247 HG3 MET 32 2HG MET 32 3.995 -7.973 -23.472 248 HE1 MET 32 1HE MET 32 1.540 -10.993 -24.621 249 HE2 MET 32 2HE MET 32 2.973 -10.839 -25.663 250 HE3 MET 32 3HE MET 32 2.800 -12.248 -24.595 251 H THR 33 H THR 33 1.344 -5.045 -22.830 252 HA THR 33 HA THR 33 3.323 -3.363 -24.210 253 HB THR 33 HB THR 33 2.041 -3.004 -21.457 254 HG1 THR 33 HG1 THR 33 0.558 -1.685 -22.631 255 HG21 THR 33 1HG2 THR 33 3.264 -0.998 -23.405 256 HG22 THR 33 2HG2 THR 33 4.004 -1.542 -21.879 257 HG23 THR 33 3HG2 THR 33 2.495 -0.608 -21.850 258 H VAL 34 H VAL 34 5.479 -3.278 -23.711 259 HA VAL 34 HA VAL 34 6.449 -4.946 -21.412 260 HB VAL 34 HB VAL 34 7.910 -3.824 -23.853 261 HG11 VAL 34 1HG1 VAL 34 9.890 -5.129 -22.943 262 HG12 VAL 34 2HG1 VAL 34 9.453 -3.688 -22.004 263 HG13 VAL 34 3HG1 VAL 34 8.986 -5.300 -21.419 264 HG21 VAL 34 1HG2 VAL 34 8.235 -6.121 -24.528 265 HG22 VAL 34 2HG2 VAL 34 7.539 -6.726 -23.011 266 HG23 VAL 34 3HG2 VAL 34 6.501 -5.904 -24.204 267 H LEU 35 H LEU 35 6.939 -3.888 -19.632 268 HA LEU 35 HA LEU 35 7.033 -0.936 -19.728 269 HB2 LEU 35 1HB LEU 35 7.039 -2.907 -17.410 270 HB3 LEU 35 2HB LEU 35 6.905 -1.160 -17.262 271 HG LEU 35 HG LEU 35 4.870 -2.929 -18.659 272 HD11 LEU 35 1HD1 LEU 35 3.482 -2.525 -16.658 273 HD12 LEU 35 2HD1 LEU 35 4.836 -1.662 -15.894 274 HD13 LEU 35 3HD1 LEU 35 4.973 -3.396 -16.259 275 HD21 LEU 35 1HD2 LEU 35 4.797 0.020 -17.875 276 HD22 LEU 35 2HD2 LEU 35 3.411 -0.911 -18.488 277 HD23 LEU 35 3HD2 LEU 35 4.820 -0.638 -19.528 278 H GLU 36 H GLU 36 9.005 -3.637 -18.421 279 HA GLU 36 HA GLU 36 11.464 -2.044 -18.860 280 HB2 GLU 36 1HB GLU 36 12.252 -2.498 -16.556 281 HB3 GLU 36 2HB GLU 36 10.850 -1.426 -16.591 282 HG2 GLU 36 1HG GLU 36 9.382 -3.291 -15.988 283 HG3 GLU 36 2HG GLU 36 10.769 -4.391 -15.973 284 H ARG 37 H ARG 37 13.410 -3.513 -18.239 285 HA ARG 37 HA ARG 37 12.829 -6.366 -18.972 286 HB2 ARG 37 1HB ARG 37 15.201 -4.710 -19.880 287 HB3 ARG 37 2HB ARG 37 14.853 -6.384 -20.325 288 HG2 ARG 37 1HG ARG 37 12.804 -5.549 -21.558 289 HG3 ARG 37 2HG ARG 37 13.347 -3.899 -21.209 290 HD2 ARG 37 1HD ARG 37 14.474 -5.912 -23.117 291 HD3 ARG 37 2HD ARG 37 14.316 -4.160 -23.294 292 HE ARG 37 HE ARG 37 16.286 -3.911 -21.821 293 HH11 ARG 37 1HH1 ARG 37 15.845 -7.115 -23.241 294 HH12 ARG 37 2HH1 ARG 37 17.476 -7.602 -22.828 295 HH21 ARG 37 1HH2 ARG 37 18.361 -4.625 -21.394 296 HH22 ARG 37 2HH2 ARG 37 18.842 -6.250 -21.835 297 H ASP 38 H ASP 38 14.484 -7.809 -18.105 298 HA ASP 38 HA ASP 38 15.917 -8.560 -16.497 299 HB2 ASP 38 1HB ASP 38 17.362 -6.832 -17.741 300 HB3 ASP 38 2HB ASP 38 17.129 -5.796 -16.320 301 H THR 39 H THR 39 13.390 -7.643 -15.863 302 HA THR 39 HA THR 39 13.301 -5.966 -13.542 303 HB THR 39 HB THR 39 11.437 -6.396 -15.210 304 HG1 THR 39 HG1 THR 39 10.993 -5.474 -13.182 305 HG21 THR 39 1HG2 THR 39 10.026 -8.364 -14.971 306 HG22 THR 39 2HG2 THR 39 11.045 -8.993 -13.664 307 HG23 THR 39 3HG2 THR 39 11.682 -8.895 -15.325 308 H GLN 40 H GLN 40 14.278 -9.204 -13.916 309 HA GLN 40 HA GLN 40 13.633 -9.827 -11.065 310 HB2 GLN 40 1HB GLN 40 12.630 -11.120 -13.142 311 HB3 GLN 40 2HB GLN 40 14.202 -11.928 -13.139 312 HG2 GLN 40 1HG GLN 40 13.809 -12.650 -10.800 313 HG3 GLN 40 2HG GLN 40 12.254 -11.806 -10.803 314 HE21 GLN 40 1HE2 GLN 40 11.126 -15.110 -11.496 315 HE22 GLN 40 2HE2 GLN 40 11.506 -14.005 -10.196 316 H GLY 41 H GLY 41 16.182 -8.748 -12.814 317 HA2 GLY 41 1HA GLY 41 18.457 -8.842 -12.281 318 HA3 GLY 41 2HA GLY 41 18.139 -10.148 -11.114 319 H LEU 42 H LEU 42 16.583 -10.602 -14.049 320 HA LEU 42 HA LEU 42 18.768 -12.232 -15.242 321 HB2 LEU 42 1HB LEU 42 15.802 -12.918 -15.027 322 HB3 LEU 42 2HB LEU 42 16.984 -13.840 -15.944 323 HG LEU 42 HG LEU 42 17.023 -13.513 -12.923 324 HD11 LEU 42 1HD1 LEU 42 16.007 -15.813 -14.641 325 HD12 LEU 42 2HD1 LEU 42 14.995 -14.681 -13.710 326 HD13 LEU 42 3HD1 LEU 42 16.097 -15.788 -12.863 327 HD21 LEU 42 1HD2 LEU 42 18.553 -15.470 -13.012 328 HD22 LEU 42 2HD2 LEU 42 19.231 -14.050 -13.829 329 HD23 LEU 42 3HD2 LEU 42 18.543 -15.384 -14.790 330 H ASP 43 H ASP 43 19.175 -11.107 -17.166 331 HA ASP 43 HA ASP 43 17.014 -9.562 -18.362 332 HB2 ASP 43 1HB ASP 43 19.489 -8.949 -18.577 333 HB3 ASP 43 2HB ASP 43 19.607 -10.273 -19.750 334 H GLY 44 H GLY 44 16.250 -9.978 -20.520 335 HA2 GLY 44 1HA GLY 44 15.585 -11.540 -22.226 336 HA3 GLY 44 2HA GLY 44 16.165 -12.886 -21.214 337 H TRP 45 H TRP 45 14.885 -11.250 -18.856 338 HA TRP 45 HA TRP 45 12.077 -12.167 -19.349 339 HB2 TRP 45 1HB TRP 45 13.661 -11.700 -16.806 340 HB3 TRP 45 2HB TRP 45 11.907 -11.914 -16.829 341 HD1 TRP 45 HD1 TRP 45 15.149 -13.873 -17.317 342 HE1 TRP 45 HE1 TRP 45 14.681 -16.373 -17.345 343 HE3 TRP 45 HE3 TRP 45 10.047 -13.628 -17.371 344 HZ2 TRP 45 HZ2 TRP 45 12.377 -18.070 -17.410 345 HZ3 TRP 45 HZ3 TRP 45 8.735 -15.761 -17.393 346 HH2 TRP 45 HH2 TRP 45 9.905 -17.960 -17.423 347 H TRP 46 H TRP 46 10.565 -10.596 -19.644 348 HA TRP 46 HA TRP 46 11.386 -7.819 -18.898 349 HB2 TRP 46 1HB TRP 46 9.581 -8.657 -21.176 350 HB3 TRP 46 2HB TRP 46 10.165 -7.030 -20.828 351 HD1 TRP 46 HD1 TRP 46 13.287 -8.483 -20.367 352 HE1 TRP 46 HE1 TRP 46 14.682 -8.927 -22.429 353 HE3 TRP 46 HE3 TRP 46 9.537 -8.143 -23.821 354 HZ2 TRP 46 HZ2 TRP 46 14.244 -9.154 -25.244 355 HZ3 TRP 46 HZ3 TRP 46 10.095 -8.516 -26.234 356 HH2 TRP 46 HH2 TRP 46 12.435 -9.041 -26.921 357 H LEU 47 H LEU 47 9.835 -6.529 -17.905 358 HA LEU 47 HA LEU 47 7.583 -8.036 -16.722 359 HB2 LEU 47 1HB LEU 47 8.902 -6.369 -15.382 360 HB3 LEU 47 2HB LEU 47 8.359 -5.114 -16.484 361 HG LEU 47 HG LEU 47 5.993 -5.591 -15.784 362 HD11 LEU 47 1HD1 LEU 47 5.665 -6.813 -13.646 363 HD12 LEU 47 2HD1 LEU 47 7.377 -7.295 -13.668 364 HD13 LEU 47 3HD1 LEU 47 6.267 -7.875 -14.930 365 HD21 LEU 47 1HD2 LEU 47 6.207 -4.419 -13.630 366 HD22 LEU 47 2HD2 LEU 47 7.298 -3.726 -14.845 367 HD23 LEU 47 3HD2 LEU 47 7.947 -4.801 -13.584 368 H CYS 48 H CYS 48 5.941 -8.375 -18.092 369 HA CYS 48 HA CYS 48 5.191 -6.131 -19.905 370 HB2 CYS 48 1HB CYS 48 4.462 -9.067 -20.055 371 HB3 CYS 48 2HB CYS 48 4.090 -7.823 -21.258 372 HG CYS 48 HG CYS 48 7.034 -8.910 -20.237 373 H SER 49 H SER 49 2.830 -5.879 -20.261 374 HA SER 49 HA SER 49 1.216 -6.844 -17.956 375 HB2 SER 49 1HB SER 49 1.756 -4.502 -17.503 376 HB3 SER 49 2HB SER 49 1.152 -4.041 -19.114 377 HG SER 49 HG SER 49 -0.428 -5.378 -17.158 378 H LEU 50 H LEU 50 -0.599 -7.756 -18.456 379 HA LEU 50 HA LEU 50 -2.036 -7.315 -20.967 380 HB2 LEU 50 1HB LEU 50 -0.111 -8.798 -21.624 381 HB3 LEU 50 2HB LEU 50 -0.619 -9.945 -20.403 382 HG LEU 50 HG LEU 50 -2.751 -10.290 -21.663 383 HD11 LEU 50 1HD1 LEU 50 -2.865 -8.182 -22.921 384 HD12 LEU 50 2HD1 LEU 50 -2.830 -9.563 -24.035 385 HD13 LEU 50 3HD1 LEU 50 -1.365 -8.592 -23.775 386 HD21 LEU 50 1HD2 LEU 50 -0.167 -10.783 -23.155 387 HD22 LEU 50 2HD2 LEU 50 -1.705 -11.631 -23.424 388 HD23 LEU 50 3HD2 LEU 50 -0.864 -11.800 -21.870 389 H HIS 51 H HIS 51 -4.092 -8.467 -20.838 390 HA HIS 51 HA HIS 51 -5.913 -9.346 -19.789 391 HB2 HIS 51 1HB HIS 51 -4.028 -11.223 -19.728 392 HB3 HIS 51 2HB HIS 51 -4.203 -11.017 -17.983 393 HD1 HIS 51 HD1 HIS 51 -6.968 -11.126 -17.244 394 HD2 HIS 51 HD2 HIS 51 -5.703 -13.055 -20.717 395 HE1 HIS 51 HE1 HIS 51 -8.727 -12.868 -17.809 396 H GLY 52 H GLY 52 -4.538 -6.976 -18.467 397 HA2 GLY 52 1HA GLY 52 -5.355 -5.625 -16.761 398 HA3 GLY 52 2HA GLY 52 -6.282 -6.984 -16.127 399 H ARG 53 H ARG 53 -3.117 -7.956 -16.562 400 HA ARG 53 HA ARG 53 -2.264 -7.202 -13.799 401 HB2 ARG 53 1HB ARG 53 -1.411 -9.339 -13.321 402 HB3 ARG 53 2HB ARG 53 -3.113 -9.553 -13.736 403 HG2 ARG 53 1HG ARG 53 -2.569 -10.500 -15.851 404 HG3 ARG 53 2HG ARG 53 -0.888 -9.956 -15.768 405 HD2 ARG 53 1HD ARG 53 -2.074 -11.966 -13.833 406 HD3 ARG 53 2HD ARG 53 -1.231 -12.410 -15.328 407 HE ARG 53 HE ARG 53 0.460 -10.658 -13.859 408 HH11 ARG 53 1HH1 ARG 53 -0.756 -13.980 -13.575 409 HH12 ARG 53 2HH1 ARG 53 0.651 -14.484 -12.664 410 HH21 ARG 53 1HH2 ARG 53 2.176 -11.411 -12.703 411 HH22 ARG 53 2HH2 ARG 53 2.234 -13.082 -12.174 412 H GLN 54 H GLN 54 0.098 -7.595 -13.506 413 HA GLN 54 HA GLN 54 1.502 -7.455 -16.123 414 HB2 GLN 54 1HB GLN 54 3.209 -6.068 -15.158 415 HB3 GLN 54 2HB GLN 54 1.632 -5.285 -14.989 416 HG2 GLN 54 1HG GLN 54 1.516 -6.069 -12.634 417 HG3 GLN 54 2HG GLN 54 3.141 -6.750 -12.806 418 HE21 GLN 54 1HE2 GLN 54 3.656 -3.504 -11.242 419 HE22 GLN 54 2HE2 GLN 54 3.022 -5.081 -10.835 420 H GLY 55 H GLY 55 3.658 -8.543 -16.033 421 HA2 GLY 55 1HA GLY 55 4.353 -10.157 -13.762 422 HA3 GLY 55 2HA GLY 55 3.441 -11.124 -14.939 423 H ILE 56 H ILE 56 5.998 -11.842 -14.384 424 HA ILE 56 HA ILE 56 7.832 -10.579 -16.279 425 HB ILE 56 HB ILE 56 9.450 -12.294 -15.620 426 HG12 ILE 56 1HG1 ILE 56 7.224 -13.607 -14.019 427 HG13 ILE 56 2HG1 ILE 56 7.835 -14.215 -15.555 428 HG21 ILE 56 1HG2 ILE 56 8.897 -10.337 -14.051 429 HG22 ILE 56 2HG2 ILE 56 7.951 -11.485 -13.079 430 HG23 ILE 56 3HG2 ILE 56 9.702 -11.722 -13.291 431 HD11 ILE 56 1HD1 ILE 56 10.101 -14.456 -14.482 432 HD12 ILE 56 2HD1 ILE 56 9.330 -14.054 -12.926 433 HD13 ILE 56 3HD1 ILE 56 8.831 -15.506 -13.817 434 H VAL 57 H VAL 57 8.506 -11.419 -18.238 435 HA VAL 57 HA VAL 57 7.024 -13.778 -19.297 436 HB VAL 57 HB VAL 57 7.199 -10.990 -20.526 437 HG11 VAL 57 1HG1 VAL 57 6.606 -13.624 -21.863 438 HG12 VAL 57 2HG1 VAL 57 5.978 -12.095 -22.494 439 HG13 VAL 57 3HG1 VAL 57 7.729 -12.343 -22.360 440 HG21 VAL 57 1HG2 VAL 57 4.730 -11.264 -20.740 441 HG22 VAL 57 2HG2 VAL 57 4.861 -12.800 -19.852 442 HG23 VAL 57 3HG2 VAL 57 5.302 -11.268 -19.061 443 HA PRO 58 HA PRO 58 11.235 -14.255 -20.736 444 HB2 PRO 58 1HB PRO 58 10.930 -16.398 -22.416 445 HB3 PRO 58 2HB PRO 58 10.955 -16.567 -20.631 446 HG2 PRO 58 1HG PRO 58 8.595 -16.438 -22.483 447 HG3 PRO 58 2HG PRO 58 8.920 -17.580 -21.147 448 HD2 PRO 58 1HD PRO 58 7.297 -15.426 -20.892 449 HD3 PRO 58 2HD PRO 58 8.297 -16.044 -19.540 450 H GLY 59 H GLY 59 11.695 -12.532 -21.971 451 HA2 GLY 59 1HA GLY 59 10.115 -11.515 -24.078 452 HA3 GLY 59 2HA GLY 59 11.789 -11.096 -23.731 453 H ASN 60 H ASN 60 12.450 -14.061 -24.126 454 HA ASN 60 HA ASN 60 13.222 -13.888 -26.883 455 HB2 ASN 60 1HB ASN 60 13.043 -16.257 -24.983 456 HB3 ASN 60 2HB ASN 60 13.770 -16.323 -26.596 457 HD21 ASN 60 1HD2 ASN 60 16.213 -15.524 -23.736 458 HD22 ASN 60 2HD2 ASN 60 14.847 -16.612 -23.765 459 H ARG 61 H ARG 61 10.223 -14.804 -25.355 460 HA ARG 61 HA ARG 61 9.334 -16.294 -27.758 461 HB2 ARG 61 1HB ARG 61 7.822 -15.506 -25.245 462 HB3 ARG 61 2HB ARG 61 7.192 -16.510 -26.539 463 HG2 ARG 61 1HG ARG 61 9.128 -18.140 -25.992 464 HG3 ARG 61 2HG ARG 61 9.279 -17.210 -24.480 465 HD2 ARG 61 1HD ARG 61 6.654 -17.507 -24.395 466 HD3 ARG 61 2HD ARG 61 6.937 -18.842 -25.503 467 HE ARG 61 HE ARG 61 7.519 -18.726 -22.636 468 HH11 ARG 61 1HH1 ARG 61 8.103 -20.546 -25.610 469 HH12 ARG 61 2HH1 ARG 61 8.462 -22.009 -24.734 470 HH21 ARG 61 1HH2 ARG 61 7.968 -20.611 -21.609 471 HH22 ARG 61 2HH2 ARG 61 8.409 -22.038 -22.505 472 H LEU 62 H LEU 62 9.818 -13.100 -27.235 473 HA LEU 62 HA LEU 62 7.214 -12.280 -28.480 474 HB2 LEU 62 1HB LEU 62 9.021 -10.647 -26.682 475 HB3 LEU 62 2HB LEU 62 7.463 -10.170 -27.321 476 HG LEU 62 HG LEU 62 7.962 -12.241 -25.168 477 HD11 LEU 62 1HD1 LEU 62 6.796 -10.521 -23.747 478 HD12 LEU 62 2HD1 LEU 62 6.758 -9.432 -25.136 479 HD13 LEU 62 3HD1 LEU 62 8.312 -9.927 -24.433 480 HD21 LEU 62 1HD2 LEU 62 5.497 -12.228 -24.890 481 HD22 LEU 62 2HD2 LEU 62 6.008 -12.916 -26.437 482 HD23 LEU 62 3HD2 LEU 62 5.352 -11.260 -26.376 483 H LYS 63 H LYS 63 7.246 -10.471 -29.912 484 HA LYS 63 HA LYS 63 9.974 -9.648 -30.865 485 HB2 LYS 63 1HB LYS 63 8.797 -11.133 -32.503 486 HB3 LYS 63 2HB LYS 63 7.487 -9.946 -32.589 487 HG2 LYS 63 1HG LYS 63 9.077 -8.256 -33.434 488 HG3 LYS 63 2HG LYS 63 10.395 -9.439 -33.310 489 HD2 LYS 63 1HD LYS 63 9.212 -10.903 -34.934 490 HD3 LYS 63 2HD LYS 63 7.923 -9.691 -35.067 491 HE2 LYS 63 1HE LYS 63 9.420 -9.411 -36.947 492 HE3 LYS 63 2HE LYS 63 9.623 -8.025 -35.857 493 HZ1 LYS 63 1HZ LYS 63 11.427 -10.381 -35.988 494 HZ2 LYS 63 2HZ LYS 63 11.618 -9.091 -34.979 495 HZ3 LYS 63 3HZ LYS 63 11.754 -8.889 -36.610 496 H ILE 64 H ILE 64 10.306 -7.593 -30.394 497 HA ILE 64 HA ILE 64 8.240 -5.932 -29.326 498 HB ILE 64 HB ILE 64 11.020 -5.074 -30.276 499 HG12 ILE 64 1HG1 ILE 64 11.021 -5.404 -27.472 500 HG13 ILE 64 2HG1 ILE 64 10.254 -6.862 -28.099 501 HG21 ILE 64 1HG2 ILE 64 9.120 -3.892 -28.179 502 HG22 ILE 64 2HG2 ILE 64 10.800 -3.360 -28.438 503 HG23 ILE 64 3HG2 ILE 64 9.599 -3.148 -29.720 504 HD11 ILE 64 1HD1 ILE 64 12.938 -5.773 -29.065 505 HD12 ILE 64 2HD1 ILE 64 12.746 -7.048 -27.849 506 HD13 ILE 64 3HD1 ILE 64 12.199 -7.329 -29.514 507 H LEU 65 H LEU 65 7.018 -4.348 -30.164 508 HA LEU 65 HA LEU 65 7.341 -3.591 -33.039 509 HB2 LEU 65 1HB LEU 65 5.286 -2.824 -30.908 510 HB3 LEU 65 2HB LEU 65 5.359 -2.126 -32.519 511 HG LEU 65 HG LEU 65 5.036 -4.568 -33.368 512 HD11 LEU 65 1HD1 LEU 65 3.569 -5.909 -31.833 513 HD12 LEU 65 2HD1 LEU 65 3.982 -4.790 -30.515 514 HD13 LEU 65 3HD1 LEU 65 5.247 -5.784 -31.273 515 HD21 LEU 65 1HD2 LEU 65 3.439 -2.741 -33.664 516 HD22 LEU 65 2HD2 LEU 65 2.823 -2.977 -32.014 517 HD23 LEU 65 3HD2 LEU 65 2.582 -4.237 -33.244 518 H VAL 66 H VAL 66 9.042 -2.208 -33.201 519 HA VAL 66 HA VAL 66 10.035 -0.897 -30.836 520 HB VAL 66 HB VAL 66 11.011 -0.600 -33.717 521 HG11 VAL 66 1HG1 VAL 66 12.404 -0.117 -31.035 522 HG12 VAL 66 2HG1 VAL 66 13.186 -0.040 -32.629 523 HG13 VAL 66 3HG1 VAL 66 11.928 1.133 -32.213 524 HG21 VAL 66 1HG2 VAL 66 11.791 -2.612 -31.550 525 HG22 VAL 66 2HG2 VAL 66 11.012 -2.977 -33.108 526 HG23 VAL 66 3HG2 VAL 66 12.676 -2.369 -33.073 527 H GLY 67 H GLY 67 8.508 0.556 -30.147 528 HA2 GLY 67 1HA GLY 67 8.103 2.964 -31.873 529 HA3 GLY 67 2HA GLY 67 7.120 2.515 -30.463 530 H MET 68 H MET 68 10.621 2.271 -30.579 531 HA MET 68 HA MET 68 10.846 3.774 -28.101 532 HB2 MET 68 1HB MET 68 12.935 2.581 -29.961 533 HB3 MET 68 2HB MET 68 13.267 3.251 -28.358 534 HG2 MET 68 1HG MET 68 11.857 1.545 -27.322 535 HG3 MET 68 2HG MET 68 11.442 0.894 -28.915 536 HE1 MET 68 1HE MET 68 14.069 1.133 -26.056 537 HE2 MET 68 2HE MET 68 15.550 0.480 -26.796 538 HE3 MET 68 3HE MET 68 14.946 2.080 -27.282 539 H TYR 69 H TYR 69 10.806 4.712 -31.338 540 HA TYR 69 HA TYR 69 11.418 6.574 -32.509 541 HB2 TYR 69 1HB TYR 69 10.521 7.637 -30.266 542 HB3 TYR 69 2HB TYR 69 12.221 8.036 -30.000 543 HD1 TYR 69 HD1 TYR 69 9.446 8.388 -32.526 544 HD2 TYR 69 HD2 TYR 69 13.122 10.007 -30.978 545 HE1 TYR 69 HE1 TYR 69 9.175 10.408 -33.973 546 HE2 TYR 69 HE2 TYR 69 12.856 12.002 -32.443 547 HH TYR 69 HH TYR 69 11.571 13.053 -34.010 548 H ASP 70 H ASP 70 13.562 8.304 -32.459 549 HA ASP 70 HA ASP 70 15.951 6.734 -31.731 550 HB2 ASP 70 1HB ASP 70 15.054 6.112 -34.126 551 HB3 ASP 70 2HB ASP 70 15.726 7.682 -34.589 552 H LYS 71 H LYS 71 17.926 7.998 -32.639 553 HA LYS 71 HA LYS 71 17.942 10.591 -31.349 554 HB2 LYS 71 1HB LYS 71 19.926 9.345 -33.290 555 HB3 LYS 71 2HB LYS 71 20.281 10.639 -32.145 556 HG2 LYS 71 1HG LYS 71 20.424 9.179 -30.342 557 HG3 LYS 71 2HG LYS 71 19.283 8.020 -31.045 558 HD2 LYS 71 1HD LYS 71 21.005 7.508 -32.813 559 HD3 LYS 71 2HD LYS 71 22.165 8.466 -31.867 560 HE2 LYS 71 1HE LYS 71 21.848 6.967 -29.946 561 HE3 LYS 71 2HE LYS 71 20.595 6.068 -30.837 562 HZ1 LYS 71 1HZ LYS 71 22.263 5.451 -32.462 563 HZ2 LYS 71 2HZ LYS 71 22.735 4.956 -30.961 564 HZ3 LYS 71 3HZ LYS 71 23.437 6.281 -31.651 565 H LYS 72 H LYS 72 18.692 12.574 -32.416 566 HA LYS 72 HA LYS 72 17.333 13.160 -34.927 567 HB2 LYS 72 1HB LYS 72 19.497 14.634 -33.361 568 HB3 LYS 72 2HB LYS 72 18.708 15.270 -34.809 569 HG2 LYS 72 1HG LYS 72 16.549 15.322 -33.662 570 HG3 LYS 72 2HG LYS 72 17.261 14.551 -32.234 571 HD2 LYS 72 1HD LYS 72 17.107 16.888 -31.761 572 HD3 LYS 72 2HD LYS 72 18.819 16.513 -32.022 573 HE2 LYS 72 1HE LYS 72 18.632 17.372 -34.363 574 HE3 LYS 72 2HE LYS 72 16.926 17.766 -34.069 575 HZ1 LYS 72 1HZ LYS 72 19.236 18.938 -32.621 576 HZ2 LYS 72 2HZ LYS 72 17.651 19.308 -32.343 577 HZ3 LYS 72 3HZ LYS 72 18.350 19.696 -33.788 578 HA PRO 73 HA PRO 73 20.664 11.459 -37.278 579 HB2 PRO 73 1HB PRO 73 20.477 12.764 -39.674 580 HB3 PRO 73 2HB PRO 73 19.273 11.539 -39.156 581 HG2 PRO 73 1HG PRO 73 19.132 14.540 -38.918 582 HG3 PRO 73 2HG PRO 73 17.925 13.408 -39.609 583 HD2 PRO 73 1HD PRO 73 17.711 14.313 -37.077 584 HD3 PRO 73 2HD PRO 73 17.291 12.612 -37.490 585 H ALA 74 H ALA 74 22.798 11.947 -37.951 586 HA ALA 74 HA ALA 74 23.757 14.709 -38.023 587 HB1 ALA 74 1HB ALA 74 25.434 14.337 -36.215 588 HB2 ALA 74 2HB ALA 74 23.782 14.236 -35.562 589 HB3 ALA 74 3HB ALA 74 24.712 12.747 -35.865 590 H GLY 75 H GLY 75 26.122 14.602 -38.721 591 HA2 GLY 75 1HA GLY 75 27.386 12.170 -39.434 592 HA3 GLY 75 2HA GLY 75 26.449 12.755 -40.834 593 H GLU 76 H GLU 76 28.930 12.844 -41.508 594 HA GLU 76 HA GLU 76 29.701 15.694 -41.241 595 HB2 GLU 76 1HB GLU 76 31.032 14.258 -39.628 596 HB3 GLU 76 2HB GLU 76 31.681 13.386 -41.024 597 HG2 GLU 76 1HG GLU 76 32.772 15.385 -41.834 598 HG3 GLU 76 2HG GLU 76 31.936 16.386 -40.638 599 H PHE 77 H PHE 77 31.100 16.264 -43.167 600 HA PHE 77 HA PHE 77 30.315 14.532 -45.476 601 HB2 PHE 77 1HB PHE 77 29.340 16.972 -44.941 602 HB3 PHE 77 2HB PHE 77 30.789 17.457 -45.831 603 HD1 PHE 77 HD1 PHE 77 27.636 15.475 -46.019 604 HD2 PHE 77 HD2 PHE 77 30.912 17.183 -48.225 605 HE1 PHE 77 HE1 PHE 77 26.433 15.011 -48.151 606 HE2 PHE 77 HE2 PHE 77 29.719 16.724 -50.364 607 HZ PHE 77 HZ PHE 77 27.474 15.635 -50.331 608 H ILE 78 H ILE 78 32.961 15.256 -43.738 609 HA ILE 78 HA ILE 78 34.741 15.150 -46.133 610 HB ILE 78 HB ILE 78 36.448 16.416 -44.811 611 HG12 ILE 78 1HG1 ILE 78 34.177 17.132 -42.914 612 HG13 ILE 78 2HG1 ILE 78 35.351 15.866 -42.561 613 HG21 ILE 78 1HG2 ILE 78 34.932 17.550 -46.487 614 HG22 ILE 78 2HG2 ILE 78 33.851 18.005 -45.151 615 HG23 ILE 78 3HG2 ILE 78 35.511 18.643 -45.213 616 HD11 ILE 78 1HD1 ILE 78 35.953 18.824 -42.928 617 HD12 ILE 78 2HD1 ILE 78 36.015 17.886 -41.420 618 HD13 ILE 78 3HD1 ILE 78 37.189 17.558 -42.714 619 H VAL 79 H VAL 79 36.801 14.036 -45.603 620 HA VAL 79 HA VAL 79 37.852 12.129 -44.965 621 HB VAL 79 HB VAL 79 36.532 12.135 -42.222 622 HG11 VAL 79 1HG1 VAL 79 38.140 10.318 -42.779 623 HG12 VAL 79 2HG1 VAL 79 39.374 11.530 -43.194 624 HG13 VAL 79 3HG1 VAL 79 38.795 11.379 -41.518 625 HG21 VAL 79 1HG2 VAL 79 38.357 13.741 -41.485 626 HG22 VAL 79 2HG2 VAL 79 38.697 14.066 -43.202 627 HG23 VAL 79 3HG2 VAL 79 37.115 14.480 -42.498 628 H THR 80 H THR 80 35.184 12.233 -46.161 629 HA THR 80 HA THR 80 33.965 9.638 -45.362 630 HB THR 80 HB THR 80 32.247 10.375 -47.121 631 HG1 THR 80 HG1 THR 80 32.469 12.764 -47.482 632 HG21 THR 80 1HG2 THR 80 31.195 12.064 -45.708 633 HG22 THR 80 2HG2 THR 80 32.733 12.374 -44.876 634 HG23 THR 80 3HG2 THR 80 31.917 10.809 -44.681 635 H ASP 81 H ASP 81 36.534 10.549 -46.927 636 HA ASP 81 HA ASP 81 36.344 9.671 -49.611 637 HB2 ASP 81 1HB ASP 81 38.800 9.958 -47.807 638 HB3 ASP 81 2HB ASP 81 38.811 9.952 -49.573 639 HXT ASP 81 H02 ASP 81 35.256 7.870 -48.771 Start of MODEL 29 1 H2 GLY 1 2H0 GLY 1 6.211 11.982 -22.092 2 H GLY 1 1H0 GLY 1 6.384 10.967 -20.819 3 HA2 GLY 1 1HA GLY 1 8.572 11.738 -21.227 4 HA3 GLY 1 2HA GLY 1 7.972 13.408 -21.414 5 H SER 2 H SER 2 6.149 12.775 -19.182 6 HA SER 2 HA SER 2 7.787 13.902 -17.030 7 HB2 SER 2 1HB SER 2 5.408 14.559 -17.458 8 HB3 SER 2 2HB SER 2 4.902 12.929 -16.963 9 HG SER 2 HG SER 2 6.130 13.444 -14.953 10 H MET 3 H MET 3 7.359 10.791 -18.137 11 HA MET 3 HA MET 3 8.321 9.635 -15.595 12 HB2 MET 3 1HB MET 3 5.803 9.369 -15.628 13 HB3 MET 3 2HB MET 3 5.958 8.504 -17.162 14 HG2 MET 3 1HG MET 3 7.304 6.764 -16.031 15 HG3 MET 3 2HG MET 3 7.121 7.629 -14.495 16 HE1 MET 3 1HE MET 3 4.771 4.457 -14.099 17 HE2 MET 3 2HE MET 3 6.298 4.507 -15.007 18 HE3 MET 3 3HE MET 3 6.170 5.329 -13.432 19 H LYS 4 H LYS 4 9.576 7.712 -16.074 20 HA LYS 4 HA LYS 4 9.952 7.158 -18.983 21 HB2 LYS 4 1HB LYS 4 12.068 7.767 -16.908 22 HB3 LYS 4 2HB LYS 4 12.415 6.781 -18.336 23 HG2 LYS 4 1HG LYS 4 11.619 8.632 -19.782 24 HG3 LYS 4 2HG LYS 4 11.434 9.650 -18.341 25 HD2 LYS 4 1HD LYS 4 13.828 9.405 -17.838 26 HD3 LYS 4 2HD LYS 4 14.029 8.329 -19.234 27 HE2 LYS 4 1HE LYS 4 13.107 11.229 -19.381 28 HE3 LYS 4 2HE LYS 4 14.764 10.668 -19.697 29 HZ1 LYS 4 1HZ LYS 4 12.356 9.855 -21.230 30 HZ2 LYS 4 2HZ LYS 4 13.892 9.323 -21.520 31 HZ3 LYS 4 3HZ LYS 4 13.511 10.912 -21.749 32 H TYR 5 H TYR 5 9.220 5.244 -19.255 33 HA TYR 5 HA TYR 5 10.604 2.997 -17.992 34 HB2 TYR 5 1HB TYR 5 8.590 1.726 -17.556 35 HB3 TYR 5 2HB TYR 5 8.513 3.206 -16.600 36 HD1 TYR 5 HD1 TYR 5 6.985 5.099 -17.404 37 HD2 TYR 5 HD2 TYR 5 6.937 1.173 -19.142 38 HE1 TYR 5 HE1 TYR 5 4.745 5.563 -18.396 39 HE2 TYR 5 HE2 TYR 5 4.719 1.634 -20.138 40 HH TYR 5 HH TYR 5 3.097 3.265 -20.539 41 H LEU 6 H LEU 6 9.839 1.080 -19.692 42 HA LEU 6 HA LEU 6 10.717 2.202 -22.154 43 HB2 LEU 6 1HB LEU 6 9.421 -0.464 -21.560 44 HB3 LEU 6 2HB LEU 6 10.181 -0.056 -23.100 45 HG LEU 6 HG LEU 6 11.652 0.019 -20.445 46 HD11 LEU 6 1HD1 LEU 6 11.529 -2.173 -22.525 47 HD12 LEU 6 2HD1 LEU 6 10.789 -2.207 -20.905 48 HD13 LEU 6 3HD1 LEU 6 12.552 -2.134 -21.067 49 HD21 LEU 6 1HD2 LEU 6 13.659 -0.110 -21.907 50 HD22 LEU 6 2HD2 LEU 6 12.711 1.360 -22.192 51 HD23 LEU 6 3HD2 LEU 6 12.605 0.005 -23.338 52 H ASN 7 H ASN 7 7.438 1.139 -21.275 53 HA ASN 7 HA ASN 7 5.433 1.358 -22.346 54 HB2 ASN 7 1HB ASN 7 6.127 3.765 -21.754 55 HB3 ASN 7 2HB ASN 7 6.472 3.962 -23.475 56 HD21 ASN 7 1HD2 ASN 7 3.164 4.922 -23.932 57 HD22 ASN 7 2HD2 ASN 7 4.864 5.269 -24.126 58 H VAL 8 H VAL 8 7.132 -0.253 -23.805 59 HA VAL 8 HA VAL 8 6.439 0.458 -26.635 60 HB VAL 8 HB VAL 8 8.947 0.376 -26.075 61 HG11 VAL 8 1HG1 VAL 8 8.821 -1.529 -24.459 62 HG12 VAL 8 2HG1 VAL 8 8.460 -2.622 -25.814 63 HG13 VAL 8 3HG1 VAL 8 10.023 -1.778 -25.742 64 HG21 VAL 8 1HG2 VAL 8 9.561 -0.813 -28.096 65 HG22 VAL 8 2HG2 VAL 8 8.016 -1.690 -28.111 66 HG23 VAL 8 3HG2 VAL 8 8.049 0.070 -28.378 67 H LEU 9 H LEU 9 5.861 -1.655 -27.872 68 HA LEU 9 HA LEU 9 4.787 -3.672 -25.966 69 HB2 LEU 9 1HB LEU 9 2.780 -3.779 -27.606 70 HB3 LEU 9 2HB LEU 9 2.790 -2.641 -26.281 71 HG LEU 9 HG LEU 9 3.595 -1.736 -29.042 72 HD11 LEU 9 1HD1 LEU 9 1.433 -2.926 -29.244 73 HD12 LEU 9 2HD1 LEU 9 1.227 -1.178 -29.448 74 HD13 LEU 9 3HD1 LEU 9 0.770 -1.954 -27.913 75 HD21 LEU 9 1HD2 LEU 9 3.935 -0.133 -27.160 76 HD22 LEU 9 2HD2 LEU 9 2.248 -0.343 -26.667 77 HD23 LEU 9 3HD2 LEU 9 2.636 0.423 -28.226 78 H ALA 10 H ALA 10 4.269 -5.706 -26.918 79 HA ALA 10 HA ALA 10 5.762 -6.247 -29.439 80 HB1 ALA 10 1HB ALA 10 7.338 -6.475 -27.516 81 HB2 ALA 10 2HB ALA 10 6.241 -7.674 -26.790 82 HB3 ALA 10 3HB ALA 10 7.035 -8.016 -28.345 83 H LYS 11 H LYS 11 5.211 -8.197 -30.440 84 HA LYS 11 HA LYS 11 2.590 -9.357 -29.561 85 HB2 LYS 11 1HB LYS 11 2.834 -8.582 -31.945 86 HB3 LYS 11 2HB LYS 11 4.164 -9.730 -32.145 87 HG2 LYS 11 1HG LYS 11 2.060 -11.286 -31.120 88 HG3 LYS 11 2HG LYS 11 1.264 -10.185 -32.237 89 HD2 LYS 11 1HD LYS 11 3.775 -11.624 -33.100 90 HD3 LYS 11 2HD LYS 11 2.241 -12.504 -33.058 91 HE2 LYS 11 1HE LYS 11 2.656 -9.887 -34.548 92 HE3 LYS 11 2HE LYS 11 2.769 -11.497 -35.292 93 HZ1 LYS 11 1HZ LYS 11 0.350 -10.448 -33.917 94 HZ2 LYS 11 2HZ LYS 11 0.470 -11.894 -34.698 95 HZ3 LYS 11 3HZ LYS 11 0.554 -10.492 -35.558 96 H ALA 12 H ALA 12 2.549 -11.433 -28.740 97 HA ALA 12 HA ALA 12 5.106 -12.748 -28.263 98 HB1 ALA 12 1HB ALA 12 3.589 -14.594 -27.405 99 HB2 ALA 12 2HB ALA 12 3.439 -13.026 -26.594 100 HB3 ALA 12 3HB ALA 12 2.225 -13.523 -27.792 101 H LEU 13 H LEU 13 6.023 -14.373 -29.322 102 HA LEU 13 HA LEU 13 4.890 -15.149 -31.964 103 HB2 LEU 13 1HB LEU 13 7.557 -15.672 -30.606 104 HB3 LEU 13 2HB LEU 13 7.137 -16.233 -32.221 105 HG LEU 13 HG LEU 13 7.261 -13.302 -31.432 106 HD11 LEU 13 1HD1 LEU 13 9.464 -14.361 -31.175 107 HD12 LEU 13 2HD1 LEU 13 9.445 -13.287 -32.587 108 HD13 LEU 13 3HD1 LEU 13 9.340 -15.049 -32.813 109 HD21 LEU 13 1HD2 LEU 13 7.107 -14.738 -34.124 110 HD22 LEU 13 2HD2 LEU 13 7.403 -12.998 -33.925 111 HD23 LEU 13 3HD2 LEU 13 5.860 -13.695 -33.396 112 H TYR 14 H TYR 14 5.480 -16.330 -28.740 113 HA TYR 14 HA TYR 14 4.464 -19.025 -29.536 114 HB2 TYR 14 1HB TYR 14 6.486 -18.407 -27.372 115 HB3 TYR 14 2HB TYR 14 5.911 -20.007 -27.845 116 HD1 TYR 14 HD1 TYR 14 6.725 -21.052 -29.963 117 HD2 TYR 14 HD2 TYR 14 8.129 -17.196 -28.705 118 HE1 TYR 14 HE1 TYR 14 8.615 -21.195 -31.592 119 HE2 TYR 14 HE2 TYR 14 10.027 -17.349 -30.295 120 HH TYR 14 HH TYR 14 10.487 -20.174 -32.432 121 H ASP 15 H ASP 15 3.343 -20.118 -27.763 122 HA ASP 15 HA ASP 15 1.897 -18.179 -26.030 123 HB2 ASP 15 1HB ASP 15 0.244 -20.032 -25.810 124 HB3 ASP 15 2HB ASP 15 0.447 -19.466 -27.469 125 H ASN 16 H ASN 16 1.306 -18.974 -23.853 126 HA ASN 16 HA ASN 16 3.157 -20.938 -22.654 127 HB2 ASN 16 1HB ASN 16 4.221 -18.583 -22.687 128 HB3 ASN 16 2HB ASN 16 2.919 -18.099 -21.595 129 HD21 ASN 16 1HD2 ASN 16 4.694 -19.165 -18.815 130 HD22 ASN 16 2HD2 ASN 16 3.578 -18.041 -19.570 131 H VAL 17 H VAL 17 2.460 -21.426 -20.432 132 HA VAL 17 HA VAL 17 -0.189 -20.309 -19.680 133 HB VAL 17 HB VAL 17 -0.654 -22.606 -20.495 134 HG11 VAL 17 1HG1 VAL 17 1.420 -23.556 -18.465 135 HG12 VAL 17 2HG1 VAL 17 0.355 -24.593 -19.440 136 HG13 VAL 17 3HG1 VAL 17 1.592 -23.603 -20.235 137 HG21 VAL 17 1HG2 VAL 17 -0.686 -22.488 -17.446 138 HG22 VAL 17 2HG2 VAL 17 -1.894 -21.749 -18.527 139 HG23 VAL 17 3HG2 VAL 17 -1.708 -23.514 -18.480 140 H ALA 18 H ALA 18 -0.105 -19.586 -17.589 141 HA ALA 18 HA ALA 18 2.612 -19.639 -16.405 142 HB1 ALA 18 1HB ALA 18 1.674 -17.427 -16.780 143 HB2 ALA 18 2HB ALA 18 0.182 -17.869 -15.911 144 HB3 ALA 18 3HB ALA 18 1.716 -17.741 -15.033 145 H GLU 19 H GLU 19 3.032 -20.357 -14.370 146 HA GLU 19 HA GLU 19 0.687 -21.417 -12.828 147 HB2 GLU 19 1HB GLU 19 2.012 -23.217 -11.979 148 HB3 GLU 19 2HB GLU 19 2.032 -23.272 -13.740 149 HG2 GLU 19 1HG GLU 19 4.296 -22.283 -13.748 150 HG3 GLU 19 2HG GLU 19 4.272 -22.219 -11.977 151 H SER 20 H SER 20 3.629 -19.515 -12.872 152 HA SER 20 HA SER 20 3.598 -19.213 -9.937 153 HB2 SER 20 1HB SER 20 5.203 -17.807 -12.100 154 HB3 SER 20 2HB SER 20 5.441 -17.605 -10.355 155 HG SER 20 HG SER 20 5.674 -20.039 -11.817 156 HA PRO 21 HA PRO 21 0.721 -15.922 -10.249 157 HB2 PRO 21 1HB PRO 21 1.187 -14.398 -8.032 158 HB3 PRO 21 2HB PRO 21 0.483 -16.046 -7.937 159 HG2 PRO 21 1HG PRO 21 3.349 -15.198 -7.580 160 HG3 PRO 21 2HG PRO 21 2.335 -16.218 -6.511 161 HD2 PRO 21 1HD PRO 21 4.060 -17.304 -8.293 162 HD3 PRO 21 2HD PRO 21 2.462 -18.061 -7.958 163 H ASP 22 H ASP 22 4.131 -15.180 -10.016 164 HA ASP 22 HA ASP 22 3.827 -12.376 -10.808 165 HB2 ASP 22 1HB ASP 22 6.237 -14.215 -10.513 166 HB3 ASP 22 2HB ASP 22 6.340 -12.494 -10.913 167 H GLU 23 H GLU 23 3.558 -15.285 -12.448 168 HA GLU 23 HA GLU 23 5.051 -14.437 -14.852 169 HB2 GLU 23 1HB GLU 23 5.256 -16.700 -13.791 170 HB3 GLU 23 2HB GLU 23 3.560 -16.983 -14.182 171 HG2 GLU 23 1HG GLU 23 4.143 -16.672 -16.585 172 HG3 GLU 23 2HG GLU 23 5.837 -16.552 -16.085 173 H LEU 24 H LEU 24 4.055 -14.054 -16.848 174 HA LEU 24 HA LEU 24 1.107 -13.691 -16.696 175 HB2 LEU 24 1HB LEU 24 3.301 -12.394 -18.109 176 HB3 LEU 24 2HB LEU 24 2.003 -12.853 -19.208 177 HG LEU 24 HG LEU 24 1.665 -11.147 -16.722 178 HD11 LEU 24 1HD1 LEU 24 1.354 -9.309 -18.315 179 HD12 LEU 24 2HD1 LEU 24 1.675 -10.417 -19.672 180 HD13 LEU 24 3HD1 LEU 24 2.957 -10.046 -18.492 181 HD21 LEU 24 1HD2 LEU 24 -0.588 -10.633 -17.756 182 HD22 LEU 24 2HD2 LEU 24 -0.418 -12.279 -17.128 183 HD23 LEU 24 3HD2 LEU 24 -0.308 -11.986 -18.879 184 H SER 25 H SER 25 -0.313 -14.932 -17.767 185 HA SER 25 HA SER 25 0.728 -17.144 -19.434 186 HB2 SER 25 1HB SER 25 -1.111 -17.441 -17.699 187 HB3 SER 25 2HB SER 25 -2.163 -16.475 -18.748 188 HG SER 25 HG SER 25 -1.618 -18.073 -20.422 189 H PHE 26 H PHE 26 1.536 -15.857 -21.165 190 HA PHE 26 HA PHE 26 -0.445 -14.257 -22.706 191 HB2 PHE 26 1HB PHE 26 1.541 -13.536 -23.998 192 HB3 PHE 26 2HB PHE 26 1.708 -13.199 -22.271 193 HD1 PHE 26 HD1 PHE 26 3.294 -14.422 -20.885 194 HD2 PHE 26 HD2 PHE 26 2.962 -15.234 -25.093 195 HE1 PHE 26 HE1 PHE 26 5.417 -15.693 -20.791 196 HE2 PHE 26 HE2 PHE 26 5.117 -16.479 -25.026 197 HZ PHE 26 HZ PHE 26 6.344 -16.714 -22.861 198 H ARG 27 H ARG 27 -0.529 -14.575 -25.084 199 HA ARG 27 HA ARG 27 0.074 -17.400 -25.833 200 HB2 ARG 27 1HB ARG 27 -2.449 -15.860 -26.439 201 HB3 ARG 27 2HB ARG 27 -2.044 -17.452 -27.089 202 HG2 ARG 27 1HG ARG 27 -2.016 -18.398 -24.810 203 HG3 ARG 27 2HG ARG 27 -2.443 -16.810 -24.140 204 HD2 ARG 27 1HD ARG 27 -4.103 -18.335 -26.155 205 HD3 ARG 27 2HD ARG 27 -4.378 -18.346 -24.398 206 HE ARG 27 HE ARG 27 -4.282 -15.642 -25.224 207 HH11 ARG 27 1HH1 ARG 27 -6.417 -18.423 -25.671 208 HH12 ARG 27 2HH1 ARG 27 -7.821 -17.418 -25.904 209 HH21 ARG 27 1HH2 ARG 27 -6.091 -14.431 -25.530 210 HH22 ARG 27 2HH2 ARG 27 -7.639 -15.186 -25.816 211 H LYS 28 H LYS 28 0.418 -17.780 -28.034 212 HA LYS 28 HA LYS 28 1.903 -15.759 -29.375 213 HB2 LYS 28 1HB LYS 28 1.823 -17.304 -31.333 214 HB3 LYS 28 2HB LYS 28 2.343 -18.057 -29.836 215 HG2 LYS 28 1HG LYS 28 -0.097 -18.869 -29.582 216 HG3 LYS 28 2HG LYS 28 -0.258 -18.473 -31.303 217 HD2 LYS 28 1HD LYS 28 1.530 -20.015 -31.875 218 HD3 LYS 28 2HD LYS 28 1.963 -20.209 -30.167 219 HE2 LYS 28 1HE LYS 28 -0.521 -21.048 -29.907 220 HE3 LYS 28 2HE LYS 28 -0.394 -21.355 -31.653 221 HZ1 LYS 28 1HZ LYS 28 0.273 -23.286 -30.332 222 HZ2 LYS 28 2HZ LYS 28 1.431 -22.408 -29.546 223 HZ3 LYS 28 3HZ LYS 28 1.579 -22.717 -31.166 224 H GLY 29 H GLY 29 1.441 -14.287 -30.853 225 HA2 GLY 29 1HA GLY 29 0.103 -13.235 -32.506 226 HA3 GLY 29 2HA GLY 29 -1.294 -14.186 -31.995 227 H ASP 30 H ASP 30 -0.720 -13.525 -29.095 228 HA ASP 30 HA ASP 30 -2.406 -11.182 -29.002 229 HB2 ASP 30 1HB ASP 30 -1.984 -13.311 -27.371 230 HB3 ASP 30 2HB ASP 30 -0.994 -12.098 -26.543 231 H ILE 31 H ILE 31 -1.894 -9.292 -27.595 232 HA ILE 31 HA ILE 31 0.901 -8.349 -28.183 233 HB ILE 31 HB ILE 31 -1.646 -6.658 -28.068 234 HG12 ILE 31 1HG1 ILE 31 -1.840 -8.185 -29.968 235 HG13 ILE 31 2HG1 ILE 31 -1.625 -6.519 -30.492 236 HG21 ILE 31 1HG2 ILE 31 0.314 -5.317 -27.586 237 HG22 ILE 31 2HG2 ILE 31 1.218 -6.026 -28.943 238 HG23 ILE 31 3HG2 ILE 31 -0.170 -4.953 -29.253 239 HD11 ILE 31 1HD1 ILE 31 0.533 -8.653 -30.496 240 HD12 ILE 31 2HD1 ILE 31 -0.374 -8.076 -31.905 241 HD13 ILE 31 3HD1 ILE 31 0.731 -6.977 -31.056 242 H MET 32 H MET 32 2.047 -7.605 -26.462 243 HA MET 32 HA MET 32 0.505 -6.716 -24.058 244 HB2 MET 32 1HB MET 32 2.229 -7.794 -22.625 245 HB3 MET 32 2HB MET 32 1.220 -8.929 -23.508 246 HG2 MET 32 1HG MET 32 3.436 -8.535 -25.186 247 HG3 MET 32 2HG MET 32 4.107 -8.609 -23.546 248 HE1 MET 32 1HE MET 32 0.936 -10.337 -25.306 249 HE2 MET 32 2HE MET 32 2.285 -10.497 -26.450 250 HE3 MET 32 3HE MET 32 1.625 -11.937 -25.644 251 H THR 33 H THR 33 1.396 -5.112 -22.851 252 HA THR 33 HA THR 33 3.383 -3.446 -24.265 253 HB THR 33 HB THR 33 2.004 -2.957 -21.583 254 HG1 THR 33 HG1 THR 33 0.575 -1.686 -22.890 255 HG21 THR 33 1HG2 THR 33 3.965 -1.503 -21.986 256 HG22 THR 33 2HG2 THR 33 2.460 -0.572 -22.114 257 HG23 THR 33 3HG2 THR 33 3.321 -1.066 -23.588 258 H VAL 34 H VAL 34 5.504 -3.290 -23.693 259 HA VAL 34 HA VAL 34 6.434 -4.938 -21.371 260 HB VAL 34 HB VAL 34 7.950 -3.748 -23.747 261 HG11 VAL 34 1HG1 VAL 34 8.935 -5.393 -21.381 262 HG12 VAL 34 2HG1 VAL 34 9.885 -5.102 -22.859 263 HG13 VAL 34 3HG1 VAL 34 9.419 -3.743 -21.822 264 HG21 VAL 34 1HG2 VAL 34 8.239 -6.018 -24.522 265 HG22 VAL 34 2HG2 VAL 34 7.507 -6.683 -23.048 266 HG23 VAL 34 3HG2 VAL 34 6.507 -5.789 -24.222 267 H LEU 35 H LEU 35 7.075 -3.950 -19.590 268 HA LEU 35 HA LEU 35 7.151 -0.974 -19.601 269 HB2 LEU 35 1HB LEU 35 6.968 -2.929 -17.287 270 HB3 LEU 35 2HB LEU 35 6.759 -1.184 -17.202 271 HG LEU 35 HG LEU 35 4.904 -3.105 -18.668 272 HD11 LEU 35 1HD1 LEU 35 3.354 -2.665 -16.799 273 HD12 LEU 35 2HD1 LEU 35 4.613 -1.707 -15.984 274 HD13 LEU 35 3HD1 LEU 35 4.847 -3.449 -16.248 275 HD21 LEU 35 1HD2 LEU 35 4.621 -0.139 -18.036 276 HD22 LEU 35 2HD2 LEU 35 3.349 -1.173 -18.730 277 HD23 LEU 35 3HD2 LEU 35 4.832 -0.861 -19.650 278 H GLU 36 H GLU 36 8.887 -3.790 -18.234 279 HA GLU 36 HA GLU 36 11.421 -2.196 -18.194 280 HB2 GLU 36 1HB GLU 36 9.987 -3.592 -15.958 281 HB3 GLU 36 2HB GLU 36 11.735 -3.765 -16.024 282 HG2 GLU 36 1HG GLU 36 11.321 -1.955 -14.577 283 HG3 GLU 36 2HG GLU 36 11.927 -1.259 -16.088 284 H ARG 37 H ARG 37 13.337 -3.745 -17.785 285 HA ARG 37 HA ARG 37 12.847 -6.504 -18.818 286 HB2 ARG 37 1HB ARG 37 15.126 -4.687 -19.679 287 HB3 ARG 37 2HB ARG 37 14.936 -6.389 -20.112 288 HG2 ARG 37 1HG ARG 37 12.751 -5.729 -21.247 289 HG3 ARG 37 2HG ARG 37 13.254 -4.054 -21.011 290 HD2 ARG 37 1HD ARG 37 14.795 -6.185 -22.509 291 HD3 ARG 37 2HD ARG 37 13.892 -4.844 -23.245 292 HE ARG 37 HE ARG 37 15.659 -3.602 -21.527 293 HH11 ARG 37 1HH1 ARG 37 16.117 -5.914 -24.154 294 HH12 ARG 37 2HH1 ARG 37 17.721 -5.330 -24.512 295 HH21 ARG 37 1HH2 ARG 37 17.704 -2.907 -22.045 296 HH22 ARG 37 2HH2 ARG 37 18.598 -3.656 -23.336 297 H ASP 38 H ASP 38 14.483 -7.984 -18.038 298 HA ASP 38 HA ASP 38 15.714 -8.900 -16.361 299 HB2 ASP 38 1HB ASP 38 17.437 -7.303 -17.353 300 HB3 ASP 38 2HB ASP 38 17.086 -6.226 -15.991 301 H THR 39 H THR 39 13.235 -8.059 -15.751 302 HA THR 39 HA THR 39 13.126 -6.347 -13.433 303 HB THR 39 HB THR 39 11.302 -6.516 -15.098 304 HG1 THR 39 HG1 THR 39 10.794 -7.220 -12.408 305 HG21 THR 39 1HG2 THR 39 9.798 -8.504 -15.073 306 HG22 THR 39 2HG2 THR 39 10.957 -9.352 -14.038 307 HG23 THR 39 3HG2 THR 39 11.415 -8.885 -15.693 308 H GLN 40 H GLN 40 14.394 -9.341 -13.537 309 HA GLN 40 HA GLN 40 13.516 -9.984 -10.751 310 HB2 GLN 40 1HB GLN 40 13.373 -11.708 -13.218 311 HB3 GLN 40 2HB GLN 40 13.689 -12.466 -11.659 312 HG2 GLN 40 1HG GLN 40 11.283 -10.728 -12.244 313 HG3 GLN 40 2HG GLN 40 11.303 -12.495 -12.314 314 HE21 GLN 40 1HE2 GLN 40 10.365 -10.865 -8.895 315 HE22 GLN 40 2HE2 GLN 40 10.171 -10.159 -10.480 316 H GLY 41 H GLY 41 16.120 -9.300 -12.745 317 HA2 GLY 41 1HA GLY 41 18.399 -9.654 -12.295 318 HA3 GLY 41 2HA GLY 41 17.979 -10.870 -11.061 319 H LEU 42 H LEU 42 15.980 -11.505 -13.533 320 HA LEU 42 HA LEU 42 17.756 -13.546 -14.757 321 HB2 LEU 42 1HB LEU 42 14.755 -13.064 -14.991 322 HB3 LEU 42 2HB LEU 42 15.636 -14.387 -15.741 323 HG LEU 42 HG LEU 42 15.318 -14.020 -12.745 324 HD11 LEU 42 1HD1 LEU 42 13.151 -14.393 -13.864 325 HD12 LEU 42 2HD1 LEU 42 13.633 -15.816 -12.923 326 HD13 LEU 42 3HD1 LEU 42 13.812 -15.820 -14.694 327 HD21 LEU 42 1HD2 LEU 42 16.308 -16.370 -14.413 328 HD22 LEU 42 2HD2 LEU 42 16.022 -16.395 -12.657 329 HD23 LEU 42 3HD2 LEU 42 17.290 -15.354 -13.330 330 H ASP 43 H ASP 43 18.877 -12.630 -16.423 331 HA ASP 43 HA ASP 43 17.883 -10.353 -17.864 332 HB2 ASP 43 1HB ASP 43 20.325 -10.995 -17.629 333 HB3 ASP 43 2HB ASP 43 20.021 -12.301 -18.788 334 H GLY 44 H GLY 44 17.185 -10.288 -20.004 335 HA2 GLY 44 1HA GLY 44 16.147 -11.135 -21.924 336 HA3 GLY 44 2HA GLY 44 16.352 -12.781 -21.309 337 H TRP 45 H TRP 45 14.991 -11.629 -18.663 338 HA TRP 45 HA TRP 45 12.241 -12.181 -19.666 339 HB2 TRP 45 1HB TRP 45 13.472 -12.040 -16.903 340 HB3 TRP 45 2HB TRP 45 11.726 -12.147 -17.171 341 HD1 TRP 45 HD1 TRP 45 14.929 -14.198 -17.974 342 HE1 TRP 45 HE1 TRP 45 14.350 -16.669 -18.097 343 HE3 TRP 45 HE3 TRP 45 9.865 -13.765 -17.407 344 HZ2 TRP 45 HZ2 TRP 45 11.987 -18.276 -17.960 345 HZ3 TRP 45 HZ3 TRP 45 8.470 -15.844 -17.386 346 HH2 TRP 45 HH2 TRP 45 9.539 -18.079 -17.664 347 H TRP 46 H TRP 46 10.653 -10.657 -19.767 348 HA TRP 46 HA TRP 46 11.457 -7.905 -18.929 349 HB2 TRP 46 1HB TRP 46 9.679 -8.756 -21.230 350 HB3 TRP 46 2HB TRP 46 10.159 -7.107 -20.831 351 HD1 TRP 46 HD1 TRP 46 13.324 -8.716 -20.400 352 HE1 TRP 46 HE1 TRP 46 14.777 -8.848 -22.468 353 HE3 TRP 46 HE3 TRP 46 9.696 -7.694 -23.848 354 HZ2 TRP 46 HZ2 TRP 46 14.423 -8.564 -25.288 355 HZ3 TRP 46 HZ3 TRP 46 10.325 -7.652 -26.271 356 HH2 TRP 46 HH2 TRP 46 12.677 -8.102 -26.968 357 H LEU 47 H LEU 47 9.879 -6.595 -17.995 358 HA LEU 47 HA LEU 47 7.619 -8.079 -16.783 359 HB2 LEU 47 1HB LEU 47 8.915 -6.404 -15.445 360 HB3 LEU 47 2HB LEU 47 8.452 -5.155 -16.589 361 HG LEU 47 HG LEU 47 6.064 -5.501 -15.962 362 HD11 LEU 47 1HD1 LEU 47 7.246 -7.367 -13.857 363 HD12 LEU 47 2HD1 LEU 47 6.116 -7.811 -15.159 364 HD13 LEU 47 3HD1 LEU 47 5.579 -6.747 -13.848 365 HD21 LEU 47 1HD2 LEU 47 7.948 -4.895 -13.650 366 HD22 LEU 47 2HD2 LEU 47 6.244 -4.392 -13.778 367 HD23 LEU 47 3HD2 LEU 47 7.447 -3.745 -14.914 368 H CYS 48 H CYS 48 5.857 -8.335 -18.016 369 HA CYS 48 HA CYS 48 5.201 -6.133 -19.923 370 HB2 CYS 48 1HB CYS 48 4.505 -9.076 -20.110 371 HB3 CYS 48 2HB CYS 48 4.160 -7.827 -21.319 372 HG CYS 48 HG CYS 48 7.077 -8.888 -20.204 373 H SER 49 H SER 49 2.839 -5.968 -20.388 374 HA SER 49 HA SER 49 1.167 -6.881 -18.098 375 HB2 SER 49 1HB SER 49 1.682 -4.475 -17.834 376 HB3 SER 49 2HB SER 49 0.989 -4.165 -19.441 377 HG SER 49 HG SER 49 -0.463 -5.494 -17.392 378 H LEU 50 H LEU 50 -0.659 -7.828 -18.608 379 HA LEU 50 HA LEU 50 -1.851 -7.549 -21.308 380 HB2 LEU 50 1HB LEU 50 -0.085 -9.330 -21.478 381 HB3 LEU 50 2HB LEU 50 -0.871 -10.179 -20.159 382 HG LEU 50 HG LEU 50 -2.958 -10.048 -21.850 383 HD11 LEU 50 1HD1 LEU 50 -0.551 -10.312 -23.665 384 HD12 LEU 50 2HD1 LEU 50 -1.555 -8.850 -23.548 385 HD13 LEU 50 3HD1 LEU 50 -2.268 -10.373 -24.124 386 HD21 LEU 50 1HD2 LEU 50 -2.348 -12.345 -22.531 387 HD22 LEU 50 2HD2 LEU 50 -2.093 -12.067 -20.798 388 HD23 LEU 50 3HD2 LEU 50 -0.700 -12.076 -21.906 389 H HIS 51 H HIS 51 -4.036 -7.832 -21.171 390 HA HIS 51 HA HIS 51 -6.119 -8.086 -20.267 391 HB2 HIS 51 1HB HIS 51 -4.871 -10.478 -18.875 392 HB3 HIS 51 2HB HIS 51 -6.599 -10.181 -19.092 393 HD1 HIS 51 HD1 HIS 51 -6.134 -9.199 -22.224 394 HD2 HIS 51 HD2 HIS 51 -5.036 -12.790 -20.419 395 HE1 HIS 51 HE1 HIS 51 -5.900 -10.909 -24.073 396 H GLY 52 H GLY 52 -4.348 -6.296 -18.734 397 HA2 GLY 52 1HA GLY 52 -4.887 -4.955 -16.908 398 HA3 GLY 52 2HA GLY 52 -6.069 -6.151 -16.375 399 H ARG 53 H ARG 53 -3.267 -7.873 -16.876 400 HA ARG 53 HA ARG 53 -2.399 -7.471 -14.024 401 HB2 ARG 53 1HB ARG 53 -2.210 -9.904 -15.851 402 HB3 ARG 53 2HB ARG 53 -1.441 -9.777 -14.266 403 HG2 ARG 53 1HG ARG 53 -3.771 -9.400 -13.309 404 HG3 ARG 53 2HG ARG 53 -4.390 -9.922 -14.895 405 HD2 ARG 53 1HD ARG 53 -3.086 -12.022 -14.686 406 HD3 ARG 53 2HD ARG 53 -2.495 -11.492 -13.100 407 HE ARG 53 HE ARG 53 -5.368 -11.484 -13.175 408 HH11 ARG 53 1HH1 ARG 53 -2.624 -13.695 -12.872 409 HH12 ARG 53 2HH1 ARG 53 -3.565 -14.893 -12.026 410 HH21 ARG 53 1HH2 ARG 53 -6.503 -13.064 -12.090 411 HH22 ARG 53 2HH2 ARG 53 -5.716 -14.534 -11.582 412 H GLN 54 H GLN 54 -0.062 -7.812 -13.701 413 HA GLN 54 HA GLN 54 1.559 -7.295 -16.150 414 HB2 GLN 54 1HB GLN 54 2.147 -6.446 -13.288 415 HB3 GLN 54 2HB GLN 54 3.244 -6.268 -14.669 416 HG2 GLN 54 1HG GLN 54 1.670 -4.731 -15.734 417 HG3 GLN 54 2HG GLN 54 0.555 -4.915 -14.379 418 HE21 GLN 54 1HE2 GLN 54 2.187 -1.849 -13.501 419 HE22 GLN 54 2HE2 GLN 54 0.875 -2.492 -14.460 420 H GLY 55 H GLY 55 3.574 -8.511 -16.106 421 HA2 GLY 55 1HA GLY 55 4.212 -10.315 -13.992 422 HA3 GLY 55 2HA GLY 55 3.248 -11.180 -15.200 423 H ILE 56 H ILE 56 5.815 -11.964 -14.656 424 HA ILE 56 HA ILE 56 7.629 -10.683 -16.548 425 HB ILE 56 HB ILE 56 9.301 -12.256 -15.774 426 HG12 ILE 56 1HG1 ILE 56 7.099 -13.703 -14.248 427 HG13 ILE 56 2HG1 ILE 56 7.828 -14.292 -15.737 428 HG21 ILE 56 1HG2 ILE 56 9.385 -11.618 -13.451 429 HG22 ILE 56 2HG2 ILE 56 8.515 -10.314 -14.274 430 HG23 ILE 56 3HG2 ILE 56 7.619 -11.519 -13.326 431 HD11 ILE 56 1HD1 ILE 56 8.849 -15.462 -13.904 432 HD12 ILE 56 2HD1 ILE 56 10.063 -14.340 -14.556 433 HD13 ILE 56 3HD1 ILE 56 9.202 -13.949 -13.045 434 H VAL 57 H VAL 57 8.385 -11.429 -18.441 435 HA VAL 57 HA VAL 57 7.143 -13.875 -19.628 436 HB VAL 57 HB VAL 57 7.235 -11.056 -20.817 437 HG11 VAL 57 1HG1 VAL 57 6.030 -12.142 -22.774 438 HG12 VAL 57 2HG1 VAL 57 7.761 -12.485 -22.626 439 HG13 VAL 57 3HG1 VAL 57 6.568 -13.696 -22.125 440 HG21 VAL 57 1HG2 VAL 57 4.909 -12.863 -20.065 441 HG22 VAL 57 2HG2 VAL 57 5.342 -11.298 -19.339 442 HG23 VAL 57 3HG2 VAL 57 4.745 -11.363 -21.008 443 HA PRO 58 HA PRO 58 11.445 -13.903 -20.850 444 HB2 PRO 58 1HB PRO 58 11.512 -16.015 -22.587 445 HB3 PRO 58 2HB PRO 58 11.419 -16.234 -20.809 446 HG2 PRO 58 1HG PRO 58 9.217 -16.303 -22.843 447 HG3 PRO 58 2HG PRO 58 9.559 -17.448 -21.514 448 HD2 PRO 58 1HD PRO 58 7.688 -15.482 -21.338 449 HD3 PRO 58 2HD PRO 58 8.634 -16.040 -19.922 450 H GLY 59 H GLY 59 12.097 -12.301 -22.165 451 HA2 GLY 59 1HA GLY 59 10.419 -11.229 -24.174 452 HA3 GLY 59 2HA GLY 59 12.097 -10.791 -23.864 453 H ASN 60 H ASN 60 12.845 -13.727 -24.450 454 HA ASN 60 HA ASN 60 13.384 -13.296 -27.250 455 HB2 ASN 60 1HB ASN 60 14.738 -14.686 -25.555 456 HB3 ASN 60 2HB ASN 60 13.555 -15.972 -25.849 457 HD21 ASN 60 1HD2 ASN 60 15.380 -17.070 -28.589 458 HD22 ASN 60 2HD2 ASN 60 14.447 -17.436 -27.162 459 H ARG 61 H ARG 61 10.550 -14.312 -25.671 460 HA ARG 61 HA ARG 61 9.638 -15.871 -28.052 461 HB2 ARG 61 1HB ARG 61 8.324 -15.367 -25.357 462 HB3 ARG 61 2HB ARG 61 7.598 -16.282 -26.672 463 HG2 ARG 61 1HG ARG 61 9.543 -17.895 -26.525 464 HG3 ARG 61 2HG ARG 61 10.030 -17.047 -25.037 465 HD2 ARG 61 1HD ARG 61 7.686 -17.417 -24.176 466 HD3 ARG 61 2HD ARG 61 7.377 -18.434 -25.581 467 HE ARG 61 HE ARG 61 9.679 -19.413 -24.238 468 HH11 ARG 61 1HH1 ARG 61 6.183 -19.218 -23.772 469 HH12 ARG 61 2HH1 ARG 61 6.157 -20.560 -22.661 470 HH21 ARG 61 1HH2 ARG 61 9.545 -21.178 -22.848 471 HH22 ARG 61 2HH2 ARG 61 8.005 -21.655 -22.183 472 H LEU 62 H LEU 62 9.998 -12.713 -27.390 473 HA LEU 62 HA LEU 62 7.281 -11.960 -28.407 474 HB2 LEU 62 1HB LEU 62 9.244 -10.337 -26.753 475 HB3 LEU 62 2HB LEU 62 7.682 -9.796 -27.327 476 HG LEU 62 HG LEU 62 8.142 -11.941 -25.239 477 HD11 LEU 62 1HD1 LEU 62 7.163 -10.237 -23.699 478 HD12 LEU 62 2HD1 LEU 62 7.106 -9.073 -25.036 479 HD13 LEU 62 3HD1 LEU 62 8.669 -9.676 -24.441 480 HD21 LEU 62 1HD2 LEU 62 6.120 -12.463 -26.418 481 HD22 LEU 62 2HD2 LEU 62 5.591 -10.759 -26.396 482 HD23 LEU 62 3HD2 LEU 62 5.664 -11.702 -24.891 483 H LYS 63 H LYS 63 7.112 -10.542 -30.110 484 HA LYS 63 HA LYS 63 9.709 -9.681 -31.364 485 HB2 LYS 63 1HB LYS 63 8.013 -11.240 -32.597 486 HB3 LYS 63 2HB LYS 63 7.027 -9.796 -32.781 487 HG2 LYS 63 1HG LYS 63 9.899 -10.090 -33.776 488 HG3 LYS 63 2HG LYS 63 8.457 -10.355 -34.771 489 HD2 LYS 63 1HD LYS 63 7.763 -8.001 -34.360 490 HD3 LYS 63 2HD LYS 63 9.255 -7.755 -33.441 491 HE2 LYS 63 1HE LYS 63 10.588 -8.322 -35.438 492 HE3 LYS 63 2HE LYS 63 9.081 -8.459 -36.377 493 HZ1 LYS 63 1HZ LYS 63 10.167 -6.229 -36.489 494 HZ2 LYS 63 2HZ LYS 63 9.870 -6.021 -34.875 495 HZ3 LYS 63 3HZ LYS 63 8.616 -6.163 -35.931 496 H ILE 64 H ILE 64 10.106 -7.607 -30.960 497 HA ILE 64 HA ILE 64 8.213 -5.855 -29.745 498 HB ILE 64 HB ILE 64 10.832 -5.111 -31.151 499 HG12 ILE 64 1HG1 ILE 64 11.398 -5.114 -28.474 500 HG13 ILE 64 2HG1 ILE 64 10.271 -6.468 -28.557 501 HG21 ILE 64 1HG2 ILE 64 10.839 -3.194 -29.532 502 HG22 ILE 64 2HG2 ILE 64 9.440 -3.132 -30.620 503 HG23 ILE 64 3HG2 ILE 64 9.235 -3.701 -28.946 504 HD11 ILE 64 1HD1 ILE 64 11.703 -7.649 -30.128 505 HD12 ILE 64 2HD1 ILE 64 12.737 -6.213 -30.344 506 HD13 ILE 64 3HD1 ILE 64 12.724 -7.078 -28.796 507 H LEU 65 H LEU 65 6.832 -4.384 -30.528 508 HA LEU 65 HA LEU 65 6.543 -4.138 -33.469 509 HB2 LEU 65 1HB LEU 65 4.965 -2.971 -31.144 510 HB3 LEU 65 2HB LEU 65 4.538 -2.799 -32.847 511 HG LEU 65 HG LEU 65 4.705 -5.474 -31.404 512 HD11 LEU 65 1HD1 LEU 65 2.987 -4.091 -30.392 513 HD12 LEU 65 2HD1 LEU 65 2.248 -5.385 -31.350 514 HD13 LEU 65 3HD1 LEU 65 2.296 -3.725 -31.990 515 HD21 LEU 65 1HD2 LEU 65 3.339 -6.269 -33.328 516 HD22 LEU 65 2HD2 LEU 65 4.938 -5.692 -33.830 517 HD23 LEU 65 3HD2 LEU 65 3.503 -4.670 -34.088 518 H VAL 66 H VAL 66 7.921 -2.749 -34.377 519 HA VAL 66 HA VAL 66 9.004 -0.513 -32.763 520 HB VAL 66 HB VAL 66 9.884 -1.628 -35.479 521 HG11 VAL 66 1HG1 VAL 66 10.560 0.715 -35.221 522 HG12 VAL 66 2HG1 VAL 66 11.219 0.382 -33.602 523 HG13 VAL 66 3HG1 VAL 66 11.978 -0.330 -35.044 524 HG21 VAL 66 1HG2 VAL 66 11.806 -2.592 -34.194 525 HG22 VAL 66 2HG2 VAL 66 11.036 -2.064 -32.679 526 HG23 VAL 66 3HG2 VAL 66 10.252 -3.290 -33.701 527 H GLY 67 H GLY 67 8.507 1.582 -33.211 528 HA2 GLY 67 1HA GLY 67 6.290 2.091 -35.003 529 HA3 GLY 67 2HA GLY 67 7.168 3.282 -34.030 530 H MET 68 H MET 68 6.458 4.165 -36.407 531 HA MET 68 HA MET 68 8.901 3.919 -38.119 532 HB2 MET 68 1HB MET 68 6.497 3.208 -38.955 533 HB3 MET 68 2HB MET 68 6.240 4.950 -39.101 534 HG2 MET 68 1HG MET 68 8.162 5.107 -40.633 535 HG3 MET 68 2HG MET 68 8.465 3.368 -40.437 536 HE1 MET 68 1HE MET 68 8.367 2.895 -43.048 537 HE2 MET 68 2HE MET 68 7.588 1.645 -42.046 538 HE3 MET 68 3HE MET 68 6.812 2.193 -43.551 539 H TYR 69 H TYR 69 9.588 5.940 -39.083 540 HA TYR 69 HA TYR 69 10.147 8.131 -39.092 541 HB2 TYR 69 1HB TYR 69 7.556 8.297 -39.266 542 HB3 TYR 69 2HB TYR 69 7.640 8.894 -37.608 543 HD1 TYR 69 HD1 TYR 69 8.444 11.146 -37.127 544 HD2 TYR 69 HD2 TYR 69 8.606 9.594 -41.140 545 HE1 TYR 69 HE1 TYR 69 8.919 13.437 -37.998 546 HE2 TYR 69 HE2 TYR 69 9.071 11.894 -42.003 547 HH TYR 69 HH TYR 69 9.204 14.139 -41.470 548 H ASP 70 H ASP 70 10.077 6.384 -36.290 549 HA ASP 70 HA ASP 70 10.666 8.419 -34.340 550 HB2 ASP 70 1HB ASP 70 10.086 6.024 -33.807 551 HB3 ASP 70 2HB ASP 70 11.687 5.555 -34.403 552 H LYS 71 H LYS 71 12.305 9.746 -34.348 553 HA LYS 71 HA LYS 71 14.977 8.837 -35.289 554 HB2 LYS 71 1HB LYS 71 13.551 11.380 -36.164 555 HB3 LYS 71 2HB LYS 71 15.257 11.037 -36.467 556 HG2 LYS 71 1HG LYS 71 14.707 9.178 -37.917 557 HG3 LYS 71 2HG LYS 71 12.984 9.317 -37.536 558 HD2 LYS 71 1HD LYS 71 14.573 11.550 -38.822 559 HD3 LYS 71 2HD LYS 71 13.697 10.315 -39.748 560 HE2 LYS 71 1HE LYS 71 11.578 10.968 -38.654 561 HE3 LYS 71 2HE LYS 71 12.437 12.195 -37.705 562 HZ1 LYS 71 1HZ LYS 71 12.240 12.165 -40.653 563 HZ2 LYS 71 2HZ LYS 71 13.030 13.304 -39.756 564 HZ3 LYS 71 3HZ LYS 71 11.389 13.155 -39.643 565 H LYS 72 H LYS 72 14.580 8.769 -32.772 566 HA LYS 72 HA LYS 72 14.802 11.151 -31.259 567 HB2 LYS 72 1HB LYS 72 15.872 9.742 -29.544 568 HB3 LYS 72 2HB LYS 72 14.483 8.929 -30.265 569 HG2 LYS 72 1HG LYS 72 15.904 7.154 -30.340 570 HG3 LYS 72 2HG LYS 72 16.432 7.910 -31.851 571 HD2 LYS 72 1HD LYS 72 18.056 9.239 -30.282 572 HD3 LYS 72 2HD LYS 72 17.743 7.924 -29.142 573 HE2 LYS 72 1HE LYS 72 19.698 7.289 -30.322 574 HE3 LYS 72 2HE LYS 72 18.389 6.338 -31.065 575 HZ1 LYS 72 1HZ LYS 72 19.794 7.382 -32.744 576 HZ2 LYS 72 2HZ LYS 72 19.498 8.884 -32.119 577 HZ3 LYS 72 3HZ LYS 72 18.277 8.033 -32.814 578 HA PRO 73 HA PRO 73 18.499 12.769 -32.854 579 HB2 PRO 73 1HB PRO 73 19.442 14.396 -30.874 580 HB3 PRO 73 2HB PRO 73 17.921 14.740 -31.761 581 HG2 PRO 73 1HG PRO 73 18.279 13.349 -29.114 582 HG3 PRO 73 2HG PRO 73 17.230 14.751 -29.518 583 HD2 PRO 73 1HD PRO 73 16.233 12.255 -29.472 584 HD3 PRO 73 2HD PRO 73 15.729 13.416 -30.751 585 H ALA 74 H ALA 74 20.830 12.919 -32.734 586 HA ALA 74 HA ALA 74 22.311 11.595 -30.627 587 HB1 ALA 74 1HB ALA 74 21.550 9.563 -31.821 588 HB2 ALA 74 2HB ALA 74 22.078 10.256 -33.375 589 HB3 ALA 74 3HB ALA 74 23.279 9.826 -32.134 590 H GLY 75 H GLY 75 24.681 11.764 -31.213 591 HA2 GLY 75 1HA GLY 75 26.454 12.659 -32.447 592 HA3 GLY 75 2HA GLY 75 25.303 13.415 -33.558 593 H GLU 76 H GLU 76 24.283 15.419 -32.937 594 HA GLU 76 HA GLU 76 26.143 17.091 -31.437 595 HB2 GLU 76 1HB GLU 76 24.981 17.793 -33.545 596 HB3 GLU 76 2HB GLU 76 23.451 17.790 -32.657 597 HG2 GLU 76 1HG GLU 76 24.375 19.510 -31.115 598 HG3 GLU 76 2HG GLU 76 25.872 19.527 -32.065 599 H PHE 77 H PHE 77 25.984 17.743 -29.394 600 HA PHE 77 HA PHE 77 23.354 17.754 -28.031 601 HB2 PHE 77 1HB PHE 77 25.838 16.339 -26.975 602 HB3 PHE 77 2HB PHE 77 24.413 16.726 -26.003 603 HD1 PHE 77 HD1 PHE 77 22.155 15.736 -26.684 604 HD2 PHE 77 HD2 PHE 77 25.900 14.343 -28.278 605 HE1 PHE 77 HE1 PHE 77 21.065 13.600 -27.354 606 HE2 PHE 77 HE2 PHE 77 24.825 12.195 -28.936 607 HZ PHE 77 HZ PHE 77 22.400 11.817 -28.469 608 H ILE 78 H ILE 78 24.062 20.047 -28.788 609 HA ILE 78 HA ILE 78 26.011 21.222 -26.871 610 HB ILE 78 HB ILE 78 26.416 21.573 -29.325 611 HG12 ILE 78 1HG1 ILE 78 25.777 24.170 -27.881 612 HG13 ILE 78 2HG1 ILE 78 27.149 23.136 -27.465 613 HG21 ILE 78 1HG2 ILE 78 23.994 21.727 -30.036 614 HG22 ILE 78 2HG2 ILE 78 23.907 23.330 -29.275 615 HG23 ILE 78 3HG2 ILE 78 24.992 23.050 -30.655 616 HD11 ILE 78 1HD1 ILE 78 26.703 24.548 -30.126 617 HD12 ILE 78 2HD1 ILE 78 27.908 24.954 -28.885 618 HD13 ILE 78 3HD1 ILE 78 28.043 23.424 -29.782 619 H VAL 79 H VAL 79 25.464 22.821 -25.493 620 HA VAL 79 HA VAL 79 22.556 23.515 -25.295 621 HB VAL 79 HB VAL 79 24.616 23.330 -23.038 622 HG11 VAL 79 1HG1 VAL 79 22.619 23.609 -21.552 623 HG12 VAL 79 2HG1 VAL 79 22.914 25.037 -22.562 624 HG13 VAL 79 3HG1 VAL 79 21.613 23.900 -22.991 625 HG21 VAL 79 1HG2 VAL 79 22.301 21.484 -23.792 626 HG22 VAL 79 2HG2 VAL 79 24.035 21.086 -23.830 627 HG23 VAL 79 3HG2 VAL 79 23.229 21.380 -22.277 628 H THR 80 H THR 80 25.921 24.634 -24.949 629 HA THR 80 HA THR 80 25.096 27.317 -25.790 630 HB THR 80 HB THR 80 26.689 27.002 -23.191 631 HG1 THR 80 HG1 THR 80 23.943 27.194 -23.703 632 HG21 THR 80 1HG2 THR 80 26.172 29.405 -22.943 633 HG22 THR 80 2HG2 THR 80 25.347 29.393 -24.517 634 HG23 THR 80 3HG2 THR 80 27.102 29.097 -24.426 635 H ASP 81 H ASP 81 27.977 25.954 -24.128 636 HA ASP 81 HA ASP 81 29.501 25.712 -26.614 637 HB2 ASP 81 1HB ASP 81 29.912 28.095 -26.198 638 HB3 ASP 81 2HB ASP 81 30.290 27.778 -24.500 639 HXT ASP 81 H02 ASP 81 31.069 24.546 -23.266 Start of MODEL 30 1 H2 GLY 1 2H0 GLY 1 8.037 2.892 -7.640 2 H GLY 1 1H0 GLY 1 8.770 4.373 -7.643 3 HA2 GLY 1 1HA GLY 1 9.436 2.744 -9.465 4 HA3 GLY 1 2HA GLY 1 7.863 3.157 -10.177 5 H SER 2 H SER 2 9.580 3.609 -11.890 6 HA SER 2 HA SER 2 11.092 6.080 -11.568 7 HB2 SER 2 1HB SER 2 10.488 4.380 -14.015 8 HB3 SER 2 2HB SER 2 11.649 5.720 -13.955 9 HG SER 2 HG SER 2 12.438 3.448 -13.574 10 H MET 3 H MET 3 10.870 7.960 -12.889 11 HA MET 3 HA MET 3 8.186 8.981 -12.996 12 HB2 MET 3 1HB MET 3 9.198 10.985 -13.859 13 HB3 MET 3 2HB MET 3 10.270 10.319 -12.626 14 HG2 MET 3 1HG MET 3 11.675 9.306 -14.431 15 HG3 MET 3 2HG MET 3 10.646 10.108 -15.634 16 HE1 MET 3 1HE MET 3 10.069 13.022 -14.461 17 HE2 MET 3 2HE MET 3 11.455 13.904 -15.137 18 HE3 MET 3 3HE MET 3 10.601 12.690 -16.130 19 H LYS 4 H LYS 4 9.714 6.874 -15.130 20 HA LYS 4 HA LYS 4 7.708 7.359 -17.204 21 HB2 LYS 4 1HB LYS 4 9.716 8.920 -17.616 22 HB3 LYS 4 2HB LYS 4 10.653 7.455 -17.949 23 HG2 LYS 4 1HG LYS 4 9.150 6.918 -19.811 24 HG3 LYS 4 2HG LYS 4 8.149 8.332 -19.422 25 HD2 LYS 4 1HD LYS 4 10.138 9.796 -19.781 26 HD3 LYS 4 2HD LYS 4 11.069 8.373 -20.283 27 HE2 LYS 4 1HE LYS 4 9.488 7.975 -22.129 28 HE3 LYS 4 2HE LYS 4 8.532 9.382 -21.612 29 HZ1 LYS 4 1HZ LYS 4 10.050 9.967 -23.412 30 HZ2 LYS 4 2HZ LYS 4 11.355 9.457 -22.537 31 HZ3 LYS 4 3HZ LYS 4 10.488 10.767 -22.040 32 H TYR 5 H TYR 5 7.476 5.502 -18.524 33 HA TYR 5 HA TYR 5 9.157 3.127 -17.773 34 HB2 TYR 5 1HB TYR 5 6.216 3.430 -18.329 35 HB3 TYR 5 2HB TYR 5 7.032 1.917 -18.742 36 HD1 TYR 5 HD1 TYR 5 5.670 3.924 -16.003 37 HD2 TYR 5 HD2 TYR 5 8.223 0.593 -16.961 38 HE1 TYR 5 HE1 TYR 5 5.494 3.095 -13.657 39 HE2 TYR 5 HE2 TYR 5 8.030 -0.242 -14.648 40 HH TYR 5 HH TYR 5 6.078 1.489 -12.168 41 H LEU 6 H LEU 6 9.211 1.497 -19.678 42 HA LEU 6 HA LEU 6 10.290 2.827 -21.966 43 HB2 LEU 6 1HB LEU 6 9.205 0.014 -21.630 44 HB3 LEU 6 2HB LEU 6 10.069 0.573 -23.063 45 HG LEU 6 HG LEU 6 11.272 0.485 -20.282 46 HD11 LEU 6 1HD1 LEU 6 12.466 -1.503 -21.108 47 HD12 LEU 6 2HD1 LEU 6 11.545 -1.423 -22.634 48 HD13 LEU 6 3HD1 LEU 6 10.708 -1.748 -21.092 49 HD21 LEU 6 1HD2 LEU 6 12.388 2.135 -21.693 50 HD22 LEU 6 2HD2 LEU 6 12.517 0.945 -23.027 51 HD23 LEU 6 3HD2 LEU 6 13.415 0.703 -21.506 52 H ASN 7 H ASN 7 7.050 1.451 -21.362 53 HA ASN 7 HA ASN 7 5.068 1.674 -22.488 54 HB2 ASN 7 1HB ASN 7 5.582 4.082 -21.883 55 HB3 ASN 7 2HB ASN 7 6.224 4.290 -23.513 56 HD21 ASN 7 1HD2 ASN 7 3.133 5.223 -24.695 57 HD22 ASN 7 2HD2 ASN 7 4.857 5.427 -24.648 58 H VAL 8 H VAL 8 6.902 0.046 -23.814 59 HA VAL 8 HA VAL 8 6.214 0.575 -26.669 60 HB VAL 8 HB VAL 8 8.148 -0.875 -27.234 61 HG11 VAL 8 1HG1 VAL 8 9.909 0.748 -26.849 62 HG12 VAL 8 2HG1 VAL 8 8.388 1.624 -27.101 63 HG13 VAL 8 3HG1 VAL 8 9.039 1.424 -25.455 64 HG21 VAL 8 1HG2 VAL 8 9.870 -1.383 -25.493 65 HG22 VAL 8 2HG2 VAL 8 8.721 -0.852 -24.253 66 HG23 VAL 8 3HG2 VAL 8 8.349 -2.262 -25.273 67 H LEU 9 H LEU 9 6.086 -1.749 -27.798 68 HA LEU 9 HA LEU 9 4.798 -3.658 -25.907 69 HB2 LEU 9 1HB LEU 9 2.957 -3.921 -27.625 70 HB3 LEU 9 2HB LEU 9 2.913 -2.467 -26.637 71 HG LEU 9 HG LEU 9 4.362 -2.051 -29.150 72 HD11 LEU 9 1HD1 LEU 9 2.728 -3.681 -29.993 73 HD12 LEU 9 2HD1 LEU 9 2.398 -2.044 -30.596 74 HD13 LEU 9 3HD1 LEU 9 1.412 -2.726 -29.283 75 HD21 LEU 9 1HD2 LEU 9 3.005 -0.034 -29.180 76 HD22 LEU 9 2HD2 LEU 9 3.601 -0.312 -27.520 77 HD23 LEU 9 3HD2 LEU 9 1.921 -0.715 -27.939 78 H ALA 10 H ALA 10 4.338 -5.731 -26.872 79 HA ALA 10 HA ALA 10 5.999 -6.400 -29.224 80 HB1 ALA 10 1HB ALA 10 6.292 -7.848 -26.576 81 HB2 ALA 10 2HB ALA 10 7.244 -8.093 -28.058 82 HB3 ALA 10 3HB ALA 10 7.420 -6.595 -27.126 83 H LYS 11 H LYS 11 5.438 -8.334 -30.208 84 HA LYS 11 HA LYS 11 2.752 -9.401 -29.442 85 HB2 LYS 11 1HB LYS 11 3.104 -8.569 -31.769 86 HB3 LYS 11 2HB LYS 11 4.409 -9.749 -31.969 87 HG2 LYS 11 1HG LYS 11 2.839 -11.603 -31.784 88 HG3 LYS 11 2HG LYS 11 1.533 -10.507 -31.327 89 HD2 LYS 11 1HD LYS 11 1.143 -11.032 -33.581 90 HD3 LYS 11 2HD LYS 11 1.817 -9.390 -33.589 91 HE2 LYS 11 1HE LYS 11 4.044 -10.326 -34.158 92 HE3 LYS 11 2HE LYS 11 3.367 -11.971 -34.119 93 HZ1 LYS 11 1HZ LYS 11 1.876 -11.320 -35.914 94 HZ2 LYS 11 2HZ LYS 11 3.441 -11.102 -36.376 95 HZ3 LYS 11 3HZ LYS 11 2.509 -9.802 -35.958 96 H ALA 12 H ALA 12 2.527 -11.500 -28.763 97 HA ALA 12 HA ALA 12 4.943 -12.958 -28.057 98 HB1 ALA 12 1HB ALA 12 3.245 -14.760 -27.467 99 HB2 ALA 12 2HB ALA 12 3.048 -13.208 -26.636 100 HB3 ALA 12 3HB ALA 12 1.989 -13.613 -27.990 101 H LEU 13 H LEU 13 5.949 -14.560 -29.062 102 HA LEU 13 HA LEU 13 5.021 -15.292 -31.809 103 HB2 LEU 13 1HB LEU 13 7.642 -15.734 -30.347 104 HB3 LEU 13 2HB LEU 13 7.319 -16.261 -31.993 105 HG LEU 13 HG LEU 13 7.279 -13.354 -31.124 106 HD11 LEU 13 1HD1 LEU 13 9.505 -14.977 -32.424 107 HD12 LEU 13 2HD1 LEU 13 9.528 -14.311 -30.768 108 HD13 LEU 13 3HD1 LEU 13 9.522 -13.215 -32.169 109 HD21 LEU 13 1HD2 LEU 13 7.525 -12.996 -33.608 110 HD22 LEU 13 2HD2 LEU 13 5.995 -13.762 -33.155 111 HD23 LEU 13 3HD2 LEU 13 7.308 -14.747 -33.845 112 H TYR 14 H TYR 14 5.442 -16.513 -28.597 113 HA TYR 14 HA TYR 14 4.625 -19.258 -29.496 114 HB2 TYR 14 1HB TYR 14 6.356 -18.477 -27.107 115 HB3 TYR 14 2HB TYR 14 5.863 -20.113 -27.554 116 HD1 TYR 14 HD1 TYR 14 7.989 -17.227 -28.612 117 HD2 TYR 14 HD2 TYR 14 7.083 -21.388 -29.220 118 HE1 TYR 14 HE1 TYR 14 10.062 -17.472 -29.986 119 HE2 TYR 14 HE2 TYR 14 9.154 -21.621 -30.603 120 HH TYR 14 HH TYR 14 11.015 -20.565 -31.465 121 H ASP 15 H ASP 15 3.174 -20.298 -27.865 122 HA ASP 15 HA ASP 15 1.731 -18.238 -26.253 123 HB2 ASP 15 1HB ASP 15 -0.116 -19.886 -26.179 124 HB3 ASP 15 2HB ASP 15 0.260 -19.344 -27.820 125 H ASN 16 H ASN 16 1.338 -18.554 -24.081 126 HA ASN 16 HA ASN 16 2.646 -20.866 -22.748 127 HB2 ASN 16 1HB ASN 16 4.316 -18.952 -23.142 128 HB3 ASN 16 2HB ASN 16 3.320 -17.996 -22.031 129 HD21 ASN 16 1HD2 ASN 16 4.997 -19.246 -19.270 130 HD22 ASN 16 2HD2 ASN 16 4.072 -17.968 -20.032 131 H VAL 17 H VAL 17 1.279 -21.546 -21.182 132 HA VAL 17 HA VAL 17 -0.679 -19.567 -20.076 133 HB VAL 17 HB VAL 17 -0.686 -22.471 -19.265 134 HG11 VAL 17 1HG1 VAL 17 -2.896 -20.473 -19.896 135 HG12 VAL 17 2HG1 VAL 17 -3.116 -22.102 -19.221 136 HG13 VAL 17 3HG1 VAL 17 -2.273 -20.869 -18.271 137 HG21 VAL 17 1HG2 VAL 17 -0.441 -22.769 -21.670 138 HG22 VAL 17 2HG2 VAL 17 -2.140 -23.027 -21.263 139 HG23 VAL 17 3HG2 VAL 17 -1.643 -21.487 -21.995 140 H ALA 18 H ALA 18 -0.327 -18.809 -17.999 141 HA ALA 18 HA ALA 18 2.286 -19.275 -16.907 142 HB1 ALA 18 1HB ALA 18 -0.128 -17.895 -15.685 143 HB2 ALA 18 2HB ALA 18 1.550 -17.748 -15.139 144 HB3 ALA 18 3HB ALA 18 1.093 -17.126 -16.730 145 H GLU 19 H GLU 19 2.890 -21.048 -15.874 146 HA GLU 19 HA GLU 19 0.953 -22.608 -14.283 147 HB2 GLU 19 1HB GLU 19 2.739 -24.223 -14.089 148 HB3 GLU 19 2HB GLU 19 2.580 -23.716 -15.778 149 HG2 GLU 19 1HG GLU 19 4.541 -22.165 -15.436 150 HG3 GLU 19 2HG GLU 19 4.730 -22.852 -13.810 151 H SER 20 H SER 20 3.062 -20.005 -13.877 152 HA SER 20 HA SER 20 3.042 -20.358 -10.912 153 HB2 SER 20 1HB SER 20 5.140 -19.037 -12.680 154 HB3 SER 20 2HB SER 20 5.107 -18.925 -10.914 155 HG SER 20 HG SER 20 5.258 -21.346 -12.399 156 HA PRO 21 HA PRO 21 0.525 -16.856 -11.286 157 HB2 PRO 21 1HB PRO 21 0.776 -15.537 -8.904 158 HB3 PRO 21 2HB PRO 21 -0.031 -17.132 -9.034 159 HG2 PRO 21 1HG PRO 21 2.825 -16.525 -8.269 160 HG3 PRO 21 2HG PRO 21 1.614 -17.541 -7.408 161 HD2 PRO 21 1HD PRO 21 3.449 -18.663 -9.039 162 HD3 PRO 21 2HD PRO 21 1.752 -19.259 -9.003 163 H ASP 22 H ASP 22 3.917 -16.243 -10.521 164 HA ASP 22 HA ASP 22 3.742 -13.376 -10.909 165 HB2 ASP 22 1HB ASP 22 6.101 -15.284 -10.925 166 HB3 ASP 22 2HB ASP 22 6.231 -13.525 -10.905 167 H GLU 23 H GLU 23 3.999 -16.146 -12.968 168 HA GLU 23 HA GLU 23 5.180 -14.698 -15.243 169 HB2 GLU 23 1HB GLU 23 5.526 -17.168 -14.709 170 HB3 GLU 23 2HB GLU 23 3.851 -17.434 -15.172 171 HG2 GLU 23 1HG GLU 23 4.395 -17.508 -17.347 172 HG3 GLU 23 2HG GLU 23 5.175 -15.936 -17.261 173 H LEU 24 H LEU 24 3.981 -14.261 -17.208 174 HA LEU 24 HA LEU 24 1.101 -13.765 -16.644 175 HB2 LEU 24 1HB LEU 24 3.165 -12.389 -18.053 176 HB3 LEU 24 2HB LEU 24 1.931 -12.836 -19.229 177 HG LEU 24 HG LEU 24 1.421 -11.269 -16.670 178 HD11 LEU 24 1HD1 LEU 24 2.818 -10.063 -18.299 179 HD12 LEU 24 2HD1 LEU 24 1.198 -9.351 -18.173 180 HD13 LEU 24 3HD1 LEU 24 1.602 -10.369 -19.569 181 HD21 LEU 24 1HD2 LEU 24 -0.399 -11.952 -19.021 182 HD22 LEU 24 2HD2 LEU 24 -0.775 -10.736 -17.779 183 HD23 LEU 24 3HD2 LEU 24 -0.607 -12.445 -17.328 184 H SER 25 H SER 25 -0.540 -14.705 -17.784 185 HA SER 25 HA SER 25 0.111 -16.927 -19.610 186 HB2 SER 25 1HB SER 25 -2.550 -15.770 -18.681 187 HB3 SER 25 2HB SER 25 -2.369 -17.198 -19.727 188 HG SER 25 HG SER 25 -2.644 -17.695 -17.469 189 H PHE 26 H PHE 26 0.246 -16.661 -21.760 190 HA PHE 26 HA PHE 26 -1.359 -14.546 -23.075 191 HB2 PHE 26 1HB PHE 26 0.605 -13.605 -24.243 192 HB3 PHE 26 2HB PHE 26 0.685 -13.317 -22.504 193 HD1 PHE 26 HD1 PHE 26 2.124 -15.332 -25.286 194 HD2 PHE 26 HD2 PHE 26 2.440 -14.239 -21.147 195 HE1 PHE 26 HE1 PHE 26 4.416 -16.321 -25.198 196 HE2 PHE 26 HE2 PHE 26 4.681 -15.262 -21.034 197 HZ PHE 26 HZ PHE 26 5.687 -16.296 -23.068 198 H ARG 27 H ARG 27 -1.211 -14.817 -25.502 199 HA ARG 27 HA ARG 27 -0.172 -17.520 -26.197 200 HB2 ARG 27 1HB ARG 27 -2.843 -16.410 -27.105 201 HB3 ARG 27 2HB ARG 27 -2.090 -17.898 -27.689 202 HG2 ARG 27 1HG ARG 27 -2.041 -18.452 -25.064 203 HG3 ARG 27 2HG ARG 27 -3.416 -17.334 -25.075 204 HD2 ARG 27 1HD ARG 27 -4.465 -19.364 -25.415 205 HD3 ARG 27 2HD ARG 27 -4.232 -18.832 -27.089 206 HE ARG 27 HE ARG 27 -1.957 -20.352 -26.351 207 HH11 ARG 27 1HH1 ARG 27 -5.412 -20.928 -26.792 208 HH12 ARG 27 2HH1 ARG 27 -5.173 -22.610 -27.201 209 HH21 ARG 27 1HH2 ARG 27 -1.711 -22.502 -26.888 210 HH22 ARG 27 2HH2 ARG 27 -3.118 -23.478 -27.253 211 H LYS 28 H LYS 28 0.435 -17.809 -28.392 212 HA LYS 28 HA LYS 28 1.855 -15.597 -29.428 213 HB2 LYS 28 1HB LYS 28 2.146 -16.967 -31.466 214 HB3 LYS 28 2HB LYS 28 2.485 -17.844 -29.983 215 HG2 LYS 28 1HG LYS 28 0.208 -18.903 -30.118 216 HG3 LYS 28 2HG LYS 28 0.049 -18.158 -31.730 217 HD2 LYS 28 1HD LYS 28 2.143 -19.305 -32.420 218 HD3 LYS 28 2HD LYS 28 2.258 -20.045 -30.812 219 HE2 LYS 28 1HE LYS 28 0.058 -21.135 -31.180 220 HE3 LYS 28 2HE LYS 28 0.024 -20.464 -32.831 221 HZ1 LYS 28 1HZ LYS 28 2.074 -22.315 -31.745 222 HZ2 LYS 28 2HZ LYS 28 2.100 -21.664 -33.262 223 HZ3 LYS 28 3HZ LYS 28 0.901 -22.706 -32.830 224 H GLY 29 H GLY 29 1.473 -14.044 -30.829 225 HA2 GLY 29 1HA GLY 29 0.200 -12.939 -32.544 226 HA3 GLY 29 2HA GLY 29 -1.206 -13.921 -32.116 227 H ASP 30 H ASP 30 -0.643 -13.401 -29.156 228 HA ASP 30 HA ASP 30 -2.329 -11.059 -28.946 229 HB2 ASP 30 1HB ASP 30 -2.118 -13.168 -27.425 230 HB3 ASP 30 2HB ASP 30 -0.749 -12.308 -26.682 231 H ILE 31 H ILE 31 -1.798 -9.134 -27.733 232 HA ILE 31 HA ILE 31 1.042 -8.261 -28.178 233 HB ILE 31 HB ILE 31 -1.492 -6.534 -28.212 234 HG12 ILE 31 1HG1 ILE 31 -1.566 -8.071 -30.122 235 HG13 ILE 31 2HG1 ILE 31 -1.321 -6.406 -30.639 236 HG21 ILE 31 1HG2 ILE 31 0.430 -5.195 -27.624 237 HG22 ILE 31 2HG2 ILE 31 1.414 -5.914 -28.920 238 HG23 ILE 31 3HG2 ILE 31 0.052 -4.852 -29.319 239 HD11 ILE 31 1HD1 ILE 31 0.830 -8.534 -30.493 240 HD12 ILE 31 2HD1 ILE 31 0.017 -7.962 -31.957 241 HD13 ILE 31 3HD1 ILE 31 1.066 -6.858 -31.043 242 H MET 32 H MET 32 2.112 -7.542 -26.392 243 HA MET 32 HA MET 32 0.453 -6.606 -24.083 244 HB2 MET 32 1HB MET 32 2.025 -7.723 -22.548 245 HB3 MET 32 2HB MET 32 1.140 -8.853 -23.568 246 HG2 MET 32 1HG MET 32 3.352 -8.574 -25.100 247 HG3 MET 32 2HG MET 32 4.057 -8.234 -23.511 248 HE1 MET 32 1HE MET 32 2.549 -10.773 -25.971 249 HE2 MET 32 2HE MET 32 2.110 -12.171 -24.963 250 HE3 MET 32 3HE MET 32 1.157 -10.675 -24.869 251 H THR 33 H THR 33 1.387 -5.062 -22.760 252 HA THR 33 HA THR 33 3.318 -3.334 -24.186 253 HB THR 33 HB THR 33 1.906 -2.927 -21.490 254 HG1 THR 33 HG1 THR 33 0.523 -3.074 -23.378 255 HG21 THR 33 1HG2 THR 33 3.928 -1.489 -21.778 256 HG22 THR 33 2HG2 THR 33 2.433 -0.539 -21.863 257 HG23 THR 33 3HG2 THR 33 3.300 -0.943 -23.356 258 H VAL 34 H VAL 34 5.459 -3.257 -23.731 259 HA VAL 34 HA VAL 34 6.441 -4.864 -21.389 260 HB VAL 34 HB VAL 34 7.919 -3.651 -23.766 261 HG11 VAL 34 1HG1 VAL 34 8.943 -5.246 -21.381 262 HG12 VAL 34 2HG1 VAL 34 9.882 -4.958 -22.859 263 HG13 VAL 34 3HG1 VAL 34 9.397 -3.585 -21.848 264 HG21 VAL 34 1HG2 VAL 34 6.542 -5.715 -24.243 265 HG22 VAL 34 2HG2 VAL 34 8.284 -5.957 -24.483 266 HG23 VAL 34 3HG2 VAL 34 7.497 -6.578 -23.014 267 H LEU 35 H LEU 35 6.944 -3.861 -19.588 268 HA LEU 35 HA LEU 35 6.935 -0.894 -19.582 269 HB2 LEU 35 1HB LEU 35 6.951 -2.933 -17.321 270 HB3 LEU 35 2HB LEU 35 6.860 -1.197 -17.120 271 HG LEU 35 HG LEU 35 4.766 -2.944 -18.431 272 HD11 LEU 35 1HD1 LEU 35 4.934 -3.234 -16.012 273 HD12 LEU 35 2HD1 LEU 35 3.432 -2.377 -16.434 274 HD13 LEU 35 3HD1 LEU 35 4.827 -1.478 -15.774 275 HD21 LEU 35 1HD2 LEU 35 3.343 -0.878 -18.337 276 HD22 LEU 35 2HD2 LEU 35 4.699 -0.744 -19.467 277 HD23 LEU 35 3HD2 LEU 35 4.792 0.061 -17.882 278 H GLU 36 H GLU 36 9.008 -3.619 -18.640 279 HA GLU 36 HA GLU 36 11.423 -1.954 -18.816 280 HB2 GLU 36 1HB GLU 36 12.141 -2.465 -16.522 281 HB3 GLU 36 2HB GLU 36 10.679 -1.471 -16.541 282 HG2 GLU 36 1HG GLU 36 9.335 -3.501 -16.144 283 HG3 GLU 36 2HG GLU 36 10.827 -4.447 -16.031 284 H ARG 37 H ARG 37 13.369 -3.482 -18.207 285 HA ARG 37 HA ARG 37 12.765 -6.301 -19.000 286 HB2 ARG 37 1HB ARG 37 15.062 -4.653 -20.113 287 HB3 ARG 37 2HB ARG 37 14.605 -6.297 -20.570 288 HG2 ARG 37 1HG ARG 37 12.377 -5.249 -21.396 289 HG3 ARG 37 2HG ARG 37 13.214 -3.696 -21.234 290 HD2 ARG 37 1HD ARG 37 13.955 -6.024 -23.001 291 HD3 ARG 37 2HD ARG 37 13.463 -4.399 -23.510 292 HE ARG 37 HE ARG 37 15.752 -4.065 -21.940 293 HH11 ARG 37 1HH1 ARG 37 15.020 -5.829 -24.918 294 HH12 ARG 37 2HH1 ARG 37 16.655 -5.702 -25.496 295 HH21 ARG 37 1HH2 ARG 37 17.827 -3.957 -22.749 296 HH22 ARG 37 2HH2 ARG 37 18.213 -4.675 -24.299 297 H ASP 38 H ASP 38 14.488 -7.756 -18.331 298 HA ASP 38 HA ASP 38 15.892 -8.640 -16.767 299 HB2 ASP 38 1HB ASP 38 17.458 -6.885 -17.858 300 HB3 ASP 38 2HB ASP 38 17.185 -5.912 -16.398 301 H THR 39 H THR 39 13.401 -7.808 -16.111 302 HA THR 39 HA THR 39 13.220 -6.020 -13.899 303 HB THR 39 HB THR 39 11.409 -6.520 -15.539 304 HG1 THR 39 HG1 THR 39 10.922 -5.659 -13.460 305 HG21 THR 39 1HG2 THR 39 11.099 -9.149 -14.027 306 HG22 THR 39 2HG2 THR 39 11.699 -9.004 -15.695 307 HG23 THR 39 3HG2 THR 39 10.024 -8.552 -15.304 308 H GLN 40 H GLN 40 14.246 -9.279 -13.964 309 HA GLN 40 HA GLN 40 13.727 -9.501 -11.030 310 HB2 GLN 40 1HB GLN 40 12.377 -10.968 -12.821 311 HB3 GLN 40 2HB GLN 40 13.827 -11.965 -12.724 312 HG2 GLN 40 1HG GLN 40 13.522 -12.210 -10.301 313 HG3 GLN 40 2HG GLN 40 12.126 -11.117 -10.343 314 HE21 GLN 40 1HE2 GLN 40 9.967 -13.793 -10.785 315 HE22 GLN 40 2HE2 GLN 40 10.325 -12.272 -10.024 316 H GLY 41 H GLY 41 16.134 -8.781 -12.964 317 HA2 GLY 41 1HA GLY 41 18.423 -9.042 -12.715 318 HA3 GLY 41 2HA GLY 41 18.136 -10.153 -11.356 319 H LEU 42 H LEU 42 16.437 -10.745 -14.272 320 HA LEU 42 HA LEU 42 18.310 -12.938 -15.022 321 HB2 LEU 42 1HB LEU 42 15.269 -12.878 -15.237 322 HB3 LEU 42 2HB LEU 42 16.314 -14.160 -15.830 323 HG LEU 42 HG LEU 42 15.947 -13.430 -12.912 324 HD11 LEU 42 1HD1 LEU 42 14.864 -15.768 -14.537 325 HD12 LEU 42 2HD1 LEU 42 13.916 -14.374 -13.954 326 HD13 LEU 42 3HD1 LEU 42 14.640 -15.500 -12.794 327 HD21 LEU 42 1HD2 LEU 42 18.142 -14.426 -13.249 328 HD22 LEU 42 2HD2 LEU 42 17.438 -15.728 -14.243 329 HD23 LEU 42 3HD2 LEU 42 17.067 -15.631 -12.508 330 H ASP 43 H ASP 43 19.256 -12.344 -16.885 331 HA ASP 43 HA ASP 43 18.319 -10.216 -18.505 332 HB2 ASP 43 1HB ASP 43 20.685 -11.075 -18.460 333 HB3 ASP 43 2HB ASP 43 20.133 -12.494 -19.370 334 H GLY 44 H GLY 44 17.290 -10.160 -20.425 335 HA2 GLY 44 1HA GLY 44 16.037 -10.972 -22.217 336 HA3 GLY 44 2HA GLY 44 16.266 -12.617 -21.626 337 H TRP 45 H TRP 45 15.158 -11.462 -18.856 338 HA TRP 45 HA TRP 45 12.353 -12.077 -19.615 339 HB2 TRP 45 1HB TRP 45 13.806 -11.781 -16.978 340 HB3 TRP 45 2HB TRP 45 12.043 -11.897 -17.082 341 HD1 TRP 45 HD1 TRP 45 15.201 -13.991 -17.828 342 HE1 TRP 45 HE1 TRP 45 14.610 -16.452 -17.918 343 HE3 TRP 45 HE3 TRP 45 10.132 -13.505 -17.443 344 HZ2 TRP 45 HZ2 TRP 45 12.234 -18.041 -17.829 345 HZ3 TRP 45 HZ3 TRP 45 8.728 -15.578 -17.437 346 HH2 TRP 45 HH2 TRP 45 9.784 -17.824 -17.626 347 H TRP 46 H TRP 46 10.736 -10.616 -19.767 348 HA TRP 46 HA TRP 46 11.448 -7.816 -18.998 349 HB2 TRP 46 1HB TRP 46 9.665 -8.746 -21.263 350 HB3 TRP 46 2HB TRP 46 10.108 -7.081 -20.898 351 HD1 TRP 46 HD1 TRP 46 13.341 -8.524 -20.510 352 HE1 TRP 46 HE1 TRP 46 14.756 -8.686 -22.611 353 HE3 TRP 46 HE3 TRP 46 9.577 -7.863 -23.897 354 HZ2 TRP 46 HZ2 TRP 46 14.309 -8.545 -25.429 355 HZ3 TRP 46 HZ3 TRP 46 10.142 -7.906 -26.340 356 HH2 TRP 46 HH2 TRP 46 12.487 -8.248 -27.086 357 H LEU 47 H LEU 47 9.816 -6.556 -18.056 358 HA LEU 47 HA LEU 47 7.614 -8.140 -16.867 359 HB2 LEU 47 1HB LEU 47 8.918 -6.402 -15.556 360 HB3 LEU 47 2HB LEU 47 8.218 -5.185 -16.612 361 HG LEU 47 HG LEU 47 5.943 -5.873 -15.802 362 HD11 LEU 47 1HD1 LEU 47 6.413 -8.153 -15.019 363 HD12 LEU 47 2HD1 LEU 47 5.862 -7.170 -13.642 364 HD13 LEU 47 3HD1 LEU 47 7.591 -7.526 -13.843 365 HD21 LEU 47 1HD2 LEU 47 6.161 -4.738 -13.636 366 HD22 LEU 47 2HD2 LEU 47 7.161 -3.945 -14.869 367 HD23 LEU 47 3HD2 LEU 47 7.927 -5.000 -13.658 368 H CYS 48 H CYS 48 5.831 -8.396 -18.040 369 HA CYS 48 HA CYS 48 5.154 -6.249 -20.007 370 HB2 CYS 48 1HB CYS 48 4.479 -9.200 -20.028 371 HB3 CYS 48 2HB CYS 48 3.975 -8.012 -21.248 372 HG CYS 48 HG CYS 48 7.008 -8.978 -20.368 373 H SER 49 H SER 49 2.877 -5.836 -20.293 374 HA SER 49 HA SER 49 1.238 -6.559 -17.899 375 HB2 SER 49 1HB SER 49 1.962 -4.220 -17.743 376 HB3 SER 49 2HB SER 49 1.351 -3.909 -19.377 377 HG SER 49 HG SER 49 -0.103 -3.310 -17.643 378 H LEU 50 H LEU 50 -0.590 -7.532 -18.348 379 HA LEU 50 HA LEU 50 -2.031 -7.169 -20.884 380 HB2 LEU 50 1HB LEU 50 -0.172 -8.753 -21.448 381 HB3 LEU 50 2HB LEU 50 -0.715 -9.801 -20.153 382 HG LEU 50 HG LEU 50 -2.840 -10.212 -21.363 383 HD11 LEU 50 1HD1 LEU 50 -2.973 -9.588 -23.759 384 HD12 LEU 50 2HD1 LEU 50 -1.507 -8.599 -23.572 385 HD13 LEU 50 3HD1 LEU 50 -3.000 -8.153 -22.699 386 HD21 LEU 50 1HD2 LEU 50 -1.830 -11.642 -23.084 387 HD22 LEU 50 2HD2 LEU 50 -0.942 -11.719 -21.552 388 HD23 LEU 50 3HD2 LEU 50 -0.292 -10.763 -22.899 389 H HIS 51 H HIS 51 -4.161 -8.037 -20.664 390 HA HIS 51 HA HIS 51 -6.070 -8.609 -19.528 391 HB2 HIS 51 1HB HIS 51 -4.521 -10.752 -19.429 392 HB3 HIS 51 2HB HIS 51 -4.519 -10.419 -17.696 393 HD1 HIS 51 HD1 HIS 51 -7.151 -10.131 -16.693 394 HD2 HIS 51 HD2 HIS 51 -6.608 -12.243 -20.247 395 HE1 HIS 51 HE1 HIS 51 -9.225 -11.549 -17.032 396 H GLY 52 H GLY 52 -4.329 -6.398 -18.425 397 HA2 GLY 52 1HA GLY 52 -4.916 -4.820 -16.821 398 HA3 GLY 52 2HA GLY 52 -5.994 -5.996 -16.056 399 H ARG 53 H ARG 53 -2.974 -7.482 -16.423 400 HA ARG 53 HA ARG 53 -1.945 -6.303 -13.884 401 HB2 ARG 53 1HB ARG 53 -1.572 -8.394 -12.853 402 HB3 ARG 53 2HB ARG 53 -3.259 -8.395 -13.353 403 HG2 ARG 53 1HG ARG 53 -2.777 -9.913 -15.193 404 HG3 ARG 53 2HG ARG 53 -1.031 -9.769 -14.911 405 HD2 ARG 53 1HD ARG 53 -1.320 -10.690 -12.632 406 HD3 ARG 53 2HD ARG 53 -3.048 -10.887 -12.939 407 HE ARG 53 HE ARG 53 -2.613 -12.721 -14.343 408 HH11 ARG 53 1HH1 ARG 53 0.485 -11.369 -13.212 409 HH12 ARG 53 2HH1 ARG 53 1.330 -12.870 -13.541 410 HH21 ARG 53 1HH2 ARG 53 -1.418 -14.534 -14.760 411 HH22 ARG 53 2HH2 ARG 53 0.304 -14.583 -14.439 412 H GLN 54 H GLN 54 0.286 -6.909 -13.438 413 HA GLN 54 HA GLN 54 1.791 -7.137 -15.988 414 HB2 GLN 54 1HB GLN 54 2.748 -6.462 -13.178 415 HB3 GLN 54 2HB GLN 54 3.708 -6.406 -14.663 416 HG2 GLN 54 1HG GLN 54 3.197 -4.234 -14.635 417 HG3 GLN 54 2HG GLN 54 1.685 -4.761 -15.366 418 HE21 GLN 54 1HE2 GLN 54 1.450 -2.606 -12.128 419 HE22 GLN 54 2HE2 GLN 54 2.689 -2.572 -13.367 420 H GLY 55 H GLY 55 3.659 -8.613 -16.025 421 HA2 GLY 55 1HA GLY 55 4.049 -10.554 -13.946 422 HA3 GLY 55 2HA GLY 55 3.120 -11.256 -15.283 423 H ILE 56 H ILE 56 5.704 -12.171 -14.632 424 HA ILE 56 HA ILE 56 7.585 -10.786 -16.418 425 HB ILE 56 HB ILE 56 9.245 -12.455 -15.711 426 HG12 ILE 56 1HG1 ILE 56 7.012 -13.839 -14.182 427 HG13 ILE 56 2HG1 ILE 56 7.690 -14.433 -15.688 428 HG21 ILE 56 1HG2 ILE 56 9.383 -11.880 -13.360 429 HG22 ILE 56 2HG2 ILE 56 8.628 -10.504 -14.192 430 HG23 ILE 56 3HG2 ILE 56 7.623 -11.633 -13.246 431 HD11 ILE 56 1HD1 ILE 56 8.677 -15.682 -13.902 432 HD12 ILE 56 2HD1 ILE 56 9.936 -14.600 -14.542 433 HD13 ILE 56 3HD1 ILE 56 9.116 -14.213 -13.006 434 H VAL 57 H VAL 57 8.375 -11.515 -18.343 435 HA VAL 57 HA VAL 57 7.151 -13.969 -19.528 436 HB VAL 57 HB VAL 57 7.148 -11.172 -20.801 437 HG11 VAL 57 1HG1 VAL 57 7.644 -12.726 -22.545 438 HG12 VAL 57 2HG1 VAL 57 6.427 -13.877 -21.947 439 HG13 VAL 57 3HG1 VAL 57 5.910 -12.351 -22.670 440 HG21 VAL 57 1HG2 VAL 57 5.305 -11.398 -19.243 441 HG22 VAL 57 2HG2 VAL 57 4.661 -11.502 -20.893 442 HG23 VAL 57 3HG2 VAL 57 4.862 -12.980 -19.925 443 HA PRO 58 HA PRO 58 11.447 -13.938 -20.800 444 HB2 PRO 58 1HB PRO 58 11.502 -16.090 -22.490 445 HB3 PRO 58 2HB PRO 58 11.422 -16.265 -20.709 446 HG2 PRO 58 1HG PRO 58 9.201 -16.387 -22.726 447 HG3 PRO 58 2HG PRO 58 9.539 -17.492 -21.362 448 HD2 PRO 58 1HD PRO 58 7.679 -15.526 -21.254 449 HD3 PRO 58 2HD PRO 58 8.613 -16.053 -19.817 450 H GLY 59 H GLY 59 11.996 -12.277 -22.075 451 HA2 GLY 59 1HA GLY 59 10.362 -11.301 -24.154 452 HA3 GLY 59 2HA GLY 59 12.013 -10.809 -23.793 453 H ASN 60 H ASN 60 12.948 -13.683 -24.381 454 HA ASN 60 HA ASN 60 13.493 -13.239 -27.172 455 HB2 ASN 60 1HB ASN 60 13.831 -15.664 -25.371 456 HB3 ASN 60 2HB ASN 60 14.285 -15.673 -27.080 457 HD21 ASN 60 1HD2 ASN 60 17.286 -14.819 -25.065 458 HD22 ASN 60 2HD2 ASN 60 16.160 -16.165 -25.127 459 H ARG 61 H ARG 61 10.759 -14.551 -25.514 460 HA ARG 61 HA ARG 61 9.848 -16.034 -27.926 461 HB2 ARG 61 1HB ARG 61 8.542 -15.679 -25.204 462 HB3 ARG 61 2HB ARG 61 7.940 -16.687 -26.517 463 HG2 ARG 61 1HG ARG 61 10.325 -17.798 -26.367 464 HG3 ARG 61 2HG ARG 61 10.336 -17.105 -24.736 465 HD2 ARG 61 1HD ARG 61 7.806 -18.272 -24.964 466 HD3 ARG 61 2HD ARG 61 8.856 -19.413 -25.816 467 HE ARG 61 HE ARG 61 8.753 -18.877 -22.949 468 HH11 ARG 61 1HH1 ARG 61 10.837 -20.178 -25.509 469 HH12 ARG 61 2HH1 ARG 61 11.770 -21.116 -24.378 470 HH21 ARG 61 1HH2 ARG 61 9.980 -20.114 -21.600 471 HH22 ARG 61 2HH2 ARG 61 11.312 -21.062 -22.200 472 H LEU 62 H LEU 62 10.073 -12.914 -27.295 473 HA LEU 62 HA LEU 62 7.335 -12.259 -28.323 474 HB2 LEU 62 1HB LEU 62 9.184 -10.535 -26.641 475 HB3 LEU 62 2HB LEU 62 7.606 -10.076 -27.251 476 HG LEU 62 HG LEU 62 8.112 -12.176 -25.135 477 HD11 LEU 62 1HD1 LEU 62 7.102 -10.474 -23.634 478 HD12 LEU 62 2HD1 LEU 62 7.007 -9.339 -24.993 479 HD13 LEU 62 3HD1 LEU 62 8.591 -9.885 -24.387 480 HD21 LEU 62 1HD2 LEU 62 5.553 -11.080 -26.348 481 HD22 LEU 62 2HD2 LEU 62 5.618 -11.979 -24.819 482 HD23 LEU 62 3HD2 LEU 62 6.118 -12.777 -26.311 483 H LYS 63 H LYS 63 7.177 -10.541 -29.812 484 HA LYS 63 HA LYS 63 9.772 -9.797 -31.143 485 HB2 LYS 63 1HB LYS 63 8.321 -11.263 -32.522 486 HB3 LYS 63 2HB LYS 63 6.988 -10.136 -32.334 487 HG2 LYS 63 1HG LYS 63 7.886 -9.756 -34.502 488 HG3 LYS 63 2HG LYS 63 8.415 -8.390 -33.508 489 HD2 LYS 63 1HD LYS 63 10.626 -9.496 -33.208 490 HD3 LYS 63 2HD LYS 63 10.068 -10.854 -34.215 491 HE2 LYS 63 1HE LYS 63 9.659 -9.245 -36.083 492 HE3 LYS 63 2HE LYS 63 10.331 -7.945 -35.079 493 HZ1 LYS 63 1HZ LYS 63 12.004 -8.860 -36.575 494 HZ2 LYS 63 2HZ LYS 63 11.819 -10.371 -35.949 495 HZ3 LYS 63 3HZ LYS 63 12.435 -9.156 -35.010 496 H ILE 64 H ILE 64 10.243 -7.740 -30.682 497 HA ILE 64 HA ILE 64 8.347 -5.825 -29.679 498 HB ILE 64 HB ILE 64 11.071 -5.443 -31.021 499 HG12 ILE 64 1HG1 ILE 64 11.042 -6.688 -28.840 500 HG13 ILE 64 2HG1 ILE 64 11.985 -5.201 -28.840 501 HG21 ILE 64 1HG2 ILE 64 9.910 -3.350 -31.308 502 HG22 ILE 64 2HG2 ILE 64 9.259 -3.392 -29.653 503 HG23 ILE 64 3HG2 ILE 64 11.003 -3.126 -29.925 504 HD11 ILE 64 1HD1 ILE 64 10.670 -5.518 -26.718 505 HD12 ILE 64 2HD1 ILE 64 10.250 -4.015 -27.559 506 HD13 ILE 64 3HD1 ILE 64 9.165 -5.416 -27.656 507 H LEU 65 H LEU 65 6.979 -4.497 -30.714 508 HA LEU 65 HA LEU 65 7.207 -4.204 -33.663 509 HB2 LEU 65 1HB LEU 65 5.269 -5.838 -32.261 510 HB3 LEU 65 2HB LEU 65 4.444 -4.461 -32.987 511 HG LEU 65 HG LEU 65 6.260 -6.352 -34.519 512 HD11 LEU 65 1HD1 LEU 65 3.220 -6.322 -34.275 513 HD12 LEU 65 2HD1 LEU 65 4.329 -7.574 -33.638 514 HD13 LEU 65 3HD1 LEU 65 4.174 -7.334 -35.388 515 HD21 LEU 65 1HD2 LEU 65 4.286 -4.208 -35.413 516 HD22 LEU 65 2HD2 LEU 65 5.075 -5.376 -36.510 517 HD23 LEU 65 3HD2 LEU 65 6.049 -4.198 -35.626 518 H VAL 66 H VAL 66 6.431 -2.206 -34.363 519 HA VAL 66 HA VAL 66 5.765 -0.287 -32.198 520 HB VAL 66 HB VAL 66 6.037 1.450 -33.987 521 HG11 VAL 66 1HG1 VAL 66 7.964 0.777 -32.562 522 HG12 VAL 66 2HG1 VAL 66 8.424 -0.441 -33.783 523 HG13 VAL 66 3HG1 VAL 66 8.482 1.287 -34.192 524 HG21 VAL 66 1HG2 VAL 66 5.409 0.007 -35.950 525 HG22 VAL 66 2HG2 VAL 66 6.941 0.872 -36.193 526 HG23 VAL 66 3HG2 VAL 66 6.956 -0.859 -35.783 527 H GLY 67 H GLY 67 3.858 1.019 -32.389 528 HA2 GLY 67 1HA GLY 67 1.786 1.108 -34.053 529 HA3 GLY 67 2HA GLY 67 1.639 -0.575 -33.513 530 H MET 68 H MET 68 1.828 2.802 -32.342 531 HA MET 68 HA MET 68 0.970 2.080 -29.662 532 HB2 MET 68 1HB MET 68 0.889 4.765 -31.097 533 HB3 MET 68 2HB MET 68 0.692 4.514 -29.364 534 HG2 MET 68 1HG MET 68 2.889 5.209 -29.474 535 HG3 MET 68 2HG MET 68 3.064 3.446 -29.465 536 HE1 MET 68 1HE MET 68 3.563 6.802 -31.432 537 HE2 MET 68 2HE MET 68 3.763 6.276 -33.118 538 HE3 MET 68 3HE MET 68 2.170 6.164 -32.339 539 H TYR 69 H TYR 69 -1.089 1.948 -28.899 540 HA TYR 69 HA TYR 69 -3.285 1.937 -30.830 541 HB2 TYR 69 1HB TYR 69 -3.136 1.464 -27.826 542 HB3 TYR 69 2HB TYR 69 -4.632 1.386 -28.756 543 HD1 TYR 69 HD1 TYR 69 -1.380 -0.312 -28.138 544 HD2 TYR 69 HD2 TYR 69 -5.125 -0.456 -30.278 545 HE1 TYR 69 HE1 TYR 69 -0.958 -2.695 -28.727 546 HE2 TYR 69 HE2 TYR 69 -4.690 -2.834 -30.857 547 HH TYR 69 HH TYR 69 -3.286 -4.629 -30.628 548 H ASP 70 H ASP 70 -2.952 4.204 -31.415 549 HA ASP 70 HA ASP 70 -3.568 6.393 -31.428 550 HB2 ASP 70 1HB ASP 70 -5.930 5.293 -29.887 551 HB3 ASP 70 2HB ASP 70 -5.894 6.832 -30.775 552 H LYS 71 H LYS 71 -1.892 5.691 -29.079 553 HA LYS 71 HA LYS 71 -2.889 7.270 -26.868 554 HB2 LYS 71 1HB LYS 71 -0.098 6.249 -27.516 555 HB3 LYS 71 2HB LYS 71 -0.503 7.178 -26.066 556 HG2 LYS 71 1HG LYS 71 -2.267 5.410 -25.569 557 HG3 LYS 71 2HG LYS 71 -1.473 4.409 -26.814 558 HD2 LYS 71 1HD LYS 71 0.679 4.643 -25.567 559 HD3 LYS 71 2HD LYS 71 -0.172 5.595 -24.326 560 HE2 LYS 71 1HE LYS 71 -1.701 3.638 -23.955 561 HE3 LYS 71 2HE LYS 71 -0.701 2.685 -25.071 562 HZ1 LYS 71 1HZ LYS 71 0.171 3.881 -22.492 563 HZ2 LYS 71 2HZ LYS 71 1.197 3.141 -23.551 564 HZ3 LYS 71 3HZ LYS 71 -0.006 2.280 -22.824 565 H LYS 72 H LYS 72 -2.406 9.242 -26.207 566 HA LYS 72 HA LYS 72 -1.091 11.084 -28.161 567 HB2 LYS 72 1HB LYS 72 -2.652 12.795 -27.280 568 HB3 LYS 72 2HB LYS 72 -3.509 11.448 -28.010 569 HG2 LYS 72 1HG LYS 72 -3.973 10.507 -25.746 570 HG3 LYS 72 2HG LYS 72 -3.087 11.856 -25.017 571 HD2 LYS 72 1HD LYS 72 -5.381 12.366 -24.817 572 HD3 LYS 72 2HD LYS 72 -4.720 13.427 -26.086 573 HE2 LYS 72 1HE LYS 72 -5.643 11.893 -27.825 574 HE3 LYS 72 2HE LYS 72 -6.284 10.835 -26.548 575 HZ1 LYS 72 1HZ LYS 72 -7.958 12.382 -27.419 576 HZ2 LYS 72 2HZ LYS 72 -7.052 13.680 -26.956 577 HZ3 LYS 72 3HZ LYS 72 -7.678 12.660 -25.818 578 HA PRO 73 HA PRO 73 1.534 11.995 -24.691 579 HB2 PRO 73 1HB PRO 73 2.157 14.621 -24.935 580 HB3 PRO 73 2HB PRO 73 2.711 13.425 -26.152 581 HG2 PRO 73 1HG PRO 73 0.302 15.233 -26.259 582 HG3 PRO 73 2HG PRO 73 1.591 15.022 -27.477 583 HD2 PRO 73 1HD PRO 73 -0.766 13.704 -27.660 584 HD3 PRO 73 2HD PRO 73 0.779 12.914 -28.133 585 H ALA 74 H ALA 74 1.747 13.562 -22.732 586 HA ALA 74 HA ALA 74 -0.773 14.891 -21.969 587 HB1 ALA 74 1HB ALA 74 0.475 12.640 -20.305 588 HB2 ALA 74 2HB ALA 74 -0.921 13.644 -19.833 589 HB3 ALA 74 3HB ALA 74 -1.066 12.514 -21.203 590 H GLY 75 H GLY 75 -0.439 16.193 -19.988 591 HA2 GLY 75 1HA GLY 75 1.461 16.834 -18.350 592 HA3 GLY 75 2HA GLY 75 2.397 17.124 -19.835 593 H GLU 76 H GLU 76 -0.390 18.156 -17.889 594 HA GLU 76 HA GLU 76 -0.818 20.456 -19.724 595 HB2 GLU 76 1HB GLU 76 -2.991 20.639 -18.698 596 HB3 GLU 76 2HB GLU 76 -2.698 18.961 -19.190 597 HG2 GLU 76 1HG GLU 76 -2.005 18.500 -16.781 598 HG3 GLU 76 2HG GLU 76 -2.626 20.102 -16.371 599 H PHE 77 H PHE 77 0.919 19.899 -16.907 600 HA PHE 77 HA PHE 77 0.980 22.789 -16.401 601 HB2 PHE 77 1HB PHE 77 0.552 22.656 -14.047 602 HB3 PHE 77 2HB PHE 77 -0.808 21.871 -14.868 603 HD1 PHE 77 HD1 PHE 77 1.913 21.477 -12.463 604 HD2 PHE 77 HD2 PHE 77 -0.917 19.327 -14.884 605 HE1 PHE 77 HE1 PHE 77 2.255 19.452 -11.068 606 HE2 PHE 77 HE2 PHE 77 -0.578 17.299 -13.498 607 HZ PHE 77 HZ PHE 77 1.021 17.354 -11.593 608 H ILE 78 H ILE 78 2.848 23.393 -15.158 609 HA ILE 78 HA ILE 78 4.984 21.301 -15.086 610 HB ILE 78 HB ILE 78 6.585 23.041 -15.880 611 HG12 ILE 78 1HG1 ILE 78 4.133 24.767 -16.447 612 HG13 ILE 78 2HG1 ILE 78 5.185 24.997 -15.049 613 HG21 ILE 78 1HG2 ILE 78 4.234 22.745 -17.835 614 HG22 ILE 78 2HG2 ILE 78 5.957 22.989 -18.236 615 HG23 ILE 78 3HG2 ILE 78 5.433 21.471 -17.485 616 HD11 ILE 78 1HD1 ILE 78 7.118 25.383 -16.587 617 HD12 ILE 78 2HD1 ILE 78 5.990 25.295 -17.967 618 HD13 ILE 78 3HD1 ILE 78 5.813 26.580 -16.756 619 H VAL 79 H VAL 79 3.141 22.797 -13.104 620 HA VAL 79 HA VAL 79 3.207 23.638 -10.993 621 HB VAL 79 HB VAL 79 6.130 22.772 -10.807 622 HG11 VAL 79 1HG1 VAL 79 5.384 24.229 -8.960 623 HG12 VAL 79 2HG1 VAL 79 3.960 23.192 -8.693 624 HG13 VAL 79 3HG1 VAL 79 5.596 22.566 -8.383 625 HG21 VAL 79 1HG2 VAL 79 5.241 20.646 -9.859 626 HG22 VAL 79 2HG2 VAL 79 3.598 21.170 -10.270 627 HG23 VAL 79 3HG2 VAL 79 4.787 20.858 -11.560 628 H THR 80 H THR 80 2.859 25.696 -11.923 629 HA THR 80 HA THR 80 5.025 27.516 -12.491 630 HB THR 80 HB THR 80 2.997 29.183 -12.104 631 HG1 THR 80 HG1 THR 80 1.062 28.194 -11.951 632 HG21 THR 80 1HG2 THR 80 2.960 27.088 -14.322 633 HG22 THR 80 2HG2 THR 80 3.900 28.596 -14.329 634 HG23 THR 80 3HG2 THR 80 2.123 28.661 -14.348 635 H ASP 81 H ASP 81 2.900 26.912 -9.722 636 HA ASP 81 HA ASP 81 2.844 27.654 -7.563 637 HB2 ASP 81 1HB ASP 81 5.104 26.304 -7.841 638 HB3 ASP 81 2HB ASP 81 5.864 27.878 -7.514 639 HXT ASP 81 H02 ASP 81 4.510 29.297 -6.274 Start of MODEL 31 1 H2 GLY 1 2H0 GLY 1 4.225 11.961 -17.960 2 H GLY 1 1H0 GLY 1 2.863 12.001 -18.978 3 HA2 GLY 1 1HA GLY 1 3.940 9.564 -17.588 4 HA3 GLY 1 2HA GLY 1 2.434 9.574 -18.528 5 H SER 2 H SER 2 4.467 11.586 -20.176 6 HA SER 2 HA SER 2 4.896 9.714 -22.305 7 HB2 SER 2 1HB SER 2 6.422 12.300 -21.885 8 HB3 SER 2 2HB SER 2 6.101 11.477 -23.416 9 HG SER 2 HG SER 2 4.227 12.434 -23.466 10 H MET 3 H MET 3 6.916 10.836 -19.680 11 HA MET 3 HA MET 3 9.088 8.929 -20.487 12 HB2 MET 3 1HB MET 3 9.742 11.316 -20.822 13 HB3 MET 3 2HB MET 3 9.397 11.681 -19.118 14 HG2 MET 3 1HG MET 3 11.136 10.083 -18.462 15 HG3 MET 3 2HG MET 3 11.469 9.693 -20.138 16 HE1 MET 3 1HE MET 3 12.720 11.239 -21.878 17 HE2 MET 3 2HE MET 3 11.577 12.610 -21.734 18 HE3 MET 3 3HE MET 3 13.344 12.860 -21.517 19 H LYS 4 H LYS 4 8.286 7.309 -19.143 20 HA LYS 4 HA LYS 4 8.708 7.743 -16.263 21 HB2 LYS 4 1HB LYS 4 6.063 7.887 -17.299 22 HB3 LYS 4 2HB LYS 4 6.234 6.314 -16.509 23 HG2 LYS 4 1HG LYS 4 6.899 8.976 -15.189 24 HG3 LYS 4 2HG LYS 4 5.400 8.064 -14.926 25 HD2 LYS 4 1HD LYS 4 6.697 6.166 -14.068 26 HD3 LYS 4 2HD LYS 4 8.198 7.123 -14.251 27 HE2 LYS 4 1HE LYS 4 7.305 8.819 -12.736 28 HE3 LYS 4 2HE LYS 4 5.827 7.824 -12.509 29 HZ1 LYS 4 1HZ LYS 4 7.414 7.448 -10.744 30 HZ2 LYS 4 2HZ LYS 4 8.624 7.060 -11.808 31 HZ3 LYS 4 3HZ LYS 4 7.304 6.067 -11.627 32 H TYR 5 H TYR 5 7.755 5.455 -18.817 33 HA TYR 5 HA TYR 5 9.599 3.488 -17.679 34 HB2 TYR 5 1HB TYR 5 7.975 1.682 -17.527 35 HB3 TYR 5 2HB TYR 5 7.386 3.009 -16.569 36 HD1 TYR 5 HD1 TYR 5 5.510 4.505 -17.510 37 HD2 TYR 5 HD2 TYR 5 6.639 0.767 -19.298 38 HE1 TYR 5 HE1 TYR 5 3.287 4.396 -18.630 39 HE2 TYR 5 HE2 TYR 5 4.379 0.623 -20.432 40 HH TYR 5 HH TYR 5 1.952 3.201 -20.156 41 H LEU 6 H LEU 6 9.260 1.414 -19.443 42 HA LEU 6 HA LEU 6 10.396 2.567 -21.783 43 HB2 LEU 6 1HB LEU 6 9.306 -0.172 -21.208 44 HB3 LEU 6 2HB LEU 6 10.102 0.226 -22.740 45 HG LEU 6 HG LEU 6 11.398 0.563 -19.990 46 HD11 LEU 6 1HD1 LEU 6 11.669 -1.744 -22.012 47 HD12 LEU 6 2HD1 LEU 6 10.783 -1.789 -20.458 48 HD13 LEU 6 3HD1 LEU 6 12.545 -1.545 -20.450 49 HD21 LEU 6 1HD2 LEU 6 12.440 0.581 -22.862 50 HD22 LEU 6 2HD2 LEU 6 13.468 0.563 -21.414 51 HD23 LEU 6 3HD2 LEU 6 12.414 1.939 -21.711 52 H ASN 7 H ASN 7 7.143 1.288 -21.312 53 HA ASN 7 HA ASN 7 5.271 1.381 -22.523 54 HB2 ASN 7 1HB ASN 7 5.804 3.752 -21.736 55 HB3 ASN 7 2HB ASN 7 6.270 4.109 -23.396 56 HD21 ASN 7 1HD2 ASN 7 2.958 5.145 -23.821 57 HD22 ASN 7 2HD2 ASN 7 4.630 5.603 -23.616 58 H VAL 8 H VAL 8 7.176 -0.054 -24.031 59 HA VAL 8 HA VAL 8 6.150 0.552 -26.789 60 HB VAL 8 HB VAL 8 8.055 -0.851 -27.609 61 HG11 VAL 8 1HG1 VAL 8 9.784 0.918 -27.401 62 HG12 VAL 8 2HG1 VAL 8 8.171 1.560 -27.763 63 HG13 VAL 8 3HG1 VAL 8 8.827 1.699 -26.081 64 HG21 VAL 8 1HG2 VAL 8 8.532 -1.935 -25.373 65 HG22 VAL 8 2HG2 VAL 8 9.962 -1.370 -26.217 66 HG23 VAL 8 3HG2 VAL 8 9.329 -0.429 -24.840 67 H LEU 9 H LEU 9 5.756 -1.597 -27.975 68 HA LEU 9 HA LEU 9 4.824 -3.639 -25.971 69 HB2 LEU 9 1HB LEU 9 2.844 -3.888 -27.638 70 HB3 LEU 9 2HB LEU 9 2.823 -2.614 -26.395 71 HG LEU 9 HG LEU 9 3.925 -1.705 -28.979 72 HD11 LEU 9 1HD1 LEU 9 0.967 -2.507 -28.800 73 HD12 LEU 9 2HD1 LEU 9 2.216 -3.288 -29.823 74 HD13 LEU 9 3HD1 LEU 9 1.747 -1.632 -30.152 75 HD21 LEU 9 1HD2 LEU 9 1.668 -0.681 -27.201 76 HD22 LEU 9 2HD2 LEU 9 2.500 0.210 -28.498 77 HD23 LEU 9 3HD2 LEU 9 3.372 -0.275 -27.005 78 H ALA 10 H ALA 10 4.373 -5.693 -26.891 79 HA ALA 10 HA ALA 10 6.049 -6.279 -29.299 80 HB1 ALA 10 1HB ALA 10 7.409 -6.515 -27.280 81 HB2 ALA 10 2HB ALA 10 6.201 -7.622 -26.584 82 HB3 ALA 10 3HB ALA 10 7.106 -8.119 -28.032 83 H LYS 11 H LYS 11 5.732 -8.464 -30.100 84 HA LYS 11 HA LYS 11 2.889 -9.433 -29.684 85 HB2 LYS 11 1HB LYS 11 3.420 -8.855 -32.040 86 HB3 LYS 11 2HB LYS 11 4.882 -9.866 -31.957 87 HG2 LYS 11 1HG LYS 11 3.378 -11.812 -31.550 88 HG3 LYS 11 2HG LYS 11 1.976 -10.789 -31.816 89 HD2 LYS 11 1HD LYS 11 2.723 -10.361 -34.074 90 HD3 LYS 11 2HD LYS 11 4.219 -11.277 -33.782 91 HE2 LYS 11 1HE LYS 11 2.862 -13.308 -33.287 92 HE3 LYS 11 2HE LYS 11 1.400 -12.389 -33.748 93 HZ1 LYS 11 1HZ LYS 11 3.677 -13.035 -35.524 94 HZ2 LYS 11 2HZ LYS 11 2.351 -12.144 -35.961 95 HZ3 LYS 11 3HZ LYS 11 2.191 -13.764 -35.555 96 H ALA 12 H ALA 12 2.551 -11.407 -28.822 97 HA ALA 12 HA ALA 12 4.848 -12.960 -27.897 98 HB1 ALA 12 1HB ALA 12 3.014 -14.616 -27.268 99 HB2 ALA 12 2HB ALA 12 2.807 -13.009 -26.585 100 HB3 ALA 12 3HB ALA 12 1.839 -13.502 -28.002 101 H LEU 13 H LEU 13 6.008 -14.304 -29.184 102 HA LEU 13 HA LEU 13 4.881 -15.033 -31.827 103 HB2 LEU 13 1HB LEU 13 7.589 -15.525 -30.532 104 HB3 LEU 13 2HB LEU 13 7.206 -15.989 -32.165 105 HG LEU 13 HG LEU 13 7.229 -13.105 -31.164 106 HD11 LEU 13 1HD1 LEU 13 9.263 -14.633 -32.821 107 HD12 LEU 13 2HD1 LEU 13 9.454 -14.148 -31.148 108 HD13 LEU 13 3HD1 LEU 13 9.311 -12.916 -32.393 109 HD21 LEU 13 1HD2 LEU 13 7.047 -14.268 -33.984 110 HD22 LEU 13 2HD2 LEU 13 7.155 -12.538 -33.554 111 HD23 LEU 13 3HD2 LEU 13 5.728 -13.459 -33.102 112 H TYR 14 H TYR 14 5.117 -16.307 -28.690 113 HA TYR 14 HA TYR 14 4.326 -19.050 -29.626 114 HB2 TYR 14 1HB TYR 14 6.345 -18.460 -27.434 115 HB3 TYR 14 2HB TYR 14 5.793 -20.060 -27.989 116 HD1 TYR 14 HD1 TYR 14 8.098 -17.279 -28.520 117 HD2 TYR 14 HD2 TYR 14 6.525 -20.800 -30.378 118 HE1 TYR 14 HE1 TYR 14 9.992 -17.243 -30.179 119 HE2 TYR 14 HE2 TYR 14 8.376 -20.757 -32.010 120 HH TYR 14 HH TYR 14 10.884 -18.246 -32.019 121 H ASP 15 H ASP 15 3.368 -20.241 -27.628 122 HA ASP 15 HA ASP 15 1.780 -18.285 -26.031 123 HB2 ASP 15 1HB ASP 15 0.250 -20.210 -25.741 124 HB3 ASP 15 2HB ASP 15 0.558 -19.807 -27.422 125 H ASN 16 H ASN 16 1.254 -18.937 -23.776 126 HA ASN 16 HA ASN 16 2.951 -20.902 -22.444 127 HB2 ASN 16 1HB ASN 16 4.254 -18.716 -22.505 128 HB3 ASN 16 2HB ASN 16 2.957 -17.994 -21.549 129 HD21 ASN 16 1HD2 ASN 16 4.633 -19.007 -18.629 130 HD22 ASN 16 2HD2 ASN 16 3.776 -17.730 -19.564 131 H VAL 17 H VAL 17 2.256 -21.339 -20.265 132 HA VAL 17 HA VAL 17 -0.273 -20.010 -19.425 133 HB VAL 17 HB VAL 17 0.502 -22.944 -19.069 134 HG11 VAL 17 1HG1 VAL 17 -0.751 -22.002 -17.166 135 HG12 VAL 17 2HG1 VAL 17 -2.015 -21.486 -18.282 136 HG13 VAL 17 3HG1 VAL 17 -1.721 -23.213 -18.068 137 HG21 VAL 17 1HG2 VAL 17 -0.165 -22.611 -21.376 138 HG22 VAL 17 2HG2 VAL 17 -1.498 -23.389 -20.523 139 HG23 VAL 17 3HG2 VAL 17 -1.594 -21.652 -20.827 140 H ALA 18 H ALA 18 0.034 -19.098 -17.399 141 HA ALA 18 HA ALA 18 2.679 -19.160 -16.334 142 HB1 ALA 18 1HB ALA 18 1.253 -17.177 -16.194 143 HB2 ALA 18 2HB ALA 18 0.102 -18.085 -15.164 144 HB3 ALA 18 3HB ALA 18 1.750 -17.720 -14.585 145 H GLU 19 H GLU 19 3.596 -20.370 -14.807 146 HA GLU 19 HA GLU 19 1.897 -22.324 -13.285 147 HB2 GLU 19 1HB GLU 19 4.907 -22.045 -13.670 148 HB3 GLU 19 2HB GLU 19 4.152 -23.309 -12.686 149 HG2 GLU 19 1HG GLU 19 3.676 -22.968 -15.697 150 HG3 GLU 19 2HG GLU 19 4.947 -23.951 -15.022 151 H SER 20 H SER 20 4.349 -19.773 -13.106 152 HA SER 20 HA SER 20 4.172 -19.599 -10.171 153 HB2 SER 20 1HB SER 20 6.353 -19.277 -11.227 154 HB3 SER 20 2HB SER 20 5.684 -17.998 -12.268 155 HG SER 20 HG SER 20 6.793 -17.188 -10.434 156 HA PRO 21 HA PRO 21 0.993 -16.498 -10.574 157 HB2 PRO 21 1HB PRO 21 1.136 -15.133 -8.229 158 HB3 PRO 21 2HB PRO 21 0.596 -16.833 -8.273 159 HG2 PRO 21 1HG PRO 21 3.326 -15.740 -7.676 160 HG3 PRO 21 2HG PRO 21 2.332 -16.903 -6.739 161 HD2 PRO 21 1HD PRO 21 4.247 -17.767 -8.445 162 HD3 PRO 21 2HD PRO 21 2.703 -18.661 -8.225 163 H ASP 22 H ASP 22 4.326 -15.669 -10.204 164 HA ASP 22 HA ASP 22 4.075 -12.802 -10.625 165 HB2 ASP 22 1HB ASP 22 6.202 -14.800 -10.245 166 HB3 ASP 22 2HB ASP 22 6.638 -13.484 -11.342 167 H GLU 23 H GLU 23 4.059 -15.668 -12.520 168 HA GLU 23 HA GLU 23 5.226 -14.496 -14.925 169 HB2 GLU 23 1HB GLU 23 5.592 -16.829 -14.092 170 HB3 GLU 23 2HB GLU 23 3.919 -17.172 -14.422 171 HG2 GLU 23 1HG GLU 23 4.247 -16.872 -16.813 172 HG3 GLU 23 2HG GLU 23 5.941 -16.343 -16.501 173 H LEU 24 H LEU 24 4.099 -14.375 -16.934 174 HA LEU 24 HA LEU 24 1.172 -13.870 -16.584 175 HB2 LEU 24 1HB LEU 24 3.369 -12.560 -17.983 176 HB3 LEU 24 2HB LEU 24 2.078 -12.994 -19.100 177 HG LEU 24 HG LEU 24 1.652 -11.322 -16.580 178 HD11 LEU 24 1HD1 LEU 24 1.505 -9.442 -18.153 179 HD12 LEU 24 2HD1 LEU 24 1.943 -10.518 -19.506 180 HD13 LEU 24 3HD1 LEU 24 3.069 -10.181 -18.175 181 HD21 LEU 24 1HD2 LEU 24 -0.418 -12.399 -17.188 182 HD22 LEU 24 2HD2 LEU 24 -0.160 -12.087 -18.929 183 HD23 LEU 24 3HD2 LEU 24 -0.501 -10.727 -17.801 184 H SER 25 H SER 25 -0.308 -15.039 -17.682 185 HA SER 25 HA SER 25 0.605 -17.160 -19.488 186 HB2 SER 25 1HB SER 25 -2.182 -16.217 -18.646 187 HB3 SER 25 2HB SER 25 -1.877 -17.560 -19.728 188 HG SER 25 HG SER 25 -2.174 -18.003 -17.391 189 H PHE 26 H PHE 26 0.829 -16.701 -21.639 190 HA PHE 26 HA PHE 26 -0.816 -14.471 -22.787 191 HB2 PHE 26 1HB PHE 26 1.191 -13.711 -24.097 192 HB3 PHE 26 2HB PHE 26 1.343 -13.428 -22.356 193 HD1 PHE 26 HD1 PHE 26 2.996 -14.625 -21.025 194 HD2 PHE 26 HD2 PHE 26 2.575 -15.397 -25.236 195 HE1 PHE 26 HE1 PHE 26 5.241 -15.681 -21.043 196 HE2 PHE 26 HE2 PHE 26 4.816 -16.503 -25.205 197 HZ PHE 26 HZ PHE 26 6.168 -16.596 -23.159 198 H ARG 27 H ARG 27 -0.893 -14.753 -25.209 199 HA ARG 27 HA ARG 27 -0.373 -17.627 -25.949 200 HB2 ARG 27 1HB ARG 27 -2.853 -15.992 -26.571 201 HB3 ARG 27 2HB ARG 27 -2.442 -17.572 -27.284 202 HG2 ARG 27 1HG ARG 27 -2.339 -18.551 -25.000 203 HG3 ARG 27 2HG ARG 27 -2.959 -17.050 -24.331 204 HD2 ARG 27 1HD ARG 27 -4.369 -18.711 -26.470 205 HD3 ARG 27 2HD ARG 27 -4.689 -18.839 -24.744 206 HE ARG 27 HE ARG 27 -4.879 -16.113 -25.657 207 HH11 ARG 27 1HH1 ARG 27 -6.716 -19.134 -25.595 208 HH12 ARG 27 2HH1 ARG 27 -8.257 -18.297 -25.646 209 HH21 ARG 27 1HH2 ARG 27 -6.885 -15.127 -25.709 210 HH22 ARG 27 2HH2 ARG 27 -8.350 -16.105 -25.695 211 H LYS 28 H LYS 28 0.050 -18.092 -28.043 212 HA LYS 28 HA LYS 28 1.653 -16.263 -29.468 213 HB2 LYS 28 1HB LYS 28 1.319 -17.866 -31.386 214 HB3 LYS 28 2HB LYS 28 1.908 -18.601 -29.897 215 HG2 LYS 28 1HG LYS 28 -0.376 -19.406 -29.397 216 HG3 LYS 28 2HG LYS 28 -0.957 -18.697 -30.887 217 HD2 LYS 28 1HD LYS 28 0.560 -20.134 -32.181 218 HD3 LYS 28 2HD LYS 28 1.200 -20.819 -30.642 219 HE2 LYS 28 1HE LYS 28 -1.047 -21.656 -30.091 220 HE3 LYS 28 2HE LYS 28 -1.689 -20.950 -31.629 221 HZ1 LYS 28 1HZ LYS 28 0.359 -23.073 -31.416 222 HZ2 LYS 28 2HZ LYS 28 -0.225 -22.451 -32.815 223 HZ3 LYS 28 3HZ LYS 28 -1.223 -23.309 -31.832 224 H GLY 29 H GLY 29 1.271 -14.535 -30.608 225 HA2 GLY 29 1HA GLY 29 0.216 -13.476 -32.463 226 HA3 GLY 29 2HA GLY 29 -1.307 -14.288 -32.137 227 H ASP 30 H ASP 30 -0.490 -13.507 -29.117 228 HA ASP 30 HA ASP 30 -2.258 -11.205 -29.141 229 HB2 ASP 30 1HB ASP 30 -1.821 -13.227 -27.415 230 HB3 ASP 30 2HB ASP 30 -0.749 -11.993 -26.656 231 H ILE 31 H ILE 31 -1.792 -9.179 -27.935 232 HA ILE 31 HA ILE 31 1.080 -8.298 -28.300 233 HB ILE 31 HB ILE 31 -1.464 -6.633 -28.584 234 HG12 ILE 31 1HG1 ILE 31 -1.269 -8.229 -30.458 235 HG13 ILE 31 2HG1 ILE 31 -1.071 -6.577 -30.976 236 HG21 ILE 31 1HG2 ILE 31 1.461 -5.886 -29.119 237 HG22 ILE 31 2HG2 ILE 31 0.050 -4.868 -29.503 238 HG23 ILE 31 3HG2 ILE 31 0.429 -5.243 -27.807 239 HD11 ILE 31 1HD1 ILE 31 1.097 -8.665 -30.718 240 HD12 ILE 31 2HD1 ILE 31 0.527 -7.885 -32.188 241 HD13 ILE 31 3HD1 ILE 31 1.469 -6.965 -30.995 242 H MET 32 H MET 32 2.012 -7.229 -26.550 243 HA MET 32 HA MET 32 0.297 -6.355 -24.294 244 HB2 MET 32 1HB MET 32 1.754 -7.553 -22.683 245 HB3 MET 32 2HB MET 32 0.735 -8.613 -23.698 246 HG2 MET 32 1HG MET 32 3.043 -8.578 -25.146 247 HG3 MET 32 2HG MET 32 3.666 -8.417 -23.535 248 HE1 MET 32 1HE MET 32 0.476 -10.370 -25.053 249 HE2 MET 32 2HE MET 32 1.868 -10.527 -26.181 250 HE3 MET 32 3HE MET 32 1.261 -11.944 -25.295 251 H THR 33 H THR 33 1.303 -4.834 -22.920 252 HA THR 33 HA THR 33 3.409 -3.260 -24.240 253 HB THR 33 HB THR 33 2.147 -2.892 -21.491 254 HG1 THR 33 HG1 THR 33 0.894 -1.334 -22.948 255 HG21 THR 33 1HG2 THR 33 3.428 -0.977 -23.488 256 HG22 THR 33 2HG2 THR 33 4.090 -1.455 -21.938 257 HG23 THR 33 3HG2 THR 33 2.603 -0.484 -21.996 258 H VAL 34 H VAL 34 5.587 -3.254 -23.719 259 HA VAL 34 HA VAL 34 6.417 -4.972 -21.478 260 HB VAL 34 HB VAL 34 8.021 -3.540 -23.624 261 HG11 VAL 34 1HG1 VAL 34 8.917 -5.307 -21.353 262 HG12 VAL 34 2HG1 VAL 34 9.952 -4.882 -22.747 263 HG13 VAL 34 3HG1 VAL 34 9.355 -3.616 -21.647 264 HG21 VAL 34 1HG2 VAL 34 8.494 -5.789 -24.483 265 HG22 VAL 34 2HG2 VAL 34 7.542 -6.530 -23.129 266 HG23 VAL 34 3HG2 VAL 34 6.765 -5.558 -24.390 267 H LEU 35 H LEU 35 6.820 -4.174 -19.531 268 HA LEU 35 HA LEU 35 6.680 -1.237 -19.228 269 HB2 LEU 35 1HB LEU 35 6.725 -3.423 -17.131 270 HB3 LEU 35 2HB LEU 35 6.412 -1.737 -16.875 271 HG LEU 35 HG LEU 35 4.616 -3.771 -18.206 272 HD11 LEU 35 1HD1 LEU 35 3.137 -3.058 -16.343 273 HD12 LEU 35 2HD1 LEU 35 4.432 -2.014 -15.735 274 HD13 LEU 35 3HD1 LEU 35 4.675 -3.763 -15.773 275 HD21 LEU 35 1HD2 LEU 35 2.947 -1.996 -18.517 276 HD22 LEU 35 2HD2 LEU 35 4.365 -1.602 -19.464 277 HD23 LEU 35 3HD2 LEU 35 4.066 -0.765 -17.922 278 H GLU 36 H GLU 36 8.699 -4.016 -18.189 279 HA GLU 36 HA GLU 36 11.094 -2.241 -17.905 280 HB2 GLU 36 1HB GLU 36 9.751 -2.802 -15.724 281 HB3 GLU 36 2HB GLU 36 10.314 -4.478 -15.969 282 HG2 GLU 36 1HG GLU 36 11.729 -3.457 -14.352 283 HG3 GLU 36 2HG GLU 36 12.660 -3.610 -15.863 284 H ARG 37 H ARG 37 13.109 -3.695 -17.933 285 HA ARG 37 HA ARG 37 12.604 -6.349 -19.194 286 HB2 ARG 37 1HB ARG 37 14.598 -4.244 -20.140 287 HB3 ARG 37 2HB ARG 37 14.567 -5.944 -20.648 288 HG2 ARG 37 1HG ARG 37 12.213 -5.572 -21.521 289 HG3 ARG 37 2HG ARG 37 12.421 -3.861 -21.208 290 HD2 ARG 37 1HD ARG 37 14.150 -5.542 -22.989 291 HD3 ARG 37 2HD ARG 37 12.854 -4.386 -23.529 292 HE ARG 37 HE ARG 37 14.655 -2.989 -21.868 293 HH11 ARG 37 1HH1 ARG 37 14.876 -4.650 -24.964 294 HH12 ARG 37 2HH1 ARG 37 16.202 -3.635 -25.511 295 HH21 ARG 37 1HH2 ARG 37 16.295 -1.729 -22.631 296 HH22 ARG 37 2HH2 ARG 37 16.964 -1.983 -24.249 297 H ASP 38 H ASP 38 14.121 -7.888 -18.709 298 HA ASP 38 HA ASP 38 15.454 -9.057 -17.329 299 HB2 ASP 38 1HB ASP 38 17.178 -6.567 -17.275 300 HB3 ASP 38 2HB ASP 38 17.694 -8.225 -16.937 301 H THR 39 H THR 39 13.266 -7.929 -16.360 302 HA THR 39 HA THR 39 13.514 -6.409 -13.958 303 HB THR 39 HB THR 39 11.473 -6.560 -15.401 304 HG1 THR 39 HG1 THR 39 11.350 -7.174 -12.626 305 HG21 THR 39 1HG2 THR 39 11.084 -9.325 -14.119 306 HG22 THR 39 2HG2 THR 39 11.427 -8.994 -15.841 307 HG23 THR 39 3HG2 THR 39 9.903 -8.458 -15.152 308 H GLN 40 H GLN 40 14.141 -9.741 -14.423 309 HA GLN 40 HA GLN 40 13.637 -10.298 -11.494 310 HB2 GLN 40 1HB GLN 40 13.331 -11.841 -13.959 311 HB3 GLN 40 2HB GLN 40 14.247 -12.705 -12.722 312 HG2 GLN 40 1HG GLN 40 12.006 -11.503 -11.447 313 HG3 GLN 40 2HG GLN 40 11.449 -12.253 -12.941 314 HE21 GLN 40 1HE2 GLN 40 12.799 -14.588 -9.923 315 HE22 GLN 40 2HE2 GLN 40 13.076 -12.858 -9.891 316 H GLY 41 H GLY 41 16.071 -9.222 -13.484 317 HA2 GLY 41 1HA GLY 41 18.346 -9.082 -13.085 318 HA3 GLY 41 2HA GLY 41 18.199 -10.365 -11.804 319 H LEU 42 H LEU 42 16.441 -11.611 -14.126 320 HA LEU 42 HA LEU 42 18.623 -13.193 -15.334 321 HB2 LEU 42 1HB LEU 42 15.588 -13.424 -15.512 322 HB3 LEU 42 2HB LEU 42 16.729 -14.515 -16.302 323 HG LEU 42 HG LEU 42 16.460 -14.202 -13.288 324 HD11 LEU 42 1HD1 LEU 42 14.394 -15.156 -14.390 325 HD12 LEU 42 2HD1 LEU 42 15.271 -16.381 -13.427 326 HD13 LEU 42 3HD1 LEU 42 15.434 -16.367 -15.207 327 HD21 LEU 42 1HD2 LEU 42 17.797 -16.284 -13.200 328 HD22 LEU 42 2HD2 LEU 42 18.730 -14.988 -13.926 329 HD23 LEU 42 3HD2 LEU 42 18.019 -16.256 -14.970 330 H ASP 43 H ASP 43 19.493 -12.425 -17.164 331 HA ASP 43 HA ASP 43 18.305 -10.340 -18.686 332 HB2 ASP 43 1HB ASP 43 20.519 -12.346 -19.304 333 HB3 ASP 43 2HB ASP 43 19.969 -11.183 -20.495 334 H GLY 44 H GLY 44 17.042 -10.304 -20.390 335 HA2 GLY 44 1HA GLY 44 15.928 -11.233 -22.248 336 HA3 GLY 44 2HA GLY 44 16.288 -12.871 -21.676 337 H TRP 45 H TRP 45 15.112 -11.335 -18.942 338 HA TRP 45 HA TRP 45 12.320 -12.274 -19.598 339 HB2 TRP 45 1HB TRP 45 13.926 -12.291 -17.043 340 HB3 TRP 45 2HB TRP 45 12.184 -12.274 -17.005 341 HD1 TRP 45 HD1 TRP 45 15.064 -14.481 -18.285 342 HE1 TRP 45 HE1 TRP 45 14.269 -16.857 -18.596 343 HE3 TRP 45 HE3 TRP 45 10.127 -13.706 -17.333 344 HZ2 TRP 45 HZ2 TRP 45 11.811 -18.281 -18.382 345 HZ3 TRP 45 HZ3 TRP 45 8.569 -15.648 -17.365 346 HH2 TRP 45 HH2 TRP 45 9.422 -17.931 -17.908 347 H TRP 46 H TRP 46 10.834 -10.753 -19.940 348 HA TRP 46 HA TRP 46 11.437 -8.006 -18.875 349 HB2 TRP 46 1HB TRP 46 9.791 -8.889 -21.265 350 HB3 TRP 46 2HB TRP 46 10.148 -7.216 -20.807 351 HD1 TRP 46 HD1 TRP 46 13.376 -8.684 -20.271 352 HE1 TRP 46 HE1 TRP 46 14.885 -8.687 -22.345 353 HE3 TRP 46 HE3 TRP 46 9.771 -7.731 -23.823 354 HZ2 TRP 46 HZ2 TRP 46 14.557 -8.394 -25.162 355 HZ3 TRP 46 HZ3 TRP 46 10.469 -7.668 -26.195 356 HH2 TRP 46 HH2 TRP 46 12.830 -8.022 -26.866 357 H LEU 47 H LEU 47 9.829 -6.767 -17.957 358 HA LEU 47 HA LEU 47 7.548 -8.258 -16.804 359 HB2 LEU 47 1HB LEU 47 8.990 -6.460 -15.603 360 HB3 LEU 47 2HB LEU 47 8.254 -5.290 -16.640 361 HG LEU 47 HG LEU 47 6.024 -5.889 -15.683 362 HD11 LEU 47 1HD1 LEU 47 6.471 -8.169 -14.897 363 HD12 LEU 47 2HD1 LEU 47 6.000 -7.162 -13.562 364 HD13 LEU 47 3HD1 LEU 47 7.729 -7.540 -13.778 365 HD21 LEU 47 1HD2 LEU 47 7.340 -3.974 -14.862 366 HD22 LEU 47 2HD2 LEU 47 8.232 -5.056 -13.718 367 HD23 LEU 47 3HD2 LEU 47 6.477 -4.739 -13.516 368 H CYS 48 H CYS 48 5.662 -8.343 -17.968 369 HA CYS 48 HA CYS 48 5.124 -6.151 -19.913 370 HB2 CYS 48 1HB CYS 48 4.367 -9.086 -20.062 371 HB3 CYS 48 2HB CYS 48 3.812 -7.854 -21.203 372 HG CYS 48 HG CYS 48 6.902 -8.759 -20.483 373 H SER 49 H SER 49 2.762 -5.742 -20.263 374 HA SER 49 HA SER 49 1.118 -6.487 -17.886 375 HB2 SER 49 1HB SER 49 1.739 -4.205 -17.502 376 HB3 SER 49 2HB SER 49 1.356 -3.780 -19.205 377 HG SER 49 HG SER 49 -0.253 -3.652 -17.148 378 H LEU 50 H LEU 50 -0.825 -7.221 -18.297 379 HA LEU 50 HA LEU 50 -2.238 -6.823 -20.863 380 HB2 LEU 50 1HB LEU 50 -0.506 -8.623 -21.289 381 HB3 LEU 50 2HB LEU 50 -1.254 -9.574 -19.998 382 HG LEU 50 HG LEU 50 -3.367 -9.585 -21.364 383 HD11 LEU 50 1HD1 LEU 50 -1.524 -8.376 -23.413 384 HD12 LEU 50 2HD1 LEU 50 -3.018 -7.719 -22.846 385 HD13 LEU 50 3HD1 LEU 50 -3.029 -9.207 -23.824 386 HD21 LEU 50 1HD2 LEU 50 -1.809 -11.513 -21.328 387 HD22 LEU 50 2HD2 LEU 50 -0.892 -10.780 -22.685 388 HD23 LEU 50 3HD2 LEU 50 -2.554 -11.330 -22.950 389 H HIS 51 H HIS 51 -4.444 -7.145 -20.485 390 HA HIS 51 HA HIS 51 -6.405 -7.518 -19.316 391 HB2 HIS 51 1HB HIS 51 -5.527 -9.905 -19.728 392 HB3 HIS 51 2HB HIS 51 -4.975 -9.884 -18.084 393 HD1 HIS 51 HD1 HIS 51 -8.233 -9.506 -20.037 394 HD2 HIS 51 HD2 HIS 51 -6.860 -10.608 -16.286 395 HE1 HIS 51 HE1 HIS 51 -10.250 -10.313 -18.724 396 H GLY 52 H GLY 52 -4.557 -5.669 -18.072 397 HA2 GLY 52 1HA GLY 52 -4.694 -4.388 -16.165 398 HA3 GLY 52 2HA GLY 52 -5.916 -5.506 -15.524 399 H ARG 53 H ARG 53 -3.279 -7.346 -16.364 400 HA ARG 53 HA ARG 53 -2.175 -7.250 -13.586 401 HB2 ARG 53 1HB ARG 53 -2.260 -9.541 -15.591 402 HB3 ARG 53 2HB ARG 53 -1.571 -9.605 -13.960 403 HG2 ARG 53 1HG ARG 53 -3.823 -9.269 -12.990 404 HG3 ARG 53 2HG ARG 53 -4.513 -9.114 -14.637 405 HD2 ARG 53 1HD ARG 53 -3.614 -11.455 -15.098 406 HD3 ARG 53 2HD ARG 53 -3.177 -11.561 -13.370 407 HE ARG 53 HE ARG 53 -5.871 -11.640 -14.590 408 HH11 ARG 53 1HH1 ARG 53 -3.992 -11.370 -11.617 409 HH12 ARG 53 2HH1 ARG 53 -5.344 -11.810 -10.564 410 HH21 ARG 53 1HH2 ARG 53 -7.554 -12.229 -13.285 411 HH22 ARG 53 2HH2 ARG 53 -7.370 -12.297 -11.540 412 H GLN 54 H GLN 54 0.206 -7.774 -13.583 413 HA GLN 54 HA GLN 54 1.506 -7.447 -16.177 414 HB2 GLN 54 1HB GLN 54 3.125 -5.850 -15.157 415 HB3 GLN 54 2HB GLN 54 1.511 -5.167 -15.352 416 HG2 GLN 54 1HG GLN 54 1.103 -5.733 -12.931 417 HG3 GLN 54 2HG GLN 54 2.846 -6.083 -12.794 418 HE21 GLN 54 1HE2 GLN 54 3.520 -2.754 -12.178 419 HE22 GLN 54 2HE2 GLN 54 3.898 -4.445 -11.952 420 H GLY 55 H GLY 55 3.444 -8.631 -16.177 421 HA2 GLY 55 1HA GLY 55 4.371 -9.984 -13.809 422 HA3 GLY 55 2HA GLY 55 3.318 -11.022 -14.786 423 H ILE 56 H ILE 56 5.748 -11.964 -14.600 424 HA ILE 56 HA ILE 56 7.586 -10.730 -16.510 425 HB ILE 56 HB ILE 56 9.182 -12.426 -15.809 426 HG12 ILE 56 1HG1 ILE 56 6.943 -13.617 -14.134 427 HG13 ILE 56 2HG1 ILE 56 7.533 -14.342 -15.623 428 HG21 ILE 56 1HG2 ILE 56 8.593 -10.373 -14.354 429 HG22 ILE 56 2HG2 ILE 56 7.656 -11.504 -13.351 430 HG23 ILE 56 3HG2 ILE 56 9.364 -11.728 -13.531 431 HD11 ILE 56 1HD1 ILE 56 9.073 -13.986 -13.071 432 HD12 ILE 56 2HD1 ILE 56 8.556 -15.501 -13.878 433 HD13 ILE 56 3HD1 ILE 56 9.798 -14.463 -14.635 434 H VAL 57 H VAL 57 8.239 -11.389 -18.410 435 HA VAL 57 HA VAL 57 7.004 -13.788 -19.661 436 HB VAL 57 HB VAL 57 7.012 -10.916 -20.793 437 HG11 VAL 57 1HG1 VAL 57 6.287 -13.576 -22.155 438 HG12 VAL 57 2HG1 VAL 57 5.810 -11.977 -22.776 439 HG13 VAL 57 3HG1 VAL 57 7.539 -12.394 -22.673 440 HG21 VAL 57 1HG2 VAL 57 4.773 -12.816 -20.040 441 HG22 VAL 57 2HG2 VAL 57 5.141 -11.195 -19.349 442 HG23 VAL 57 3HG2 VAL 57 4.530 -11.324 -21.012 443 HA PRO 58 HA PRO 58 11.299 -13.859 -20.933 444 HB2 PRO 58 1HB PRO 58 11.258 -15.890 -22.776 445 HB3 PRO 58 2HB PRO 58 11.250 -16.158 -21.012 446 HG2 PRO 58 1HG PRO 58 8.908 -16.140 -22.934 447 HG3 PRO 58 2HG PRO 58 9.306 -17.328 -21.631 448 HD2 PRO 58 1HD PRO 58 7.503 -15.389 -21.292 449 HD3 PRO 58 2HD PRO 58 8.567 -15.953 -19.954 450 H GLY 59 H GLY 59 12.003 -12.207 -22.146 451 HA2 GLY 59 1HA GLY 59 10.552 -11.210 -24.391 452 HA3 GLY 59 2HA GLY 59 12.179 -10.720 -23.853 453 H ASN 60 H ASN 60 12.911 -13.733 -24.146 454 HA ASN 60 HA ASN 60 13.839 -13.582 -26.885 455 HB2 ASN 60 1HB ASN 60 13.552 -15.976 -25.040 456 HB3 ASN 60 2HB ASN 60 14.490 -15.956 -26.568 457 HD21 ASN 60 1HD2 ASN 60 16.677 -15.324 -23.497 458 HD22 ASN 60 2HD2 ASN 60 15.498 -16.561 -23.889 459 H ARG 61 H ARG 61 10.772 -14.311 -25.558 460 HA ARG 61 HA ARG 61 9.987 -15.829 -28.012 461 HB2 ARG 61 1HB ARG 61 8.470 -15.376 -25.389 462 HB3 ARG 61 2HB ARG 61 7.900 -16.301 -26.766 463 HG2 ARG 61 1HG ARG 61 10.009 -17.763 -26.462 464 HG3 ARG 61 2HG ARG 61 10.158 -16.977 -24.882 465 HD2 ARG 61 1HD ARG 61 7.831 -17.724 -24.334 466 HD3 ARG 61 2HD ARG 61 7.757 -18.593 -25.866 467 HE ARG 61 HE ARG 61 10.032 -19.419 -24.359 468 HH11 ARG 61 1HH1 ARG 61 6.491 -19.857 -24.445 469 HH12 ARG 61 2HH1 ARG 61 6.544 -21.342 -23.536 470 HH21 ARG 61 1HH2 ARG 61 9.985 -21.360 -23.232 471 HH22 ARG 61 2HH2 ARG 61 8.509 -22.154 -22.898 472 H LEU 62 H LEU 62 10.337 -12.723 -27.334 473 HA LEU 62 HA LEU 62 7.645 -11.866 -28.324 474 HB2 LEU 62 1HB LEU 62 9.623 -10.480 -26.510 475 HB3 LEU 62 2HB LEU 62 8.222 -9.709 -27.216 476 HG LEU 62 HG LEU 62 8.152 -11.954 -25.174 477 HD11 LEU 62 1HD1 LEU 62 7.106 -10.057 -23.793 478 HD12 LEU 62 2HD1 LEU 62 7.668 -8.919 -25.028 479 HD13 LEU 62 3HD1 LEU 62 8.857 -9.915 -24.127 480 HD21 LEU 62 1HD2 LEU 62 5.739 -11.507 -25.085 481 HD22 LEU 62 2HD2 LEU 62 6.224 -12.112 -26.679 482 HD23 LEU 62 3HD2 LEU 62 5.883 -10.383 -26.457 483 H LYS 63 H LYS 63 7.481 -10.226 -29.851 484 HA LYS 63 HA LYS 63 10.059 -9.422 -31.162 485 HB2 LYS 63 1HB LYS 63 8.601 -10.945 -32.587 486 HB3 LYS 63 2HB LYS 63 7.352 -9.716 -32.524 487 HG2 LYS 63 1HG LYS 63 8.857 -8.097 -33.650 488 HG3 LYS 63 2HG LYS 63 10.177 -9.279 -33.606 489 HD2 LYS 63 1HD LYS 63 8.731 -10.819 -35.018 490 HD3 LYS 63 2HD LYS 63 7.557 -9.474 -35.179 491 HE2 LYS 63 1HE LYS 63 9.345 -8.057 -36.123 492 HE3 LYS 63 2HE LYS 63 10.497 -9.423 -36.024 493 HZ1 LYS 63 1HZ LYS 63 8.056 -9.320 -37.705 494 HZ2 LYS 63 2HZ LYS 63 9.038 -10.627 -37.564 495 HZ3 LYS 63 3HZ LYS 63 9.609 -9.242 -38.205 496 H ILE 64 H ILE 64 10.455 -7.327 -30.877 497 HA ILE 64 HA ILE 64 8.570 -5.510 -29.627 498 HB ILE 64 HB ILE 64 11.174 -5.060 -31.141 499 HG12 ILE 64 1HG1 ILE 64 11.346 -6.396 -29.037 500 HG13 ILE 64 2HG1 ILE 64 12.162 -4.849 -28.940 501 HG21 ILE 64 1HG2 ILE 64 10.023 -2.954 -31.275 502 HG22 ILE 64 2HG2 ILE 64 9.367 -3.105 -29.613 503 HG23 ILE 64 3HG2 ILE 64 11.103 -2.817 -29.871 504 HD11 ILE 64 1HD1 ILE 64 11.060 -5.213 -26.809 505 HD12 ILE 64 2HD1 ILE 64 10.197 -3.910 -27.648 506 HD13 ILE 64 3HD1 ILE 64 9.515 -5.531 -27.608 507 H LEU 65 H LEU 65 7.190 -4.018 -30.478 508 HA LEU 65 HA LEU 65 7.063 -3.623 -33.454 509 HB2 LEU 65 1HB LEU 65 4.850 -4.258 -31.482 510 HB3 LEU 65 2HB LEU 65 4.528 -3.168 -32.821 511 HG LEU 65 HG LEU 65 3.695 -5.291 -33.373 512 HD11 LEU 65 1HD1 LEU 65 4.827 -5.703 -35.518 513 HD12 LEU 65 2HD1 LEU 65 6.278 -4.863 -34.971 514 HD13 LEU 65 3HD1 LEU 65 4.741 -3.942 -35.191 515 HD21 LEU 65 1HD2 LEU 65 6.462 -6.453 -33.159 516 HD22 LEU 65 2HD2 LEU 65 4.974 -7.308 -33.564 517 HD23 LEU 65 3HD2 LEU 65 5.232 -6.646 -31.946 518 H VAL 66 H VAL 66 5.564 -1.546 -33.768 519 HA VAL 66 HA VAL 66 5.531 0.734 -33.719 520 HB VAL 66 HB VAL 66 5.858 0.576 -30.707 521 HG11 VAL 66 1HG1 VAL 66 4.583 2.606 -32.598 522 HG12 VAL 66 2HG1 VAL 66 4.419 2.659 -30.847 523 HG13 VAL 66 3HG1 VAL 66 6.033 2.839 -31.567 524 HG21 VAL 66 1HG2 VAL 66 3.354 0.601 -30.619 525 HG22 VAL 66 2HG2 VAL 66 3.337 0.277 -32.388 526 HG23 VAL 66 3HG2 VAL 66 4.016 -0.923 -31.249 527 H GLY 67 H GLY 67 7.635 0.386 -34.841 528 HA2 GLY 67 1HA GLY 67 9.882 1.489 -33.236 529 HA3 GLY 67 2HA GLY 67 10.041 0.425 -34.624 530 H MET 68 H MET 68 8.094 3.361 -34.133 531 HA MET 68 HA MET 68 7.767 5.186 -35.446 532 HB2 MET 68 1HB MET 68 10.046 5.662 -34.632 533 HB3 MET 68 2HB MET 68 10.691 4.978 -36.135 534 HG2 MET 68 1HG MET 68 10.559 7.469 -36.284 535 HG3 MET 68 2HG MET 68 9.468 6.696 -37.451 536 HE1 MET 68 1HE MET 68 9.754 9.062 -34.369 537 HE2 MET 68 2HE MET 68 8.128 9.033 -33.665 538 HE3 MET 68 3HE MET 68 9.175 7.599 -33.518 539 H TYR 69 H TYR 69 6.334 4.305 -36.878 540 HA TYR 69 HA TYR 69 7.412 3.822 -39.594 541 HB2 TYR 69 1HB TYR 69 6.686 1.723 -37.966 542 HB3 TYR 69 2HB TYR 69 5.096 2.145 -38.663 543 HD1 TYR 69 HD1 TYR 69 8.649 1.285 -39.643 544 HD2 TYR 69 HD2 TYR 69 4.524 1.402 -40.845 545 HE1 TYR 69 HE1 TYR 69 9.224 -0.024 -41.692 546 HE2 TYR 69 HE2 TYR 69 5.108 0.075 -42.931 547 HH TYR 69 HH TYR 69 8.408 -0.958 -43.613 548 H ASP 70 H ASP 70 5.997 4.576 -41.196 549 HA ASP 70 HA ASP 70 4.149 6.598 -40.358 550 HB2 ASP 70 1HB ASP 70 4.681 5.408 -43.091 551 HB3 ASP 70 2HB ASP 70 3.800 6.910 -42.789 552 H LYS 71 H LYS 71 2.950 4.697 -39.097 553 HA LYS 71 HA LYS 71 0.444 4.255 -40.692 554 HB2 LYS 71 1HB LYS 71 1.978 2.171 -39.087 555 HB3 LYS 71 2HB LYS 71 0.235 2.079 -39.312 556 HG2 LYS 71 1HG LYS 71 0.632 2.244 -41.788 557 HG3 LYS 71 2HG LYS 71 2.367 1.995 -41.475 558 HD2 LYS 71 1HD LYS 71 1.886 -0.177 -40.486 559 HD3 LYS 71 2HD LYS 71 0.137 0.098 -40.529 560 HE2 LYS 71 1HE LYS 71 1.965 -0.170 -42.960 561 HE3 LYS 71 2HE LYS 71 0.878 -1.406 -42.343 562 HZ1 LYS 71 1HZ LYS 71 -0.165 -0.227 -44.152 563 HZ2 LYS 71 2HZ LYS 71 0.057 1.234 -43.423 564 HZ3 LYS 71 3HZ LYS 71 -1.006 0.150 -42.804 565 H LYS 72 H LYS 72 -1.396 4.094 -39.305 566 HA LYS 72 HA LYS 72 -1.120 5.866 -36.944 567 HB2 LYS 72 1HB LYS 72 -3.470 4.804 -38.590 568 HB3 LYS 72 2HB LYS 72 -3.721 5.451 -36.964 569 HG2 LYS 72 1HG LYS 72 -4.147 7.273 -38.414 570 HG3 LYS 72 2HG LYS 72 -2.560 7.570 -37.691 571 HD2 LYS 72 1HD LYS 72 -1.503 6.600 -39.792 572 HD3 LYS 72 2HD LYS 72 -3.114 6.537 -40.517 573 HE2 LYS 72 1HE LYS 72 -3.314 9.005 -40.237 574 HE3 LYS 72 2HE LYS 72 -1.730 9.046 -39.475 575 HZ1 LYS 72 1HZ LYS 72 -2.264 8.169 -42.274 576 HZ2 LYS 72 2HZ LYS 72 -0.759 8.266 -41.555 577 HZ3 LYS 72 3HZ LYS 72 -1.641 9.673 -41.825 578 HA PRO 73 HA PRO 73 -0.869 2.460 -34.319 579 HB2 PRO 73 1HB PRO 73 -2.066 3.289 -31.985 580 HB3 PRO 73 2HB PRO 73 -0.489 3.920 -32.551 581 HG2 PRO 73 1HG PRO 73 -3.236 5.142 -32.809 582 HG3 PRO 73 2HG PRO 73 -1.678 5.886 -32.303 583 HD2 PRO 73 1HD PRO 73 -2.623 6.145 -34.826 584 HD3 PRO 73 2HD PRO 73 -0.881 6.030 -34.469 585 H ALA 74 H ALA 74 -1.989 0.643 -33.577 586 HA ALA 74 HA ALA 74 -4.828 0.428 -34.376 587 HB1 ALA 74 1HB ALA 74 -4.487 -1.982 -34.065 588 HB2 ALA 74 2HB ALA 74 -3.148 -1.342 -35.051 589 HB3 ALA 74 3HB ALA 74 -2.884 -1.664 -33.327 590 H GLY 75 H GLY 75 -6.230 -0.921 -32.722 591 HA2 GLY 75 1HA GLY 75 -5.647 0.112 -29.979 592 HA3 GLY 75 2HA GLY 75 -7.254 -0.015 -30.724 593 H GLU 76 H GLU 76 -8.172 -2.107 -31.076 594 HA GLU 76 HA GLU 76 -8.719 -4.188 -30.402 595 HB2 GLU 76 1HB GLU 76 -5.783 -4.759 -30.948 596 HB3 GLU 76 2HB GLU 76 -7.093 -5.908 -30.951 597 HG2 GLU 76 1HG GLU 76 -6.598 -3.642 -32.866 598 HG3 GLU 76 2HG GLU 76 -6.745 -5.396 -33.233 599 H PHE 77 H PHE 77 -9.133 -3.535 -28.199 600 HA PHE 77 HA PHE 77 -7.455 -4.465 -26.033 601 HB2 PHE 77 1HB PHE 77 -10.430 -3.892 -26.215 602 HB3 PHE 77 2HB PHE 77 -9.655 -4.407 -24.722 603 HD1 PHE 77 HD1 PHE 77 -8.533 -2.881 -23.335 604 HD2 PHE 77 HD2 PHE 77 -9.777 -1.676 -27.279 605 HE1 PHE 77 HE1 PHE 77 -8.069 -0.482 -22.767 606 HE2 PHE 77 HE2 PHE 77 -9.205 0.701 -26.715 607 HZ PHE 77 HZ PHE 77 -8.365 1.280 -24.476 608 H ILE 78 H ILE 78 -7.408 -6.534 -25.120 609 HA ILE 78 HA ILE 78 -8.598 -8.664 -26.629 610 HB ILE 78 HB ILE 78 -7.940 -10.056 -24.536 611 HG12 ILE 78 1HG1 ILE 78 -6.358 -7.530 -23.846 612 HG13 ILE 78 2HG1 ILE 78 -7.859 -8.004 -23.045 613 HG21 ILE 78 1HG2 ILE 78 -5.709 -8.491 -25.965 614 HG22 ILE 78 2HG2 ILE 78 -5.616 -10.179 -25.306 615 HG23 ILE 78 3HG2 ILE 78 -6.660 -9.854 -26.690 616 HD11 ILE 78 1HD1 ILE 78 -5.908 -8.651 -21.723 617 HD12 ILE 78 2HD1 ILE 78 -6.848 -10.104 -22.278 618 HD13 ILE 78 3HD1 ILE 78 -5.276 -9.646 -23.071 619 H VAL 79 H VAL 79 -10.543 -9.417 -26.560 620 HA VAL 79 HA VAL 79 -12.363 -8.892 -24.194 621 HB VAL 79 HB VAL 79 -14.226 -8.884 -25.920 622 HG11 VAL 79 1HG1 VAL 79 -12.098 -6.772 -26.369 623 HG12 VAL 79 2HG1 VAL 79 -13.816 -6.632 -26.701 624 HG13 VAL 79 3HG1 VAL 79 -13.233 -6.830 -25.011 625 HG21 VAL 79 1HG2 VAL 79 -13.727 -8.634 -28.268 626 HG22 VAL 79 2HG2 VAL 79 -11.991 -8.683 -27.969 627 HG23 VAL 79 3HG2 VAL 79 -12.964 -10.138 -27.709 628 H THR 80 H THR 80 -10.488 -11.104 -24.870 629 HA THR 80 HA THR 80 -12.242 -13.332 -25.722 630 HB THR 80 HB THR 80 -9.907 -13.607 -26.279 631 HG1 THR 80 HG1 THR 80 -10.153 -15.187 -23.961 632 HG21 THR 80 1HG2 THR 80 -8.779 -12.144 -24.718 633 HG22 THR 80 2HG2 THR 80 -8.155 -13.791 -24.416 634 HG23 THR 80 3HG2 THR 80 -9.333 -13.063 -23.358 635 H ASP 81 H ASP 81 -13.356 -14.659 -24.583 636 HA ASP 81 HA ASP 81 -13.123 -14.803 -21.626 637 HB2 ASP 81 1HB ASP 81 -14.766 -12.967 -21.794 638 HB3 ASP 81 2HB ASP 81 -15.649 -13.842 -23.044 639 HXT ASP 81 H02 ASP 81 -14.325 -17.890 -21.985 Start of MODEL 32 1 H2 GLY 1 2H0 GLY 1 6.886 15.249 -10.827 2 H GLY 1 1H0 GLY 1 5.636 14.908 -11.845 3 HA2 GLY 1 1HA GLY 1 7.852 15.074 -12.981 4 HA3 GLY 1 2HA GLY 1 8.273 13.588 -12.095 5 H SER 2 H SER 2 8.391 12.003 -13.515 6 HA SER 2 HA SER 2 5.978 11.291 -15.023 7 HB2 SER 2 1HB SER 2 7.199 11.117 -17.192 8 HB3 SER 2 2HB SER 2 7.044 12.796 -16.639 9 HG SER 2 HG SER 2 9.179 12.629 -15.819 10 H MET 3 H MET 3 5.949 9.092 -15.554 11 HA MET 3 HA MET 3 7.976 7.457 -14.152 12 HB2 MET 3 1HB MET 3 5.401 6.759 -15.607 13 HB3 MET 3 2HB MET 3 6.458 5.585 -14.812 14 HG2 MET 3 1HG MET 3 6.079 6.687 -12.648 15 HG3 MET 3 2HG MET 3 5.043 7.890 -13.438 16 HE1 MET 3 1HE MET 3 5.425 4.232 -12.125 17 HE2 MET 3 2HE MET 3 3.970 3.419 -12.743 18 HE3 MET 3 3HE MET 3 5.285 3.844 -13.859 19 H LYS 4 H LYS 4 9.828 7.484 -15.377 20 HA LYS 4 HA LYS 4 9.562 7.184 -18.307 21 HB2 LYS 4 1HB LYS 4 12.001 7.696 -16.574 22 HB3 LYS 4 2HB LYS 4 11.974 7.638 -18.342 23 HG2 LYS 4 1HG LYS 4 10.285 9.536 -18.285 24 HG3 LYS 4 2HG LYS 4 10.555 9.637 -16.540 25 HD2 LYS 4 1HD LYS 4 11.922 11.316 -17.542 26 HD3 LYS 4 2HD LYS 4 13.007 10.021 -17.009 27 HE2 LYS 4 1HE LYS 4 13.665 10.816 -19.237 28 HE3 LYS 4 2HE LYS 4 13.096 9.139 -19.330 29 HZ1 LYS 4 1HZ LYS 4 11.484 11.526 -20.044 30 HZ2 LYS 4 2HZ LYS 4 10.962 9.967 -20.133 31 HZ3 LYS 4 3HZ LYS 4 12.184 10.481 -21.117 32 H TYR 5 H TYR 5 8.764 5.052 -18.237 33 HA TYR 5 HA TYR 5 10.916 2.993 -17.889 34 HB2 TYR 5 1HB TYR 5 9.119 1.358 -17.626 35 HB3 TYR 5 2HB TYR 5 8.993 2.602 -16.383 36 HD1 TYR 5 HD1 TYR 5 7.392 0.978 -19.207 37 HD2 TYR 5 HD2 TYR 5 7.164 4.358 -16.585 38 HE1 TYR 5 HE1 TYR 5 5.052 1.367 -19.926 39 HE2 TYR 5 HE2 TYR 5 4.805 4.756 -17.301 40 HH TYR 5 HH TYR 5 3.262 2.813 -19.863 41 H LEU 6 H LEU 6 10.208 1.118 -19.659 42 HA LEU 6 HA LEU 6 10.882 2.400 -22.097 43 HB2 LEU 6 1HB LEU 6 9.659 -0.339 -21.691 44 HB3 LEU 6 2HB LEU 6 10.501 0.199 -23.140 45 HG LEU 6 HG LEU 6 11.799 -0.048 -20.407 46 HD11 LEU 6 1HD1 LEU 6 10.993 -2.180 -21.270 47 HD12 LEU 6 2HD1 LEU 6 12.764 -2.093 -21.288 48 HD13 LEU 6 3HD1 LEU 6 11.843 -1.896 -22.803 49 HD21 LEU 6 1HD2 LEU 6 12.963 0.381 -23.189 50 HD22 LEU 6 2HD2 LEU 6 13.905 0.057 -21.710 51 HD23 LEU 6 3HD2 LEU 6 12.962 1.550 -21.846 52 H ASN 7 H ASN 7 7.738 1.040 -21.137 53 HA ASN 7 HA ASN 7 5.665 1.153 -22.073 54 HB2 ASN 7 1HB ASN 7 6.214 3.584 -21.401 55 HB3 ASN 7 2HB ASN 7 6.387 3.881 -23.133 56 HD21 ASN 7 1HD2 ASN 7 2.986 4.489 -23.385 57 HD22 ASN 7 2HD2 ASN 7 4.630 4.923 -23.781 58 H VAL 8 H VAL 8 7.441 -0.212 -23.761 59 HA VAL 8 HA VAL 8 6.505 0.592 -26.490 60 HB VAL 8 HB VAL 8 8.259 -0.948 -27.330 61 HG11 VAL 8 1HG1 VAL 8 9.411 1.117 -25.414 62 HG12 VAL 8 2HG1 VAL 8 10.196 0.457 -26.867 63 HG13 VAL 8 3HG1 VAL 8 8.750 1.472 -27.028 64 HG21 VAL 8 1HG2 VAL 8 8.446 -2.518 -25.475 65 HG22 VAL 8 2HG2 VAL 8 10.030 -1.787 -25.780 66 HG23 VAL 8 3HG2 VAL 8 9.055 -1.241 -24.399 67 H LEU 9 H LEU 9 6.066 -1.599 -27.820 68 HA LEU 9 HA LEU 9 4.816 -3.574 -25.980 69 HB2 LEU 9 1HB LEU 9 2.823 -3.650 -27.517 70 HB3 LEU 9 2HB LEU 9 2.928 -2.272 -26.437 71 HG LEU 9 HG LEU 9 3.993 -1.863 -29.192 72 HD11 LEU 9 1HD1 LEU 9 1.943 -3.159 -29.608 73 HD12 LEU 9 2HD1 LEU 9 1.718 -1.459 -30.066 74 HD13 LEU 9 3HD1 LEU 9 1.024 -2.075 -28.546 75 HD21 LEU 9 1HD2 LEU 9 2.987 0.353 -28.830 76 HD22 LEU 9 2HD2 LEU 9 3.948 -0.086 -27.401 77 HD23 LEU 9 3HD2 LEU 9 2.181 -0.225 -27.353 78 H ALA 10 H ALA 10 4.289 -5.579 -26.953 79 HA ALA 10 HA ALA 10 5.901 -6.166 -29.386 80 HB1 ALA 10 1HB ALA 10 7.066 -7.951 -28.228 81 HB2 ALA 10 2HB ALA 10 7.308 -6.447 -27.315 82 HB3 ALA 10 3HB ALA 10 6.134 -7.653 -26.743 83 H LYS 11 H LYS 11 5.483 -8.244 -30.300 84 HA LYS 11 HA LYS 11 2.744 -9.293 -29.635 85 HB2 LYS 11 1HB LYS 11 3.065 -8.483 -31.961 86 HB3 LYS 11 2HB LYS 11 4.422 -9.600 -32.164 87 HG2 LYS 11 1HG LYS 11 2.938 -11.513 -31.928 88 HG3 LYS 11 2HG LYS 11 1.575 -10.452 -31.538 89 HD2 LYS 11 1HD LYS 11 1.777 -9.413 -33.787 90 HD3 LYS 11 2HD LYS 11 3.059 -10.585 -34.180 91 HE2 LYS 11 1HE LYS 11 1.490 -12.439 -33.740 92 HE3 LYS 11 2HE LYS 11 0.218 -11.270 -33.331 93 HZ1 LYS 11 1HZ LYS 11 0.322 -10.455 -35.603 94 HZ2 LYS 11 2HZ LYS 11 -0.022 -12.069 -35.576 95 HZ3 LYS 11 3HZ LYS 11 1.491 -11.552 -35.989 96 H ALA 12 H ALA 12 2.547 -11.355 -28.918 97 HA ALA 12 HA ALA 12 4.978 -12.782 -28.197 98 HB1 ALA 12 1HB ALA 12 3.014 -12.911 -26.763 99 HB2 ALA 12 2HB ALA 12 2.035 -13.546 -28.099 100 HB3 ALA 12 3HB ALA 12 3.352 -14.528 -27.411 101 H LEU 13 H LEU 13 6.046 -14.289 -29.282 102 HA LEU 13 HA LEU 13 5.012 -15.099 -31.956 103 HB2 LEU 13 1HB LEU 13 7.685 -15.574 -30.588 104 HB3 LEU 13 2HB LEU 13 7.302 -15.983 -32.257 105 HG LEU 13 HG LEU 13 7.405 -13.160 -31.131 106 HD11 LEU 13 1HD1 LEU 13 9.606 -14.247 -31.126 107 HD12 LEU 13 2HD1 LEU 13 9.535 -13.009 -32.394 108 HD13 LEU 13 3HD1 LEU 13 9.395 -14.730 -32.826 109 HD21 LEU 13 1HD2 LEU 13 7.117 -14.199 -33.984 110 HD22 LEU 13 2HD2 LEU 13 7.416 -12.504 -33.539 111 HD23 LEU 13 3HD2 LEU 13 5.903 -13.289 -33.056 112 H TYR 14 H TYR 14 5.593 -16.276 -28.731 113 HA TYR 14 HA TYR 14 4.732 -19.017 -29.557 114 HB2 TYR 14 1HB TYR 14 6.671 -18.284 -27.341 115 HB3 TYR 14 2HB TYR 14 6.147 -19.912 -27.777 116 HD1 TYR 14 HD1 TYR 14 7.065 -21.039 -29.779 117 HD2 TYR 14 HD2 TYR 14 8.256 -17.038 -28.772 118 HE1 TYR 14 HE1 TYR 14 8.956 -21.181 -31.407 119 HE2 TYR 14 HE2 TYR 14 10.152 -17.189 -30.367 120 HH TYR 14 HH TYR 14 10.750 -20.106 -32.338 121 H ASP 15 H ASP 15 3.647 -20.165 -27.718 122 HA ASP 15 HA ASP 15 2.085 -18.223 -26.094 123 HB2 ASP 15 1HB ASP 15 0.427 -20.064 -25.873 124 HB3 ASP 15 2HB ASP 15 0.668 -19.556 -27.542 125 H ASN 16 H ASN 16 1.662 -18.675 -23.898 126 HA ASN 16 HA ASN 16 3.433 -20.723 -22.672 127 HB2 ASN 16 1HB ASN 16 4.535 -18.386 -22.951 128 HB3 ASN 16 2HB ASN 16 3.428 -17.859 -21.676 129 HD21 ASN 16 1HD2 ASN 16 5.237 -19.422 -19.107 130 HD22 ASN 16 2HD2 ASN 16 3.741 -18.644 -19.568 131 H VAL 17 H VAL 17 2.376 -21.758 -21.078 132 HA VAL 17 HA VAL 17 -0.100 -20.535 -19.955 133 HB VAL 17 HB VAL 17 1.134 -23.318 -19.575 134 HG11 VAL 17 1HG1 VAL 17 -0.134 -22.636 -17.581 135 HG12 VAL 17 2HG1 VAL 17 -1.528 -22.178 -18.592 136 HG13 VAL 17 3HG1 VAL 17 -1.030 -23.882 -18.470 137 HG21 VAL 17 1HG2 VAL 17 -0.818 -24.123 -20.896 138 HG22 VAL 17 2HG2 VAL 17 -1.301 -22.434 -21.191 139 HG23 VAL 17 3HG2 VAL 17 0.233 -23.057 -21.845 140 H ALA 18 H ALA 18 0.113 -19.515 -17.990 141 HA ALA 18 HA ALA 18 2.723 -19.152 -16.874 142 HB1 ALA 18 1HB ALA 18 0.989 -17.430 -16.651 143 HB2 ALA 18 2HB ALA 18 -0.049 -18.559 -15.742 144 HB3 ALA 18 3HB ALA 18 1.484 -17.993 -15.045 145 H GLU 19 H GLU 19 3.818 -20.696 -15.826 146 HA GLU 19 HA GLU 19 2.259 -22.744 -14.298 147 HB2 GLU 19 1HB GLU 19 4.259 -24.075 -14.319 148 HB3 GLU 19 2HB GLU 19 3.887 -23.529 -15.957 149 HG2 GLU 19 1HG GLU 19 5.633 -21.771 -15.738 150 HG3 GLU 19 2HG GLU 19 6.037 -22.406 -14.134 151 H SER 20 H SER 20 3.930 -19.864 -13.946 152 HA SER 20 HA SER 20 4.176 -20.284 -10.985 153 HB2 SER 20 1HB SER 20 6.333 -19.682 -12.030 154 HB3 SER 20 2HB SER 20 5.557 -18.288 -12.808 155 HG SER 20 HG SER 20 6.706 -17.782 -10.854 156 HA PRO 21 HA PRO 21 0.857 -17.381 -11.096 157 HB2 PRO 21 1HB PRO 21 0.946 -16.198 -8.655 158 HB3 PRO 21 2HB PRO 21 0.446 -17.905 -8.877 159 HG2 PRO 21 1HG PRO 21 3.145 -16.828 -8.109 160 HG3 PRO 21 2HG PRO 21 2.163 -18.083 -7.289 161 HD2 PRO 21 1HD PRO 21 4.123 -18.745 -9.013 162 HD3 PRO 21 2HD PRO 21 2.584 -19.671 -8.965 163 H ASP 22 H ASP 22 4.144 -16.400 -10.459 164 HA ASP 22 HA ASP 22 3.701 -13.515 -10.686 165 HB2 ASP 22 1HB ASP 22 5.568 -14.680 -9.415 166 HB3 ASP 22 2HB ASP 22 6.240 -15.175 -10.976 167 H GLU 23 H GLU 23 3.943 -16.182 -12.834 168 HA GLU 23 HA GLU 23 5.095 -14.654 -15.051 169 HB2 GLU 23 1HB GLU 23 5.559 -17.077 -14.556 170 HB3 GLU 23 2HB GLU 23 3.891 -17.435 -15.009 171 HG2 GLU 23 1HG GLU 23 4.306 -16.629 -17.264 172 HG3 GLU 23 2HG GLU 23 5.950 -16.148 -16.810 173 H LEU 24 H LEU 24 4.012 -13.962 -16.866 174 HA LEU 24 HA LEU 24 1.103 -13.633 -16.510 175 HB2 LEU 24 1HB LEU 24 3.207 -12.215 -17.800 176 HB3 LEU 24 2HB LEU 24 2.086 -12.727 -19.062 177 HG LEU 24 HG LEU 24 1.312 -11.178 -16.573 178 HD11 LEU 24 1HD1 LEU 24 1.119 -9.253 -18.068 179 HD12 LEU 24 2HD1 LEU 24 1.682 -10.240 -19.440 180 HD13 LEU 24 3HD1 LEU 24 2.773 -9.890 -18.079 181 HD21 LEU 24 1HD2 LEU 24 -0.810 -10.749 -17.874 182 HD22 LEU 24 2HD2 LEU 24 -0.594 -12.435 -17.380 183 HD23 LEU 24 3HD2 LEU 24 -0.265 -11.959 -19.060 184 H SER 25 H SER 25 -0.444 -14.770 -17.585 185 HA SER 25 HA SER 25 0.415 -16.955 -19.363 186 HB2 SER 25 1HB SER 25 -2.332 -16.941 -19.372 187 HB3 SER 25 2HB SER 25 -1.333 -17.810 -18.184 188 HG SER 25 HG SER 25 -2.911 -16.442 -17.203 189 H PHE 26 H PHE 26 0.660 -16.584 -21.493 190 HA PHE 26 HA PHE 26 -1.203 -14.703 -22.859 191 HB2 PHE 26 1HB PHE 26 0.644 -13.589 -24.012 192 HB3 PHE 26 2HB PHE 26 0.771 -13.348 -22.268 193 HD1 PHE 26 HD1 PHE 26 2.269 -15.040 -25.208 194 HD2 PHE 26 HD2 PHE 26 2.585 -14.303 -20.985 195 HE1 PHE 26 HE1 PHE 26 4.606 -15.892 -25.240 196 HE2 PHE 26 HE2 PHE 26 4.904 -15.188 -20.994 197 HZ PHE 26 HZ PHE 26 5.927 -15.983 -23.125 198 H ARG 27 H ARG 27 -0.976 -14.959 -25.298 199 HA ARG 27 HA ARG 27 0.131 -17.641 -25.952 200 HB2 ARG 27 1HB ARG 27 -2.640 -16.650 -26.633 201 HB3 ARG 27 2HB ARG 27 -1.870 -18.041 -27.411 202 HG2 ARG 27 1HG ARG 27 -1.578 -19.091 -25.164 203 HG3 ARG 27 2HG ARG 27 -2.494 -17.760 -24.446 204 HD2 ARG 27 1HD ARG 27 -4.476 -18.386 -25.705 205 HD3 ARG 27 2HD ARG 27 -3.553 -19.603 -26.611 206 HE ARG 27 HE ARG 27 -3.585 -21.039 -24.779 207 HH11 ARG 27 1HH1 ARG 27 -4.927 -17.925 -23.768 208 HH12 ARG 27 2HH1 ARG 27 -5.523 -18.572 -22.264 209 HH21 ARG 27 1HH2 ARG 27 -4.367 -21.781 -22.841 210 HH22 ARG 27 2HH2 ARG 27 -5.209 -20.714 -21.755 211 H LYS 28 H LYS 28 0.546 -18.045 -28.151 212 HA LYS 28 HA LYS 28 1.972 -15.960 -29.422 213 HB2 LYS 28 1HB LYS 28 1.972 -17.498 -31.418 214 HB3 LYS 28 2HB LYS 28 2.529 -18.218 -29.918 215 HG2 LYS 28 1HG LYS 28 -0.013 -19.038 -29.747 216 HG3 LYS 28 2HG LYS 28 0.072 -18.861 -31.506 217 HD2 LYS 28 1HD LYS 28 1.929 -20.416 -31.631 218 HD3 LYS 28 2HD LYS 28 2.142 -20.370 -29.874 219 HE2 LYS 28 1HE LYS 28 -0.292 -21.272 -29.743 220 HE3 LYS 28 2HE LYS 28 -0.077 -21.702 -31.451 221 HZ1 LYS 28 1HZ LYS 28 1.858 -23.027 -30.777 222 HZ2 LYS 28 2HZ LYS 28 0.518 -23.531 -29.955 223 HZ3 LYS 28 3HZ LYS 28 1.645 -22.603 -29.192 224 H GLY 29 H GLY 29 1.453 -14.392 -30.777 225 HA2 GLY 29 1HA GLY 29 0.061 -13.457 -32.505 226 HA3 GLY 29 2HA GLY 29 -1.313 -14.377 -31.898 227 H ASP 30 H ASP 30 -0.508 -13.612 -29.041 228 HA ASP 30 HA ASP 30 -2.279 -11.350 -28.895 229 HB2 ASP 30 1HB ASP 30 -1.753 -13.339 -27.240 230 HB3 ASP 30 2HB ASP 30 -0.506 -12.243 -26.622 231 H ILE 31 H ILE 31 -1.789 -9.367 -27.671 232 HA ILE 31 HA ILE 31 0.942 -8.295 -28.331 233 HB ILE 31 HB ILE 31 -1.694 -6.736 -28.301 234 HG12 ILE 31 1HG1 ILE 31 -1.800 -8.351 -30.136 235 HG13 ILE 31 2HG1 ILE 31 -1.689 -6.697 -30.725 236 HG21 ILE 31 1HG2 ILE 31 1.135 -5.997 -29.210 237 HG22 ILE 31 2HG2 ILE 31 -0.306 -4.999 -29.537 238 HG23 ILE 31 3HG2 ILE 31 0.209 -5.293 -27.866 239 HD11 ILE 31 1HD1 ILE 31 0.645 -8.627 -30.605 240 HD12 ILE 31 2HD1 ILE 31 -0.345 -8.315 -32.038 241 HD13 ILE 31 3HD1 ILE 31 0.636 -7.011 -31.343 242 H MET 32 H MET 32 1.986 -7.373 -26.593 243 HA MET 32 HA MET 32 0.330 -6.518 -24.264 244 HB2 MET 32 1HB MET 32 1.750 -7.713 -22.703 245 HB3 MET 32 2HB MET 32 1.056 -8.844 -23.864 246 HG2 MET 32 1HG MET 32 3.268 -8.610 -25.165 247 HG3 MET 32 2HG MET 32 3.904 -7.835 -23.701 248 HE1 MET 32 1HE MET 32 2.794 -12.238 -24.354 249 HE2 MET 32 2HE MET 32 1.478 -11.043 -24.397 250 HE3 MET 32 3HE MET 32 2.825 -10.927 -25.554 251 H THR 33 H THR 33 1.410 -5.010 -22.865 252 HA THR 33 HA THR 33 3.387 -3.395 -24.360 253 HB THR 33 HB THR 33 2.081 -2.887 -21.654 254 HG1 THR 33 HG1 THR 33 0.686 -1.550 -22.893 255 HG21 THR 33 1HG2 THR 33 2.667 -0.542 -22.046 256 HG22 THR 33 2HG2 THR 33 3.392 -0.962 -23.614 257 HG23 THR 33 3HG2 THR 33 4.138 -1.535 -22.104 258 H VAL 34 H VAL 34 5.534 -3.370 -23.875 259 HA VAL 34 HA VAL 34 6.441 -5.066 -21.566 260 HB VAL 34 HB VAL 34 7.970 -3.928 -23.956 261 HG11 VAL 34 1HG1 VAL 34 9.922 -5.229 -23.030 262 HG12 VAL 34 2HG1 VAL 34 9.446 -3.850 -22.024 263 HG13 VAL 34 3HG1 VAL 34 8.981 -5.496 -21.542 264 HG21 VAL 34 1HG2 VAL 34 6.531 -5.992 -24.346 265 HG22 VAL 34 2HG2 VAL 34 8.266 -6.220 -24.656 266 HG23 VAL 34 3HG2 VAL 34 7.550 -6.841 -23.153 267 H LEU 35 H LEU 35 6.746 -4.017 -19.760 268 HA LEU 35 HA LEU 35 6.845 -1.073 -19.800 269 HB2 LEU 35 1HB LEU 35 6.869 -3.041 -17.484 270 HB3 LEU 35 2HB LEU 35 6.627 -1.300 -17.360 271 HG LEU 35 HG LEU 35 4.730 -3.256 -18.724 272 HD11 LEU 35 1HD1 LEU 35 3.298 -2.823 -16.750 273 HD12 LEU 35 2HD1 LEU 35 4.606 -1.857 -16.027 274 HD13 LEU 35 3HD1 LEU 35 4.834 -3.598 -16.311 275 HD21 LEU 35 1HD2 LEU 35 4.405 -0.298 -18.063 276 HD22 LEU 35 2HD2 LEU 35 3.127 -1.366 -18.685 277 HD23 LEU 35 3HD2 LEU 35 4.539 -1.005 -19.691 278 H GLU 36 H GLU 36 8.791 -3.859 -18.708 279 HA GLU 36 HA GLU 36 11.231 -2.182 -18.842 280 HB2 GLU 36 1HB GLU 36 9.922 -2.723 -16.399 281 HB3 GLU 36 2HB GLU 36 11.261 -3.875 -16.479 282 HG2 GLU 36 1HG GLU 36 12.120 -1.952 -15.392 283 HG3 GLU 36 2HG GLU 36 12.774 -1.920 -17.041 284 H ARG 37 H ARG 37 13.196 -3.677 -18.451 285 HA ARG 37 HA ARG 37 12.623 -6.433 -19.482 286 HB2 ARG 37 1HB ARG 37 14.726 -4.442 -20.383 287 HB3 ARG 37 2HB ARG 37 14.811 -6.173 -20.727 288 HG2 ARG 37 1HG ARG 37 12.672 -6.023 -21.937 289 HG3 ARG 37 2HG ARG 37 12.647 -4.289 -21.671 290 HD2 ARG 37 1HD ARG 37 14.993 -5.667 -22.992 291 HD3 ARG 37 2HD ARG 37 13.573 -5.157 -23.918 292 HE ARG 37 HE ARG 37 14.102 -2.899 -23.558 293 HH11 ARG 37 1HH1 ARG 37 16.520 -4.926 -21.916 294 HH12 ARG 37 2HH1 ARG 37 17.632 -3.598 -21.766 295 HH21 ARG 37 1HH2 ARG 37 15.574 -1.283 -23.310 296 HH22 ARG 37 2HH2 ARG 37 17.106 -1.583 -22.536 297 H ASP 38 H ASP 38 14.191 -7.964 -18.908 298 HA ASP 38 HA ASP 38 15.640 -9.041 -17.544 299 HB2 ASP 38 1HB ASP 38 17.095 -6.387 -17.391 300 HB3 ASP 38 2HB ASP 38 17.790 -8.013 -17.275 301 H THR 39 H THR 39 13.319 -7.975 -16.474 302 HA THR 39 HA THR 39 13.700 -6.313 -14.198 303 HB THR 39 HB THR 39 11.597 -6.549 -15.586 304 HG1 THR 39 HG1 THR 39 11.494 -6.835 -12.760 305 HG21 THR 39 1HG2 THR 39 11.516 -9.071 -15.624 306 HG22 THR 39 2HG2 THR 39 10.003 -8.330 -15.075 307 HG23 THR 39 3HG2 THR 39 11.105 -9.046 -13.889 308 H GLN 40 H GLN 40 14.009 -9.747 -14.440 309 HA GLN 40 HA GLN 40 13.450 -10.077 -11.534 310 HB2 GLN 40 1HB GLN 40 12.608 -11.566 -13.597 311 HB3 GLN 40 2HB GLN 40 14.166 -12.351 -13.349 312 HG2 GLN 40 1HG GLN 40 12.736 -13.647 -12.048 313 HG3 GLN 40 2HG GLN 40 13.415 -12.540 -10.848 314 HE21 GLN 40 1HE2 GLN 40 9.572 -12.847 -10.773 315 HE22 GLN 40 2HE2 GLN 40 10.838 -14.047 -10.964 316 H GLY 41 H GLY 41 16.006 -9.139 -13.338 317 HA2 GLY 41 1HA GLY 41 18.291 -9.136 -12.791 318 HA3 GLY 41 2HA GLY 41 17.988 -10.341 -11.513 319 H LEU 42 H LEU 42 16.289 -11.415 -14.043 320 HA LEU 42 HA LEU 42 18.449 -13.202 -15.027 321 HB2 LEU 42 1HB LEU 42 15.417 -13.363 -15.274 322 HB3 LEU 42 2HB LEU 42 16.553 -14.544 -15.914 323 HG LEU 42 HG LEU 42 16.133 -13.954 -12.962 324 HD11 LEU 42 1HD1 LEU 42 14.155 -14.966 -14.046 325 HD12 LEU 42 2HD1 LEU 42 14.939 -16.106 -12.933 326 HD13 LEU 42 3HD1 LEU 42 15.174 -16.273 -14.689 327 HD21 LEU 42 1HD2 LEU 42 17.728 -16.127 -14.384 328 HD22 LEU 42 2HD2 LEU 42 17.396 -16.077 -12.638 329 HD23 LEU 42 3HD2 LEU 42 18.384 -14.807 -13.385 330 H ASP 43 H ASP 43 19.317 -12.600 -16.910 331 HA ASP 43 HA ASP 43 18.372 -10.440 -18.476 332 HB2 ASP 43 1HB ASP 43 20.178 -12.784 -19.177 333 HB3 ASP 43 2HB ASP 43 19.932 -11.376 -20.222 334 H GLY 44 H GLY 44 17.008 -10.278 -20.140 335 HA2 GLY 44 1HA GLY 44 15.758 -11.031 -21.966 336 HA3 GLY 44 2HA GLY 44 16.150 -12.703 -21.572 337 H TRP 45 H TRP 45 14.992 -11.473 -18.685 338 HA TRP 45 HA TRP 45 12.214 -12.366 -19.389 339 HB2 TRP 45 1HB TRP 45 13.768 -12.194 -16.810 340 HB3 TRP 45 2HB TRP 45 11.996 -12.245 -16.811 341 HD1 TRP 45 HD1 TRP 45 15.024 -14.436 -17.718 342 HE1 TRP 45 HE1 TRP 45 14.307 -16.868 -17.934 343 HE3 TRP 45 HE3 TRP 45 9.975 -13.714 -17.335 344 HZ2 TRP 45 HZ2 TRP 45 11.846 -18.328 -17.945 345 HZ3 TRP 45 HZ3 TRP 45 8.462 -15.705 -17.447 346 HH2 TRP 45 HH2 TRP 45 9.401 -17.989 -17.754 347 H TRP 46 H TRP 46 10.744 -10.813 -19.815 348 HA TRP 46 HA TRP 46 11.466 -8.057 -18.945 349 HB2 TRP 46 1HB TRP 46 9.690 -9.071 -21.186 350 HB3 TRP 46 2HB TRP 46 10.048 -7.376 -20.845 351 HD1 TRP 46 HD1 TRP 46 13.290 -8.899 -20.328 352 HE1 TRP 46 HE1 TRP 46 14.801 -8.883 -22.364 353 HE3 TRP 46 HE3 TRP 46 9.693 -7.924 -23.826 354 HZ2 TRP 46 HZ2 TRP 46 14.488 -8.524 -25.188 355 HZ3 TRP 46 HZ3 TRP 46 10.367 -7.792 -26.230 356 HH2 TRP 46 HH2 TRP 46 12.753 -8.078 -26.895 357 H LEU 47 H LEU 47 9.913 -6.666 -18.108 358 HA LEU 47 HA LEU 47 7.667 -8.040 -16.740 359 HB2 LEU 47 1HB LEU 47 9.091 -6.374 -15.512 360 HB3 LEU 47 2HB LEU 47 8.605 -5.142 -16.663 361 HG LEU 47 HG LEU 47 6.230 -5.454 -15.904 362 HD11 LEU 47 1HD1 LEU 47 6.323 -7.716 -14.991 363 HD12 LEU 47 2HD1 LEU 47 5.890 -6.592 -13.692 364 HD13 LEU 47 3HD1 LEU 47 7.547 -7.224 -13.796 365 HD21 LEU 47 1HD2 LEU 47 6.562 -4.242 -13.781 366 HD22 LEU 47 2HD2 LEU 47 7.665 -3.647 -15.039 367 HD23 LEU 47 3HD2 LEU 47 8.271 -4.731 -13.766 368 H CYS 48 H CYS 48 5.852 -8.271 -17.934 369 HA CYS 48 HA CYS 48 5.201 -6.051 -19.828 370 HB2 CYS 48 1HB CYS 48 4.405 -8.967 -19.994 371 HB3 CYS 48 2HB CYS 48 4.049 -7.705 -21.182 372 HG CYS 48 HG CYS 48 6.962 -8.897 -20.200 373 H SER 49 H SER 49 2.924 -5.625 -20.157 374 HA SER 49 HA SER 49 1.225 -6.426 -17.834 375 HB2 SER 49 1HB SER 49 0.013 -4.232 -18.357 376 HB3 SER 49 2HB SER 49 1.583 -4.124 -17.539 377 HG SER 49 HG SER 49 1.469 -2.660 -19.253 378 H LEU 50 H LEU 50 -0.562 -7.458 -18.275 379 HA LEU 50 HA LEU 50 -2.027 -7.177 -20.799 380 HB2 LEU 50 1HB LEU 50 -0.126 -8.709 -21.405 381 HB3 LEU 50 2HB LEU 50 -0.611 -9.772 -20.103 382 HG LEU 50 HG LEU 50 -2.767 -10.199 -21.280 383 HD11 LEU 50 1HD1 LEU 50 -2.941 -8.186 -22.658 384 HD12 LEU 50 2HD1 LEU 50 -2.889 -9.618 -23.702 385 HD13 LEU 50 3HD1 LEU 50 -1.445 -8.604 -23.508 386 HD21 LEU 50 1HD2 LEU 50 -0.209 -10.768 -22.813 387 HD22 LEU 50 2HD2 LEU 50 -1.748 -11.637 -23.003 388 HD23 LEU 50 3HD2 LEU 50 -0.873 -11.726 -21.461 389 H HIS 51 H HIS 51 -4.120 -8.253 -20.522 390 HA HIS 51 HA HIS 51 -5.928 -8.976 -19.320 391 HB2 HIS 51 1HB HIS 51 -4.175 -10.950 -19.209 392 HB3 HIS 51 2HB HIS 51 -4.138 -10.561 -17.486 393 HD1 HIS 51 HD1 HIS 51 -6.824 -10.400 -16.465 394 HD2 HIS 51 HD2 HIS 51 -6.010 -12.812 -19.765 395 HE1 HIS 51 HE1 HIS 51 -8.705 -12.096 -16.627 396 H GLY 52 H GLY 52 -4.499 -6.527 -18.326 397 HA2 GLY 52 1HA GLY 52 -4.983 -5.013 -16.649 398 HA3 GLY 52 2HA GLY 52 -6.113 -6.183 -15.965 399 H ARG 53 H ARG 53 -2.882 -7.354 -16.402 400 HA ARG 53 HA ARG 53 -2.096 -6.555 -13.655 401 HB2 ARG 53 1HB ARG 53 -1.556 -8.806 -13.011 402 HB3 ARG 53 2HB ARG 53 -3.255 -8.757 -13.475 403 HG2 ARG 53 1HG ARG 53 -2.975 -10.320 -15.075 404 HG3 ARG 53 2HG ARG 53 -1.549 -9.513 -15.740 405 HD2 ARG 53 1HD ARG 53 -0.162 -10.966 -14.766 406 HD3 ARG 53 2HD ARG 53 -0.893 -10.692 -13.177 407 HE ARG 53 HE ARG 53 -2.649 -12.358 -14.621 408 HH11 ARG 53 1HH1 ARG 53 0.613 -12.542 -13.290 409 HH12 ARG 53 2HH1 ARG 53 0.531 -14.267 -13.051 410 HH21 ARG 53 1HH2 ARG 53 -2.695 -14.571 -14.266 411 HH22 ARG 53 2HH2 ARG 53 -1.301 -15.382 -13.599 412 H GLN 54 H GLN 54 0.228 -7.221 -13.279 413 HA GLN 54 HA GLN 54 1.751 -7.116 -15.848 414 HB2 GLN 54 1HB GLN 54 2.604 -6.247 -13.053 415 HB3 GLN 54 2HB GLN 54 3.638 -6.288 -14.484 416 HG2 GLN 54 1HG GLN 54 3.025 -4.029 -14.186 417 HG3 GLN 54 2HG GLN 54 2.094 -4.624 -15.564 418 HE21 GLN 54 1HE2 GLN 54 0.158 -3.766 -12.030 419 HE22 GLN 54 2HE2 GLN 54 1.839 -4.253 -12.013 420 H GLY 55 H GLY 55 3.644 -8.550 -15.868 421 HA2 GLY 55 1HA GLY 55 4.110 -10.387 -13.701 422 HA3 GLY 55 2HA GLY 55 3.147 -11.162 -14.979 423 H ILE 56 H ILE 56 5.719 -12.075 -14.395 424 HA ILE 56 HA ILE 56 7.564 -10.775 -16.261 425 HB ILE 56 HB ILE 56 9.161 -12.524 -15.669 426 HG12 ILE 56 1HG1 ILE 56 6.959 -13.791 -13.997 427 HG13 ILE 56 2HG1 ILE 56 7.495 -14.410 -15.558 428 HG21 ILE 56 1HG2 ILE 56 9.445 -11.954 -13.340 429 HG22 ILE 56 2HG2 ILE 56 8.723 -10.548 -14.133 430 HG23 ILE 56 3HG2 ILE 56 7.717 -11.626 -13.131 431 HD11 ILE 56 1HD1 ILE 56 8.548 -15.730 -13.878 432 HD12 ILE 56 2HD1 ILE 56 9.808 -14.680 -14.568 433 HD13 ILE 56 3HD1 ILE 56 9.088 -14.292 -12.986 434 H VAL 57 H VAL 57 8.290 -11.528 -18.194 435 HA VAL 57 HA VAL 57 6.857 -13.838 -19.422 436 HB VAL 57 HB VAL 57 7.082 -10.986 -20.512 437 HG11 VAL 57 1HG1 VAL 57 6.366 -13.545 -21.960 438 HG12 VAL 57 2HG1 VAL 57 5.881 -11.946 -22.545 439 HG13 VAL 57 3HG1 VAL 57 7.602 -12.346 -22.386 440 HG21 VAL 57 1HG2 VAL 57 4.597 -11.193 -20.752 441 HG22 VAL 57 2HG2 VAL 57 4.683 -12.774 -19.941 442 HG23 VAL 57 3HG2 VAL 57 5.146 -11.295 -19.068 443 HA PRO 58 HA PRO 58 11.137 -14.258 -20.717 444 HB2 PRO 58 1HB PRO 58 10.896 -16.279 -22.546 445 HB3 PRO 58 2HB PRO 58 10.822 -16.561 -20.777 446 HG2 PRO 58 1HG PRO 58 8.558 -16.262 -22.741 447 HG3 PRO 58 2HG PRO 58 8.797 -17.504 -21.476 448 HD2 PRO 58 1HD PRO 58 7.200 -15.360 -21.132 449 HD3 PRO 58 2HD PRO 58 8.144 -16.073 -19.785 450 H GLY 59 H GLY 59 11.681 -12.444 -21.800 451 HA2 GLY 59 1HA GLY 59 10.112 -11.256 -23.803 452 HA3 GLY 59 2HA GLY 59 11.765 -10.824 -23.372 453 H ASN 60 H ASN 60 12.779 -13.537 -24.205 454 HA ASN 60 HA ASN 60 13.268 -12.819 -26.957 455 HB2 ASN 60 1HB ASN 60 14.787 -14.165 -25.385 456 HB3 ASN 60 2HB ASN 60 13.753 -15.557 -25.756 457 HD21 ASN 60 1HD2 ASN 60 15.715 -16.261 -28.535 458 HD22 ASN 60 2HD2 ASN 60 14.882 -16.820 -27.106 459 H ARG 61 H ARG 61 10.567 -14.276 -25.499 460 HA ARG 61 HA ARG 61 9.851 -15.790 -27.964 461 HB2 ARG 61 1HB ARG 61 8.298 -15.428 -25.379 462 HB3 ARG 61 2HB ARG 61 7.870 -16.491 -26.711 463 HG2 ARG 61 1HG ARG 61 10.186 -17.612 -26.259 464 HG3 ARG 61 2HG ARG 61 10.089 -16.777 -24.695 465 HD2 ARG 61 1HD ARG 61 7.650 -17.797 -24.634 466 HD3 ARG 61 2HD ARG 61 8.292 -18.935 -25.824 467 HE ARG 61 HE ARG 61 8.831 -18.835 -22.965 468 HH11 ARG 61 1HH1 ARG 61 10.124 -20.027 -26.031 469 HH12 ARG 61 2HH1 ARG 61 11.063 -21.274 -25.248 470 HH21 ARG 61 1HH2 ARG 61 10.038 -20.431 -22.048 471 HH22 ARG 61 2HH2 ARG 61 11.015 -21.491 -23.029 472 H LEU 62 H LEU 62 9.953 -12.647 -27.215 473 HA LEU 62 HA LEU 62 7.275 -12.024 -28.422 474 HB2 LEU 62 1HB LEU 62 9.012 -10.267 -26.667 475 HB3 LEU 62 2HB LEU 62 7.415 -9.893 -27.280 476 HG LEU 62 HG LEU 62 8.060 -11.938 -25.141 477 HD11 LEU 62 1HD1 LEU 62 6.732 -9.187 -25.038 478 HD12 LEU 62 2HD1 LEU 62 8.355 -9.592 -24.434 479 HD13 LEU 62 3HD1 LEU 62 6.922 -10.285 -23.659 480 HD21 LEU 62 1HD2 LEU 62 6.105 -12.677 -26.357 481 HD22 LEU 62 2HD2 LEU 62 5.400 -11.043 -26.304 482 HD23 LEU 62 3HD2 LEU 62 5.587 -11.990 -24.814 483 H LYS 63 H LYS 63 7.246 -10.277 -29.961 484 HA LYS 63 HA LYS 63 9.973 -9.368 -30.838 485 HB2 LYS 63 1HB LYS 63 8.891 -10.873 -32.524 486 HB3 LYS 63 2HB LYS 63 7.559 -9.707 -32.647 487 HG2 LYS 63 1HG LYS 63 9.239 -7.954 -33.265 488 HG3 LYS 63 2HG LYS 63 10.487 -9.208 -33.284 489 HD2 LYS 63 1HD LYS 63 9.220 -10.398 -35.058 490 HD3 LYS 63 2HD LYS 63 8.025 -9.079 -35.056 491 HE2 LYS 63 1HE LYS 63 11.001 -8.803 -35.664 492 HE3 LYS 63 2HE LYS 63 9.689 -8.762 -36.860 493 HZ1 LYS 63 1HZ LYS 63 10.461 -6.527 -36.219 494 HZ2 LYS 63 2HZ LYS 63 10.012 -6.788 -34.656 495 HZ3 LYS 63 3HZ LYS 63 8.869 -6.736 -35.835 496 H ILE 64 H ILE 64 10.281 -7.309 -30.501 497 HA ILE 64 HA ILE 64 8.335 -5.465 -29.580 498 HB ILE 64 HB ILE 64 11.025 -4.963 -30.973 499 HG12 ILE 64 1HG1 ILE 64 11.231 -6.355 -28.942 500 HG13 ILE 64 2HG1 ILE 64 11.988 -4.780 -28.755 501 HG21 ILE 64 1HG2 ILE 64 9.831 -2.880 -31.033 502 HG22 ILE 64 2HG2 ILE 64 9.237 -3.074 -29.371 503 HG23 ILE 64 3HG2 ILE 64 10.965 -2.762 -29.678 504 HD11 ILE 64 1HD1 ILE 64 9.295 -5.597 -27.555 505 HD12 ILE 64 2HD1 ILE 64 10.831 -5.418 -26.687 506 HD13 ILE 64 3HD1 ILE 64 10.047 -3.993 -27.388 507 H LEU 65 H LEU 65 7.055 -4.011 -30.519 508 HA LEU 65 HA LEU 65 6.752 -4.129 -33.497 509 HB2 LEU 65 1HB LEU 65 4.801 -3.321 -31.306 510 HB3 LEU 65 2HB LEU 65 4.440 -3.359 -33.031 511 HG LEU 65 HG LEU 65 5.172 -5.801 -31.391 512 HD11 LEU 65 1HD1 LEU 65 2.785 -6.332 -31.490 513 HD12 LEU 65 2HD1 LEU 65 2.463 -4.791 -32.314 514 HD13 LEU 65 3HD1 LEU 65 3.070 -4.809 -30.641 515 HD21 LEU 65 1HD2 LEU 65 4.081 -5.500 -34.220 516 HD22 LEU 65 2HD2 LEU 65 4.238 -7.036 -33.340 517 HD23 LEU 65 3HD2 LEU 65 5.690 -6.110 -33.754 518 H VAL 66 H VAL 66 5.391 -1.884 -33.988 519 HA VAL 66 HA VAL 66 5.547 0.341 -34.395 520 HB VAL 66 HB VAL 66 6.875 0.719 -31.671 521 HG11 VAL 66 1HG1 VAL 66 5.731 2.918 -31.762 522 HG12 VAL 66 2HG1 VAL 66 6.848 2.720 -33.121 523 HG13 VAL 66 3HG1 VAL 66 5.095 2.525 -33.377 524 HG21 VAL 66 1HG2 VAL 66 4.540 1.033 -30.804 525 HG22 VAL 66 2HG2 VAL 66 3.911 0.424 -32.353 526 HG23 VAL 66 3HG2 VAL 66 4.879 -0.633 -31.293 527 H GLY 67 H GLY 67 7.012 -0.340 -36.080 528 HA2 GLY 67 1HA GLY 67 9.207 1.361 -36.380 529 HA3 GLY 67 2HA GLY 67 9.851 -0.178 -35.769 530 H MET 68 H MET 68 8.434 1.493 -38.499 531 HA MET 68 HA MET 68 9.171 -0.672 -40.315 532 HB2 MET 68 1HB MET 68 6.807 -1.159 -39.255 533 HB3 MET 68 2HB MET 68 6.250 0.144 -40.302 534 HG2 MET 68 1HG MET 68 6.702 -1.075 -42.253 535 HG3 MET 68 2HG MET 68 7.840 -2.161 -41.428 536 HE1 MET 68 1HE MET 68 7.225 -4.358 -40.232 537 HE2 MET 68 2HE MET 68 6.568 -3.350 -38.917 538 HE3 MET 68 3HE MET 68 5.613 -4.706 -39.562 539 H TYR 69 H TYR 69 8.958 0.134 -42.576 540 HA TYR 69 HA TYR 69 9.494 2.960 -42.777 541 HB2 TYR 69 1HB TYR 69 8.812 0.899 -44.920 542 HB3 TYR 69 2HB TYR 69 9.431 2.523 -45.233 543 HD1 TYR 69 HD1 TYR 69 11.792 3.108 -44.656 544 HD2 TYR 69 HD2 TYR 69 10.299 -0.904 -44.188 545 HE1 TYR 69 HE1 TYR 69 14.130 2.245 -44.517 546 HE2 TYR 69 HE2 TYR 69 12.645 -1.752 -44.042 547 HH TYR 69 HH TYR 69 15.471 0.407 -44.295 548 H ASP 70 H ASP 70 6.729 0.862 -43.524 549 HA ASP 70 HA ASP 70 5.093 3.030 -44.551 550 HB2 ASP 70 1HB ASP 70 4.547 0.135 -43.830 551 HB3 ASP 70 2HB ASP 70 3.318 1.226 -44.496 552 H LYS 71 H LYS 71 3.204 3.838 -43.622 553 HA LYS 71 HA LYS 71 3.411 4.014 -40.668 554 HB2 LYS 71 1HB LYS 71 2.048 5.680 -42.812 555 HB3 LYS 71 2HB LYS 71 1.640 5.858 -41.105 556 HG2 LYS 71 1HG LYS 71 3.221 7.569 -41.566 557 HG3 LYS 71 2HG LYS 71 4.093 6.343 -40.638 558 HD2 LYS 71 1HD LYS 71 5.083 5.467 -42.748 559 HD3 LYS 71 2HD LYS 71 4.210 6.709 -43.667 560 HE2 LYS 71 1HE LYS 71 5.453 8.466 -42.522 561 HE3 LYS 71 2HE LYS 71 6.224 7.269 -41.456 562 HZ1 LYS 71 1HZ LYS 71 7.210 6.247 -43.435 563 HZ2 LYS 71 2HZ LYS 71 7.702 7.818 -43.263 564 HZ3 LYS 71 3HZ LYS 71 6.568 7.430 -44.393 565 H LYS 72 H LYS 72 1.602 3.700 -39.321 566 HA LYS 72 HA LYS 72 -0.189 1.578 -40.230 567 HB2 LYS 72 1HB LYS 72 -0.010 3.210 -37.660 568 HB3 LYS 72 2HB LYS 72 -1.185 1.924 -37.901 569 HG2 LYS 72 1HG LYS 72 1.837 1.541 -37.984 570 HG3 LYS 72 2HG LYS 72 0.830 1.247 -36.565 571 HD2 LYS 72 1HD LYS 72 0.569 -0.222 -39.236 572 HD3 LYS 72 2HD LYS 72 1.396 -0.849 -37.804 573 HE2 LYS 72 1HE LYS 72 -1.578 -0.192 -38.009 574 HE3 LYS 72 2HE LYS 72 -0.866 -1.811 -38.025 575 HZ1 LYS 72 1HZ LYS 72 -0.751 0.088 -35.747 576 HZ2 LYS 72 2HZ LYS 72 -0.090 -1.421 -35.759 577 HZ3 LYS 72 3HZ LYS 72 -1.728 -1.233 -35.847 578 HA PRO 73 HA PRO 73 -3.404 4.394 -41.435 579 HB2 PRO 73 1HB PRO 73 -5.644 2.871 -41.261 580 HB3 PRO 73 2HB PRO 73 -4.361 2.507 -42.460 581 HG2 PRO 73 1HG PRO 73 -4.795 1.304 -39.738 582 HG3 PRO 73 2HG PRO 73 -4.601 0.479 -41.317 583 HD2 PRO 73 1HD PRO 73 -2.517 0.819 -39.619 584 HD3 PRO 73 2HD PRO 73 -2.300 0.921 -41.401 585 H ALA 74 H ALA 74 -2.924 3.447 -38.306 586 HA ALA 74 HA ALA 74 -3.551 4.201 -36.268 587 HB1 ALA 74 1HB ALA 74 -4.171 6.493 -36.065 588 HB2 ALA 74 2HB ALA 74 -3.130 6.382 -37.499 589 HB3 ALA 74 3HB ALA 74 -4.890 6.521 -37.695 590 H GLY 75 H GLY 75 -5.924 5.846 -35.672 591 HA2 GLY 75 1HA GLY 75 -8.329 4.428 -36.289 592 HA3 GLY 75 2HA GLY 75 -7.650 3.862 -34.735 593 H GLU 76 H GLU 76 -9.172 4.931 -33.365 594 HA GLU 76 HA GLU 76 -9.879 7.698 -33.584 595 HB2 GLU 76 1HB GLU 76 -9.684 5.863 -31.165 596 HB3 GLU 76 2HB GLU 76 -10.454 7.456 -31.158 597 HG2 GLU 76 1HG GLU 76 -12.145 6.711 -32.715 598 HG3 GLU 76 2HG GLU 76 -11.330 5.152 -32.926 599 H PHE 77 H PHE 77 -7.056 6.055 -32.369 600 HA PHE 77 HA PHE 77 -5.942 8.665 -31.447 601 HB2 PHE 77 1HB PHE 77 -5.192 5.826 -30.651 602 HB3 PHE 77 2HB PHE 77 -4.331 7.290 -30.148 603 HD1 PHE 77 HD1 PHE 77 -5.497 8.978 -28.694 604 HD2 PHE 77 HD2 PHE 77 -7.223 5.132 -29.548 605 HE1 PHE 77 HE1 PHE 77 -7.055 9.257 -26.770 606 HE2 PHE 77 HE2 PHE 77 -8.794 5.405 -27.634 607 HZ PHE 77 HZ PHE 77 -8.706 7.467 -26.237 608 H ILE 78 H ILE 78 -4.110 9.376 -32.368 609 HA ILE 78 HA ILE 78 -2.632 7.657 -34.274 610 HB ILE 78 HB ILE 78 -4.419 8.852 -35.614 611 HG12 ILE 78 1HG1 ILE 78 -1.674 10.016 -36.201 612 HG13 ILE 78 2HG1 ILE 78 -2.081 8.323 -36.482 613 HG21 ILE 78 1HG2 ILE 78 -4.406 11.300 -35.850 614 HG22 ILE 78 2HG2 ILE 78 -4.656 10.867 -34.154 615 HG23 ILE 78 3HG2 ILE 78 -3.062 11.440 -34.694 616 HD11 ILE 78 1HD1 ILE 78 -3.913 9.060 -38.041 617 HD12 ILE 78 2HD1 ILE 78 -3.360 10.739 -37.833 618 HD13 ILE 78 3HD1 ILE 78 -2.286 9.535 -38.576 619 H VAL 79 H VAL 79 -0.472 8.455 -34.559 620 HA VAL 79 HA VAL 79 0.331 10.732 -32.836 621 HB VAL 79 HB VAL 79 2.341 9.426 -32.072 622 HG11 VAL 79 1HG1 VAL 79 0.340 9.657 -30.611 623 HG12 VAL 79 2HG1 VAL 79 -0.287 8.116 -31.240 624 HG13 VAL 79 3HG1 VAL 79 1.229 8.151 -30.310 625 HG21 VAL 79 1HG2 VAL 79 2.378 6.968 -32.244 626 HG22 VAL 79 2HG2 VAL 79 0.866 6.982 -33.176 627 HG23 VAL 79 3HG2 VAL 79 2.347 7.690 -33.865 628 H THR 80 H THR 80 2.445 11.569 -33.515 629 HA THR 80 HA THR 80 3.242 10.761 -36.276 630 HB THR 80 HB THR 80 3.673 13.214 -36.711 631 HG1 THR 80 HG1 THR 80 2.870 14.703 -35.274 632 HG21 THR 80 1HG2 THR 80 0.763 12.669 -35.977 633 HG22 THR 80 2HG2 THR 80 1.539 12.109 -37.478 634 HG23 THR 80 3HG2 THR 80 1.368 13.850 -37.159 635 H ASP 81 H ASP 81 5.485 11.461 -36.747 636 HA ASP 81 HA ASP 81 7.187 11.374 -34.317 637 HB2 ASP 81 1HB ASP 81 8.999 10.725 -35.855 638 HB3 ASP 81 2HB ASP 81 7.638 9.615 -36.005 639 HXT ASP 81 H02 ASP 81 8.851 14.222 -35.006 Start of MODEL 33 1 H2 GLY 1 2H0 GLY 1 -1.049 9.381 -19.425 2 H GLY 1 1H0 GLY 1 -0.027 9.260 -20.711 3 HA2 GLY 1 1HA GLY 1 0.134 11.426 -19.453 4 HA3 GLY 1 2HA GLY 1 0.823 10.459 -18.146 5 H SER 2 H SER 2 2.812 11.065 -18.003 6 HA SER 2 HA SER 2 4.593 10.808 -20.398 7 HB2 SER 2 1HB SER 2 4.715 13.112 -18.424 8 HB3 SER 2 2HB SER 2 5.688 12.903 -19.891 9 HG SER 2 HG SER 2 3.426 12.762 -20.882 10 H MET 3 H MET 3 4.199 8.950 -18.276 11 HA MET 3 HA MET 3 6.233 9.255 -16.230 12 HB2 MET 3 1HB MET 3 4.696 6.833 -17.263 13 HB3 MET 3 2HB MET 3 5.824 6.784 -15.910 14 HG2 MET 3 1HG MET 3 3.737 6.979 -14.874 15 HG3 MET 3 2HG MET 3 4.351 8.643 -14.837 16 HE1 MET 3 1HE MET 3 0.448 8.997 -15.408 17 HE2 MET 3 2HE MET 3 1.241 7.713 -14.481 18 HE3 MET 3 3HE MET 3 1.821 9.394 -14.339 19 H LYS 4 H LYS 4 8.281 8.406 -16.182 20 HA LYS 4 HA LYS 4 9.455 7.702 -18.782 21 HB2 LYS 4 1HB LYS 4 10.722 8.226 -16.076 22 HB3 LYS 4 2HB LYS 4 11.614 7.793 -17.544 23 HG2 LYS 4 1HG LYS 4 10.688 9.814 -18.659 24 HG3 LYS 4 2HG LYS 4 9.912 10.304 -17.151 25 HD2 LYS 4 1HD LYS 4 12.913 9.861 -17.500 26 HD3 LYS 4 2HD LYS 4 12.132 11.431 -17.650 27 HE2 LYS 4 1HE LYS 4 12.136 9.708 -15.129 28 HE3 LYS 4 2HE LYS 4 13.166 11.127 -15.421 29 HZ1 LYS 4 1HZ LYS 4 11.156 12.476 -15.586 30 HZ2 LYS 4 2HZ LYS 4 11.215 11.707 -14.129 31 HZ3 LYS 4 3HZ LYS 4 10.227 11.138 -15.321 32 H TYR 5 H TYR 5 8.459 5.698 -19.055 33 HA TYR 5 HA TYR 5 9.875 3.454 -17.711 34 HB2 TYR 5 1HB TYR 5 7.144 4.122 -17.180 35 HB3 TYR 5 2HB TYR 5 7.112 2.734 -18.280 36 HD1 TYR 5 HD1 TYR 5 9.184 3.798 -15.274 37 HD2 TYR 5 HD2 TYR 5 6.974 0.678 -17.211 38 HE1 TYR 5 HE1 TYR 5 9.673 2.248 -13.360 39 HE2 TYR 5 HE2 TYR 5 7.490 -0.868 -15.291 40 HH TYR 5 HH TYR 5 9.655 -0.067 -12.686 41 H LEU 6 H LEU 6 9.431 1.436 -19.337 42 HA LEU 6 HA LEU 6 10.340 2.445 -21.846 43 HB2 LEU 6 1HB LEU 6 9.429 -0.236 -20.936 44 HB3 LEU 6 2HB LEU 6 9.618 0.027 -22.638 45 HG LEU 6 HG LEU 6 11.540 -1.096 -21.612 46 HD11 LEU 6 1HD1 LEU 6 13.268 0.302 -22.679 47 HD12 LEU 6 2HD1 LEU 6 12.155 1.682 -22.699 48 HD13 LEU 6 3HD1 LEU 6 11.793 0.239 -23.672 49 HD21 LEU 6 1HD2 LEU 6 11.509 0.068 -19.403 50 HD22 LEU 6 2HD2 LEU 6 12.165 1.520 -20.204 51 HD23 LEU 6 3HD2 LEU 6 13.099 0.009 -20.180 52 H ASN 7 H ASN 7 7.156 1.017 -21.063 53 HA ASN 7 HA ASN 7 5.197 0.999 -22.221 54 HB2 ASN 7 1HB ASN 7 5.499 3.418 -21.415 55 HB3 ASN 7 2HB ASN 7 5.925 3.794 -23.087 56 HD21 ASN 7 1HD2 ASN 7 2.527 4.464 -23.560 57 HD22 ASN 7 2HD2 ASN 7 4.149 5.100 -23.479 58 H VAL 8 H VAL 8 7.027 -0.343 -23.753 59 HA VAL 8 HA VAL 8 6.312 0.517 -26.555 60 HB VAL 8 HB VAL 8 8.206 -0.902 -27.275 61 HG11 VAL 8 1HG1 VAL 8 9.180 1.096 -25.229 62 HG12 VAL 8 2HG1 VAL 8 10.045 0.556 -26.680 63 HG13 VAL 8 3HG1 VAL 8 8.569 1.544 -26.837 64 HG21 VAL 8 1HG2 VAL 8 8.321 -2.536 -25.494 65 HG22 VAL 8 2HG2 VAL 8 9.899 -1.722 -25.634 66 HG23 VAL 8 3HG2 VAL 8 8.771 -1.280 -24.335 67 H LEU 9 H LEU 9 6.063 -1.720 -27.865 68 HA LEU 9 HA LEU 9 4.731 -3.698 -26.099 69 HB2 LEU 9 1HB LEU 9 2.889 -3.846 -27.797 70 HB3 LEU 9 2HB LEU 9 2.879 -2.438 -26.742 71 HG LEU 9 HG LEU 9 4.289 -1.909 -29.263 72 HD11 LEU 9 1HD1 LEU 9 2.278 -1.845 -30.667 73 HD12 LEU 9 2HD1 LEU 9 1.335 -2.600 -29.358 74 HD13 LEU 9 3HD1 LEU 9 2.647 -3.510 -30.149 75 HD21 LEU 9 1HD2 LEU 9 2.854 0.096 -29.152 76 HD22 LEU 9 2HD2 LEU 9 3.592 -0.235 -27.555 77 HD23 LEU 9 3HD2 LEU 9 1.893 -0.652 -27.850 78 H ALA 10 H ALA 10 4.372 -5.714 -26.992 79 HA ALA 10 HA ALA 10 6.031 -6.327 -29.395 80 HB1 ALA 10 1HB ALA 10 6.243 -7.749 -26.693 81 HB2 ALA 10 2HB ALA 10 7.219 -8.041 -28.169 82 HB3 ALA 10 3HB ALA 10 7.390 -6.524 -27.290 83 H LYS 11 H LYS 11 5.572 -8.318 -30.354 84 HA LYS 11 HA LYS 11 2.827 -9.383 -29.784 85 HB2 LYS 11 1HB LYS 11 3.362 -8.793 -32.133 86 HB3 LYS 11 2HB LYS 11 4.800 -9.832 -32.075 87 HG2 LYS 11 1HG LYS 11 3.172 -11.742 -31.578 88 HG3 LYS 11 2HG LYS 11 1.887 -10.668 -32.067 89 HD2 LYS 11 1HD LYS 11 4.311 -11.293 -33.800 90 HD3 LYS 11 2HD LYS 11 2.821 -12.289 -33.812 91 HE2 LYS 11 1HE LYS 11 1.505 -10.257 -34.329 92 HE3 LYS 11 2HE LYS 11 3.028 -9.336 -34.452 93 HZ1 LYS 11 1HZ LYS 11 2.275 -11.686 -36.120 94 HZ2 LYS 11 2HZ LYS 11 3.698 -10.858 -36.251 95 HZ3 LYS 11 3HZ LYS 11 2.284 -10.116 -36.624 96 H ALA 12 H ALA 12 2.534 -11.359 -28.883 97 HA ALA 12 HA ALA 12 4.841 -12.969 -28.093 98 HB1 ALA 12 1HB ALA 12 1.832 -13.389 -28.063 99 HB2 ALA 12 2HB ALA 12 2.985 -14.622 -27.525 100 HB3 ALA 12 3HB ALA 12 2.914 -13.074 -26.677 101 H LEU 13 H LEU 13 5.903 -14.377 -29.324 102 HA LEU 13 HA LEU 13 4.800 -15.016 -32.013 103 HB2 LEU 13 1HB LEU 13 7.411 -15.742 -30.613 104 HB3 LEU 13 2HB LEU 13 7.031 -16.131 -32.293 105 HG LEU 13 HG LEU 13 7.269 -13.301 -31.189 106 HD11 LEU 13 1HD1 LEU 13 9.413 -14.482 -31.112 107 HD12 LEU 13 2HD1 LEU 13 9.431 -13.268 -32.398 108 HD13 LEU 13 3HD1 LEU 13 9.223 -14.988 -32.804 109 HD21 LEU 13 1HD2 LEU 13 5.809 -13.332 -33.132 110 HD22 LEU 13 2HD2 LEU 13 6.979 -14.354 -34.026 111 HD23 LEU 13 3HD2 LEU 13 7.399 -12.689 -33.612 112 H TYR 14 H TYR 14 5.229 -16.400 -28.851 113 HA TYR 14 HA TYR 14 4.144 -19.009 -29.802 114 HB2 TYR 14 1HB TYR 14 6.130 -18.650 -27.544 115 HB3 TYR 14 2HB TYR 14 5.601 -20.169 -28.269 116 HD1 TYR 14 HD1 TYR 14 7.884 -17.307 -28.513 117 HD2 TYR 14 HD2 TYR 14 6.517 -20.842 -30.545 118 HE1 TYR 14 HE1 TYR 14 9.892 -17.221 -29.996 119 HE2 TYR 14 HE2 TYR 14 8.538 -20.747 -32.036 120 HH TYR 14 HH TYR 14 11.047 -18.222 -31.666 121 H ASP 15 H ASP 15 3.099 -20.187 -27.865 122 HA ASP 15 HA ASP 15 1.672 -18.143 -26.225 123 HB2 ASP 15 1HB ASP 15 0.135 -20.194 -25.797 124 HB3 ASP 15 2HB ASP 15 0.075 -19.404 -27.364 125 H ASN 16 H ASN 16 1.155 -18.630 -24.014 126 HA ASN 16 HA ASN 16 2.878 -20.602 -22.648 127 HB2 ASN 16 1HB ASN 16 4.130 -18.355 -22.974 128 HB3 ASN 16 2HB ASN 16 2.967 -17.722 -21.796 129 HD21 ASN 16 1HD2 ASN 16 4.769 -18.897 -19.102 130 HD22 ASN 16 2HD2 ASN 16 3.584 -17.773 -19.750 131 H VAL 17 H VAL 17 2.066 -21.237 -20.658 132 HA VAL 17 HA VAL 17 -0.381 -19.801 -19.698 133 HB VAL 17 HB VAL 17 0.284 -22.775 -19.458 134 HG11 VAL 17 1HG1 VAL 17 -1.944 -22.947 -18.380 135 HG12 VAL 17 2HG1 VAL 17 -0.836 -21.935 -17.431 136 HG13 VAL 17 3HG1 VAL 17 -2.102 -21.175 -18.432 137 HG21 VAL 17 1HG2 VAL 17 -1.947 -21.373 -20.988 138 HG22 VAL 17 2HG2 VAL 17 -0.542 -22.198 -21.712 139 HG23 VAL 17 3HG2 VAL 17 -1.755 -23.130 -20.799 140 H ALA 18 H ALA 18 0.019 -18.912 -17.701 141 HA ALA 18 HA ALA 18 2.682 -18.845 -16.769 142 HB1 ALA 18 1HB ALA 18 1.072 -17.057 -16.330 143 HB2 ALA 18 2HB ALA 18 0.089 -18.156 -15.316 144 HB3 ALA 18 3HB ALA 18 1.731 -17.677 -14.808 145 H GLU 19 H GLU 19 3.854 -20.113 -15.565 146 HA GLU 19 HA GLU 19 2.559 -22.441 -14.201 147 HB2 GLU 19 1HB GLU 19 5.484 -21.768 -14.707 148 HB3 GLU 19 2HB GLU 19 4.846 -23.308 -14.085 149 HG2 GLU 19 1HG GLU 19 3.574 -23.552 -16.263 150 HG3 GLU 19 2HG GLU 19 4.436 -22.137 -16.849 151 H SER 20 H SER 20 3.469 -19.301 -13.539 152 HA SER 20 HA SER 20 3.745 -19.833 -10.627 153 HB2 SER 20 1HB SER 20 6.019 -19.581 -11.518 154 HB3 SER 20 2HB SER 20 5.536 -18.109 -12.381 155 HG SER 20 HG SER 20 6.629 -17.688 -10.403 156 HA PRO 21 HA PRO 21 0.967 -16.386 -10.631 157 HB2 PRO 21 1HB PRO 21 1.527 -15.103 -8.265 158 HB3 PRO 21 2HB PRO 21 0.679 -16.676 -8.322 159 HG2 PRO 21 1HG PRO 21 3.619 -16.133 -7.886 160 HG3 PRO 21 2HG PRO 21 2.493 -17.117 -6.906 161 HD2 PRO 21 1HD PRO 21 4.060 -18.293 -8.707 162 HD3 PRO 21 2HD PRO 21 2.351 -18.821 -8.507 163 H ASP 22 H ASP 22 4.438 -15.915 -10.144 164 HA ASP 22 HA ASP 22 4.492 -13.052 -10.559 165 HB2 ASP 22 1HB ASP 22 6.571 -15.267 -10.921 166 HB3 ASP 22 2HB ASP 22 6.927 -13.549 -11.170 167 H GLU 23 H GLU 23 4.080 -15.795 -12.658 168 HA GLU 23 HA GLU 23 5.298 -14.427 -14.972 169 HB2 GLU 23 1HB GLU 23 5.727 -16.826 -14.320 170 HB3 GLU 23 2HB GLU 23 4.066 -17.181 -14.804 171 HG2 GLU 23 1HG GLU 23 4.559 -16.407 -17.079 172 HG3 GLU 23 2HG GLU 23 6.224 -16.026 -16.581 173 H LEU 24 H LEU 24 4.184 -14.141 -16.976 174 HA LEU 24 HA LEU 24 1.263 -13.734 -16.583 175 HB2 LEU 24 1HB LEU 24 3.352 -12.302 -17.895 176 HB3 LEU 24 2HB LEU 24 2.167 -12.775 -19.104 177 HG LEU 24 HG LEU 24 1.566 -11.247 -16.548 178 HD11 LEU 24 1HD1 LEU 24 2.898 -10.031 -18.220 179 HD12 LEU 24 2HD1 LEU 24 1.261 -9.362 -18.023 180 HD13 LEU 24 3HD1 LEU 24 1.651 -10.366 -19.450 181 HD21 LEU 24 1HD2 LEU 24 -0.241 -12.008 -18.889 182 HD22 LEU 24 2HD2 LEU 24 -0.655 -10.820 -17.635 183 HD23 LEU 24 3HD2 LEU 24 -0.411 -12.508 -17.190 184 H SER 25 H SER 25 -0.283 -14.712 -17.714 185 HA SER 25 HA SER 25 0.444 -16.876 -19.596 186 HB2 SER 25 1HB SER 25 -2.269 -15.856 -18.646 187 HB3 SER 25 2HB SER 25 -2.011 -17.286 -19.665 188 HG SER 25 HG SER 25 -2.252 -17.786 -17.412 189 H PHE 26 H PHE 26 0.207 -16.656 -21.801 190 HA PHE 26 HA PHE 26 -1.360 -14.467 -22.980 191 HB2 PHE 26 1HB PHE 26 0.549 -13.448 -24.171 192 HB3 PHE 26 2HB PHE 26 0.654 -13.205 -22.425 193 HD1 PHE 26 HD1 PHE 26 2.473 -14.125 -21.137 194 HD2 PHE 26 HD2 PHE 26 2.081 -15.055 -25.327 195 HE1 PHE 26 HE1 PHE 26 4.755 -15.085 -21.118 196 HE2 PHE 26 HE2 PHE 26 4.370 -16.014 -25.328 197 HZ PHE 26 HZ PHE 26 5.719 -16.045 -23.221 198 H ARG 27 H ARG 27 -1.251 -14.744 -25.452 199 HA ARG 27 HA ARG 27 -0.271 -17.496 -26.117 200 HB2 ARG 27 1HB ARG 27 -2.975 -16.319 -26.786 201 HB3 ARG 27 2HB ARG 27 -2.294 -17.749 -27.588 202 HG2 ARG 27 1HG ARG 27 -2.102 -18.879 -25.382 203 HG3 ARG 27 2HG ARG 27 -2.903 -17.505 -24.614 204 HD2 ARG 27 1HD ARG 27 -4.140 -19.168 -26.836 205 HD3 ARG 27 2HD ARG 27 -4.390 -19.467 -25.118 206 HE ARG 27 HE ARG 27 -5.460 -17.251 -26.714 207 HH11 ARG 27 1HH1 ARG 27 -5.080 -18.575 -23.455 208 HH12 ARG 27 2HH1 ARG 27 -6.354 -17.581 -22.813 209 HH21 ARG 27 1HH2 ARG 27 -7.037 -15.989 -25.798 210 HH22 ARG 27 2HH2 ARG 27 -7.442 -16.169 -24.114 211 H LYS 28 H LYS 28 0.124 -17.906 -28.320 212 HA LYS 28 HA LYS 28 1.652 -15.951 -29.625 213 HB2 LYS 28 1HB LYS 28 1.432 -17.417 -31.645 214 HB3 LYS 28 2HB LYS 28 1.912 -18.264 -30.177 215 HG2 LYS 28 1HG LYS 28 -0.480 -18.991 -29.882 216 HG3 LYS 28 2HG LYS 28 -0.819 -18.295 -31.487 217 HD2 LYS 28 1HD LYS 28 0.694 -19.862 -32.539 218 HD3 LYS 28 2HD LYS 28 1.316 -20.380 -30.960 219 HE2 LYS 28 1HE LYS 28 -1.202 -20.971 -30.463 220 HE3 LYS 28 2HE LYS 28 -1.335 -21.023 -32.238 221 HZ1 LYS 28 1HZ LYS 28 0.509 -22.602 -32.236 222 HZ2 LYS 28 2HZ LYS 28 -0.730 -23.178 -31.327 223 HZ3 LYS 28 3HZ LYS 28 0.606 -22.557 -30.590 224 H GLY 29 H GLY 29 1.285 -14.306 -30.935 225 HA2 GLY 29 1HA GLY 29 0.054 -13.102 -32.595 226 HA3 GLY 29 2HA GLY 29 -1.397 -14.000 -32.167 227 H ASP 30 H ASP 30 -0.744 -13.457 -29.173 228 HA ASP 30 HA ASP 30 -2.350 -11.063 -28.989 229 HB2 ASP 30 1HB ASP 30 -2.035 -13.179 -27.421 230 HB3 ASP 30 2HB ASP 30 -0.792 -12.162 -26.672 231 H ILE 31 H ILE 31 -1.762 -9.156 -27.781 232 HA ILE 31 HA ILE 31 1.082 -8.352 -28.279 233 HB ILE 31 HB ILE 31 -1.401 -6.570 -28.445 234 HG12 ILE 31 1HG1 ILE 31 -1.480 -8.129 -30.322 235 HG13 ILE 31 2HG1 ILE 31 -1.105 -6.510 -30.879 236 HG21 ILE 31 1HG2 ILE 31 0.223 -4.945 -29.544 237 HG22 ILE 31 2HG2 ILE 31 0.529 -5.256 -27.835 238 HG23 ILE 31 3HG2 ILE 31 1.540 -6.023 -29.071 239 HD11 ILE 31 1HD1 ILE 31 0.857 -8.815 -30.619 240 HD12 ILE 31 2HD1 ILE 31 0.192 -8.129 -32.107 241 HD13 ILE 31 3HD1 ILE 31 1.302 -7.157 -31.117 242 H MET 32 H MET 32 2.127 -7.527 -26.510 243 HA MET 32 HA MET 32 0.427 -6.548 -24.245 244 HB2 MET 32 1HB MET 32 1.994 -7.592 -22.654 245 HB3 MET 32 2HB MET 32 1.166 -8.785 -23.665 246 HG2 MET 32 1HG MET 32 3.406 -8.456 -25.146 247 HG3 MET 32 2HG MET 32 4.045 -8.100 -23.532 248 HE1 MET 32 1HE MET 32 1.163 -10.625 -24.848 249 HE2 MET 32 2HE MET 32 2.541 -10.672 -25.976 250 HE3 MET 32 3HE MET 32 2.176 -12.082 -24.971 251 H THR 33 H THR 33 1.364 -5.016 -22.909 252 HA THR 33 HA THR 33 3.359 -3.326 -24.260 253 HB THR 33 HB THR 33 1.956 -2.946 -21.585 254 HG1 THR 33 HG1 THR 33 0.486 -3.029 -23.352 255 HG21 THR 33 1HG2 THR 33 3.974 -1.565 -21.823 256 HG22 THR 33 2HG2 THR 33 2.499 -0.562 -21.916 257 HG23 THR 33 3HG2 THR 33 3.394 -0.972 -23.393 258 H VAL 34 H VAL 34 5.481 -3.232 -23.689 259 HA VAL 34 HA VAL 34 6.381 -4.962 -21.396 260 HB VAL 34 HB VAL 34 7.982 -3.680 -23.670 261 HG11 VAL 34 1HG1 VAL 34 9.365 -3.676 -21.702 262 HG12 VAL 34 2HG1 VAL 34 8.892 -5.338 -21.295 263 HG13 VAL 34 3HG1 VAL 34 9.913 -5.028 -22.728 264 HG21 VAL 34 1HG2 VAL 34 8.357 -5.940 -24.484 265 HG22 VAL 34 2HG2 VAL 34 7.523 -6.635 -23.068 266 HG23 VAL 34 3HG2 VAL 34 6.611 -5.724 -24.284 267 H LEU 35 H LEU 35 6.833 -4.018 -19.544 268 HA LEU 35 HA LEU 35 6.712 -1.064 -19.457 269 HB2 LEU 35 1HB LEU 35 6.719 -3.196 -17.283 270 HB3 LEU 35 2HB LEU 35 6.466 -1.479 -17.013 271 HG LEU 35 HG LEU 35 4.624 -3.250 -18.639 272 HD11 LEU 35 1HD1 LEU 35 3.095 -2.974 -16.687 273 HD12 LEU 35 2HD1 LEU 35 4.416 -2.150 -15.804 274 HD13 LEU 35 3HD1 LEU 35 4.580 -3.846 -16.289 275 HD21 LEU 35 1HD2 LEU 35 3.052 -1.334 -18.475 276 HD22 LEU 35 2HD2 LEU 35 4.520 -0.885 -19.370 277 HD23 LEU 35 3HD2 LEU 35 4.304 -0.368 -17.674 278 H GLU 36 H GLU 36 8.889 -3.753 -18.581 279 HA GLU 36 HA GLU 36 11.212 -2.056 -18.893 280 HB2 GLU 36 1HB GLU 36 12.177 -2.326 -16.715 281 HB3 GLU 36 2HB GLU 36 10.608 -1.530 -16.556 282 HG2 GLU 36 1HG GLU 36 9.594 -3.651 -15.838 283 HG3 GLU 36 2HG GLU 36 11.157 -4.446 -15.997 284 H ARG 37 H ARG 37 13.246 -3.489 -18.295 285 HA ARG 37 HA ARG 37 12.669 -6.288 -19.178 286 HB2 ARG 37 1HB ARG 37 15.020 -4.525 -19.889 287 HB3 ARG 37 2HB ARG 37 14.833 -6.226 -20.327 288 HG2 ARG 37 1HG ARG 37 12.806 -5.624 -21.646 289 HG3 ARG 37 2HG ARG 37 13.122 -3.914 -21.292 290 HD2 ARG 37 1HD ARG 37 15.027 -5.835 -22.700 291 HD3 ARG 37 2HD ARG 37 14.055 -4.598 -23.497 292 HE ARG 37 HE ARG 37 16.419 -4.168 -21.774 293 HH11 ARG 37 1HH1 ARG 37 13.885 -2.668 -23.716 294 HH12 ARG 37 2HH1 ARG 37 14.715 -1.133 -23.781 295 HH21 ARG 37 1HH2 ARG 37 17.395 -2.212 -21.855 296 HH22 ARG 37 2HH2 ARG 37 16.661 -0.867 -22.722 297 H ASP 38 H ASP 38 14.359 -7.816 -18.426 298 HA ASP 38 HA ASP 38 15.400 -8.814 -16.678 299 HB2 ASP 38 1HB ASP 38 17.447 -7.281 -15.771 300 HB3 ASP 38 2HB ASP 38 17.464 -8.199 -17.278 301 H THR 39 H THR 39 13.037 -7.778 -15.900 302 HA THR 39 HA THR 39 13.150 -6.070 -13.609 303 HB THR 39 HB THR 39 11.124 -6.451 -15.044 304 HG1 THR 39 HG1 THR 39 10.720 -5.574 -13.069 305 HG21 THR 39 1HG2 THR 39 9.703 -8.414 -14.763 306 HG22 THR 39 2HG2 THR 39 10.868 -9.115 -13.613 307 HG23 THR 39 3HG2 THR 39 11.316 -8.930 -15.320 308 H GLN 40 H GLN 40 13.680 -9.477 -14.008 309 HA GLN 40 HA GLN 40 13.414 -9.970 -11.088 310 HB2 GLN 40 1HB GLN 40 12.750 -11.498 -13.287 311 HB3 GLN 40 2HB GLN 40 14.335 -12.121 -12.902 312 HG2 GLN 40 1HG GLN 40 12.897 -13.534 -11.710 313 HG3 GLN 40 2HG GLN 40 13.499 -12.388 -10.488 314 HE21 GLN 40 1HE2 GLN 40 9.828 -12.734 -9.995 315 HE22 GLN 40 2HE2 GLN 40 11.242 -13.783 -9.926 316 H GLY 41 H GLY 41 15.670 -8.670 -13.041 317 HA2 GLY 41 1HA GLY 41 17.947 -8.306 -12.745 318 HA3 GLY 41 2HA GLY 41 17.971 -9.508 -11.426 319 H LEU 42 H LEU 42 16.416 -11.328 -13.315 320 HA LEU 42 HA LEU 42 18.690 -12.699 -14.504 321 HB2 LEU 42 1HB LEU 42 15.687 -13.167 -14.735 322 HB3 LEU 42 2HB LEU 42 16.930 -14.272 -15.316 323 HG LEU 42 HG LEU 42 16.431 -13.552 -12.406 324 HD11 LEU 42 1HD1 LEU 42 15.514 -15.793 -12.222 325 HD12 LEU 42 2HD1 LEU 42 15.846 -16.105 -13.950 326 HD13 LEU 42 3HD1 LEU 42 14.634 -14.881 -13.475 327 HD21 LEU 42 1HD2 LEU 42 18.778 -14.132 -12.696 328 HD22 LEU 42 2HD2 LEU 42 18.350 -15.564 -13.666 329 HD23 LEU 42 3HD2 LEU 42 17.957 -15.496 -11.934 330 H ASP 43 H ASP 43 19.273 -12.529 -16.693 331 HA ASP 43 HA ASP 43 18.280 -10.269 -18.113 332 HB2 ASP 43 1HB ASP 43 19.799 -10.873 -19.854 333 HB3 ASP 43 2HB ASP 43 20.610 -11.233 -18.318 334 H GLY 44 H GLY 44 17.236 -10.208 -20.125 335 HA2 GLY 44 1HA GLY 44 15.822 -10.952 -21.804 336 HA3 GLY 44 2HA GLY 44 16.074 -12.606 -21.234 337 H TRP 45 H TRP 45 15.047 -11.594 -18.449 338 HA TRP 45 HA TRP 45 12.246 -12.217 -19.078 339 HB2 TRP 45 1HB TRP 45 13.795 -11.801 -16.510 340 HB3 TRP 45 2HB TRP 45 12.040 -12.037 -16.549 341 HD1 TRP 45 HD1 TRP 45 15.294 -13.938 -16.953 342 HE1 TRP 45 HE1 TRP 45 14.858 -16.433 -17.159 343 HE3 TRP 45 HE3 TRP 45 10.222 -13.707 -17.470 344 HZ2 TRP 45 HZ2 TRP 45 12.563 -18.144 -17.473 345 HZ3 TRP 45 HZ3 TRP 45 8.933 -15.826 -17.698 346 HH2 TRP 45 HH2 TRP 45 10.111 -18.034 -17.692 347 H TRP 46 H TRP 46 10.974 -10.634 -19.856 348 HA TRP 46 HA TRP 46 11.466 -7.881 -18.911 349 HB2 TRP 46 1HB TRP 46 9.675 -8.965 -21.088 350 HB3 TRP 46 2HB TRP 46 9.963 -7.260 -20.770 351 HD1 TRP 46 HD1 TRP 46 13.297 -8.532 -20.369 352 HE1 TRP 46 HE1 TRP 46 14.691 -8.566 -22.501 353 HE3 TRP 46 HE3 TRP 46 9.477 -7.961 -23.719 354 HZ2 TRP 46 HZ2 TRP 46 14.219 -8.360 -25.312 355 HZ3 TRP 46 HZ3 TRP 46 10.010 -7.926 -26.174 356 HH2 TRP 46 HH2 TRP 46 12.381 -8.128 -26.938 357 H LEU 47 H LEU 47 9.858 -6.599 -17.975 358 HA LEU 47 HA LEU 47 7.607 -8.108 -16.738 359 HB2 LEU 47 1HB LEU 47 8.915 -6.326 -15.478 360 HB3 LEU 47 2HB LEU 47 8.317 -5.148 -16.642 361 HG LEU 47 HG LEU 47 5.993 -5.663 -15.883 362 HD11 LEU 47 1HD1 LEU 47 5.712 -6.851 -13.693 363 HD12 LEU 47 2HD1 LEU 47 7.413 -7.342 -13.802 364 HD13 LEU 47 3HD1 LEU 47 6.250 -7.911 -15.011 365 HD21 LEU 47 1HD2 LEU 47 7.945 -4.793 -13.715 366 HD22 LEU 47 2HD2 LEU 47 6.205 -4.476 -13.734 367 HD23 LEU 47 3HD2 LEU 47 7.246 -3.749 -14.973 368 H CYS 48 H CYS 48 5.791 -8.348 -17.943 369 HA CYS 48 HA CYS 48 5.178 -6.183 -19.917 370 HB2 CYS 48 1HB CYS 48 4.548 -9.139 -20.133 371 HB3 CYS 48 2HB CYS 48 4.129 -7.894 -21.310 372 HG CYS 48 HG CYS 48 7.125 -8.866 -20.300 373 H SER 49 H SER 49 2.848 -5.977 -20.386 374 HA SER 49 HA SER 49 1.200 -6.698 -18.002 375 HB2 SER 49 1HB SER 49 1.803 -4.326 -18.005 376 HB3 SER 49 2HB SER 49 1.131 -4.140 -19.639 377 HG SER 49 HG SER 49 -0.814 -4.090 -18.818 378 H LEU 50 H LEU 50 -0.579 -7.836 -18.392 379 HA LEU 50 HA LEU 50 -2.195 -7.470 -20.800 380 HB2 LEU 50 1HB LEU 50 -0.252 -9.044 -21.454 381 HB3 LEU 50 2HB LEU 50 -0.953 -10.200 -20.314 382 HG LEU 50 HG LEU 50 -3.086 -9.360 -22.006 383 HD11 LEU 50 1HD1 LEU 50 -0.624 -10.171 -23.587 384 HD12 LEU 50 2HD1 LEU 50 -1.337 -8.541 -23.563 385 HD13 LEU 50 3HD1 LEU 50 -2.262 -9.899 -24.235 386 HD21 LEU 50 1HD2 LEU 50 -2.844 -11.556 -20.944 387 HD22 LEU 50 2HD2 LEU 50 -1.453 -11.923 -21.974 388 HD23 LEU 50 3HD2 LEU 50 -3.066 -11.732 -22.697 389 H HIS 51 H HIS 51 -4.288 -8.588 -20.448 390 HA HIS 51 HA HIS 51 -6.024 -9.331 -19.121 391 HB2 HIS 51 1HB HIS 51 -4.443 -11.356 -19.198 392 HB3 HIS 51 2HB HIS 51 -3.999 -10.926 -17.550 393 HD1 HIS 51 HD1 HIS 51 -6.049 -11.033 -15.752 394 HD2 HIS 51 HD2 HIS 51 -6.754 -12.768 -19.482 395 HE1 HIS 51 HE1 HIS 51 -8.041 -12.573 -15.494 396 H GLY 52 H GLY 52 -4.787 -6.839 -18.347 397 HA2 GLY 52 1HA GLY 52 -5.040 -5.304 -16.672 398 HA3 GLY 52 2HA GLY 52 -6.097 -6.442 -15.862 399 H ARG 53 H ARG 53 -2.891 -7.680 -16.406 400 HA ARG 53 HA ARG 53 -1.930 -6.608 -13.813 401 HB2 ARG 53 1HB ARG 53 -1.418 -8.738 -12.902 402 HB3 ARG 53 2HB ARG 53 -3.124 -8.775 -13.341 403 HG2 ARG 53 1HG ARG 53 -2.561 -10.054 -15.401 404 HG3 ARG 53 2HG ARG 53 -0.859 -10.065 -14.909 405 HD2 ARG 53 1HD ARG 53 -1.527 -11.175 -12.750 406 HD3 ARG 53 2HD ARG 53 -3.193 -11.240 -13.344 407 HE ARG 53 HE ARG 53 -2.615 -12.966 -14.815 408 HH11 ARG 53 1HH1 ARG 53 0.273 -11.921 -13.052 409 HH12 ARG 53 2HH1 ARG 53 1.157 -13.386 -13.482 410 HH21 ARG 53 1HH2 ARG 53 -1.421 -14.778 -15.277 411 HH22 ARG 53 2HH2 ARG 53 0.233 -14.926 -14.705 412 H GLN 54 H GLN 54 0.391 -7.121 -13.507 413 HA GLN 54 HA GLN 54 1.694 -7.549 -16.147 414 HB2 GLN 54 1HB GLN 54 3.662 -6.346 -15.038 415 HB3 GLN 54 2HB GLN 54 2.312 -5.383 -15.641 416 HG2 GLN 54 1HG GLN 54 2.282 -6.209 -12.766 417 HG3 GLN 54 2HG GLN 54 3.437 -4.976 -13.256 418 HE21 GLN 54 1HE2 GLN 54 1.058 -2.469 -13.810 419 HE22 GLN 54 2HE2 GLN 54 2.700 -3.004 -14.095 420 H GLY 55 H GLY 55 3.659 -8.752 -16.110 421 HA2 GLY 55 1HA GLY 55 4.453 -10.230 -13.764 422 HA3 GLY 55 2HA GLY 55 3.454 -11.211 -14.850 423 H ILE 56 H ILE 56 6.013 -12.025 -14.482 424 HA ILE 56 HA ILE 56 7.771 -10.756 -16.414 425 HB ILE 56 HB ILE 56 9.427 -12.416 -15.812 426 HG12 ILE 56 1HG1 ILE 56 7.236 -13.856 -14.260 427 HG13 ILE 56 2HG1 ILE 56 7.915 -14.413 -15.784 428 HG21 ILE 56 1HG2 ILE 56 8.767 -10.522 -14.188 429 HG22 ILE 56 2HG2 ILE 56 7.940 -11.771 -13.237 430 HG23 ILE 56 3HG2 ILE 56 9.687 -11.873 -13.499 431 HD11 ILE 56 1HD1 ILE 56 8.920 -15.669 -14.027 432 HD12 ILE 56 2HD1 ILE 56 10.159 -14.568 -14.655 433 HD13 ILE 56 3HD1 ILE 56 9.344 -14.214 -13.120 434 H VAL 57 H VAL 57 8.434 -11.430 -18.387 435 HA VAL 57 HA VAL 57 7.168 -13.853 -19.564 436 HB VAL 57 HB VAL 57 7.185 -11.055 -20.806 437 HG11 VAL 57 1HG1 VAL 57 5.950 -12.188 -22.691 438 HG12 VAL 57 2HG1 VAL 57 7.663 -12.592 -22.578 439 HG13 VAL 57 3HG1 VAL 57 6.440 -13.748 -22.003 440 HG21 VAL 57 1HG2 VAL 57 5.354 -11.295 -19.236 441 HG22 VAL 57 2HG2 VAL 57 4.695 -11.408 -20.890 442 HG23 VAL 57 3HG2 VAL 57 4.927 -12.881 -19.918 443 HA PRO 58 HA PRO 58 11.451 -13.929 -20.801 444 HB2 PRO 58 1HB PRO 58 11.481 -16.034 -22.553 445 HB3 PRO 58 2HB PRO 58 11.372 -16.263 -20.775 446 HG2 PRO 58 1HG PRO 58 9.184 -16.251 -22.813 447 HG3 PRO 58 2HG PRO 58 9.499 -17.435 -21.505 448 HD2 PRO 58 1HD PRO 58 7.674 -15.470 -21.241 449 HD3 PRO 58 2HD PRO 58 8.660 -16.024 -19.853 450 H GLY 59 H GLY 59 12.130 -12.335 -22.118 451 HA2 GLY 59 1HA GLY 59 10.623 -11.225 -24.182 452 HA3 GLY 59 2HA GLY 59 12.340 -10.928 -23.911 453 H ASN 60 H ASN 60 12.902 -13.873 -24.390 454 HA ASN 60 HA ASN 60 13.461 -13.709 -27.171 455 HB2 ASN 60 1HB ASN 60 14.623 -15.154 -25.473 456 HB3 ASN 60 2HB ASN 60 13.212 -16.224 -25.509 457 HD21 ASN 60 1HD2 ASN 60 14.635 -18.046 -28.083 458 HD22 ASN 60 2HD2 ASN 60 13.816 -18.017 -26.544 459 H ARG 61 H ARG 61 10.528 -14.653 -25.488 460 HA ARG 61 HA ARG 61 9.529 -16.080 -27.876 461 HB2 ARG 61 1HB ARG 61 8.232 -15.541 -25.178 462 HB3 ARG 61 2HB ARG 61 7.479 -16.397 -26.528 463 HG2 ARG 61 1HG ARG 61 9.466 -18.024 -26.453 464 HG3 ARG 61 2HG ARG 61 9.850 -17.285 -24.890 465 HD2 ARG 61 1HD ARG 61 7.442 -17.786 -24.174 466 HD3 ARG 61 2HD ARG 61 7.288 -18.721 -25.673 467 HE ARG 61 HE ARG 61 9.569 -19.627 -24.247 468 HH11 ARG 61 1HH1 ARG 61 6.053 -19.805 -24.057 469 HH12 ARG 61 2HH1 ARG 61 6.098 -21.238 -23.074 470 HH21 ARG 61 1HH2 ARG 61 9.532 -21.500 -23.044 471 HH22 ARG 61 2HH2 ARG 61 8.005 -22.160 -22.493 472 H LEU 62 H LEU 62 9.943 -12.916 -27.185 473 HA LEU 62 HA LEU 62 7.322 -12.109 -28.364 474 HB2 LEU 62 1HB LEU 62 9.244 -10.514 -26.623 475 HB3 LEU 62 2HB LEU 62 7.719 -9.943 -27.273 476 HG LEU 62 HG LEU 62 8.030 -12.091 -25.166 477 HD11 LEU 62 1HD1 LEU 62 7.219 -9.142 -25.015 478 HD12 LEU 62 2HD1 LEU 62 8.662 -9.913 -24.305 479 HD13 LEU 62 3HD1 LEU 62 7.056 -10.322 -23.676 480 HD21 LEU 62 1HD2 LEU 62 6.028 -12.463 -26.488 481 HD22 LEU 62 2HD2 LEU 62 5.564 -10.748 -26.378 482 HD23 LEU 62 3HD2 LEU 62 5.550 -11.775 -24.941 483 H LYS 63 H LYS 63 7.295 -10.392 -29.886 484 HA LYS 63 HA LYS 63 9.988 -9.629 -30.984 485 HB2 LYS 63 1HB LYS 63 8.770 -11.117 -32.529 486 HB3 LYS 63 2HB LYS 63 7.398 -10.003 -32.562 487 HG2 LYS 63 1HG LYS 63 8.768 -8.296 -33.591 488 HG3 LYS 63 2HG LYS 63 10.237 -9.263 -33.361 489 HD2 LYS 63 1HD LYS 63 9.338 -11.021 -34.879 490 HD3 LYS 63 2HD LYS 63 7.906 -9.983 -35.193 491 HE2 LYS 63 1HE LYS 63 9.345 -8.201 -36.086 492 HE3 LYS 63 2HE LYS 63 10.785 -9.163 -35.704 493 HZ1 LYS 63 1HZ LYS 63 10.189 -9.383 -38.052 494 HZ2 LYS 63 2HZ LYS 63 8.708 -9.934 -37.661 495 HZ3 LYS 63 3HZ LYS 63 10.050 -10.829 -37.278 496 H ILE 64 H ILE 64 10.388 -7.601 -30.616 497 HA ILE 64 HA ILE 64 8.534 -5.685 -29.625 498 HB ILE 64 HB ILE 64 11.268 -5.423 -30.939 499 HG12 ILE 64 1HG1 ILE 64 11.202 -6.676 -28.808 500 HG13 ILE 64 2HG1 ILE 64 12.158 -5.196 -28.726 501 HG21 ILE 64 1HG2 ILE 64 11.369 -3.127 -29.874 502 HG22 ILE 64 2HG2 ILE 64 10.219 -3.222 -31.207 503 HG23 ILE 64 3HG2 ILE 64 9.627 -3.250 -29.529 504 HD11 ILE 64 1HD1 ILE 64 10.855 -5.535 -26.650 505 HD12 ILE 64 2HD1 ILE 64 10.327 -4.062 -27.483 506 HD13 ILE 64 3HD1 ILE 64 9.347 -5.533 -27.582 507 H LEU 65 H LEU 65 7.370 -4.109 -30.542 508 HA LEU 65 HA LEU 65 7.296 -3.954 -33.531 509 HB2 LEU 65 1HB LEU 65 5.156 -4.173 -31.465 510 HB3 LEU 65 2HB LEU 65 4.885 -2.948 -32.674 511 HG LEU 65 HG LEU 65 3.705 -4.977 -33.212 512 HD11 LEU 65 1HD1 LEU 65 4.566 -3.538 -35.040 513 HD12 LEU 65 2HD1 LEU 65 4.410 -5.239 -35.533 514 HD13 LEU 65 3HD1 LEU 65 6.002 -4.571 -35.146 515 HD21 LEU 65 1HD2 LEU 65 4.814 -7.067 -33.812 516 HD22 LEU 65 2HD2 LEU 65 5.217 -6.624 -32.136 517 HD23 LEU 65 3HD2 LEU 65 6.410 -6.361 -33.439 518 H VAL 66 H VAL 66 6.090 -1.642 -33.936 519 HA VAL 66 HA VAL 66 6.240 0.606 -33.925 520 HB VAL 66 HB VAL 66 7.086 0.497 -30.996 521 HG11 VAL 66 1HG1 VAL 66 7.398 2.705 -32.094 522 HG12 VAL 66 2HG1 VAL 66 5.706 2.665 -32.667 523 HG13 VAL 66 3HG1 VAL 66 6.070 2.752 -30.928 524 HG21 VAL 66 1HG2 VAL 66 4.301 0.501 -32.269 525 HG22 VAL 66 2HG2 VAL 66 5.006 -0.777 -31.257 526 HG23 VAL 66 3HG2 VAL 66 4.633 0.800 -30.537 527 H GLY 67 H GLY 67 7.742 0.908 -35.403 528 HA2 GLY 67 1HA GLY 67 9.961 2.366 -35.136 529 HA3 GLY 67 2HA GLY 67 10.614 0.764 -34.694 530 H MET 68 H MET 68 9.168 -0.891 -36.429 531 HA MET 68 HA MET 68 9.296 0.286 -39.128 532 HB2 MET 68 1HB MET 68 11.583 -0.693 -38.592 533 HB3 MET 68 2HB MET 68 10.817 -2.284 -38.459 534 HG2 MET 68 1HG MET 68 10.673 -0.558 -40.959 535 HG3 MET 68 2HG MET 68 11.965 -1.733 -40.676 536 HE1 MET 68 1HE MET 68 11.245 -2.674 -43.147 537 HE2 MET 68 2HE MET 68 9.668 -3.398 -43.487 538 HE3 MET 68 3HE MET 68 9.782 -1.645 -43.251 539 H TYR 69 H TYR 69 7.374 -0.248 -40.035 540 HA TYR 69 HA TYR 69 6.439 -2.988 -40.046 541 HB2 TYR 69 1HB TYR 69 4.193 -2.391 -39.050 542 HB3 TYR 69 2HB TYR 69 5.506 -2.562 -37.898 543 HD1 TYR 69 HD1 TYR 69 3.325 -0.046 -39.620 544 HD2 TYR 69 HD2 TYR 69 6.226 -0.691 -36.527 545 HE1 TYR 69 HE1 TYR 69 2.835 2.204 -38.687 546 HE2 TYR 69 HE2 TYR 69 5.738 1.580 -35.603 547 HH TYR 69 HH TYR 69 3.371 3.757 -37.069 548 H ASP 70 H ASP 70 4.824 -3.304 -41.589 549 HA ASP 70 HA ASP 70 4.545 -1.347 -43.716 550 HB2 ASP 70 1HB ASP 70 2.877 -3.809 -43.016 551 HB3 ASP 70 2HB ASP 70 2.805 -2.914 -44.547 552 H LYS 71 H LYS 71 2.339 -0.524 -44.415 553 HA LYS 71 HA LYS 71 1.015 0.986 -42.440 554 HB2 LYS 71 1HB LYS 71 -0.728 1.347 -44.146 555 HB3 LYS 71 2HB LYS 71 0.896 1.499 -44.799 556 HG2 LYS 71 1HG LYS 71 0.718 -0.795 -45.766 557 HG3 LYS 71 2HG LYS 71 -0.944 -0.900 -45.144 558 HD2 LYS 71 1HD LYS 71 -1.584 1.047 -46.523 559 HD3 LYS 71 2HD LYS 71 0.069 1.203 -47.099 560 HE2 LYS 71 1HE LYS 71 -1.230 0.095 -48.775 561 HE3 LYS 71 2HE LYS 71 -0.054 -1.044 -48.116 562 HZ1 LYS 71 1HZ LYS 71 -2.942 -0.914 -47.441 563 HZ2 LYS 71 2HZ LYS 71 -1.857 -1.922 -46.734 564 HZ3 LYS 71 3HZ LYS 71 -2.175 -2.085 -48.352 565 H LYS 72 H LYS 72 -0.914 0.781 -41.329 566 HA LYS 72 HA LYS 72 -2.043 -1.983 -41.077 567 HB2 LYS 72 1HB LYS 72 -1.030 -0.030 -39.100 568 HB3 LYS 72 2HB LYS 72 -2.671 -0.532 -38.753 569 HG2 LYS 72 1HG LYS 72 -1.268 -2.016 -37.526 570 HG3 LYS 72 2HG LYS 72 -1.859 -2.956 -38.898 571 HD2 LYS 72 1HD LYS 72 0.644 -1.534 -39.500 572 HD3 LYS 72 2HD LYS 72 0.798 -2.638 -38.106 573 HE2 LYS 72 1HE LYS 72 -0.066 -4.514 -39.440 574 HE3 LYS 72 2HE LYS 72 -0.312 -3.431 -40.807 575 HZ1 LYS 72 1HZ LYS 72 1.729 -4.550 -41.129 576 HZ2 LYS 72 2HZ LYS 72 2.272 -4.120 -39.618 577 HZ3 LYS 72 3HZ LYS 72 2.079 -2.982 -40.790 578 HA PRO 73 HA PRO 73 -5.891 0.093 -41.921 579 HB2 PRO 73 1HB PRO 73 -7.762 -1.219 -40.461 580 HB3 PRO 73 2HB PRO 73 -6.914 -2.035 -41.825 581 HG2 PRO 73 1HG PRO 73 -6.312 -2.162 -38.902 582 HG3 PRO 73 2HG PRO 73 -6.521 -3.512 -40.058 583 HD2 PRO 73 1HD PRO 73 -4.078 -2.576 -39.363 584 HD3 PRO 73 2HD PRO 73 -4.421 -3.160 -41.031 585 H ALA 74 H ALA 74 -7.667 1.358 -40.778 586 HA ALA 74 HA ALA 74 -6.563 3.018 -38.719 587 HB1 ALA 74 1HB ALA 74 -8.824 4.057 -38.688 588 HB2 ALA 74 2HB ALA 74 -8.252 3.819 -40.356 589 HB3 ALA 74 3HB ALA 74 -9.459 2.710 -39.677 590 H GLY 75 H GLY 75 -7.521 3.380 -36.569 591 HA2 GLY 75 1HA GLY 75 -9.254 1.397 -35.416 592 HA3 GLY 75 2HA GLY 75 -7.572 1.049 -34.993 593 H GLU 76 H GLU 76 -6.344 3.214 -34.313 594 HA GLU 76 HA GLU 76 -6.026 4.722 -32.639 595 HB2 GLU 76 1HB GLU 76 -8.361 5.593 -34.141 596 HB3 GLU 76 2HB GLU 76 -8.366 6.240 -32.516 597 HG2 GLU 76 1HG GLU 76 -6.014 6.454 -34.401 598 HG3 GLU 76 2HG GLU 76 -7.278 7.687 -34.226 599 H PHE 77 H PHE 77 -7.065 2.172 -31.814 600 HA PHE 77 HA PHE 77 -9.036 2.667 -29.748 601 HB2 PHE 77 1HB PHE 77 -7.252 0.244 -30.171 602 HB3 PHE 77 2HB PHE 77 -8.709 0.327 -29.183 603 HD1 PHE 77 HD1 PHE 77 -7.581 -1.036 -32.088 604 HD2 PHE 77 HD2 PHE 77 -10.766 1.547 -30.746 605 HE1 PHE 77 HE1 PHE 77 -8.945 -1.712 -34.044 606 HE2 PHE 77 HE2 PHE 77 -12.127 0.860 -32.706 607 HZ PHE 77 HZ PHE 77 -11.237 -0.775 -34.360 608 H ILE 78 H ILE 78 -8.803 2.967 -27.630 609 HA ILE 78 HA ILE 78 -6.054 2.867 -26.470 610 HB ILE 78 HB ILE 78 -6.981 5.220 -26.709 611 HG12 ILE 78 1HG1 ILE 78 -6.672 4.387 -23.808 612 HG13 ILE 78 2HG1 ILE 78 -5.320 4.484 -24.928 613 HG21 ILE 78 1HG2 ILE 78 -9.001 4.325 -24.583 614 HG22 ILE 78 2HG2 ILE 78 -8.827 5.962 -25.268 615 HG23 ILE 78 3HG2 ILE 78 -9.388 4.628 -26.298 616 HD11 ILE 78 1HD1 ILE 78 -5.817 6.927 -25.267 617 HD12 ILE 78 2HD1 ILE 78 -7.063 6.799 -23.998 618 HD13 ILE 78 3HD1 ILE 78 -5.354 6.503 -23.616 619 H VAL 79 H VAL 79 -6.039 2.103 -24.253 620 HA VAL 79 HA VAL 79 -8.232 0.120 -23.831 621 HB VAL 79 HB VAL 79 -5.358 0.123 -22.786 622 HG11 VAL 79 1HG1 VAL 79 -6.829 -1.173 -21.311 623 HG12 VAL 79 2HG1 VAL 79 -7.516 -2.044 -22.705 624 HG13 VAL 79 3HG1 VAL 79 -5.815 -2.264 -22.249 625 HG21 VAL 79 1HG2 VAL 79 -6.622 -1.403 -25.130 626 HG22 VAL 79 2HG2 VAL 79 -5.363 -0.159 -25.229 627 HG23 VAL 79 3HG2 VAL 79 -4.988 -1.705 -24.461 628 H THR 80 H THR 80 -6.373 2.687 -22.235 629 HA THR 80 HA THR 80 -7.484 2.161 -19.590 630 HB THR 80 HB THR 80 -6.518 4.473 -19.152 631 HG1 THR 80 HG1 THR 80 -6.663 5.315 -21.238 632 HG21 THR 80 1HG2 THR 80 -5.169 2.408 -18.826 633 HG22 THR 80 2HG2 THR 80 -4.188 3.786 -19.384 634 HG23 THR 80 3HG2 THR 80 -4.627 2.514 -20.521 635 H ASP 81 H ASP 81 -8.923 3.511 -18.430 636 HA ASP 81 HA ASP 81 -11.284 4.326 -19.711 637 HB2 ASP 81 1HB ASP 81 -10.182 5.201 -16.998 638 HB3 ASP 81 2HB ASP 81 -11.868 5.329 -17.502 639 HXT ASP 81 H02 ASP 81 -10.416 5.470 -21.255 Start of MODEL 34 1 H2 GLY 1 2H0 GLY 1 6.791 10.848 -26.533 2 H GLY 1 1H0 GLY 1 6.935 12.237 -25.659 3 HA2 GLY 1 1HA GLY 1 9.198 10.789 -26.986 4 HA3 GLY 1 2HA GLY 1 9.368 12.261 -25.987 5 H SER 2 H SER 2 11.059 10.589 -25.121 6 HA SER 2 HA SER 2 10.014 8.513 -23.387 7 HB2 SER 2 1HB SER 2 12.691 9.974 -23.407 8 HB3 SER 2 2HB SER 2 12.299 8.531 -22.408 9 HG SER 2 HG SER 2 12.054 7.324 -24.246 10 H MET 3 H MET 3 9.468 8.589 -21.285 11 HA MET 3 HA MET 3 9.907 11.114 -19.808 12 HB2 MET 3 1HB MET 3 7.322 9.573 -20.066 13 HB3 MET 3 2HB MET 3 7.686 10.525 -18.604 14 HG2 MET 3 1HG MET 3 7.699 11.652 -21.434 15 HG3 MET 3 2HG MET 3 6.329 11.725 -20.380 16 HE1 MET 3 1HE MET 3 6.074 13.381 -18.398 17 HE2 MET 3 2HE MET 3 7.372 12.563 -17.491 18 HE3 MET 3 3HE MET 3 7.386 14.358 -17.677 19 H LYS 4 H LYS 4 8.280 8.119 -18.829 20 HA LYS 4 HA LYS 4 10.531 7.610 -16.986 21 HB2 LYS 4 1HB LYS 4 8.377 8.826 -16.097 22 HB3 LYS 4 2HB LYS 4 7.620 7.208 -16.216 23 HG2 LYS 4 1HG LYS 4 9.596 6.367 -14.752 24 HG3 LYS 4 2HG LYS 4 10.006 8.072 -14.497 25 HD2 LYS 4 1HD LYS 4 8.736 7.485 -12.618 26 HD3 LYS 4 2HD LYS 4 7.612 8.361 -13.674 27 HE2 LYS 4 1HE LYS 4 6.611 6.308 -14.470 28 HE3 LYS 4 2HE LYS 4 7.784 5.320 -13.587 29 HZ1 LYS 4 1HZ LYS 4 6.910 6.206 -11.541 30 HZ2 LYS 4 2HZ LYS 4 5.685 5.540 -12.414 31 HZ3 LYS 4 3HZ LYS 4 5.864 7.176 -12.360 32 H TYR 5 H TYR 5 8.011 6.051 -18.980 33 HA TYR 5 HA TYR 5 9.177 3.424 -18.158 34 HB2 TYR 5 1HB TYR 5 6.359 4.293 -18.791 35 HB3 TYR 5 2HB TYR 5 6.876 2.683 -19.242 36 HD1 TYR 5 HD1 TYR 5 7.977 1.211 -17.284 37 HD2 TYR 5 HD2 TYR 5 5.474 4.623 -16.674 38 HE1 TYR 5 HE1 TYR 5 7.397 0.400 -15.010 39 HE2 TYR 5 HE2 TYR 5 4.864 3.795 -14.387 40 HH TYR 5 HH TYR 5 5.144 2.081 -12.833 41 H LEU 6 H LEU 6 8.986 1.822 -19.899 42 HA LEU 6 HA LEU 6 10.323 2.738 -22.295 43 HB2 LEU 6 1HB LEU 6 8.920 0.097 -21.775 44 HB3 LEU 6 2HB LEU 6 10.097 0.424 -23.072 45 HG LEU 6 HG LEU 6 10.746 0.520 -20.135 46 HD11 LEU 6 1HD1 LEU 6 11.803 -1.675 -20.462 47 HD12 LEU 6 2HD1 LEU 6 11.280 -1.717 -22.151 48 HD13 LEU 6 3HD1 LEU 6 10.066 -1.772 -20.857 49 HD21 LEU 6 1HD2 LEU 6 13.047 0.387 -20.900 50 HD22 LEU 6 2HD2 LEU 6 12.273 1.828 -21.547 51 HD23 LEU 6 3HD2 LEU 6 12.507 0.437 -22.599 52 H ASN 7 H ASN 7 6.956 1.889 -21.649 53 HA ASN 7 HA ASN 7 5.031 1.944 -22.921 54 HB2 ASN 7 1HB ASN 7 6.447 4.508 -23.754 55 HB3 ASN 7 2HB ASN 7 4.794 4.134 -24.176 56 HD21 ASN 7 1HD2 ASN 7 3.621 4.426 -20.782 57 HD22 ASN 7 2HD2 ASN 7 3.384 3.455 -22.207 58 H VAL 8 H VAL 8 6.676 0.078 -24.114 59 HA VAL 8 HA VAL 8 6.093 0.569 -27.026 60 HB VAL 8 HB VAL 8 8.573 0.641 -26.535 61 HG11 VAL 8 1HG1 VAL 8 8.269 -2.301 -25.777 62 HG12 VAL 8 2HG1 VAL 8 9.812 -1.360 -25.878 63 HG13 VAL 8 3HG1 VAL 8 8.654 -0.966 -24.643 64 HG21 VAL 8 1HG2 VAL 8 9.282 -0.797 -28.315 65 HG22 VAL 8 2HG2 VAL 8 7.843 -1.821 -28.176 66 HG23 VAL 8 3HG2 VAL 8 7.705 -0.098 -28.712 67 H LEU 9 H LEU 9 5.425 -1.378 -28.169 68 HA LEU 9 HA LEU 9 4.196 -3.379 -26.296 69 HB2 LEU 9 1HB LEU 9 3.421 -3.516 -29.119 70 HB3 LEU 9 2HB LEU 9 2.428 -3.548 -27.640 71 HG LEU 9 HG LEU 9 3.542 -1.028 -28.926 72 HD11 LEU 9 1HD1 LEU 9 0.810 -2.296 -29.231 73 HD12 LEU 9 2HD1 LEU 9 2.089 -2.211 -30.460 74 HD13 LEU 9 3HD1 LEU 9 1.330 -0.722 -29.887 75 HD21 LEU 9 1HD2 LEU 9 2.863 -0.809 -26.516 76 HD22 LEU 9 2HD2 LEU 9 1.250 -1.532 -26.873 77 HD23 LEU 9 3HD2 LEU 9 1.734 0.085 -27.532 78 H ALA 10 H ALA 10 4.067 -5.568 -27.064 79 HA ALA 10 HA ALA 10 5.900 -6.211 -29.261 80 HB1 ALA 10 1HB ALA 10 7.058 -7.953 -27.973 81 HB2 ALA 10 2HB ALA 10 7.313 -6.359 -27.214 82 HB3 ALA 10 3HB ALA 10 6.150 -7.501 -26.490 83 H LYS 11 H LYS 11 5.536 -8.349 -30.132 84 HA LYS 11 HA LYS 11 2.816 -9.429 -29.550 85 HB2 LYS 11 1HB LYS 11 3.097 -8.595 -31.857 86 HB3 LYS 11 2HB LYS 11 4.573 -9.585 -32.052 87 HG2 LYS 11 1HG LYS 11 3.160 -11.607 -31.897 88 HG3 LYS 11 2HG LYS 11 1.689 -10.608 -31.731 89 HD2 LYS 11 1HD LYS 11 2.257 -9.605 -33.926 90 HD3 LYS 11 2HD LYS 11 3.686 -10.683 -34.051 91 HE2 LYS 11 1HE LYS 11 2.169 -12.642 -33.996 92 HE3 LYS 11 2HE LYS 11 0.783 -11.535 -33.914 93 HZ1 LYS 11 1HZ LYS 11 1.366 -10.639 -36.056 94 HZ2 LYS 11 2HZ LYS 11 1.198 -12.274 -36.160 95 HZ3 LYS 11 3HZ LYS 11 2.697 -11.609 -36.141 96 H ALA 12 H ALA 12 2.600 -11.503 -28.931 97 HA ALA 12 HA ALA 12 4.995 -13.015 -28.266 98 HB1 ALA 12 1HB ALA 12 3.410 -14.701 -27.481 99 HB2 ALA 12 2HB ALA 12 2.836 -13.099 -26.986 100 HB3 ALA 12 3HB ALA 12 2.064 -13.873 -28.322 101 H LEU 13 H LEU 13 5.973 -14.634 -29.362 102 HA LEU 13 HA LEU 13 4.941 -15.255 -32.070 103 HB2 LEU 13 1HB LEU 13 7.536 -15.956 -30.685 104 HB3 LEU 13 2HB LEU 13 7.127 -16.333 -32.354 105 HG LEU 13 HG LEU 13 7.470 -13.539 -31.216 106 HD11 LEU 13 1HD1 LEU 13 9.525 -14.938 -31.274 107 HD12 LEU 13 2HD1 LEU 13 9.572 -13.514 -32.329 108 HD13 LEU 13 3HD1 LEU 13 9.312 -15.122 -33.008 109 HD21 LEU 13 1HD2 LEU 13 7.595 -12.892 -33.652 110 HD22 LEU 13 2HD2 LEU 13 6.001 -13.474 -33.160 111 HD23 LEU 13 3HD2 LEU 13 7.071 -14.541 -34.069 112 H TYR 14 H TYR 14 5.634 -16.627 -28.937 113 HA TYR 14 HA TYR 14 4.471 -19.258 -29.799 114 HB2 TYR 14 1HB TYR 14 6.496 -18.745 -27.617 115 HB3 TYR 14 2HB TYR 14 6.003 -20.324 -28.235 116 HD1 TYR 14 HD1 TYR 14 8.171 -17.392 -28.680 117 HD2 TYR 14 HD2 TYR 14 6.873 -21.043 -30.505 118 HE1 TYR 14 HE1 TYR 14 10.122 -17.308 -30.219 119 HE2 TYR 14 HE2 TYR 14 8.826 -20.940 -32.052 120 HH TYR 14 HH TYR 14 10.780 -19.852 -32.619 121 H ASP 15 H ASP 15 3.366 -20.356 -27.884 122 HA ASP 15 HA ASP 15 1.972 -18.262 -26.268 123 HB2 ASP 15 1HB ASP 15 0.221 -19.985 -25.975 124 HB3 ASP 15 2HB ASP 15 0.539 -19.632 -27.695 125 H ASN 16 H ASN 16 1.484 -18.657 -24.066 126 HA ASN 16 HA ASN 16 2.813 -20.787 -22.584 127 HB2 ASN 16 1HB ASN 16 4.638 -19.040 -23.165 128 HB3 ASN 16 2HB ASN 16 3.738 -17.879 -22.204 129 HD21 ASN 16 1HD2 ASN 16 4.566 -19.483 -19.100 130 HD22 ASN 16 2HD2 ASN 16 3.284 -18.573 -19.924 131 H VAL 17 H VAL 17 0.831 -21.216 -21.507 132 HA VAL 17 HA VAL 17 -0.594 -18.919 -20.269 133 HB VAL 17 HB VAL 17 -2.099 -20.683 -19.315 134 HG11 VAL 17 1HG1 VAL 17 -3.235 -21.304 -21.412 135 HG12 VAL 17 2HG1 VAL 17 -2.588 -19.687 -21.561 136 HG13 VAL 17 3HG1 VAL 17 -1.761 -21.075 -22.378 137 HG21 VAL 17 1HG2 VAL 17 -0.479 -22.742 -20.855 138 HG22 VAL 17 2HG2 VAL 17 -0.475 -22.513 -19.058 139 HG23 VAL 17 3HG2 VAL 17 -1.949 -23.024 -19.876 140 H ALA 18 H ALA 18 -0.481 -18.497 -18.045 141 HA ALA 18 HA ALA 18 2.106 -18.982 -17.011 142 HB1 ALA 18 1HB ALA 18 1.228 -17.600 -15.019 143 HB2 ALA 18 2HB ALA 18 1.028 -16.791 -16.634 144 HB3 ALA 18 3HB ALA 18 -0.355 -17.592 -15.797 145 H GLU 19 H GLU 19 2.886 -20.146 -15.408 146 HA GLU 19 HA GLU 19 1.046 -22.076 -14.034 147 HB2 GLU 19 1HB GLU 19 2.957 -23.503 -13.736 148 HB3 GLU 19 2HB GLU 19 2.836 -23.027 -15.450 149 HG2 GLU 19 1HG GLU 19 4.697 -21.500 -15.241 150 HG3 GLU 19 2HG GLU 19 4.765 -21.744 -13.508 151 H SER 20 H SER 20 2.783 -19.214 -13.515 152 HA SER 20 HA SER 20 2.812 -19.682 -10.574 153 HB2 SER 20 1HB SER 20 4.865 -18.201 -12.252 154 HB3 SER 20 2HB SER 20 4.879 -18.291 -10.482 155 HG SER 20 HG SER 20 4.972 -20.561 -12.257 156 HA PRO 21 HA PRO 21 0.555 -15.931 -10.536 157 HB2 PRO 21 1HB PRO 21 1.236 -14.665 -8.233 158 HB3 PRO 21 2HB PRO 21 0.360 -16.215 -8.202 159 HG2 PRO 21 1HG PRO 21 3.311 -15.778 -7.919 160 HG3 PRO 21 2HG PRO 21 2.212 -16.677 -6.853 161 HD2 PRO 21 1HD PRO 21 3.610 -18.004 -8.697 162 HD3 PRO 21 2HD PRO 21 1.890 -18.416 -8.399 163 H ASP 22 H ASP 22 4.049 -15.710 -10.293 164 HA ASP 22 HA ASP 22 4.235 -12.833 -10.716 165 HB2 ASP 22 1HB ASP 22 5.953 -15.027 -10.014 166 HB3 ASP 22 2HB ASP 22 6.552 -14.482 -11.583 167 H GLU 23 H GLU 23 3.500 -15.562 -12.655 168 HA GLU 23 HA GLU 23 4.881 -14.463 -15.033 169 HB2 GLU 23 1HB GLU 23 5.037 -16.879 -14.169 170 HB3 GLU 23 2HB GLU 23 3.374 -17.080 -14.809 171 HG2 GLU 23 1HG GLU 23 4.195 -16.519 -17.065 172 HG3 GLU 23 2HG GLU 23 5.827 -16.288 -16.411 173 H LEU 24 H LEU 24 3.805 -14.145 -17.019 174 HA LEU 24 HA LEU 24 0.959 -13.402 -16.656 175 HB2 LEU 24 1HB LEU 24 3.165 -12.116 -17.836 176 HB3 LEU 24 2HB LEU 24 2.149 -12.629 -19.211 177 HG LEU 24 HG LEU 24 1.179 -10.988 -16.813 178 HD11 LEU 24 1HD1 LEU 24 1.843 -10.118 -19.638 179 HD12 LEU 24 2HD1 LEU 24 2.814 -9.773 -18.162 180 HD13 LEU 24 3HD1 LEU 24 1.189 -9.118 -18.349 181 HD21 LEU 24 1HD2 LEU 24 -0.140 -11.682 -19.450 182 HD22 LEU 24 2HD2 LEU 24 -0.754 -10.518 -18.288 183 HD23 LEU 24 3HD2 LEU 24 -0.637 -12.244 -17.848 184 H SER 25 H SER 25 -0.650 -14.375 -17.707 185 HA SER 25 HA SER 25 -0.088 -16.775 -19.337 186 HB2 SER 25 1HB SER 25 -2.815 -16.482 -19.391 187 HB3 SER 25 2HB SER 25 -1.934 -17.228 -18.031 188 HG SER 25 HG SER 25 -3.478 -15.160 -17.924 189 H PHE 26 H PHE 26 0.540 -16.271 -21.415 190 HA PHE 26 HA PHE 26 -1.336 -14.529 -22.943 191 HB2 PHE 26 1HB PHE 26 0.492 -13.499 -24.128 192 HB3 PHE 26 2HB PHE 26 0.679 -13.204 -22.372 193 HD1 PHE 26 HD1 PHE 26 2.056 -14.926 -25.317 194 HD2 PHE 26 HD2 PHE 26 2.483 -14.253 -21.149 195 HE1 PHE 26 HE1 PHE 26 4.331 -15.900 -25.447 196 HE2 PHE 26 HE2 PHE 26 4.722 -15.284 -21.190 197 HZ PHE 26 HZ PHE 26 5.687 -16.108 -23.341 198 H ARG 27 H ARG 27 -1.122 -14.927 -25.343 199 HA ARG 27 HA ARG 27 -0.198 -17.729 -25.934 200 HB2 ARG 27 1HB ARG 27 -2.839 -16.443 -26.765 201 HB3 ARG 27 2HB ARG 27 -2.203 -17.934 -27.440 202 HG2 ARG 27 1HG ARG 27 -2.160 -18.884 -25.062 203 HG3 ARG 27 2HG ARG 27 -3.124 -17.458 -24.581 204 HD2 ARG 27 1HD ARG 27 -3.875 -19.404 -26.786 205 HD3 ARG 27 2HD ARG 27 -4.511 -19.453 -25.119 206 HE ARG 27 HE ARG 27 -4.893 -16.844 -26.096 207 HH11 ARG 27 1HH1 ARG 27 -6.122 -20.086 -26.783 208 HH12 ARG 27 2HH1 ARG 27 -7.602 -19.512 -27.480 209 HH21 ARG 27 1HH2 ARG 27 -6.793 -16.140 -26.983 210 HH22 ARG 27 2HH2 ARG 27 -7.966 -17.252 -27.575 211 H LYS 28 H LYS 28 0.174 -18.065 -28.267 212 HA LYS 28 HA LYS 28 1.867 -16.079 -29.364 213 HB2 LYS 28 1HB LYS 28 1.820 -17.437 -31.382 214 HB3 LYS 28 2HB LYS 28 1.914 -18.499 -30.011 215 HG2 LYS 28 1HG LYS 28 -0.508 -18.984 -30.193 216 HG3 LYS 28 2HG LYS 28 -0.644 -17.855 -31.556 217 HD2 LYS 28 1HD LYS 28 -0.611 -19.993 -32.501 218 HD3 LYS 28 2HD LYS 28 1.016 -19.277 -32.775 219 HE2 LYS 28 1HE LYS 28 1.932 -20.619 -30.951 220 HE3 LYS 28 2HE LYS 28 0.325 -21.249 -30.559 221 HZ1 LYS 28 1HZ LYS 28 0.266 -22.250 -32.776 222 HZ2 LYS 28 2HZ LYS 28 1.533 -22.820 -31.887 223 HZ3 LYS 28 3HZ LYS 28 1.794 -21.701 -33.069 224 H GLY 29 H GLY 29 1.532 -14.395 -30.798 225 HA2 GLY 29 1HA GLY 29 0.303 -13.108 -32.292 226 HA3 GLY 29 2HA GLY 29 -1.137 -14.120 -32.018 227 H ASP 30 H ASP 30 -0.496 -13.497 -28.955 228 HA ASP 30 HA ASP 30 -2.317 -11.240 -28.792 229 HB2 ASP 30 1HB ASP 30 -1.674 -13.308 -27.156 230 HB3 ASP 30 2HB ASP 30 -0.593 -12.061 -26.475 231 H ILE 31 H ILE 31 -1.680 -9.260 -27.539 232 HA ILE 31 HA ILE 31 1.095 -8.374 -28.158 233 HB ILE 31 HB ILE 31 -1.406 -6.604 -28.255 234 HG12 ILE 31 1HG1 ILE 31 -1.491 -8.182 -30.115 235 HG13 ILE 31 2HG1 ILE 31 -1.317 -6.495 -30.632 236 HG21 ILE 31 1HG2 ILE 31 0.538 -5.311 -27.639 237 HG22 ILE 31 2HG2 ILE 31 1.544 -6.030 -28.956 238 HG23 ILE 31 3HG2 ILE 31 0.174 -4.956 -29.358 239 HD11 ILE 31 1HD1 ILE 31 0.068 -7.964 -32.011 240 HD12 ILE 31 2HD1 ILE 31 1.119 -6.959 -31.036 241 HD13 ILE 31 3HD1 ILE 31 0.879 -8.631 -30.569 242 H MET 32 H MET 32 2.190 -7.504 -26.471 243 HA MET 32 HA MET 32 0.484 -6.546 -24.157 244 HB2 MET 32 1HB MET 32 2.080 -7.579 -22.584 245 HB3 MET 32 2HB MET 32 1.300 -8.779 -23.598 246 HG2 MET 32 1HG MET 32 3.463 -8.430 -25.105 247 HG3 MET 32 2HG MET 32 4.161 -7.939 -23.597 248 HE1 MET 32 1HE MET 32 2.821 -10.738 -25.871 249 HE2 MET 32 2HE MET 32 2.686 -12.133 -24.785 250 HE3 MET 32 3HE MET 32 1.492 -10.799 -24.696 251 H THR 33 H THR 33 1.454 -4.962 -22.814 252 HA THR 33 HA THR 33 3.379 -3.281 -24.267 253 HB THR 33 HB THR 33 2.103 -2.812 -21.534 254 HG1 THR 33 HG1 THR 33 0.344 -2.234 -22.530 255 HG21 THR 33 1HG2 THR 33 3.967 -1.336 -22.014 256 HG22 THR 33 2HG2 THR 33 2.437 -0.412 -22.090 257 HG23 THR 33 3HG2 THR 33 3.292 -0.910 -23.595 258 H VAL 34 H VAL 34 5.545 -3.106 -23.571 259 HA VAL 34 HA VAL 34 6.332 -4.846 -21.333 260 HB VAL 34 HB VAL 34 8.080 -3.446 -23.382 261 HG11 VAL 34 1HG1 VAL 34 9.827 -5.031 -22.536 262 HG12 VAL 34 2HG1 VAL 34 9.245 -3.856 -21.295 263 HG13 VAL 34 3HG1 VAL 34 8.709 -5.540 -21.257 264 HG21 VAL 34 1HG2 VAL 34 8.389 -5.670 -24.362 265 HG22 VAL 34 2HG2 VAL 34 7.305 -6.401 -23.127 266 HG23 VAL 34 3HG2 VAL 34 6.681 -5.264 -24.331 267 H LEU 35 H LEU 35 6.850 -3.994 -19.414 268 HA LEU 35 HA LEU 35 6.774 -1.034 -19.143 269 HB2 LEU 35 1HB LEU 35 6.692 -3.190 -17.036 270 HB3 LEU 35 2HB LEU 35 6.397 -1.462 -16.794 271 HG LEU 35 HG LEU 35 4.651 -3.487 -18.179 272 HD11 LEU 35 1HD1 LEU 35 3.036 -2.715 -16.413 273 HD12 LEU 35 2HD1 LEU 35 4.346 -1.737 -15.717 274 HD13 LEU 35 3HD1 LEU 35 4.518 -3.521 -15.748 275 HD21 LEU 35 1HD2 LEU 35 3.001 -1.561 -18.490 276 HD22 LEU 35 2HD2 LEU 35 4.432 -1.421 -19.505 277 HD23 LEU 35 3HD2 LEU 35 4.323 -0.451 -18.001 278 H GLU 36 H GLU 36 8.699 -3.880 -18.289 279 HA GLU 36 HA GLU 36 11.092 -2.165 -18.010 280 HB2 GLU 36 1HB GLU 36 9.810 -2.707 -15.743 281 HB3 GLU 36 2HB GLU 36 10.495 -4.316 -15.930 282 HG2 GLU 36 1HG GLU 36 12.001 -3.122 -14.465 283 HG3 GLU 36 2HG GLU 36 12.827 -3.128 -16.060 284 H ARG 37 H ARG 37 13.048 -3.551 -18.080 285 HA ARG 37 HA ARG 37 12.562 -6.299 -19.189 286 HB2 ARG 37 1HB ARG 37 14.603 -4.348 -20.301 287 HB3 ARG 37 2HB ARG 37 14.422 -6.022 -20.747 288 HG2 ARG 37 1HG ARG 37 12.028 -5.478 -21.447 289 HG3 ARG 37 2HG ARG 37 12.487 -3.800 -21.283 290 HD2 ARG 37 1HD ARG 37 13.991 -5.770 -23.037 291 HD3 ARG 37 2HD ARG 37 12.666 -4.736 -23.617 292 HE ARG 37 HE ARG 37 14.015 -2.849 -23.476 293 HH11 ARG 37 1HH1 ARG 37 15.857 -5.664 -22.426 294 HH12 ARG 37 2HH1 ARG 37 17.376 -4.879 -22.635 295 HH21 ARG 37 1HH2 ARG 37 16.022 -1.877 -23.741 296 HH22 ARG 37 2HH2 ARG 37 17.454 -2.777 -23.394 297 H ASP 38 H ASP 38 14.053 -7.831 -18.571 298 HA ASP 38 HA ASP 38 15.413 -8.925 -17.103 299 HB2 ASP 38 1HB ASP 38 17.087 -6.411 -17.170 300 HB3 ASP 38 2HB ASP 38 17.599 -7.993 -16.589 301 H THR 39 H THR 39 13.117 -7.906 -16.092 302 HA THR 39 HA THR 39 13.429 -6.015 -13.958 303 HB THR 39 HB THR 39 11.312 -6.458 -15.192 304 HG1 THR 39 HG1 THR 39 11.405 -6.797 -12.379 305 HG21 THR 39 1HG2 THR 39 11.204 -9.098 -13.618 306 HG22 THR 39 2HG2 THR 39 11.428 -8.941 -15.394 307 HG23 THR 39 3HG2 THR 39 9.906 -8.395 -14.619 308 H GLN 40 H GLN 40 14.073 -9.437 -13.939 309 HA GLN 40 HA GLN 40 14.036 -9.373 -10.966 310 HB2 GLN 40 1HB GLN 40 12.792 -11.226 -12.735 311 HB3 GLN 40 2HB GLN 40 14.142 -12.066 -11.970 312 HG2 GLN 40 1HG GLN 40 13.292 -11.302 -9.745 313 HG3 GLN 40 2HG GLN 40 11.924 -10.517 -10.547 314 HE21 GLN 40 1HE2 GLN 40 9.991 -13.403 -10.521 315 HE22 GLN 40 2HE2 GLN 40 10.093 -11.666 -10.595 316 H GLY 41 H GLY 41 16.021 -8.644 -13.224 317 HA2 GLY 41 1HA GLY 41 18.351 -8.594 -13.173 318 HA3 GLY 41 2HA GLY 41 18.361 -9.830 -11.902 319 H LEU 42 H LEU 42 16.484 -11.487 -13.598 320 HA LEU 42 HA LEU 42 18.446 -13.062 -15.008 321 HB2 LEU 42 1HB LEU 42 15.369 -13.014 -15.307 322 HB3 LEU 42 2HB LEU 42 16.441 -14.255 -15.959 323 HG LEU 42 HG LEU 42 16.190 -13.682 -12.967 324 HD11 LEU 42 1HD1 LEU 42 14.851 -15.828 -14.632 325 HD12 LEU 42 2HD1 LEU 42 14.028 -14.379 -13.992 326 HD13 LEU 42 3HD1 LEU 42 14.708 -15.559 -12.857 327 HD21 LEU 42 1HD2 LEU 42 17.256 -16.060 -14.539 328 HD22 LEU 42 2HD2 LEU 42 17.149 -15.988 -12.781 329 HD23 LEU 42 3HD2 LEU 42 18.236 -14.883 -13.626 330 H ASP 43 H ASP 43 19.370 -12.545 -16.930 331 HA ASP 43 HA ASP 43 18.598 -10.407 -18.618 332 HB2 ASP 43 1HB ASP 43 20.091 -12.984 -19.347 333 HB3 ASP 43 2HB ASP 43 19.917 -11.579 -20.411 334 H GLY 44 H GLY 44 17.107 -10.139 -20.080 335 HA2 GLY 44 1HA GLY 44 15.726 -10.677 -21.886 336 HA3 GLY 44 2HA GLY 44 16.105 -12.395 -21.626 337 H TRP 45 H TRP 45 15.055 -11.221 -18.634 338 HA TRP 45 HA TRP 45 12.318 -12.221 -19.247 339 HB2 TRP 45 1HB TRP 45 13.999 -12.098 -16.796 340 HB3 TRP 45 2HB TRP 45 12.237 -12.147 -16.621 341 HD1 TRP 45 HD1 TRP 45 15.168 -14.261 -17.871 342 HE1 TRP 45 HE1 TRP 45 14.439 -16.657 -18.291 343 HE3 TRP 45 HE3 TRP 45 10.162 -13.568 -17.195 344 HZ2 TRP 45 HZ2 TRP 45 11.982 -18.124 -18.298 345 HZ3 TRP 45 HZ3 TRP 45 8.621 -15.532 -17.425 346 HH2 TRP 45 HH2 TRP 45 9.553 -17.809 -17.975 347 H TRP 46 H TRP 46 11.033 -10.697 -19.998 348 HA TRP 46 HA TRP 46 11.409 -7.922 -19.025 349 HB2 TRP 46 1HB TRP 46 9.594 -9.056 -21.192 350 HB3 TRP 46 2HB TRP 46 9.866 -7.369 -20.851 351 HD1 TRP 46 HD1 TRP 46 13.217 -8.832 -20.603 352 HE1 TRP 46 HE1 TRP 46 14.540 -8.618 -22.732 353 HE3 TRP 46 HE3 TRP 46 9.317 -7.756 -23.740 354 HZ2 TRP 46 HZ2 TRP 46 14.021 -7.991 -25.467 355 HZ3 TRP 46 HZ3 TRP 46 9.803 -7.434 -26.145 356 HH2 TRP 46 HH2 TRP 46 12.146 -7.563 -27.031 357 H LEU 47 H LEU 47 9.955 -6.740 -17.985 358 HA LEU 47 HA LEU 47 7.711 -8.216 -16.737 359 HB2 LEU 47 1HB LEU 47 9.101 -6.492 -15.483 360 HB3 LEU 47 2HB LEU 47 8.419 -5.260 -16.533 361 HG LEU 47 HG LEU 47 6.149 -5.831 -15.667 362 HD11 LEU 47 1HD1 LEU 47 6.519 -8.158 -14.901 363 HD12 LEU 47 2HD1 LEU 47 5.979 -7.118 -13.537 364 HD13 LEU 47 3HD1 LEU 47 7.689 -7.560 -13.679 365 HD21 LEU 47 1HD2 LEU 47 7.571 -3.995 -14.754 366 HD22 LEU 47 2HD2 LEU 47 8.208 -5.168 -13.560 367 HD23 LEU 47 3HD2 LEU 47 6.499 -4.712 -13.531 368 H CYS 48 H CYS 48 5.868 -8.394 -17.900 369 HA CYS 48 HA CYS 48 5.282 -6.208 -19.875 370 HB2 CYS 48 1HB CYS 48 4.468 -9.122 -19.896 371 HB3 CYS 48 2HB CYS 48 3.974 -7.950 -21.089 372 HG CYS 48 HG CYS 48 6.993 -8.942 -20.310 373 H SER 49 H SER 49 2.903 -5.939 -20.305 374 HA SER 49 HA SER 49 1.222 -6.616 -17.936 375 HB2 SER 49 1HB SER 49 2.017 -4.342 -17.553 376 HB3 SER 49 2HB SER 49 1.432 -3.837 -19.160 377 HG SER 49 HG SER 49 -0.235 -4.972 -17.153 378 H LEU 50 H LEU 50 -0.586 -7.499 -18.492 379 HA LEU 50 HA LEU 50 -1.907 -6.922 -21.082 380 HB2 LEU 50 1HB LEU 50 -0.280 -8.561 -21.753 381 HB3 LEU 50 2HB LEU 50 -0.646 -9.585 -20.402 382 HG LEU 50 HG LEU 50 -2.976 -9.105 -22.104 383 HD11 LEU 50 1HD1 LEU 50 -0.659 -10.662 -23.269 384 HD12 LEU 50 2HD1 LEU 50 -1.138 -9.027 -23.802 385 HD13 LEU 50 3HD1 LEU 50 -2.270 -10.386 -23.999 386 HD21 LEU 50 1HD2 LEU 50 -1.570 -11.721 -21.289 387 HD22 LEU 50 2HD2 LEU 50 -3.252 -11.518 -21.931 388 HD23 LEU 50 3HD2 LEU 50 -2.802 -10.884 -20.304 389 H HIS 51 H HIS 51 -4.029 -7.276 -20.946 390 HA HIS 51 HA HIS 51 -6.113 -7.602 -20.026 391 HB2 HIS 51 1HB HIS 51 -5.066 -9.982 -20.421 392 HB3 HIS 51 2HB HIS 51 -5.076 -10.084 -18.672 393 HD1 HIS 51 HD1 HIS 51 -7.492 -9.853 -17.489 394 HD2 HIS 51 HD2 HIS 51 -7.503 -10.474 -21.641 395 HE1 HIS 51 HE1 HIS 51 -9.834 -10.565 -18.124 396 H GLY 52 H GLY 52 -4.446 -5.925 -18.403 397 HA2 GLY 52 1HA GLY 52 -4.962 -4.726 -16.477 398 HA3 GLY 52 2HA GLY 52 -6.088 -5.988 -16.003 399 H ARG 53 H ARG 53 -3.183 -7.599 -16.607 400 HA ARG 53 HA ARG 53 -2.266 -7.085 -13.804 401 HB2 ARG 53 1HB ARG 53 -1.644 -9.502 -13.630 402 HB3 ARG 53 2HB ARG 53 -3.420 -9.239 -13.730 403 HG2 ARG 53 1HG ARG 53 -3.619 -10.328 -15.703 404 HG3 ARG 53 2HG ARG 53 -2.031 -9.821 -16.291 405 HD2 ARG 53 1HD ARG 53 -1.900 -12.165 -15.945 406 HD3 ARG 53 2HD ARG 53 -0.948 -11.342 -14.684 407 HE ARG 53 HE ARG 53 -3.696 -12.003 -13.934 408 HH11 ARG 53 1HH1 ARG 53 -0.371 -13.222 -13.983 409 HH12 ARG 53 2HH1 ARG 53 -0.693 -14.368 -12.770 410 HH21 ARG 53 1HH2 ARG 53 -4.017 -13.505 -12.344 411 HH22 ARG 53 2HH2 ARG 53 -2.687 -14.495 -11.812 412 H GLN 54 H GLN 54 -0.003 -7.826 -13.507 413 HA GLN 54 HA GLN 54 1.568 -7.446 -15.990 414 HB2 GLN 54 1HB GLN 54 2.337 -6.832 -13.084 415 HB3 GLN 54 2HB GLN 54 3.344 -6.608 -14.540 416 HG2 GLN 54 1HG GLN 54 2.651 -4.501 -14.466 417 HG3 GLN 54 2HG GLN 54 1.191 -5.117 -15.238 418 HE21 GLN 54 1HE2 GLN 54 0.689 -3.150 -11.949 419 HE22 GLN 54 2HE2 GLN 54 1.972 -2.932 -13.123 420 H GLY 55 H GLY 55 3.640 -8.653 -15.926 421 HA2 GLY 55 1HA GLY 55 4.141 -10.590 -13.935 422 HA3 GLY 55 2HA GLY 55 3.316 -11.372 -15.323 423 H ILE 56 H ILE 56 5.935 -12.066 -14.524 424 HA ILE 56 HA ILE 56 7.725 -10.706 -16.429 425 HB ILE 56 HB ILE 56 9.425 -12.306 -15.692 426 HG12 ILE 56 1HG1 ILE 56 7.258 -13.748 -14.125 427 HG13 ILE 56 2HG1 ILE 56 7.999 -14.361 -15.596 428 HG21 ILE 56 1HG2 ILE 56 7.805 -11.533 -13.190 429 HG22 ILE 56 2HG2 ILE 56 9.585 -11.619 -13.375 430 HG23 ILE 56 3HG2 ILE 56 8.708 -10.371 -14.192 431 HD11 ILE 56 1HD1 ILE 56 9.018 -15.475 -13.740 432 HD12 ILE 56 2HD1 ILE 56 10.218 -14.265 -14.302 433 HD13 ILE 56 3HD1 ILE 56 9.246 -13.966 -12.824 434 H VAL 57 H VAL 57 8.422 -11.474 -18.365 435 HA VAL 57 HA VAL 57 7.091 -13.909 -19.481 436 HB VAL 57 HB VAL 57 7.091 -11.099 -20.682 437 HG11 VAL 57 1HG1 VAL 57 7.461 -12.504 -22.583 438 HG12 VAL 57 2HG1 VAL 57 6.366 -13.761 -21.953 439 HG13 VAL 57 3HG1 VAL 57 5.707 -12.229 -22.534 440 HG21 VAL 57 1HG2 VAL 57 4.856 -12.914 -19.796 441 HG22 VAL 57 2HG2 VAL 57 5.373 -11.388 -19.064 442 HG23 VAL 57 3HG2 VAL 57 4.641 -11.380 -20.698 443 HA PRO 58 HA PRO 58 11.267 -14.232 -20.917 444 HB2 PRO 58 1HB PRO 58 10.995 -16.202 -22.852 445 HB3 PRO 58 2HB PRO 58 11.059 -16.544 -21.088 446 HG2 PRO 58 1HG PRO 58 8.673 -16.268 -22.895 447 HG3 PRO 58 2HG PRO 58 9.044 -17.529 -21.689 448 HD2 PRO 58 1HD PRO 58 7.384 -15.456 -21.167 449 HD3 PRO 58 2HD PRO 58 8.451 -16.124 -19.911 450 H GLY 59 H GLY 59 11.984 -12.511 -22.095 451 HA2 GLY 59 1HA GLY 59 10.395 -11.358 -24.145 452 HA3 GLY 59 2HA GLY 59 12.038 -10.920 -23.751 453 H ASN 60 H ASN 60 12.766 -13.907 -24.450 454 HA ASN 60 HA ASN 60 13.460 -13.411 -27.232 455 HB2 ASN 60 1HB ASN 60 13.520 -15.890 -25.469 456 HB3 ASN 60 2HB ASN 60 13.984 -15.890 -27.185 457 HD21 ASN 60 1HD2 ASN 60 16.854 -14.998 -24.634 458 HD22 ASN 60 2HD2 ASN 60 15.398 -15.945 -24.315 459 H ARG 61 H ARG 61 10.577 -14.505 -25.684 460 HA ARG 61 HA ARG 61 9.662 -15.968 -28.145 461 HB2 ARG 61 1HB ARG 61 8.399 -15.614 -25.367 462 HB3 ARG 61 2HB ARG 61 7.742 -16.559 -26.698 463 HG2 ARG 61 1HG ARG 61 10.026 -17.818 -26.639 464 HG3 ARG 61 2HG ARG 61 10.211 -17.128 -25.043 465 HD2 ARG 61 1HD ARG 61 8.029 -18.072 -24.375 466 HD3 ARG 61 2HD ARG 61 7.817 -18.761 -25.990 467 HE ARG 61 HE ARG 61 10.291 -19.588 -24.762 468 HH11 ARG 61 1HH1 ARG 61 6.848 -20.305 -24.919 469 HH12 ARG 61 2HH1 ARG 61 7.098 -22.026 -24.463 470 HH21 ARG 61 1HH2 ARG 61 10.520 -21.746 -24.206 471 HH22 ARG 61 2HH2 ARG 61 9.114 -22.780 -24.077 472 H LEU 62 H LEU 62 10.056 -12.872 -27.421 473 HA LEU 62 HA LEU 62 7.384 -12.027 -28.433 474 HB2 LEU 62 1HB LEU 62 9.280 -10.472 -26.652 475 HB3 LEU 62 2HB LEU 62 7.741 -9.929 -27.252 476 HG LEU 62 HG LEU 62 8.140 -12.155 -25.245 477 HD11 LEU 62 1HD1 LEU 62 8.667 -10.044 -24.234 478 HD12 LEU 62 2HD1 LEU 62 7.020 -10.493 -23.698 479 HD13 LEU 62 3HD1 LEU 62 7.246 -9.259 -24.980 480 HD21 LEU 62 1HD2 LEU 62 5.645 -11.946 -24.954 481 HD22 LEU 62 2HD2 LEU 62 6.126 -12.587 -26.534 482 HD23 LEU 62 3HD2 LEU 62 5.585 -10.905 -26.370 483 H LYS 63 H LYS 63 7.324 -10.233 -29.774 484 HA LYS 63 HA LYS 63 9.962 -9.484 -31.051 485 HB2 LYS 63 1HB LYS 63 8.501 -11.043 -32.477 486 HB3 LYS 63 2HB LYS 63 7.286 -9.779 -32.478 487 HG2 LYS 63 1HG LYS 63 8.417 -9.467 -34.524 488 HG3 LYS 63 2HG LYS 63 9.167 -8.255 -33.484 489 HD2 LYS 63 1HD LYS 63 11.000 -9.325 -34.606 490 HD3 LYS 63 2HD LYS 63 11.021 -10.019 -32.969 491 HE2 LYS 63 1HE LYS 63 11.390 -11.765 -34.614 492 HE3 LYS 63 2HE LYS 63 9.769 -12.021 -33.860 493 HZ1 LYS 63 1HZ LYS 63 10.280 -10.737 -36.501 494 HZ2 LYS 63 2HZ LYS 63 8.811 -10.980 -35.786 495 HZ3 LYS 63 3HZ LYS 63 9.706 -12.256 -36.277 496 H ILE 64 H ILE 64 10.323 -7.364 -30.832 497 HA ILE 64 HA ILE 64 8.417 -5.576 -29.692 498 HB ILE 64 HB ILE 64 11.114 -5.180 -31.090 499 HG12 ILE 64 1HG1 ILE 64 11.040 -6.303 -28.877 500 HG13 ILE 64 2HG1 ILE 64 11.978 -4.845 -28.877 501 HG21 ILE 64 1HG2 ILE 64 9.286 -3.028 -29.881 502 HG22 ILE 64 2HG2 ILE 64 11.053 -2.766 -30.044 503 HG23 ILE 64 3HG2 ILE 64 10.039 -3.055 -31.488 504 HD11 ILE 64 1HD1 ILE 64 10.269 -3.619 -27.621 505 HD12 ILE 64 2HD1 ILE 64 9.142 -5.004 -27.784 506 HD13 ILE 64 3HD1 ILE 64 10.603 -5.152 -26.788 507 H LEU 65 H LEU 65 7.000 -4.182 -30.579 508 HA LEU 65 HA LEU 65 6.310 -4.618 -33.413 509 HB2 LEU 65 1HB LEU 65 5.017 -3.822 -30.974 510 HB3 LEU 65 2HB LEU 65 4.787 -2.541 -32.115 511 HG LEU 65 HG LEU 65 2.897 -4.053 -32.021 512 HD11 LEU 65 1HD1 LEU 65 2.573 -4.432 -34.406 513 HD12 LEU 65 2HD1 LEU 65 4.324 -4.289 -34.675 514 HD13 LEU 65 3HD1 LEU 65 3.386 -2.868 -34.140 515 HD21 LEU 65 1HD2 LEU 65 2.977 -6.351 -32.852 516 HD22 LEU 65 2HD2 LEU 65 4.061 -6.162 -31.439 517 HD23 LEU 65 3HD2 LEU 65 4.766 -6.195 -33.092 518 H VAL 66 H VAL 66 5.551 -2.519 -34.535 519 HA VAL 66 HA VAL 66 7.759 -0.822 -35.116 520 HB VAL 66 HB VAL 66 4.718 -0.261 -35.426 521 HG11 VAL 66 1HG1 VAL 66 5.919 1.828 -35.636 522 HG12 VAL 66 2HG1 VAL 66 7.119 1.090 -36.765 523 HG13 VAL 66 3HG1 VAL 66 5.430 1.293 -37.279 524 HG21 VAL 66 1HG2 VAL 66 5.041 -0.978 -37.801 525 HG22 VAL 66 2HG2 VAL 66 6.685 -1.535 -37.363 526 HG23 VAL 66 3HG2 VAL 66 5.270 -2.317 -36.593 527 H GLY 67 H GLY 67 8.490 1.049 -34.213 528 HA2 GLY 67 1HA GLY 67 7.034 2.771 -32.514 529 HA3 GLY 67 2HA GLY 67 7.850 1.566 -31.465 530 H MET 68 H MET 68 10.197 1.176 -33.033 531 HA MET 68 HA MET 68 11.526 3.824 -32.682 532 HB2 MET 68 1HB MET 68 12.722 1.005 -32.670 533 HB3 MET 68 2HB MET 68 13.624 2.516 -32.521 534 HG2 MET 68 1HG MET 68 13.439 2.174 -30.323 535 HG3 MET 68 2HG MET 68 11.823 2.837 -30.493 536 HE1 MET 68 1HE MET 68 11.848 -0.466 -28.037 537 HE2 MET 68 2HE MET 68 13.093 0.737 -28.301 538 HE3 MET 68 3HE MET 68 11.451 1.255 -28.038 539 H TYR 69 H TYR 69 13.159 4.350 -34.320 540 HA TYR 69 HA TYR 69 12.454 3.355 -37.021 541 HB2 TYR 69 1HB TYR 69 14.020 5.775 -36.059 542 HB3 TYR 69 2HB TYR 69 13.837 5.335 -37.755 543 HD1 TYR 69 HD1 TYR 69 11.313 4.912 -38.518 544 HD2 TYR 69 HD2 TYR 69 12.504 7.392 -35.179 545 HE1 TYR 69 HE1 TYR 69 9.191 6.067 -38.615 546 HE2 TYR 69 HE2 TYR 69 10.298 8.525 -35.276 547 HH TYR 69 HH TYR 69 8.288 8.654 -36.341 548 H ASP 70 H ASP 70 13.993 2.048 -34.889 549 HA ASP 70 HA ASP 70 15.759 0.698 -34.592 550 HB2 ASP 70 1HB ASP 70 15.382 0.550 -37.340 551 HB3 ASP 70 2HB ASP 70 17.084 0.939 -37.216 552 H LYS 71 H LYS 71 18.454 0.740 -35.429 553 HA LYS 71 HA LYS 71 19.270 3.359 -34.191 554 HB2 LYS 71 1HB LYS 71 20.423 0.580 -33.842 555 HB3 LYS 71 2HB LYS 71 21.229 2.058 -33.250 556 HG2 LYS 71 1HG LYS 71 19.213 2.541 -31.865 557 HG3 LYS 71 2HG LYS 71 18.489 0.973 -32.356 558 HD2 LYS 71 1HD LYS 71 21.135 1.335 -30.833 559 HD3 LYS 71 2HD LYS 71 19.574 0.979 -30.098 560 HE2 LYS 71 1HE LYS 71 19.483 -1.098 -31.663 561 HE3 LYS 71 2HE LYS 71 21.217 -0.825 -31.917 562 HZ1 LYS 71 1HZ LYS 71 21.565 -1.040 -29.525 563 HZ2 LYS 71 2HZ LYS 71 20.796 -2.371 -30.067 564 HZ3 LYS 71 3HZ LYS 71 19.978 -1.207 -29.225 565 H LYS 72 H LYS 72 21.503 4.054 -34.739 566 HA LYS 72 HA LYS 72 21.978 4.121 -37.541 567 HB2 LYS 72 1HB LYS 72 23.762 4.679 -35.142 568 HB3 LYS 72 2HB LYS 72 24.252 5.039 -36.805 569 HG2 LYS 72 1HG LYS 72 22.593 6.772 -37.045 570 HG3 LYS 72 2HG LYS 72 21.671 6.202 -35.657 571 HD2 LYS 72 1HD LYS 72 22.829 8.204 -35.045 572 HD3 LYS 72 2HD LYS 72 23.465 6.835 -34.127 573 HE2 LYS 72 1HE LYS 72 25.394 8.169 -34.819 574 HE3 LYS 72 2HE LYS 72 25.397 6.709 -35.796 575 HZ1 LYS 72 1HZ LYS 72 24.363 9.347 -36.675 576 HZ2 LYS 72 2HZ LYS 72 24.347 7.982 -37.619 577 HZ3 LYS 72 3HZ LYS 72 25.779 8.643 -37.146 578 HA PRO 73 HA PRO 73 24.037 0.208 -37.965 579 HB2 PRO 73 1HB PRO 73 25.363 0.552 -40.327 580 HB3 PRO 73 2HB PRO 73 23.580 0.548 -40.253 581 HG2 PRO 73 1HG PRO 73 25.415 2.908 -40.276 582 HG3 PRO 73 2HG PRO 73 24.025 2.566 -41.334 583 HD2 PRO 73 1HD PRO 73 23.800 4.161 -39.156 584 HD3 PRO 73 2HD PRO 73 22.490 3.031 -39.642 585 H ALA 74 H ALA 74 26.266 -0.743 -38.359 586 HA ALA 74 HA ALA 74 28.383 1.005 -37.245 587 HB1 ALA 74 1HB ALA 74 29.279 -1.035 -36.097 588 HB2 ALA 74 2HB ALA 74 27.619 -0.617 -35.564 589 HB3 ALA 74 3HB ALA 74 27.856 -1.949 -36.720 590 H GLY 75 H GLY 75 27.703 -1.829 -39.331 591 HA2 GLY 75 1HA GLY 75 28.707 -2.259 -41.402 592 HA3 GLY 75 2HA GLY 75 29.981 -1.106 -41.004 593 H GLU 76 H GLU 76 30.282 -3.814 -42.051 594 HA GLU 76 HA GLU 76 32.155 -4.887 -40.046 595 HB2 GLU 76 1HB GLU 76 29.945 -5.930 -39.588 596 HB3 GLU 76 2HB GLU 76 29.918 -6.562 -41.269 597 HG2 GLU 76 1HG GLU 76 31.880 -7.908 -40.822 598 HG3 GLU 76 2HG GLU 76 32.053 -7.240 -39.213 599 H PHE 77 H PHE 77 33.728 -4.122 -41.633 600 HA PHE 77 HA PHE 77 34.243 -5.993 -43.809 601 HB2 PHE 77 1HB PHE 77 32.698 -3.623 -44.352 602 HB3 PHE 77 2HB PHE 77 34.295 -3.322 -44.986 603 HD1 PHE 77 HD1 PHE 77 35.231 -4.608 -46.838 604 HD2 PHE 77 HD2 PHE 77 31.275 -5.477 -45.314 605 HE1 PHE 77 HE1 PHE 77 34.678 -5.926 -48.886 606 HE2 PHE 77 HE2 PHE 77 30.780 -6.792 -47.355 607 HZ PHE 77 HZ PHE 77 32.474 -6.975 -49.164 608 H ILE 78 H ILE 78 36.376 -5.467 -44.786 609 HA ILE 78 HA ILE 78 37.901 -3.343 -43.378 610 HB ILE 78 HB ILE 78 39.917 -4.846 -43.274 611 HG12 ILE 78 1HG1 ILE 78 37.915 -7.098 -43.642 612 HG13 ILE 78 2HG1 ILE 78 39.016 -6.556 -44.933 613 HG21 ILE 78 1HG2 ILE 78 37.583 -5.888 -41.584 614 HG22 ILE 78 2HG2 ILE 78 39.303 -5.903 -41.159 615 HG23 ILE 78 3HG2 ILE 78 38.451 -4.357 -41.269 616 HD11 ILE 78 1HD1 ILE 78 40.001 -8.492 -43.870 617 HD12 ILE 78 2HD1 ILE 78 40.955 -7.061 -43.334 618 HD13 ILE 78 3HD1 ILE 78 39.773 -7.817 -42.219 619 H VAL 79 H VAL 79 39.783 -2.679 -44.553 620 HA VAL 79 HA VAL 79 40.018 -3.452 -47.343 621 HB VAL 79 HB VAL 79 38.085 -1.828 -47.357 622 HG11 VAL 79 1HG1 VAL 79 38.312 0.488 -46.781 623 HG12 VAL 79 2HG1 VAL 79 38.696 -0.506 -45.345 624 HG13 VAL 79 3HG1 VAL 79 40.061 0.240 -46.287 625 HG21 VAL 79 1HG2 VAL 79 39.582 -1.951 -49.275 626 HG22 VAL 79 2HG2 VAL 79 38.902 -0.336 -49.075 627 HG23 VAL 79 3HG2 VAL 79 40.571 -0.635 -48.606 628 H THR 80 H THR 80 42.050 -2.764 -48.090 629 HA THR 80 HA THR 80 44.310 -2.474 -47.795 630 HB THR 80 HB THR 80 43.696 0.005 -46.166 631 HG1 THR 80 HG1 THR 80 42.983 0.998 -48.038 632 HG21 THR 80 1HG2 THR 80 45.563 -0.626 -48.487 633 HG22 THR 80 2HG2 THR 80 46.022 -0.446 -46.827 634 HG23 THR 80 3HG2 THR 80 45.422 0.927 -47.721 635 H ASP 81 H ASP 81 43.475 -4.340 -46.022 636 HA ASP 81 HA ASP 81 44.030 -5.463 -44.155 637 HB2 ASP 81 1HB ASP 81 46.392 -4.800 -44.728 638 HB3 ASP 81 2HB ASP 81 46.246 -3.483 -43.538 639 HXT ASP 81 H02 ASP 81 44.485 -2.340 -43.291 Start of MODEL 35 1 H2 GLY 1 2H0 GLY 1 8.621 15.452 -25.929 2 H GLY 1 1H0 GLY 1 7.417 16.436 -26.405 3 HA2 GLY 1 1HA GLY 1 7.151 16.910 -23.830 4 HA3 GLY 1 2HA GLY 1 6.368 15.491 -24.551 5 H SER 2 H SER 2 6.649 15.429 -21.958 6 HA SER 2 HA SER 2 9.161 14.241 -21.113 7 HB2 SER 2 1HB SER 2 7.803 15.609 -19.626 8 HB3 SER 2 2HB SER 2 6.473 14.386 -19.765 9 HG SER 2 HG SER 2 8.662 14.374 -18.179 10 H MET 3 H MET 3 9.316 12.043 -20.281 11 HA MET 3 HA MET 3 7.385 10.081 -21.386 12 HB2 MET 3 1HB MET 3 10.402 9.924 -21.319 13 HB3 MET 3 2HB MET 3 9.370 8.607 -21.764 14 HG2 MET 3 1HG MET 3 8.847 9.472 -23.837 15 HG3 MET 3 2HG MET 3 9.068 11.182 -23.303 16 HE1 MET 3 1HE MET 3 11.078 12.576 -24.068 17 HE2 MET 3 2HE MET 3 11.584 12.018 -22.456 18 HE3 MET 3 3HE MET 3 12.766 11.939 -23.820 19 H LYS 4 H LYS 4 7.557 8.067 -20.019 20 HA LYS 4 HA LYS 4 8.378 8.796 -17.214 21 HB2 LYS 4 1HB LYS 4 5.854 7.362 -18.114 22 HB3 LYS 4 2HB LYS 4 6.365 7.621 -16.443 23 HG2 LYS 4 1HG LYS 4 6.179 10.044 -16.749 24 HG3 LYS 4 2HG LYS 4 5.784 9.838 -18.441 25 HD2 LYS 4 1HD LYS 4 3.732 8.654 -17.793 26 HD3 LYS 4 2HD LYS 4 4.068 8.834 -16.121 27 HE2 LYS 4 1HE LYS 4 3.927 11.291 -16.305 28 HE3 LYS 4 2HE LYS 4 3.707 11.196 -18.058 29 HZ1 LYS 4 1HZ LYS 4 1.579 11.513 -16.930 30 HZ2 LYS 4 2HZ LYS 4 1.776 10.118 -16.029 31 HZ3 LYS 4 3HZ LYS 4 1.576 10.014 -17.637 32 H TYR 5 H TYR 5 7.642 6.079 -19.372 33 HA TYR 5 HA TYR 5 9.372 4.274 -17.864 34 HB2 TYR 5 1HB TYR 5 6.545 4.325 -17.497 35 HB3 TYR 5 2HB TYR 5 6.852 2.973 -18.617 36 HD1 TYR 5 HD1 TYR 5 7.591 0.908 -17.750 37 HD2 TYR 5 HD2 TYR 5 7.939 4.428 -15.263 38 HE1 TYR 5 HE1 TYR 5 8.392 -0.501 -15.900 39 HE2 TYR 5 HE2 TYR 5 8.736 2.962 -13.371 40 HH TYR 5 HH TYR 5 9.318 0.739 -12.716 41 H LEU 6 H LEU 6 9.242 2.131 -19.424 42 HA LEU 6 HA LEU 6 10.326 3.001 -21.891 43 HB2 LEU 6 1HB LEU 6 9.220 0.317 -21.052 44 HB3 LEU 6 2HB LEU 6 9.881 0.630 -22.636 45 HG LEU 6 HG LEU 6 11.492 0.930 -20.088 46 HD11 LEU 6 1HD1 LEU 6 10.660 -1.428 -20.582 47 HD12 LEU 6 2HD1 LEU 6 12.410 -1.266 -20.580 48 HD13 LEU 6 3HD1 LEU 6 11.484 -1.326 -22.150 49 HD21 LEU 6 1HD2 LEU 6 12.267 1.013 -23.015 50 HD22 LEU 6 2HD2 LEU 6 13.441 0.730 -21.718 51 HD23 LEU 6 3HD2 LEU 6 12.537 2.235 -21.764 52 H ASN 7 H ASN 7 6.955 1.858 -21.355 53 HA ASN 7 HA ASN 7 5.121 1.930 -22.669 54 HB2 ASN 7 1HB ASN 7 5.711 4.374 -22.212 55 HB3 ASN 7 2HB ASN 7 6.418 4.442 -23.878 56 HD21 ASN 7 1HD2 ASN 7 3.349 5.180 -25.202 57 HD22 ASN 7 2HD2 ASN 7 5.071 5.371 -25.191 58 H VAL 8 H VAL 8 7.014 0.179 -23.674 59 HA VAL 8 HA VAL 8 6.925 0.464 -26.672 60 HB VAL 8 HB VAL 8 8.779 -1.220 -24.855 61 HG11 VAL 8 1HG1 VAL 8 8.671 -0.987 -27.893 62 HG12 VAL 8 2HG1 VAL 8 10.039 -1.672 -27.013 63 HG13 VAL 8 3HG1 VAL 8 8.454 -2.469 -26.934 64 HG21 VAL 8 1HG2 VAL 8 9.303 1.220 -26.592 65 HG22 VAL 8 2HG2 VAL 8 9.430 1.127 -24.832 66 HG23 VAL 8 3HG2 VAL 8 10.591 0.203 -25.835 67 H LEU 9 H LEU 9 6.058 -1.436 -27.809 68 HA LEU 9 HA LEU 9 4.960 -3.500 -25.991 69 HB2 LEU 9 1HB LEU 9 2.960 -3.645 -27.459 70 HB3 LEU 9 2HB LEU 9 3.012 -2.279 -26.337 71 HG LEU 9 HG LEU 9 3.939 -1.744 -29.131 72 HD11 LEU 9 1HD1 LEU 9 1.962 -3.136 -29.522 73 HD12 LEU 9 2HD1 LEU 9 1.485 -1.452 -29.798 74 HD13 LEU 9 3HD1 LEU 9 1.030 -2.242 -28.274 75 HD21 LEU 9 1HD2 LEU 9 2.063 -0.130 -27.361 76 HD22 LEU 9 2HD2 LEU 9 3.048 0.418 -28.776 77 HD23 LEU 9 3HD2 LEU 9 3.843 -0.029 -27.233 78 H ALA 10 H ALA 10 4.381 -5.425 -26.914 79 HA ALA 10 HA ALA 10 6.028 -6.130 -29.360 80 HB1 ALA 10 1HB ALA 10 6.147 -7.513 -26.631 81 HB2 ALA 10 2HB ALA 10 7.119 -7.915 -28.062 82 HB3 ALA 10 3HB ALA 10 7.320 -6.302 -27.237 83 H LYS 11 H LYS 11 5.633 -8.300 -30.156 84 HA LYS 11 HA LYS 11 2.864 -9.308 -29.530 85 HB2 LYS 11 1HB LYS 11 3.186 -8.519 -31.904 86 HB3 LYS 11 2HB LYS 11 4.615 -9.579 -32.046 87 HG2 LYS 11 1HG LYS 11 3.237 -11.564 -31.888 88 HG3 LYS 11 2HG LYS 11 1.708 -10.540 -31.625 89 HD2 LYS 11 1HD LYS 11 2.049 -9.551 -33.818 90 HD3 LYS 11 2HD LYS 11 3.547 -10.433 -34.128 91 HE2 LYS 11 1HE LYS 11 2.461 -12.552 -33.972 92 HE3 LYS 11 2HE LYS 11 0.849 -11.757 -33.684 93 HZ1 LYS 11 1HZ LYS 11 2.468 -11.466 -36.180 94 HZ2 LYS 11 2HZ LYS 11 1.062 -10.711 -35.844 95 HZ3 LYS 11 3HZ LYS 11 1.079 -12.301 -36.008 96 H ALA 12 H ALA 12 2.611 -11.340 -28.805 97 HA ALA 12 HA ALA 12 5.011 -12.843 -28.140 98 HB1 ALA 12 1HB ALA 12 1.998 -13.390 -27.957 99 HB2 ALA 12 2HB ALA 12 3.269 -14.528 -27.380 100 HB3 ALA 12 3HB ALA 12 3.108 -12.888 -26.686 101 H LEU 13 H LEU 13 6.032 -14.363 -29.337 102 HA LEU 13 HA LEU 13 4.806 -15.131 -31.935 103 HB2 LEU 13 1HB LEU 13 7.548 -15.827 -30.770 104 HB3 LEU 13 2HB LEU 13 7.001 -16.042 -32.425 105 HG LEU 13 HG LEU 13 7.280 -13.325 -31.091 106 HD11 LEU 13 1HD1 LEU 13 9.403 -13.142 -32.246 107 HD12 LEU 13 2HD1 LEU 13 9.242 -14.766 -32.886 108 HD13 LEU 13 3HD1 LEU 13 9.447 -14.487 -31.124 109 HD21 LEU 13 1HD2 LEU 13 7.283 -12.440 -33.370 110 HD22 LEU 13 2HD2 LEU 13 5.841 -13.399 -33.174 111 HD23 LEU 13 3HD2 LEU 13 7.215 -14.064 -34.057 112 H TYR 14 H TYR 14 5.453 -16.342 -28.705 113 HA TYR 14 HA TYR 14 4.394 -19.037 -29.547 114 HB2 TYR 14 1HB TYR 14 6.485 -18.458 -27.356 115 HB3 TYR 14 2HB TYR 14 5.816 -20.013 -27.814 116 HD1 TYR 14 HD1 TYR 14 6.655 -21.111 -29.857 117 HD2 TYR 14 HD2 TYR 14 8.109 -17.194 -28.768 118 HE1 TYR 14 HE1 TYR 14 8.541 -21.374 -31.488 119 HE2 TYR 14 HE2 TYR 14 9.964 -17.448 -30.335 120 HH TYR 14 HH TYR 14 10.264 -20.349 -32.482 121 H ASP 15 H ASP 15 3.395 -20.200 -27.672 122 HA ASP 15 HA ASP 15 1.859 -18.290 -26.016 123 HB2 ASP 15 1HB ASP 15 0.263 -20.216 -25.761 124 HB3 ASP 15 2HB ASP 15 0.530 -19.723 -27.466 125 H ASN 16 H ASN 16 1.334 -19.034 -23.737 126 HA ASN 16 HA ASN 16 3.360 -20.813 -22.538 127 HB2 ASN 16 1HB ASN 16 4.310 -18.432 -22.588 128 HB3 ASN 16 2HB ASN 16 2.956 -17.996 -21.623 129 HD21 ASN 16 1HD2 ASN 16 4.534 -18.718 -18.648 130 HD22 ASN 16 2HD2 ASN 16 3.547 -17.595 -19.545 131 H VAL 17 H VAL 17 2.643 -21.906 -20.837 132 HA VAL 17 HA VAL 17 0.138 -21.028 -19.544 133 HB VAL 17 HB VAL 17 1.765 -23.619 -19.229 134 HG11 VAL 17 1HG1 VAL 17 0.729 -23.060 -17.116 135 HG12 VAL 17 2HG1 VAL 17 -0.852 -22.709 -17.937 136 HG13 VAL 17 3HG1 VAL 17 -0.201 -24.392 -17.913 137 HG21 VAL 17 1HG2 VAL 17 0.511 -23.631 -21.386 138 HG22 VAL 17 2HG2 VAL 17 -0.256 -24.751 -20.265 139 HG23 VAL 17 3HG2 VAL 17 -0.965 -23.180 -20.560 140 H ALA 18 H ALA 18 0.451 -19.726 -17.824 141 HA ALA 18 HA ALA 18 3.041 -19.264 -16.793 142 HB1 ALA 18 1HB ALA 18 1.415 -17.489 -16.725 143 HB2 ALA 18 2HB ALA 18 0.302 -18.466 -15.797 144 HB3 ALA 18 3HB ALA 18 1.806 -17.897 -15.031 145 H GLU 19 H GLU 19 4.140 -20.526 -15.514 146 HA GLU 19 HA GLU 19 2.725 -22.704 -14.067 147 HB2 GLU 19 1HB GLU 19 5.701 -21.961 -14.137 148 HB3 GLU 19 2HB GLU 19 5.051 -23.508 -13.564 149 HG2 GLU 19 1HG GLU 19 4.085 -23.756 -16.018 150 HG3 GLU 19 2HG GLU 19 5.116 -22.383 -16.379 151 H SER 20 H SER 20 3.968 -19.526 -13.412 152 HA SER 20 HA SER 20 3.823 -20.058 -10.496 153 HB2 SER 20 1HB SER 20 5.929 -18.592 -12.082 154 HB3 SER 20 2HB SER 20 5.806 -18.483 -10.309 155 HG SER 20 HG SER 20 6.664 -20.601 -11.893 156 HA PRO 21 HA PRO 21 1.252 -16.493 -10.439 157 HB2 PRO 21 1HB PRO 21 1.895 -15.184 -8.108 158 HB3 PRO 21 2HB PRO 21 0.984 -16.711 -8.228 159 HG2 PRO 21 1HG PRO 21 3.965 -16.350 -7.731 160 HG3 PRO 21 2HG PRO 21 2.745 -17.311 -6.763 161 HD2 PRO 21 1HD PRO 21 4.345 -18.433 -8.575 162 HD3 PRO 21 2HD PRO 21 2.648 -18.983 -8.465 163 H ASP 22 H ASP 22 4.756 -15.870 -10.198 164 HA ASP 22 HA ASP 22 4.385 -13.001 -10.777 165 HB2 ASP 22 1HB ASP 22 6.843 -14.823 -10.704 166 HB3 ASP 22 2HB ASP 22 6.880 -13.117 -11.249 167 H GLU 23 H GLU 23 4.456 -15.948 -12.552 168 HA GLU 23 HA GLU 23 5.474 -14.736 -15.006 169 HB2 GLU 23 1HB GLU 23 5.600 -17.210 -14.086 170 HB3 GLU 23 2HB GLU 23 3.974 -17.363 -14.875 171 HG2 GLU 23 1HG GLU 23 4.952 -16.914 -17.018 172 HG3 GLU 23 2HG GLU 23 6.477 -16.374 -16.283 173 H LEU 24 H LEU 24 4.320 -14.123 -16.881 174 HA LEU 24 HA LEU 24 1.432 -13.685 -16.391 175 HB2 LEU 24 1HB LEU 24 3.402 -12.263 -17.647 176 HB3 LEU 24 2HB LEU 24 2.500 -12.866 -19.044 177 HG LEU 24 HG LEU 24 1.356 -11.208 -16.761 178 HD11 LEU 24 1HD1 LEU 24 1.749 -10.602 -19.698 179 HD12 LEU 24 2HD1 LEU 24 2.934 -10.167 -18.408 180 HD13 LEU 24 3HD1 LEU 24 1.252 -9.452 -18.424 181 HD21 LEU 24 1HD2 LEU 24 -0.374 -12.695 -17.507 182 HD22 LEU 24 2HD2 LEU 24 0.050 -12.302 -19.221 183 HD23 LEU 24 3HD2 LEU 24 -0.660 -11.018 -18.186 184 H SER 25 H SER 25 -0.096 -14.709 -17.369 185 HA SER 25 HA SER 25 0.402 -17.072 -18.991 186 HB2 SER 25 1HB SER 25 -2.342 -16.717 -18.838 187 HB3 SER 25 2HB SER 25 -1.379 -17.554 -17.628 188 HG SER 25 HG SER 25 -2.074 -14.777 -17.692 189 H PHE 26 H PHE 26 0.741 -16.729 -21.199 190 HA PHE 26 HA PHE 26 -1.026 -14.798 -22.533 191 HB2 PHE 26 1HB PHE 26 0.836 -13.781 -23.782 192 HB3 PHE 26 2HB PHE 26 0.989 -13.536 -22.022 193 HD1 PHE 26 HD1 PHE 26 2.838 -14.717 -20.829 194 HD2 PHE 26 HD2 PHE 26 2.322 -15.140 -25.074 195 HE1 PHE 26 HE1 PHE 26 5.126 -15.617 -20.966 196 HE2 PHE 26 HE2 PHE 26 4.656 -16.052 -25.254 197 HZ PHE 26 HZ PHE 26 6.058 -16.323 -23.162 198 H ARG 27 H ARG 27 -0.900 -14.887 -24.940 199 HA ARG 27 HA ARG 27 -0.390 -17.732 -25.780 200 HB2 ARG 27 1HB ARG 27 -2.710 -15.907 -26.530 201 HB3 ARG 27 2HB ARG 27 -2.358 -17.513 -27.222 202 HG2 ARG 27 1HG ARG 27 -2.980 -17.038 -24.223 203 HG3 ARG 27 2HG ARG 27 -4.203 -17.495 -25.428 204 HD2 ARG 27 1HD ARG 27 -2.987 -19.629 -25.921 205 HD3 ARG 27 2HD ARG 27 -1.766 -19.135 -24.747 206 HE ARG 27 HE ARG 27 -3.144 -19.859 -23.044 207 HH11 ARG 27 1HH1 ARG 27 -5.073 -19.643 -25.983 208 HH12 ARG 27 2HH1 ARG 27 -6.450 -20.409 -25.250 209 HH21 ARG 27 1HH2 ARG 27 -4.942 -20.862 -22.155 210 HH22 ARG 27 2HH2 ARG 27 -6.338 -21.095 -23.150 211 H LYS 28 H LYS 28 0.225 -17.963 -27.952 212 HA LYS 28 HA LYS 28 1.820 -15.881 -29.055 213 HB2 LYS 28 1HB LYS 28 2.011 -17.276 -31.057 214 HB3 LYS 28 2HB LYS 28 2.134 -18.235 -29.577 215 HG2 LYS 28 1HG LYS 28 -0.367 -18.795 -29.912 216 HG3 LYS 28 2HG LYS 28 -0.138 -18.150 -31.545 217 HD2 LYS 28 1HD LYS 28 1.544 -20.287 -30.293 218 HD3 LYS 28 2HD LYS 28 0.125 -20.658 -31.277 219 HE2 LYS 28 1HE LYS 28 1.166 -19.273 -33.115 220 HE3 LYS 28 2HE LYS 28 2.665 -19.206 -32.103 221 HZ1 LYS 28 1HZ LYS 28 2.715 -21.049 -33.722 222 HZ2 LYS 28 2HZ LYS 28 1.330 -21.663 -33.125 223 HZ3 LYS 28 3HZ LYS 28 2.691 -21.672 -32.154 224 H GLY 29 H GLY 29 1.402 -14.367 -30.571 225 HA2 GLY 29 1HA GLY 29 0.164 -13.424 -32.338 226 HA3 GLY 29 2HA GLY 29 -1.292 -14.322 -31.878 227 H ASP 30 H ASP 30 -0.585 -13.471 -28.902 228 HA ASP 30 HA ASP 30 -2.374 -11.166 -29.003 229 HB2 ASP 30 1HB ASP 30 -2.061 -13.122 -27.207 230 HB3 ASP 30 2HB ASP 30 -0.972 -11.939 -26.485 231 H ILE 31 H ILE 31 -1.907 -9.250 -27.611 232 HA ILE 31 HA ILE 31 0.885 -8.245 -28.293 233 HB ILE 31 HB ILE 31 -1.807 -6.672 -28.311 234 HG12 ILE 31 1HG1 ILE 31 -1.663 -8.189 -30.213 235 HG13 ILE 31 2HG1 ILE 31 -1.547 -6.518 -30.684 236 HG21 ILE 31 1HG2 ILE 31 1.090 -5.783 -28.899 237 HG22 ILE 31 2HG2 ILE 31 -0.374 -4.847 -29.393 238 HG23 ILE 31 3HG2 ILE 31 0.012 -5.126 -27.650 239 HD11 ILE 31 1HD1 ILE 31 0.755 -8.485 -30.502 240 HD12 ILE 31 2HD1 ILE 31 -0.083 -7.986 -32.004 241 HD13 ILE 31 3HD1 ILE 31 0.897 -6.820 -31.080 242 H MET 32 H MET 32 1.960 -7.310 -26.610 243 HA MET 32 HA MET 32 0.435 -6.464 -24.199 244 HB2 MET 32 1HB MET 32 2.095 -7.598 -22.781 245 HB3 MET 32 2HB MET 32 1.229 -8.756 -23.750 246 HG2 MET 32 1HG MET 32 3.062 -8.700 -25.418 247 HG3 MET 32 2HG MET 32 4.032 -7.761 -24.285 248 HE1 MET 32 1HE MET 32 3.041 -11.279 -25.328 249 HE2 MET 32 2HE MET 32 2.829 -12.142 -23.764 250 HE3 MET 32 3HE MET 32 1.660 -10.925 -24.265 251 H THR 33 H THR 33 1.594 -5.033 -22.777 252 HA THR 33 HA THR 33 3.572 -3.304 -24.302 253 HB THR 33 HB THR 33 2.355 -2.792 -21.561 254 HG1 THR 33 HG1 THR 33 0.686 -1.819 -22.618 255 HG21 THR 33 1HG2 THR 33 3.589 -0.994 -23.741 256 HG22 THR 33 2HG2 THR 33 4.298 -1.330 -22.141 257 HG23 THR 33 3HG2 THR 33 2.755 -0.433 -22.284 258 H VAL 34 H VAL 34 5.699 -3.104 -23.633 259 HA VAL 34 HA VAL 34 6.564 -4.879 -21.417 260 HB VAL 34 HB VAL 34 8.186 -3.746 -23.751 261 HG11 VAL 34 1HG1 VAL 34 9.613 -3.905 -21.759 262 HG12 VAL 34 2HG1 VAL 34 8.987 -5.513 -21.357 263 HG13 VAL 34 3HG1 VAL 34 9.935 -5.222 -22.863 264 HG21 VAL 34 1HG2 VAL 34 6.595 -5.634 -24.302 265 HG22 VAL 34 2HG2 VAL 34 8.298 -6.010 -24.463 266 HG23 VAL 34 3HG2 VAL 34 7.420 -6.657 -23.059 267 H LEU 35 H LEU 35 6.926 -3.944 -19.619 268 HA LEU 35 HA LEU 35 7.079 -0.932 -19.467 269 HB2 LEU 35 1HB LEU 35 6.952 -3.024 -17.251 270 HB3 LEU 35 2HB LEU 35 6.656 -1.315 -17.156 271 HG LEU 35 HG LEU 35 4.919 -3.114 -18.798 272 HD11 LEU 35 1HD1 LEU 35 3.280 -3.017 -16.929 273 HD12 LEU 35 2HD1 LEU 35 4.567 -2.272 -15.949 274 HD13 LEU 35 3HD1 LEU 35 4.787 -3.904 -16.553 275 HD21 LEU 35 1HD2 LEU 35 4.570 -0.288 -17.773 276 HD22 LEU 35 2HD2 LEU 35 3.258 -1.217 -18.535 277 HD23 LEU 35 3HD2 LEU 35 4.715 -0.775 -19.472 278 H GLU 36 H GLU 36 8.992 -3.798 -18.542 279 HA GLU 36 HA GLU 36 11.492 -2.172 -18.360 280 HB2 GLU 36 1HB GLU 36 10.361 -2.236 -16.078 281 HB3 GLU 36 2HB GLU 36 10.455 -3.999 -16.138 282 HG2 GLU 36 1HG GLU 36 12.328 -3.500 -14.813 283 HG3 GLU 36 2HG GLU 36 13.020 -3.582 -16.433 284 H ARG 37 H ARG 37 13.331 -3.720 -18.378 285 HA ARG 37 HA ARG 37 12.678 -6.490 -19.297 286 HB2 ARG 37 1HB ARG 37 14.792 -4.650 -20.517 287 HB3 ARG 37 2HB ARG 37 14.470 -6.293 -20.964 288 HG2 ARG 37 1HG ARG 37 12.158 -5.650 -21.667 289 HG3 ARG 37 2HG ARG 37 12.681 -3.918 -21.514 290 HD2 ARG 37 1HD ARG 37 14.112 -5.946 -23.260 291 HD3 ARG 37 2HD ARG 37 12.838 -4.788 -23.819 292 HE ARG 37 HE ARG 37 14.957 -3.409 -22.498 293 HH11 ARG 37 1HH1 ARG 37 14.107 -4.915 -25.541 294 HH12 ARG 37 2HH1 ARG 37 15.259 -3.968 -26.421 295 HH21 ARG 37 1HH2 ARG 37 16.419 -2.254 -23.628 296 HH22 ARG 37 2HH2 ARG 37 16.522 -2.436 -25.340 297 H ASP 38 H ASP 38 14.313 -7.895 -18.525 298 HA ASP 38 HA ASP 38 15.793 -8.761 -17.038 299 HB2 ASP 38 1HB ASP 38 17.293 -6.964 -18.280 300 HB3 ASP 38 2HB ASP 38 17.277 -6.063 -16.700 301 H THR 39 H THR 39 13.347 -7.683 -16.267 302 HA THR 39 HA THR 39 13.471 -6.023 -13.977 303 HB THR 39 HB THR 39 11.466 -6.477 -15.432 304 HG1 THR 39 HG1 THR 39 11.605 -5.852 -12.946 305 HG21 THR 39 1HG2 THR 39 11.102 -8.990 -13.720 306 HG22 THR 39 2HG2 THR 39 11.706 -9.029 -15.412 307 HG23 THR 39 3HG2 THR 39 10.084 -8.482 -15.098 308 H GLN 40 H GLN 40 14.143 -9.323 -14.275 309 HA GLN 40 HA GLN 40 13.632 -9.945 -11.383 310 HB2 GLN 40 1HB GLN 40 13.498 -11.484 -13.914 311 HB3 GLN 40 2HB GLN 40 14.344 -12.262 -12.597 312 HG2 GLN 40 1HG GLN 40 11.717 -11.047 -11.873 313 HG3 GLN 40 2HG GLN 40 11.637 -12.397 -12.999 314 HE21 GLN 40 1HE2 GLN 40 12.222 -14.900 -10.706 315 HE22 GLN 40 2HE2 GLN 40 11.772 -14.418 -12.309 316 H GLY 41 H GLY 41 16.136 -8.928 -13.463 317 HA2 GLY 41 1HA GLY 41 18.422 -8.878 -12.984 318 HA3 GLY 41 2HA GLY 41 18.223 -10.063 -11.690 319 H LEU 42 H LEU 42 16.411 -11.251 -14.046 320 HA LEU 42 HA LEU 42 18.518 -13.081 -15.118 321 HB2 LEU 42 1HB LEU 42 15.535 -13.136 -15.450 322 HB3 LEU 42 2HB LEU 42 16.679 -14.323 -16.024 323 HG LEU 42 HG LEU 42 16.188 -13.783 -13.068 324 HD11 LEU 42 1HD1 LEU 42 14.693 -15.770 -13.146 325 HD12 LEU 42 2HD1 LEU 42 14.909 -15.883 -14.919 326 HD13 LEU 42 3HD1 LEU 42 14.081 -14.485 -14.172 327 HD21 LEU 42 1HD2 LEU 42 18.294 -14.987 -13.601 328 HD22 LEU 42 2HD2 LEU 42 17.429 -16.205 -14.531 329 HD23 LEU 42 3HD2 LEU 42 17.169 -16.046 -12.799 330 H ASP 43 H ASP 43 19.422 -12.404 -16.985 331 HA ASP 43 HA ASP 43 18.470 -10.539 -18.814 332 HB2 ASP 43 1HB ASP 43 20.853 -11.543 -18.564 333 HB3 ASP 43 2HB ASP 43 20.232 -12.907 -19.486 334 H GLY 44 H GLY 44 16.928 -10.640 -20.322 335 HA2 GLY 44 1HA GLY 44 15.659 -11.660 -22.014 336 HA3 GLY 44 2HA GLY 44 16.050 -13.253 -21.417 337 H TRP 45 H TRP 45 14.998 -11.616 -18.659 338 HA TRP 45 HA TRP 45 12.129 -12.378 -19.291 339 HB2 TRP 45 1HB TRP 45 13.630 -12.070 -16.689 340 HB3 TRP 45 2HB TRP 45 11.867 -12.079 -16.791 341 HD1 TRP 45 HD1 TRP 45 14.851 -14.313 -17.356 342 HE1 TRP 45 HE1 TRP 45 14.173 -16.750 -17.534 343 HE3 TRP 45 HE3 TRP 45 9.798 -13.595 -17.386 344 HZ2 TRP 45 HZ2 TRP 45 11.728 -18.240 -17.677 345 HZ3 TRP 45 HZ3 TRP 45 8.310 -15.653 -17.563 346 HH2 TRP 45 HH2 TRP 45 9.253 -17.926 -17.757 347 H TRP 46 H TRP 46 10.664 -10.852 -19.620 348 HA TRP 46 HA TRP 46 11.416 -8.037 -18.933 349 HB2 TRP 46 1HB TRP 46 9.663 -9.120 -21.163 350 HB3 TRP 46 2HB TRP 46 9.924 -7.432 -20.827 351 HD1 TRP 46 HD1 TRP 46 13.261 -8.896 -20.501 352 HE1 TRP 46 HE1 TRP 46 14.700 -8.841 -22.562 353 HE3 TRP 46 HE3 TRP 46 9.520 -7.805 -23.784 354 HZ2 TRP 46 HZ2 TRP 46 14.274 -8.291 -25.348 355 HZ3 TRP 46 HZ3 TRP 46 10.116 -7.511 -26.233 356 HH2 TRP 46 HH2 TRP 46 12.487 -7.785 -26.963 357 H LEU 47 H LEU 47 9.793 -6.723 -18.159 358 HA LEU 47 HA LEU 47 7.586 -8.204 -16.817 359 HB2 LEU 47 1HB LEU 47 9.021 -6.653 -15.525 360 HB3 LEU 47 2HB LEU 47 8.571 -5.350 -16.566 361 HG LEU 47 HG LEU 47 6.209 -5.504 -15.820 362 HD11 LEU 47 1HD1 LEU 47 6.117 -7.808 -15.014 363 HD12 LEU 47 2HD1 LEU 47 5.763 -6.685 -13.707 364 HD13 LEU 47 3HD1 LEU 47 7.377 -7.438 -13.822 365 HD21 LEU 47 1HD2 LEU 47 7.794 -3.897 -14.897 366 HD22 LEU 47 2HD2 LEU 47 8.343 -5.120 -13.702 367 HD23 LEU 47 3HD2 LEU 47 6.692 -4.460 -13.656 368 H CYS 48 H CYS 48 5.741 -8.377 -18.020 369 HA CYS 48 HA CYS 48 5.105 -6.057 -19.825 370 HB2 CYS 48 1HB CYS 48 4.275 -8.931 -20.368 371 HB3 CYS 48 2HB CYS 48 4.254 -7.535 -21.477 372 HG CYS 48 HG CYS 48 6.790 -9.230 -20.221 373 H SER 49 H SER 49 2.853 -5.648 -20.203 374 HA SER 49 HA SER 49 1.005 -6.845 -18.182 375 HB2 SER 49 1HB SER 49 -0.244 -4.727 -18.171 376 HB3 SER 49 2HB SER 49 1.457 -4.499 -17.600 377 HG SER 49 HG SER 49 0.861 -2.863 -18.995 378 H LEU 50 H LEU 50 -0.811 -7.694 -18.864 379 HA LEU 50 HA LEU 50 -1.752 -7.352 -21.640 380 HB2 LEU 50 1HB LEU 50 -0.017 -9.094 -21.677 381 HB3 LEU 50 2HB LEU 50 -0.843 -9.891 -20.340 382 HG LEU 50 HG LEU 50 -2.780 -10.392 -21.735 383 HD11 LEU 50 1HD1 LEU 50 -2.389 -8.589 -23.486 384 HD12 LEU 50 2HD1 LEU 50 -2.735 -10.195 -24.118 385 HD13 LEU 50 3HD1 LEU 50 -1.071 -9.582 -24.127 386 HD21 LEU 50 1HD2 LEU 50 -1.699 -12.218 -22.942 387 HD22 LEU 50 2HD2 LEU 50 -0.997 -12.025 -21.340 388 HD23 LEU 50 3HD2 LEU 50 -0.103 -11.442 -22.755 389 H HIS 51 H HIS 51 -3.996 -7.671 -21.696 390 HA HIS 51 HA HIS 51 -6.166 -8.088 -20.969 391 HB2 HIS 51 1HB HIS 51 -5.061 -10.420 -21.082 392 HB3 HIS 51 2HB HIS 51 -4.970 -10.386 -19.332 393 HD1 HIS 51 HD1 HIS 51 -7.705 -9.988 -22.030 394 HD2 HIS 51 HD2 HIS 51 -7.118 -11.402 -18.146 395 HE1 HIS 51 HE1 HIS 51 -9.845 -11.041 -21.335 396 H GLY 52 H GLY 52 -4.520 -6.193 -19.386 397 HA2 GLY 52 1HA GLY 52 -5.062 -4.947 -17.471 398 HA3 GLY 52 2HA GLY 52 -6.351 -6.091 -17.109 399 H ARG 53 H ARG 53 -3.586 -7.942 -17.527 400 HA ARG 53 HA ARG 53 -3.025 -7.908 -14.565 401 HB2 ARG 53 1HB ARG 53 -2.565 -10.207 -16.621 402 HB3 ARG 53 2HB ARG 53 -2.273 -10.275 -14.879 403 HG2 ARG 53 1HG ARG 53 -4.761 -9.797 -14.582 404 HG3 ARG 53 2HG ARG 53 -4.912 -9.997 -16.349 405 HD2 ARG 53 1HD ARG 53 -3.897 -12.326 -16.083 406 HD3 ARG 53 2HD ARG 53 -3.946 -12.028 -14.305 407 HE ARG 53 HE ARG 53 -6.148 -12.649 -16.126 408 HH11 ARG 53 1HH1 ARG 53 -5.397 -11.355 -12.941 409 HH12 ARG 53 2HH1 ARG 53 -6.948 -11.731 -12.252 410 HH21 ARG 53 1HH2 ARG 53 -8.134 -13.055 -15.267 411 HH22 ARG 53 2HH2 ARG 53 -8.487 -12.654 -13.600 412 H GLN 54 H GLN 54 -0.632 -8.557 -14.141 413 HA GLN 54 HA GLN 54 1.207 -7.652 -16.311 414 HB2 GLN 54 1HB GLN 54 0.630 -5.661 -14.909 415 HB3 GLN 54 2HB GLN 54 1.087 -6.590 -13.406 416 HG2 GLN 54 1HG GLN 54 3.364 -6.772 -14.212 417 HG3 GLN 54 2HG GLN 54 2.985 -5.786 -15.643 418 HE21 GLN 54 1HE2 GLN 54 3.747 -4.060 -12.057 419 HE22 GLN 54 2HE2 GLN 54 3.911 -5.782 -12.347 420 H GLY 55 H GLY 55 3.129 -8.729 -16.069 421 HA2 GLY 55 1HA GLY 55 4.026 -10.123 -13.779 422 HA3 GLY 55 2HA GLY 55 3.110 -11.282 -14.784 423 H ILE 56 H ILE 56 5.579 -12.157 -14.692 424 HA ILE 56 HA ILE 56 7.279 -10.630 -16.560 425 HB ILE 56 HB ILE 56 9.122 -12.054 -15.834 426 HG12 ILE 56 1HG1 ILE 56 7.200 -13.493 -14.016 427 HG13 ILE 56 2HG1 ILE 56 7.791 -14.151 -15.517 428 HG21 ILE 56 1HG2 ILE 56 8.331 -10.016 -14.441 429 HG22 ILE 56 2HG2 ILE 56 7.613 -11.186 -13.351 430 HG23 ILE 56 3HG2 ILE 56 9.377 -11.161 -13.600 431 HD11 ILE 56 1HD1 ILE 56 9.014 -15.095 -13.696 432 HD12 ILE 56 2HD1 ILE 56 10.074 -13.980 -14.503 433 HD13 ILE 56 3HD1 ILE 56 9.328 -13.500 -12.971 434 H VAL 57 H VAL 57 8.184 -11.427 -18.433 435 HA VAL 57 HA VAL 57 6.979 -13.887 -19.582 436 HB VAL 57 HB VAL 57 7.050 -11.042 -20.746 437 HG11 VAL 57 1HG1 VAL 57 5.893 -12.048 -22.685 438 HG12 VAL 57 2HG1 VAL 57 7.579 -12.564 -22.459 439 HG13 VAL 57 3HG1 VAL 57 6.236 -13.645 -22.033 440 HG21 VAL 57 1HG2 VAL 57 4.742 -12.872 -19.973 441 HG22 VAL 57 2HG2 VAL 57 5.152 -11.283 -19.250 442 HG23 VAL 57 3HG2 VAL 57 4.572 -11.355 -20.938 443 HA PRO 58 HA PRO 58 11.261 -13.921 -20.957 444 HB2 PRO 58 1HB PRO 58 11.189 -16.066 -22.694 445 HB3 PRO 58 2HB PRO 58 11.120 -16.304 -20.957 446 HG2 PRO 58 1HG PRO 58 8.861 -16.111 -22.907 447 HG3 PRO 58 2HG PRO 58 9.183 -17.367 -21.690 448 HD2 PRO 58 1HD PRO 58 7.421 -15.354 -21.269 449 HD3 PRO 58 2HD PRO 58 8.424 -16.021 -19.975 450 H GLY 59 H GLY 59 11.802 -12.253 -22.101 451 HA2 GLY 59 1HA GLY 59 10.367 -11.108 -24.275 452 HA3 GLY 59 2HA GLY 59 11.987 -10.731 -23.817 453 H ASN 60 H ASN 60 12.794 -13.636 -24.334 454 HA ASN 60 HA ASN 60 13.533 -13.238 -27.144 455 HB2 ASN 60 1HB ASN 60 13.988 -15.265 -25.017 456 HB3 ASN 60 2HB ASN 60 13.914 -15.905 -26.662 457 HD21 ASN 60 1HD2 ASN 60 17.177 -13.992 -25.258 458 HD22 ASN 60 2HD2 ASN 60 15.838 -14.531 -24.280 459 H ARG 61 H ARG 61 10.650 -14.451 -25.554 460 HA ARG 61 HA ARG 61 9.826 -15.966 -27.989 461 HB2 ARG 61 1HB ARG 61 8.434 -15.579 -25.337 462 HB3 ARG 61 2HB ARG 61 7.774 -16.446 -26.665 463 HG2 ARG 61 1HG ARG 61 9.904 -17.944 -26.478 464 HG3 ARG 61 2HG ARG 61 10.165 -17.137 -24.927 465 HD2 ARG 61 1HD ARG 61 7.711 -17.827 -24.407 466 HD3 ARG 61 2HD ARG 61 7.851 -18.900 -25.816 467 HE ARG 61 HE ARG 61 9.999 -19.495 -24.182 468 HH11 ARG 61 1HH1 ARG 61 6.463 -19.602 -23.698 469 HH12 ARG 61 2HH1 ARG 61 6.644 -20.870 -22.536 470 HH21 ARG 61 1HH2 ARG 61 10.025 -21.233 -22.751 471 HH22 ARG 61 2HH2 ARG 61 8.535 -21.813 -22.068 472 H LEU 62 H LEU 62 10.048 -12.784 -27.200 473 HA LEU 62 HA LEU 62 7.430 -12.059 -28.435 474 HB2 LEU 62 1HB LEU 62 9.268 -10.352 -26.729 475 HB3 LEU 62 2HB LEU 62 7.645 -9.947 -27.343 476 HG LEU 62 HG LEU 62 8.176 -11.992 -25.207 477 HD11 LEU 62 1HD1 LEU 62 8.670 -9.643 -24.535 478 HD12 LEU 62 2HD1 LEU 62 7.281 -10.258 -23.716 479 HD13 LEU 62 3HD1 LEU 62 7.058 -9.197 -25.087 480 HD21 LEU 62 1HD2 LEU 62 6.071 -12.528 -26.364 481 HD22 LEU 62 2HD2 LEU 62 5.641 -10.777 -26.301 482 HD23 LEU 62 3HD2 LEU 62 5.686 -11.769 -24.858 483 H LYS 63 H LYS 63 7.403 -10.238 -29.874 484 HA LYS 63 HA LYS 63 10.081 -9.414 -30.964 485 HB2 LYS 63 1HB LYS 63 8.818 -10.881 -32.555 486 HB3 LYS 63 2HB LYS 63 7.422 -9.763 -32.447 487 HG2 LYS 63 1HG LYS 63 9.020 -7.950 -33.362 488 HG3 LYS 63 2HG LYS 63 10.185 -9.198 -33.640 489 HD2 LYS 63 1HD LYS 63 8.532 -10.327 -35.118 490 HD3 LYS 63 2HD LYS 63 7.342 -9.084 -34.694 491 HE2 LYS 63 1HE LYS 63 8.202 -8.403 -36.818 492 HE3 LYS 63 2HE LYS 63 8.977 -7.347 -35.673 493 HZ1 LYS 63 1HZ LYS 63 10.200 -9.565 -37.178 494 HZ2 LYS 63 2HZ LYS 63 10.899 -9.046 -35.767 495 HZ3 LYS 63 3HZ LYS 63 10.689 -7.980 -36.985 496 H ILE 64 H ILE 64 10.341 -7.204 -30.796 497 HA ILE 64 HA ILE 64 8.314 -5.600 -29.534 498 HB ILE 64 HB ILE 64 10.760 -4.711 -31.147 499 HG12 ILE 64 1HG1 ILE 64 11.334 -6.186 -29.168 500 HG13 ILE 64 2HG1 ILE 64 12.015 -4.585 -29.187 501 HG21 ILE 64 1HG2 ILE 64 8.957 -3.217 -29.264 502 HG22 ILE 64 2HG2 ILE 64 10.528 -2.588 -29.749 503 HG23 ILE 64 3HG2 ILE 64 9.255 -2.847 -30.918 504 HD11 ILE 64 1HD1 ILE 64 11.176 -5.419 -26.943 505 HD12 ILE 64 2HD1 ILE 64 10.613 -3.837 -27.395 506 HD13 ILE 64 3HD1 ILE 64 9.551 -5.289 -27.588 507 H LEU 65 H LEU 65 6.598 -4.582 -30.507 508 HA LEU 65 HA LEU 65 6.640 -3.812 -33.333 509 HB2 LEU 65 1HB LEU 65 6.063 -6.283 -33.392 510 HB3 LEU 65 2HB LEU 65 4.682 -5.929 -32.424 511 HG LEU 65 HG LEU 65 3.674 -4.588 -34.206 512 HD11 LEU 65 1HD1 LEU 65 5.482 -3.625 -35.373 513 HD12 LEU 65 2HD1 LEU 65 4.701 -4.758 -36.516 514 HD13 LEU 65 3HD1 LEU 65 6.203 -5.231 -35.758 515 HD21 LEU 65 1HD2 LEU 65 3.189 -6.973 -34.176 516 HD22 LEU 65 2HD2 LEU 65 4.649 -7.331 -35.110 517 HD23 LEU 65 3HD2 LEU 65 3.311 -6.429 -35.838 518 H VAL 66 H VAL 66 5.917 -1.753 -33.029 519 HA VAL 66 HA VAL 66 4.117 -1.009 -30.933 520 HB VAL 66 HB VAL 66 4.057 1.233 -32.121 521 HG11 VAL 66 1HG1 VAL 66 5.888 0.645 -30.575 522 HG12 VAL 66 2HG1 VAL 66 6.857 0.054 -31.895 523 HG13 VAL 66 3HG1 VAL 66 6.404 1.779 -31.795 524 HG21 VAL 66 1HG2 VAL 66 4.163 0.344 -34.427 525 HG22 VAL 66 2HG2 VAL 66 5.391 1.640 -34.108 526 HG23 VAL 66 3HG2 VAL 66 5.883 -0.103 -34.174 527 H GLY 67 H GLY 67 2.067 0.163 -31.340 528 HA2 GLY 67 1HA GLY 67 0.477 0.375 -33.485 529 HA3 GLY 67 2HA GLY 67 0.330 -1.384 -33.157 530 H MET 68 H MET 68 -0.192 1.828 -31.768 531 HA MET 68 HA MET 68 -2.284 0.590 -30.055 532 HB2 MET 68 1HB MET 68 -1.733 2.165 -28.323 533 HB3 MET 68 2HB MET 68 -0.368 1.100 -28.634 534 HG2 MET 68 1HG MET 68 -0.441 3.884 -29.882 535 HG3 MET 68 2HG MET 68 0.246 3.563 -28.293 536 HE1 MET 68 1HE MET 68 2.835 4.179 -28.643 537 HE2 MET 68 2HE MET 68 3.633 3.950 -30.183 538 HE3 MET 68 3HE MET 68 2.233 4.976 -30.077 539 H TYR 69 H TYR 69 -4.067 1.926 -29.583 540 HA TYR 69 HA TYR 69 -4.594 4.081 -31.593 541 HB2 TYR 69 1HB TYR 69 -5.783 2.080 -32.228 542 HB3 TYR 69 2HB TYR 69 -6.261 1.797 -30.562 543 HD1 TYR 69 HD1 TYR 69 -6.796 3.880 -33.577 544 HD2 TYR 69 HD2 TYR 69 -8.286 2.812 -29.719 545 HE1 TYR 69 HE1 TYR 69 -8.965 5.025 -34.114 546 HE2 TYR 69 HE2 TYR 69 -10.406 3.941 -30.229 547 HH TYR 69 HH TYR 69 -10.982 5.545 -33.387 548 H ASP 70 H ASP 70 -5.328 2.879 -28.334 549 HA ASP 70 HA ASP 70 -6.882 5.172 -27.656 550 HB2 ASP 70 1HB ASP 70 -6.498 2.603 -26.638 551 HB3 ASP 70 2HB ASP 70 -5.663 3.578 -25.442 552 H LYS 71 H LYS 71 -6.300 6.266 -25.384 553 HA LYS 71 HA LYS 71 -3.622 7.467 -25.899 554 HB2 LYS 71 1HB LYS 71 -6.306 8.618 -25.424 555 HB3 LYS 71 2HB LYS 71 -4.925 9.485 -24.683 556 HG2 LYS 71 1HG LYS 71 -5.313 10.519 -26.777 557 HG3 LYS 71 2HG LYS 71 -3.841 9.580 -26.942 558 HD2 LYS 71 1HD LYS 71 -5.014 7.844 -28.177 559 HD3 LYS 71 2HD LYS 71 -6.577 8.682 -27.953 560 HE2 LYS 71 1HE LYS 71 -5.883 10.436 -29.391 561 HE3 LYS 71 2HE LYS 71 -4.214 9.808 -29.494 562 HZ1 LYS 71 1HZ LYS 71 -5.671 9.141 -31.399 563 HZ2 LYS 71 2HZ LYS 71 -6.562 8.293 -30.315 564 HZ3 LYS 71 3HZ LYS 71 -5.023 7.859 -30.573 565 H LYS 72 H LYS 72 -2.595 8.428 -24.162 566 HA LYS 72 HA LYS 72 -2.740 6.895 -21.656 567 HB2 LYS 72 1HB LYS 72 -0.714 8.246 -21.049 568 HB3 LYS 72 2HB LYS 72 -0.626 7.183 -22.497 569 HG2 LYS 72 1HG LYS 72 -0.899 9.139 -23.964 570 HG3 LYS 72 2HG LYS 72 -0.941 10.194 -22.571 571 HD2 LYS 72 1HD LYS 72 1.329 9.575 -21.963 572 HD3 LYS 72 2HD LYS 72 1.395 8.427 -23.315 573 HE2 LYS 72 1HE LYS 72 0.854 10.378 -24.842 574 HE3 LYS 72 2HE LYS 72 1.036 11.446 -23.463 575 HZ1 LYS 72 1HZ LYS 72 3.370 10.618 -23.276 576 HZ2 LYS 72 2HZ LYS 72 3.038 11.457 -24.654 577 HZ3 LYS 72 3HZ LYS 72 3.140 9.827 -24.708 578 HA PRO 73 HA PRO 73 -5.079 10.197 -19.695 579 HB2 PRO 73 1HB PRO 73 -4.467 9.853 -17.078 580 HB3 PRO 73 2HB PRO 73 -5.512 8.681 -17.968 581 HG2 PRO 73 1HG PRO 73 -2.592 8.565 -17.276 582 HG3 PRO 73 2HG PRO 73 -3.863 7.298 -17.139 583 HD2 PRO 73 1HD PRO 73 -2.107 7.353 -19.170 584 HD3 PRO 73 2HD PRO 73 -3.782 6.775 -19.329 585 H ALA 74 H ALA 74 -4.797 12.220 -18.588 586 HA ALA 74 HA ALA 74 -2.046 13.086 -17.978 587 HB1 ALA 74 1HB ALA 74 -3.710 14.373 -20.225 588 HB2 ALA 74 2HB ALA 74 -2.268 15.059 -19.547 589 HB3 ALA 74 3HB ALA 74 -2.182 13.524 -20.457 590 H GLY 75 H GLY 75 -2.253 15.045 -16.656 591 HA2 GLY 75 1HA GLY 75 -3.457 16.727 -15.514 592 HA3 GLY 75 2HA GLY 75 -4.949 16.048 -16.117 593 H GLU 76 H GLU 76 -2.993 13.594 -14.824 594 HA GLU 76 HA GLU 76 -4.562 13.715 -12.279 595 HB2 GLU 76 1HB GLU 76 -3.243 11.350 -13.653 596 HB3 GLU 76 2HB GLU 76 -4.194 11.269 -12.158 597 HG2 GLU 76 1HG GLU 76 -6.185 12.066 -13.445 598 HG3 GLU 76 2HG GLU 76 -5.197 12.033 -14.916 599 H PHE 77 H PHE 77 -3.567 13.492 -10.341 600 HA PHE 77 HA PHE 77 -0.779 12.699 -10.080 601 HB2 PHE 77 1HB PHE 77 -0.816 15.220 -10.592 602 HB3 PHE 77 2HB PHE 77 -1.602 15.428 -8.968 603 HD1 PHE 77 HD1 PHE 77 1.531 15.437 -10.628 604 HD2 PHE 77 HD2 PHE 77 -0.277 14.224 -6.951 605 HE1 PHE 77 HE1 PHE 77 3.779 15.456 -9.532 606 HE2 PHE 77 HE2 PHE 77 1.898 14.177 -5.851 607 HZ PHE 77 HZ PHE 77 3.932 14.823 -7.122 608 H ILE 78 H ILE 78 -0.804 11.407 -8.226 609 HA ILE 78 HA ILE 78 -2.726 12.043 -6.117 610 HB ILE 78 HB ILE 78 -3.912 10.583 -7.824 611 HG12 ILE 78 1HG1 ILE 78 -3.573 9.119 -5.239 612 HG13 ILE 78 2HG1 ILE 78 -4.339 10.690 -5.301 613 HG21 ILE 78 1HG2 ILE 78 -2.066 8.388 -6.885 614 HG22 ILE 78 2HG2 ILE 78 -3.317 8.243 -8.087 615 HG23 ILE 78 3HG2 ILE 78 -1.883 9.177 -8.439 616 HD11 ILE 78 1HD1 ILE 78 -6.025 8.897 -5.369 617 HD12 ILE 78 2HD1 ILE 78 -6.012 9.782 -6.919 618 HD13 ILE 78 3HD1 ILE 78 -5.233 8.171 -6.779 619 H VAL 79 H VAL 79 -2.187 11.142 -4.092 620 HA VAL 79 HA VAL 79 0.656 10.579 -3.821 621 HB VAL 79 HB VAL 79 -0.655 11.919 -2.148 622 HG11 VAL 79 1HG1 VAL 79 -2.715 10.609 -2.027 623 HG12 VAL 79 2HG1 VAL 79 -1.824 9.270 -1.242 624 HG13 VAL 79 3HG1 VAL 79 -2.009 10.870 -0.439 625 HG21 VAL 79 1HG2 VAL 79 0.686 9.485 -0.878 626 HG22 VAL 79 2HG2 VAL 79 1.516 10.899 -1.554 627 HG23 VAL 79 3HG2 VAL 79 0.515 11.111 -0.161 628 H THR 80 H THR 80 1.640 8.593 -3.211 629 HA THR 80 HA THR 80 -0.146 6.200 -3.186 630 HB THR 80 HB THR 80 1.966 5.142 -4.389 631 HG1 THR 80 HG1 THR 80 3.119 6.600 -5.546 632 HG21 THR 80 1HG2 THR 80 1.110 5.545 -6.586 633 HG22 THR 80 2HG2 THR 80 0.275 7.072 -6.030 634 HG23 THR 80 3HG2 THR 80 -0.298 5.477 -5.469 635 H ASP 81 H ASP 81 0.408 4.740 -1.646 636 HA ASP 81 HA ASP 81 2.760 5.033 0.039 637 HB2 ASP 81 1HB ASP 81 0.784 6.435 1.009 638 HB3 ASP 81 2HB ASP 81 -0.006 4.882 1.274 639 HXT ASP 81 H02 ASP 81 2.700 1.740 0.298 Start of MODEL 36 1 H2 GLY 1 2H0 GLY 1 -0.975 7.772 -17.834 2 H GLY 1 1H0 GLY 1 -1.351 7.008 -16.447 3 HA2 GLY 1 1HA GLY 1 -0.388 9.861 -16.679 4 HA3 GLY 1 2HA GLY 1 -0.853 9.136 -15.084 5 H SER 2 H SER 2 1.001 7.500 -17.674 6 HA SER 2 HA SER 2 3.157 6.594 -16.095 7 HB2 SER 2 1HB SER 2 2.982 7.136 -19.119 8 HB3 SER 2 2HB SER 2 4.140 6.021 -18.308 9 HG SER 2 HG SER 2 2.224 4.868 -17.536 10 H MET 3 H MET 3 5.212 7.307 -15.732 11 HA MET 3 HA MET 3 5.878 10.031 -16.805 12 HB2 MET 3 1HB MET 3 6.464 8.784 -14.044 13 HB3 MET 3 2HB MET 3 7.091 10.364 -14.610 14 HG2 MET 3 1HG MET 3 4.837 11.179 -14.849 15 HG3 MET 3 2HG MET 3 4.244 9.657 -14.203 16 HE1 MET 3 1HE MET 3 3.299 12.113 -13.107 17 HE2 MET 3 2HE MET 3 3.033 10.712 -12.008 18 HE3 MET 3 3HE MET 3 3.662 12.245 -11.366 19 H LYS 4 H LYS 4 7.030 9.219 -18.523 20 HA LYS 4 HA LYS 4 8.819 8.537 -19.652 21 HB2 LYS 4 1HB LYS 4 10.335 8.852 -17.059 22 HB3 LYS 4 2HB LYS 4 10.980 8.811 -18.710 23 HG2 LYS 4 1HG LYS 4 9.816 10.931 -19.234 24 HG3 LYS 4 2HG LYS 4 9.219 10.994 -17.517 25 HD2 LYS 4 1HD LYS 4 11.571 10.756 -16.745 26 HD3 LYS 4 2HD LYS 4 12.185 10.869 -18.413 27 HE2 LYS 4 1HE LYS 4 12.438 13.040 -17.604 28 HE3 LYS 4 2HE LYS 4 10.880 13.216 -18.454 29 HZ1 LYS 4 1HZ LYS 4 9.708 12.929 -16.402 30 HZ2 LYS 4 2HZ LYS 4 10.857 14.160 -16.147 31 HZ3 LYS 4 3HZ LYS 4 11.101 12.628 -15.519 32 H TYR 5 H TYR 5 7.211 6.500 -18.682 33 HA TYR 5 HA TYR 5 9.053 4.256 -18.038 34 HB2 TYR 5 1HB TYR 5 6.180 4.771 -18.018 35 HB3 TYR 5 2HB TYR 5 6.485 3.286 -18.941 36 HD1 TYR 5 HD1 TYR 5 6.431 1.315 -17.594 37 HD2 TYR 5 HD2 TYR 5 7.807 4.998 -15.745 38 HE1 TYR 5 HE1 TYR 5 6.842 0.085 -15.489 39 HE2 TYR 5 HE2 TYR 5 8.074 3.751 -13.611 40 HH TYR 5 HH TYR 5 7.544 0.296 -13.202 41 H LEU 6 H LEU 6 8.979 2.306 -19.496 42 HA LEU 6 HA LEU 6 10.098 2.997 -21.977 43 HB2 LEU 6 1HB LEU 6 8.874 0.496 -20.831 44 HB3 LEU 6 2HB LEU 6 9.294 0.538 -22.497 45 HG LEU 6 HG LEU 6 10.921 -0.638 -21.225 46 HD11 LEU 6 1HD1 LEU 6 11.410 0.583 -23.327 47 HD12 LEU 6 2HD1 LEU 6 12.854 0.437 -22.293 48 HD13 LEU 6 3HD1 LEU 6 11.974 1.968 -22.410 49 HD21 LEU 6 1HD2 LEU 6 12.537 0.491 -19.683 50 HD22 LEU 6 2HD2 LEU 6 10.891 0.708 -19.065 51 HD23 LEU 6 3HD2 LEU 6 11.684 2.038 -19.898 52 H ASN 7 H ASN 7 6.802 1.824 -21.441 53 HA ASN 7 HA ASN 7 5.008 1.609 -22.867 54 HB2 ASN 7 1HB ASN 7 5.149 4.065 -22.259 55 HB3 ASN 7 2HB ASN 7 5.859 4.329 -23.855 56 HD21 ASN 7 1HD2 ASN 7 2.634 4.953 -24.991 57 HD22 ASN 7 2HD2 ASN 7 4.234 5.547 -24.653 58 H VAL 8 H VAL 8 7.042 0.108 -23.821 59 HA VAL 8 HA VAL 8 6.463 0.378 -26.794 60 HB VAL 8 HB VAL 8 8.282 -1.303 -27.068 61 HG11 VAL 8 1HG1 VAL 8 10.115 0.426 -26.942 62 HG12 VAL 8 2HG1 VAL 8 8.667 0.997 -27.725 63 HG13 VAL 8 3HG1 VAL 8 9.010 1.508 -26.068 64 HG21 VAL 8 1HG2 VAL 8 8.548 -2.067 -24.726 65 HG22 VAL 8 2HG2 VAL 8 10.082 -1.442 -25.353 66 HG23 VAL 8 3HG2 VAL 8 9.099 -0.448 -24.282 67 H LEU 9 H LEU 9 6.118 -1.744 -27.750 68 HA LEU 9 HA LEU 9 4.844 -3.653 -25.900 69 HB2 LEU 9 1HB LEU 9 2.837 -3.768 -27.396 70 HB3 LEU 9 2HB LEU 9 2.967 -2.354 -26.362 71 HG LEU 9 HG LEU 9 3.890 -2.029 -29.201 72 HD11 LEU 9 1HD1 LEU 9 1.801 -3.331 -29.357 73 HD12 LEU 9 2HD1 LEU 9 1.616 -1.701 -30.013 74 HD13 LEU 9 3HD1 LEU 9 0.946 -2.059 -28.425 75 HD21 LEU 9 1HD2 LEU 9 4.120 -0.123 -27.799 76 HD22 LEU 9 2HD2 LEU 9 2.471 -0.319 -27.141 77 HD23 LEU 9 3HD2 LEU 9 2.706 0.210 -28.823 78 H ALA 10 H ALA 10 4.361 -5.724 -26.939 79 HA ALA 10 HA ALA 10 5.927 -6.268 -29.441 80 HB1 ALA 10 1HB ALA 10 7.240 -6.645 -27.107 81 HB2 ALA 10 2HB ALA 10 6.149 -8.039 -26.961 82 HB3 ALA 10 3HB ALA 10 7.287 -7.936 -28.318 83 H LYS 11 H LYS 11 5.517 -8.374 -30.325 84 HA LYS 11 HA LYS 11 2.794 -9.383 -29.709 85 HB2 LYS 11 1HB LYS 11 3.457 -8.791 -32.119 86 HB3 LYS 11 2HB LYS 11 4.670 -10.053 -32.054 87 HG2 LYS 11 1HG LYS 11 2.412 -11.428 -31.262 88 HG3 LYS 11 2HG LYS 11 1.660 -10.197 -32.276 89 HD2 LYS 11 1HD LYS 11 3.984 -12.001 -33.102 90 HD3 LYS 11 2HD LYS 11 2.268 -12.444 -33.402 91 HE2 LYS 11 1HE LYS 11 2.021 -10.282 -34.645 92 HE3 LYS 11 2HE LYS 11 3.775 -10.135 -34.590 93 HZ1 LYS 11 1HZ LYS 11 3.941 -12.010 -35.999 94 HZ2 LYS 11 2HZ LYS 11 2.628 -11.317 -36.608 95 HZ3 LYS 11 3HZ LYS 11 2.509 -12.611 -35.584 96 H ALA 12 H ALA 12 2.591 -11.402 -28.726 97 HA ALA 12 HA ALA 12 5.062 -12.873 -28.024 98 HB1 ALA 12 1HB ALA 12 3.357 -14.570 -27.260 99 HB2 ALA 12 2HB ALA 12 3.268 -12.990 -26.482 100 HB3 ALA 12 3HB ALA 12 2.070 -13.425 -27.735 101 H LEU 13 H LEU 13 6.012 -14.440 -29.188 102 HA LEU 13 HA LEU 13 4.833 -15.069 -31.830 103 HB2 LEU 13 1HB LEU 13 7.588 -15.661 -30.652 104 HB3 LEU 13 2HB LEU 13 7.119 -15.978 -32.295 105 HG LEU 13 HG LEU 13 7.364 -13.186 -31.097 106 HD11 LEU 13 1HD1 LEU 13 9.449 -13.166 -32.557 107 HD12 LEU 13 2HD1 LEU 13 9.189 -14.849 -32.958 108 HD13 LEU 13 3HD1 LEU 13 9.570 -14.369 -31.290 109 HD21 LEU 13 1HD2 LEU 13 6.978 -14.004 -34.018 110 HD22 LEU 13 2HD2 LEU 13 7.241 -12.392 -33.458 111 HD23 LEU 13 3HD2 LEU 13 5.761 -13.178 -33.030 112 H TYR 14 H TYR 14 5.199 -16.364 -28.693 113 HA TYR 14 HA TYR 14 4.398 -19.088 -29.653 114 HB2 TYR 14 1HB TYR 14 6.470 -18.407 -27.432 115 HB3 TYR 14 2HB TYR 14 5.897 -20.011 -27.947 116 HD1 TYR 14 HD1 TYR 14 8.075 -17.147 -28.732 117 HD2 TYR 14 HD2 TYR 14 6.552 -20.909 -30.209 118 HE1 TYR 14 HE1 TYR 14 9.779 -17.100 -30.567 119 HE2 TYR 14 HE2 TYR 14 8.329 -20.900 -31.953 120 HH TYR 14 HH TYR 14 10.682 -18.198 -32.341 121 H ASP 15 H ASP 15 3.340 -20.319 -27.689 122 HA ASP 15 HA ASP 15 1.727 -18.266 -26.254 123 HB2 ASP 15 1HB ASP 15 0.144 -20.090 -25.816 124 HB3 ASP 15 2HB ASP 15 0.439 -19.911 -27.577 125 H ASN 16 H ASN 16 1.089 -18.815 -23.923 126 HA ASN 16 HA ASN 16 3.017 -20.663 -22.602 127 HB2 ASN 16 1HB ASN 16 4.123 -18.384 -22.769 128 HB3 ASN 16 2HB ASN 16 2.798 -17.757 -21.776 129 HD21 ASN 16 1HD2 ASN 16 4.321 -18.894 -18.811 130 HD22 ASN 16 2HD2 ASN 16 3.042 -18.014 -19.609 131 H VAL 17 H VAL 17 2.218 -21.683 -20.925 132 HA VAL 17 HA VAL 17 -0.412 -20.676 -19.740 133 HB VAL 17 HB VAL 17 1.047 -23.399 -19.332 134 HG11 VAL 17 1HG1 VAL 17 -0.511 -22.466 -17.436 135 HG12 VAL 17 2HG1 VAL 17 -1.854 -22.751 -18.582 136 HG13 VAL 17 3HG1 VAL 17 -0.808 -24.112 -18.024 137 HG21 VAL 17 1HG2 VAL 17 -0.662 -24.439 -20.747 138 HG22 VAL 17 2HG2 VAL 17 -1.570 -22.893 -20.873 139 HG23 VAL 17 3HG2 VAL 17 -0.023 -23.038 -21.669 140 H ALA 18 H ALA 18 -0.288 -19.473 -17.939 141 HA ALA 18 HA ALA 18 2.318 -19.312 -16.565 142 HB1 ALA 18 1HB ALA 18 1.193 -17.195 -16.876 143 HB2 ALA 18 2HB ALA 18 -0.332 -17.823 -16.184 144 HB3 ALA 18 3HB ALA 18 1.085 -17.574 -15.155 145 H GLU 19 H GLU 19 2.866 -20.695 -15.075 146 HA GLU 19 HA GLU 19 0.813 -22.026 -13.345 147 HB2 GLU 19 1HB GLU 19 3.796 -22.670 -13.773 148 HB3 GLU 19 2HB GLU 19 2.658 -23.592 -12.773 149 HG2 GLU 19 1HG GLU 19 1.364 -24.002 -14.925 150 HG3 GLU 19 2HG GLU 19 2.719 -23.262 -15.761 151 H SER 20 H SER 20 3.357 -19.697 -13.389 152 HA SER 20 HA SER 20 3.584 -19.719 -10.450 153 HB2 SER 20 1HB SER 20 5.708 -19.436 -11.198 154 HB3 SER 20 2HB SER 20 5.228 -18.628 -12.705 155 HG SER 20 HG SER 20 6.275 -17.223 -11.216 156 HA PRO 21 HA PRO 21 0.855 -16.427 -10.336 157 HB2 PRO 21 1HB PRO 21 1.359 -15.135 -8.028 158 HB3 PRO 21 2HB PRO 21 0.685 -16.825 -8.076 159 HG2 PRO 21 1HG PRO 21 3.529 -15.899 -7.722 160 HG3 PRO 21 2HG PRO 21 2.552 -17.079 -6.751 161 HD2 PRO 21 1HD PRO 21 4.342 -17.781 -8.704 162 HD3 PRO 21 2HD PRO 21 2.864 -18.768 -8.376 163 H ASP 22 H ASP 22 4.293 -15.826 -10.192 164 HA ASP 22 HA ASP 22 4.129 -12.924 -10.628 165 HB2 ASP 22 1HB ASP 22 6.353 -14.987 -10.604 166 HB3 ASP 22 2HB ASP 22 6.643 -13.257 -10.922 167 H GLU 23 H GLU 23 4.131 -15.821 -12.447 168 HA GLU 23 HA GLU 23 5.218 -14.746 -14.932 169 HB2 GLU 23 1HB GLU 23 5.417 -17.089 -14.173 170 HB3 GLU 23 2HB GLU 23 3.694 -17.253 -14.338 171 HG2 GLU 23 1HG GLU 23 3.861 -16.908 -16.736 172 HG3 GLU 23 2HG GLU 23 5.623 -16.677 -16.554 173 H LEU 24 H LEU 24 4.058 -14.077 -16.792 174 HA LEU 24 HA LEU 24 1.163 -13.509 -16.451 175 HB2 LEU 24 1HB LEU 24 3.357 -12.174 -17.803 176 HB3 LEU 24 2HB LEU 24 2.208 -12.764 -19.029 177 HG LEU 24 HG LEU 24 1.417 -10.978 -16.728 178 HD11 LEU 24 1HD1 LEU 24 1.311 -9.213 -18.359 179 HD12 LEU 24 2HD1 LEU 24 1.677 -10.328 -19.730 180 HD13 LEU 24 3HD1 LEU 24 2.897 -9.961 -18.495 181 HD21 LEU 24 1HD2 LEU 24 -0.524 -12.253 -17.350 182 HD22 LEU 24 2HD2 LEU 24 -0.240 -11.952 -19.106 183 HD23 LEU 24 3HD2 LEU 24 -0.678 -10.605 -18.004 184 H SER 25 H SER 25 -0.414 -14.403 -17.486 185 HA SER 25 HA SER 25 0.081 -16.711 -19.236 186 HB2 SER 25 1HB SER 25 -2.492 -16.782 -19.295 187 HB3 SER 25 2HB SER 25 -1.778 -16.838 -17.684 188 HG SER 25 HG SER 25 -2.810 -14.500 -18.897 189 H PHE 26 H PHE 26 0.291 -16.607 -21.416 190 HA PHE 26 HA PHE 26 -1.317 -14.567 -22.859 191 HB2 PHE 26 1HB PHE 26 0.581 -13.624 -24.075 192 HB3 PHE 26 2HB PHE 26 0.654 -13.268 -22.354 193 HD1 PHE 26 HD1 PHE 26 2.209 -15.074 -25.205 194 HD2 PHE 26 HD2 PHE 26 2.458 -14.317 -20.972 195 HE1 PHE 26 HE1 PHE 26 4.464 -16.054 -25.201 196 HE2 PHE 26 HE2 PHE 26 4.719 -15.322 -20.933 197 HZ PHE 26 HZ PHE 26 5.718 -16.218 -23.090 198 H ARG 27 H ARG 27 -0.859 -14.777 -25.340 199 HA ARG 27 HA ARG 27 -0.250 -17.614 -25.955 200 HB2 ARG 27 1HB ARG 27 -2.660 -16.109 -27.036 201 HB3 ARG 27 2HB ARG 27 -2.272 -17.760 -27.406 202 HG2 ARG 27 1HG ARG 27 -2.668 -18.392 -24.967 203 HG3 ARG 27 2HG ARG 27 -3.169 -16.668 -24.749 204 HD2 ARG 27 1HD ARG 27 -4.880 -16.998 -26.499 205 HD3 ARG 27 2HD ARG 27 -4.329 -18.672 -26.650 206 HE ARG 27 HE ARG 27 -5.426 -19.292 -24.739 207 HH11 ARG 27 1HH1 ARG 27 -5.652 -15.799 -25.090 208 HH12 ARG 27 2HH1 ARG 27 -6.792 -15.636 -23.772 209 HH21 ARG 27 1HH2 ARG 27 -6.859 -18.980 -23.057 210 HH22 ARG 27 2HH2 ARG 27 -7.465 -17.404 -22.642 211 H LYS 28 H LYS 28 0.099 -17.912 -28.236 212 HA LYS 28 HA LYS 28 1.826 -15.907 -29.366 213 HB2 LYS 28 1HB LYS 28 1.698 -17.352 -31.413 214 HB3 LYS 28 2HB LYS 28 2.070 -18.249 -29.928 215 HG2 LYS 28 1HG LYS 28 -0.237 -19.106 -29.776 216 HG3 LYS 28 2HG LYS 28 -0.748 -18.155 -31.171 217 HD2 LYS 28 1HD LYS 28 0.723 -19.486 -32.585 218 HD3 LYS 28 2HD LYS 28 1.328 -20.321 -31.126 219 HE2 LYS 28 1HE LYS 28 -0.959 -21.164 -30.722 220 HE3 LYS 28 2HE LYS 28 -1.554 -20.344 -32.187 221 HZ1 LYS 28 1HZ LYS 28 -1.122 -22.554 -32.718 222 HZ2 LYS 28 2HZ LYS 28 0.331 -22.550 -32.055 223 HZ3 LYS 28 3HZ LYS 28 0.062 -21.707 -33.426 224 H GLY 29 H GLY 29 1.429 -14.303 -30.873 225 HA2 GLY 29 1HA GLY 29 0.061 -13.028 -32.360 226 HA3 GLY 29 2HA GLY 29 -1.291 -14.062 -32.036 227 H ASP 30 H ASP 30 -0.627 -13.486 -28.988 228 HA ASP 30 HA ASP 30 -2.333 -11.123 -28.856 229 HB2 ASP 30 1HB ASP 30 -1.744 -13.131 -27.131 230 HB3 ASP 30 2HB ASP 30 -0.825 -11.793 -26.441 231 H ILE 31 H ILE 31 -1.697 -9.134 -27.736 232 HA ILE 31 HA ILE 31 1.064 -8.301 -28.352 233 HB ILE 31 HB ILE 31 -1.496 -6.584 -28.366 234 HG12 ILE 31 1HG1 ILE 31 -1.538 -8.163 -30.212 235 HG13 ILE 31 2HG1 ILE 31 -1.312 -6.486 -30.763 236 HG21 ILE 31 1HG2 ILE 31 0.149 -5.072 -27.866 237 HG22 ILE 31 2HG2 ILE 31 1.398 -5.948 -28.789 238 HG23 ILE 31 3HG2 ILE 31 0.151 -5.011 -29.641 239 HD11 ILE 31 1HD1 ILE 31 0.127 -8.098 -32.009 240 HD12 ILE 31 2HD1 ILE 31 1.145 -6.950 -31.117 241 HD13 ILE 31 3HD1 ILE 31 0.905 -8.591 -30.505 242 H MET 32 H MET 32 2.190 -7.418 -26.550 243 HA MET 32 HA MET 32 0.446 -6.452 -24.315 244 HB2 MET 32 1HB MET 32 1.809 -7.594 -22.632 245 HB3 MET 32 2HB MET 32 0.924 -8.706 -23.666 246 HG2 MET 32 1HG MET 32 3.880 -8.085 -24.073 247 HG3 MET 32 2HG MET 32 3.294 -9.404 -23.076 248 HE1 MET 32 1HE MET 32 1.932 -11.559 -24.190 249 HE2 MET 32 2HE MET 32 0.806 -10.360 -24.864 250 HE3 MET 32 3HE MET 32 1.515 -11.606 -25.909 251 H THR 33 H THR 33 1.406 -5.037 -22.927 252 HA THR 33 HA THR 33 3.379 -3.376 -24.242 253 HB THR 33 HB THR 33 2.130 -2.918 -21.476 254 HG1 THR 33 HG1 THR 33 1.068 -1.846 -23.809 255 HG21 THR 33 1HG2 THR 33 2.490 -0.577 -21.998 256 HG22 THR 33 2HG2 THR 33 2.992 -0.980 -23.636 257 HG23 THR 33 3HG2 THR 33 4.019 -1.470 -22.245 258 H VAL 34 H VAL 34 5.486 -3.033 -23.536 259 HA VAL 34 HA VAL 34 6.342 -4.902 -21.347 260 HB VAL 34 HB VAL 34 7.962 -3.660 -23.608 261 HG11 VAL 34 1HG1 VAL 34 9.433 -3.753 -21.699 262 HG12 VAL 34 2HG1 VAL 34 8.825 -5.356 -21.214 263 HG13 VAL 34 3HG1 VAL 34 9.809 -5.167 -22.696 264 HG21 VAL 34 1HG2 VAL 34 6.464 -5.518 -24.252 265 HG22 VAL 34 2HG2 VAL 34 8.172 -5.848 -24.448 266 HG23 VAL 34 3HG2 VAL 34 7.294 -6.537 -23.056 267 H LEU 35 H LEU 35 6.790 -3.993 -19.504 268 HA LEU 35 HA LEU 35 6.876 -1.049 -19.384 269 HB2 LEU 35 1HB LEU 35 6.665 -3.176 -17.240 270 HB3 LEU 35 2HB LEU 35 6.661 -1.426 -16.965 271 HG LEU 35 HG LEU 35 4.611 -2.936 -18.662 272 HD11 LEU 35 1HD1 LEU 35 4.642 -3.665 -16.277 273 HD12 LEU 35 2HD1 LEU 35 3.136 -2.801 -16.674 274 HD13 LEU 35 3HD1 LEU 35 4.386 -1.983 -15.734 275 HD21 LEU 35 1HD2 LEU 35 4.160 -0.209 -17.335 276 HD22 LEU 35 2HD2 LEU 35 3.281 -0.969 -18.683 277 HD23 LEU 35 3HD2 LEU 35 4.891 -0.355 -18.966 278 H GLU 36 H GLU 36 8.899 -3.871 -18.624 279 HA GLU 36 HA GLU 36 11.268 -2.117 -18.360 280 HB2 GLU 36 1HB GLU 36 10.016 -2.199 -16.133 281 HB3 GLU 36 2HB GLU 36 10.455 -3.903 -16.032 282 HG2 GLU 36 1HG GLU 36 12.826 -3.337 -16.103 283 HG3 GLU 36 2HG GLU 36 12.390 -1.620 -16.216 284 H ARG 37 H ARG 37 13.262 -3.413 -18.521 285 HA ARG 37 HA ARG 37 12.689 -6.189 -19.537 286 HB2 ARG 37 1HB ARG 37 15.052 -4.457 -20.308 287 HB3 ARG 37 2HB ARG 37 14.583 -6.039 -20.997 288 HG2 ARG 37 1HG ARG 37 12.305 -4.828 -21.590 289 HG3 ARG 37 2HG ARG 37 13.235 -3.312 -21.373 290 HD2 ARG 37 1HD ARG 37 13.690 -5.516 -23.422 291 HD3 ARG 37 2HD ARG 37 13.254 -3.806 -23.662 292 HE ARG 37 HE ARG 37 15.760 -4.027 -22.274 293 HH11 ARG 37 1HH1 ARG 37 14.373 -4.274 -25.496 294 HH12 ARG 37 2HH1 ARG 37 15.908 -4.043 -26.285 295 HH21 ARG 37 1HH2 ARG 37 17.667 -3.718 -23.277 296 HH22 ARG 37 2HH2 ARG 37 17.785 -3.697 -25.011 297 H ASP 38 H ASP 38 14.163 -7.854 -18.814 298 HA ASP 38 HA ASP 38 15.443 -8.907 -17.325 299 HB2 ASP 38 1HB ASP 38 17.080 -6.333 -17.354 300 HB3 ASP 38 2HB ASP 38 17.629 -7.904 -16.810 301 H THR 39 H THR 39 13.207 -7.842 -16.306 302 HA THR 39 HA THR 39 13.636 -6.033 -14.159 303 HB THR 39 HB THR 39 11.454 -6.331 -15.404 304 HG1 THR 39 HG1 THR 39 11.449 -5.178 -13.461 305 HG21 THR 39 1HG2 THR 39 11.529 -8.947 -15.038 306 HG22 THR 39 2HG2 THR 39 9.979 -8.144 -14.951 307 HG23 THR 39 3HG2 THR 39 10.829 -8.576 -13.443 308 H GLN 40 H GLN 40 14.216 -9.381 -14.249 309 HA GLN 40 HA GLN 40 13.785 -9.626 -11.288 310 HB2 GLN 40 1HB GLN 40 12.447 -11.101 -12.989 311 HB3 GLN 40 2HB GLN 40 13.986 -11.935 -13.234 312 HG2 GLN 40 1HG GLN 40 12.951 -13.262 -11.613 313 HG3 GLN 40 2HG GLN 40 14.042 -12.255 -10.645 314 HE21 GLN 40 1HE2 GLN 40 10.114 -12.158 -10.004 315 HE22 GLN 40 2HE2 GLN 40 10.852 -13.206 -11.148 316 H GLY 41 H GLY 41 16.109 -8.964 -13.496 317 HA2 GLY 41 1HA GLY 41 18.379 -8.918 -13.076 318 HA3 GLY 41 2HA GLY 41 18.161 -10.125 -11.800 319 H LEU 42 H LEU 42 16.379 -11.508 -13.921 320 HA LEU 42 HA LEU 42 18.446 -13.157 -15.048 321 HB2 LEU 42 1HB LEU 42 15.499 -13.227 -15.518 322 HB3 LEU 42 2HB LEU 42 16.671 -14.473 -15.996 323 HG LEU 42 HG LEU 42 16.040 -13.637 -13.130 324 HD11 LEU 42 1HD1 LEU 42 14.065 -14.599 -14.360 325 HD12 LEU 42 2HD1 LEU 42 14.583 -15.522 -12.961 326 HD13 LEU 42 3HD1 LEU 42 14.998 -16.096 -14.597 327 HD21 LEU 42 1HD2 LEU 42 17.588 -15.986 -14.316 328 HD22 LEU 42 2HD2 LEU 42 17.138 -15.839 -12.600 329 HD23 LEU 42 3HD2 LEU 42 18.244 -14.677 -13.329 330 H ASP 43 H ASP 43 19.290 -12.921 -17.015 331 HA ASP 43 HA ASP 43 18.529 -10.699 -18.599 332 HB2 ASP 43 1HB ASP 43 20.779 -11.697 -18.548 333 HB3 ASP 43 2HB ASP 43 20.185 -13.070 -19.478 334 H GLY 44 H GLY 44 17.062 -10.406 -20.121 335 HA2 GLY 44 1HA GLY 44 15.769 -11.057 -22.020 336 HA3 GLY 44 2HA GLY 44 16.183 -12.743 -21.673 337 H TRP 45 H TRP 45 14.954 -11.417 -18.847 338 HA TRP 45 HA TRP 45 12.202 -12.321 -19.356 339 HB2 TRP 45 1HB TRP 45 13.823 -12.082 -16.893 340 HB3 TRP 45 2HB TRP 45 12.027 -12.195 -16.791 341 HD1 TRP 45 HD1 TRP 45 15.137 -14.298 -17.637 342 HE1 TRP 45 HE1 TRP 45 14.526 -16.730 -17.927 343 HE3 TRP 45 HE3 TRP 45 10.057 -13.783 -17.584 344 HZ2 TRP 45 HZ2 TRP 45 12.045 -18.268 -18.212 345 HZ3 TRP 45 HZ3 TRP 45 8.645 -15.727 -17.931 346 HH2 TRP 45 HH2 TRP 45 9.608 -17.996 -18.235 347 H TRP 46 H TRP 46 11.047 -10.574 -20.014 348 HA TRP 46 HA TRP 46 11.548 -7.900 -18.801 349 HB2 TRP 46 1HB TRP 46 9.693 -8.675 -21.148 350 HB3 TRP 46 2HB TRP 46 10.234 -7.067 -20.627 351 HD1 TRP 46 HD1 TRP 46 13.349 -8.589 -20.270 352 HE1 TRP 46 HE1 TRP 46 14.814 -8.670 -22.355 353 HE3 TRP 46 HE3 TRP 46 9.629 -7.931 -23.711 354 HZ2 TRP 46 HZ2 TRP 46 14.361 -8.443 -25.267 355 HZ3 TRP 46 HZ3 TRP 46 10.249 -7.843 -26.118 356 HH2 TRP 46 HH2 TRP 46 12.576 -8.113 -26.876 357 H LEU 47 H LEU 47 9.840 -6.636 -17.965 358 HA LEU 47 HA LEU 47 7.543 -8.144 -16.791 359 HB2 LEU 47 1HB LEU 47 8.844 -6.531 -15.468 360 HB3 LEU 47 2HB LEU 47 8.345 -5.243 -16.575 361 HG LEU 47 HG LEU 47 5.948 -5.831 -15.824 362 HD11 LEU 47 1HD1 LEU 47 7.332 -7.329 -13.584 363 HD12 LEU 47 2HD1 LEU 47 6.560 -8.105 -14.956 364 HD13 LEU 47 3HD1 LEU 47 5.598 -7.114 -13.855 365 HD21 LEU 47 1HD2 LEU 47 7.955 -4.783 -13.758 366 HD22 LEU 47 2HD2 LEU 47 6.186 -4.648 -13.628 367 HD23 LEU 47 3HD2 LEU 47 7.063 -3.840 -14.994 368 H CYS 48 H CYS 48 5.667 -8.322 -17.928 369 HA CYS 48 HA CYS 48 5.094 -6.054 -19.858 370 HB2 CYS 48 1HB CYS 48 4.378 -9.013 -20.045 371 HB3 CYS 48 2HB CYS 48 3.964 -7.775 -21.250 372 HG CYS 48 HG CYS 48 6.884 -8.826 -20.347 373 H SER 49 H SER 49 2.776 -5.768 -20.209 374 HA SER 49 HA SER 49 1.133 -6.793 -17.899 375 HB2 SER 49 1HB SER 49 1.740 -4.442 -17.543 376 HB3 SER 49 2HB SER 49 1.028 -4.021 -19.170 377 HG SER 49 HG SER 49 -0.336 -3.899 -17.005 378 H LEU 50 H LEU 50 -0.775 -7.726 -18.535 379 HA LEU 50 HA LEU 50 -1.973 -7.176 -21.167 380 HB2 LEU 50 1HB LEU 50 -0.364 -8.841 -21.778 381 HB3 LEU 50 2HB LEU 50 -0.855 -9.881 -20.467 382 HG LEU 50 HG LEU 50 -3.097 -10.140 -21.543 383 HD11 LEU 50 1HD1 LEU 50 -3.119 -9.689 -24.073 384 HD12 LEU 50 2HD1 LEU 50 -1.719 -8.639 -23.831 385 HD13 LEU 50 3HD1 LEU 50 -3.260 -8.246 -23.057 386 HD21 LEU 50 1HD2 LEU 50 -0.630 -10.829 -23.237 387 HD22 LEU 50 2HD2 LEU 50 -2.171 -11.736 -23.157 388 HD23 LEU 50 3HD2 LEU 50 -1.127 -11.687 -21.709 389 H HIS 51 H HIS 51 -4.093 -7.506 -21.154 390 HA HIS 51 HA HIS 51 -6.190 -7.890 -20.359 391 HB2 HIS 51 1HB HIS 51 -5.160 -10.275 -20.615 392 HB3 HIS 51 2HB HIS 51 -5.165 -10.256 -18.875 393 HD1 HIS 51 HD1 HIS 51 -7.753 -9.588 -17.900 394 HD2 HIS 51 HD2 HIS 51 -7.361 -11.287 -21.691 395 HE1 HIS 51 HE1 HIS 51 -10.083 -10.482 -18.560 396 H GLY 52 H GLY 52 -4.390 -6.133 -18.739 397 HA2 GLY 52 1HA GLY 52 -4.688 -4.953 -16.853 398 HA3 GLY 52 2HA GLY 52 -6.036 -6.017 -16.370 399 H ARG 53 H ARG 53 -3.248 -7.920 -17.007 400 HA ARG 53 HA ARG 53 -2.512 -7.929 -14.104 401 HB2 ARG 53 1HB ARG 53 -2.493 -10.277 -16.046 402 HB3 ARG 53 2HB ARG 53 -2.000 -10.310 -14.331 403 HG2 ARG 53 1HG ARG 53 -4.393 -9.533 -13.820 404 HG3 ARG 53 2HG ARG 53 -4.776 -9.838 -15.519 405 HD2 ARG 53 1HD ARG 53 -5.411 -11.905 -14.460 406 HD3 ARG 53 2HD ARG 53 -3.774 -12.176 -15.201 407 HE ARG 53 HE ARG 53 -2.815 -12.214 -13.033 408 HH11 ARG 53 1HH1 ARG 53 -6.257 -11.548 -12.828 409 HH12 ARG 53 2HH1 ARG 53 -6.319 -11.685 -11.108 410 HH21 ARG 53 1HH2 ARG 53 -2.927 -12.387 -10.848 411 HH22 ARG 53 2HH2 ARG 53 -4.423 -12.185 -10.013 412 H GLN 54 H GLN 54 -0.291 -7.821 -13.636 413 HA GLN 54 HA GLN 54 1.464 -7.461 -16.082 414 HB2 GLN 54 1HB GLN 54 2.121 -6.879 -13.201 415 HB3 GLN 54 2HB GLN 54 3.008 -6.407 -14.657 416 HG2 GLN 54 1HG GLN 54 2.091 -4.423 -14.393 417 HG3 GLN 54 2HG GLN 54 0.664 -5.144 -15.108 418 HE21 GLN 54 1HE2 GLN 54 0.592 -3.743 -11.401 419 HE22 GLN 54 2HE2 GLN 54 1.874 -3.417 -12.511 420 H GLY 55 H GLY 55 3.399 -8.717 -16.192 421 HA2 GLY 55 1HA GLY 55 4.161 -10.327 -13.950 422 HA3 GLY 55 2HA GLY 55 3.288 -11.321 -15.147 423 H ILE 56 H ILE 56 5.772 -12.161 -14.609 424 HA ILE 56 HA ILE 56 7.639 -10.801 -16.402 425 HB ILE 56 HB ILE 56 9.267 -12.499 -15.778 426 HG12 ILE 56 1HG1 ILE 56 7.186 -13.825 -14.032 427 HG13 ILE 56 2HG1 ILE 56 7.756 -14.393 -15.626 428 HG21 ILE 56 1HG2 ILE 56 7.814 -11.415 -13.335 429 HG22 ILE 56 2HG2 ILE 56 9.542 -11.833 -13.470 430 HG23 ILE 56 3HG2 ILE 56 8.919 -10.475 -14.381 431 HD11 ILE 56 1HD1 ILE 56 9.176 -15.626 -14.372 432 HD12 ILE 56 2HD1 ILE 56 10.157 -14.152 -14.312 433 HD13 ILE 56 3HD1 ILE 56 9.098 -14.543 -12.973 434 H VAL 57 H VAL 57 8.445 -11.467 -18.355 435 HA VAL 57 HA VAL 57 7.025 -13.786 -19.650 436 HB VAL 57 HB VAL 57 7.169 -10.915 -20.766 437 HG11 VAL 57 1HG1 VAL 57 6.234 -13.526 -21.999 438 HG12 VAL 57 2HG1 VAL 57 5.743 -11.923 -22.631 439 HG13 VAL 57 3HG1 VAL 57 7.440 -12.391 -22.629 440 HG21 VAL 57 1HG2 VAL 57 4.848 -12.672 -19.844 441 HG22 VAL 57 2HG2 VAL 57 5.352 -11.159 -19.146 442 HG23 VAL 57 3HG2 VAL 57 4.610 -11.170 -20.776 443 HA PRO 58 HA PRO 58 11.164 -14.132 -20.974 444 HB2 PRO 58 1HB PRO 58 11.013 -16.193 -22.840 445 HB3 PRO 58 2HB PRO 58 10.850 -16.490 -21.095 446 HG2 PRO 58 1HG PRO 58 8.682 -16.121 -23.120 447 HG3 PRO 58 2HG PRO 58 8.851 -17.438 -21.895 448 HD2 PRO 58 1HD PRO 58 7.234 -15.330 -21.359 449 HD3 PRO 58 2HD PRO 58 8.230 -16.078 -20.128 450 H GLY 59 H GLY 59 12.066 -12.765 -22.192 451 HA2 GLY 59 1HA GLY 59 10.589 -11.310 -24.182 452 HA3 GLY 59 2HA GLY 59 12.241 -11.066 -23.677 453 H ASN 60 H ASN 60 12.949 -13.939 -24.360 454 HA ASN 60 HA ASN 60 13.707 -13.364 -27.110 455 HB2 ASN 60 1HB ASN 60 15.002 -14.758 -25.353 456 HB3 ASN 60 2HB ASN 60 13.856 -16.086 -25.675 457 HD21 ASN 60 1HD2 ASN 60 16.014 -17.213 -28.178 458 HD22 ASN 60 2HD2 ASN 60 15.184 -17.524 -26.679 459 H ARG 61 H ARG 61 10.794 -14.281 -25.756 460 HA ARG 61 HA ARG 61 9.904 -15.836 -28.133 461 HB2 ARG 61 1HB ARG 61 8.691 -15.625 -25.402 462 HB3 ARG 61 2HB ARG 61 7.911 -16.472 -26.725 463 HG2 ARG 61 1HG ARG 61 10.423 -17.772 -26.537 464 HG3 ARG 61 2HG ARG 61 10.159 -17.313 -24.853 465 HD2 ARG 61 1HD ARG 61 7.665 -18.365 -25.465 466 HD3 ARG 61 2HD ARG 61 8.665 -19.319 -26.557 467 HE ARG 61 HE ARG 61 8.540 -19.521 -23.672 468 HH11 ARG 61 1HH1 ARG 61 10.734 -20.154 -26.378 469 HH12 ARG 61 2HH1 ARG 61 11.671 -21.284 -25.416 470 HH21 ARG 61 1HH2 ARG 61 9.709 -20.933 -22.531 471 HH22 ARG 61 2HH2 ARG 61 11.118 -21.726 -23.280 472 H LEU 62 H LEU 62 10.205 -12.811 -27.283 473 HA LEU 62 HA LEU 62 7.531 -12.033 -28.363 474 HB2 LEU 62 1HB LEU 62 9.380 -10.372 -26.614 475 HB3 LEU 62 2HB LEU 62 7.828 -9.872 -27.271 476 HG LEU 62 HG LEU 62 8.256 -11.883 -25.082 477 HD11 LEU 62 1HD1 LEU 62 7.088 -9.089 -25.122 478 HD12 LEU 62 2HD1 LEU 62 8.531 -9.715 -24.248 479 HD13 LEU 62 3HD1 LEU 62 6.906 -10.261 -23.774 480 HD21 LEU 62 1HD2 LEU 62 5.611 -10.966 -26.250 481 HD22 LEU 62 2HD2 LEU 62 5.864 -12.084 -24.903 482 HD23 LEU 62 3HD2 LEU 62 6.415 -12.572 -26.484 483 H LYS 63 H LYS 63 7.393 -10.425 -29.832 484 HA LYS 63 HA LYS 63 10.027 -9.405 -30.890 485 HB2 LYS 63 1HB LYS 63 8.880 -11.007 -32.479 486 HB3 LYS 63 2HB LYS 63 7.544 -9.872 -32.610 487 HG2 LYS 63 1HG LYS 63 9.251 -8.121 -33.303 488 HG3 LYS 63 2HG LYS 63 10.414 -9.504 -33.391 489 HD2 LYS 63 1HD LYS 63 9.537 -9.221 -35.568 490 HD3 LYS 63 2HD LYS 63 8.566 -10.552 -34.914 491 HE2 LYS 63 1HE LYS 63 6.779 -8.934 -34.386 492 HE3 LYS 63 2HE LYS 63 7.799 -7.593 -34.967 493 HZ1 LYS 63 1HZ LYS 63 6.782 -9.821 -36.634 494 HZ2 LYS 63 2HZ LYS 63 7.820 -8.667 -37.146 495 HZ3 LYS 63 3HZ LYS 63 6.309 -8.227 -36.739 496 H ILE 64 H ILE 64 10.210 -7.398 -30.320 497 HA ILE 64 HA ILE 64 8.246 -5.494 -29.548 498 HB ILE 64 HB ILE 64 10.944 -4.935 -30.980 499 HG12 ILE 64 1HG1 ILE 64 11.280 -6.395 -29.005 500 HG13 ILE 64 2HG1 ILE 64 11.985 -4.793 -28.782 501 HG21 ILE 64 1HG2 ILE 64 9.735 -2.846 -30.915 502 HG22 ILE 64 2HG2 ILE 64 9.110 -3.112 -29.304 503 HG23 ILE 64 3HG2 ILE 64 10.832 -2.737 -29.511 504 HD11 ILE 64 1HD1 ILE 64 9.497 -5.844 -27.418 505 HD12 ILE 64 2HD1 ILE 64 11.039 -5.356 -26.677 506 HD13 ILE 64 3HD1 ILE 64 9.960 -4.128 -27.389 507 H LEU 65 H LEU 65 6.977 -4.053 -30.561 508 HA LEU 65 HA LEU 65 6.377 -4.669 -33.302 509 HB2 LEU 65 1HB LEU 65 5.091 -3.498 -31.070 510 HB3 LEU 65 2HB LEU 65 5.051 -2.248 -32.324 511 HG LEU 65 HG LEU 65 4.142 -4.100 -33.859 512 HD11 LEU 65 1HD1 LEU 65 2.994 -5.975 -32.676 513 HD12 LEU 65 2HD1 LEU 65 3.743 -5.472 -31.153 514 HD13 LEU 65 3HD1 LEU 65 4.767 -6.061 -32.475 515 HD21 LEU 65 1HD2 LEU 65 1.831 -3.757 -33.072 516 HD22 LEU 65 2HD2 LEU 65 2.725 -2.266 -32.874 517 HD23 LEU 65 3HD2 LEU 65 2.432 -3.283 -31.488 518 H VAL 66 H VAL 66 5.594 -2.347 -34.418 519 HA VAL 66 HA VAL 66 7.977 -1.244 -35.561 520 HB VAL 66 HB VAL 66 6.388 0.450 -36.508 521 HG11 VAL 66 1HG1 VAL 66 4.923 -1.107 -37.749 522 HG12 VAL 66 2HG1 VAL 66 6.533 -1.836 -37.540 523 HG13 VAL 66 3HG1 VAL 66 5.171 -2.368 -36.543 524 HG21 VAL 66 1HG2 VAL 66 4.117 -0.893 -34.905 525 HG22 VAL 66 2HG2 VAL 66 4.911 0.586 -34.305 526 HG23 VAL 66 3HG2 VAL 66 4.060 0.604 -35.860 527 H GLY 67 H GLY 67 8.677 1.002 -35.579 528 HA2 GLY 67 1HA GLY 67 8.313 3.194 -34.289 529 HA3 GLY 67 2HA GLY 67 8.563 2.210 -32.815 530 H MET 68 H MET 68 10.565 0.464 -34.056 531 HA MET 68 HA MET 68 12.810 2.157 -34.948 532 HB2 MET 68 1HB MET 68 12.684 2.307 -32.429 533 HB3 MET 68 2HB MET 68 13.080 0.598 -32.341 534 HG2 MET 68 1HG MET 68 14.840 2.493 -33.889 535 HG3 MET 68 2HG MET 68 14.893 2.495 -32.111 536 HE1 MET 68 1HE MET 68 17.434 2.092 -33.591 537 HE2 MET 68 2HE MET 68 17.303 1.862 -31.794 538 HE3 MET 68 3HE MET 68 18.137 0.640 -32.825 539 H TYR 69 H TYR 69 14.650 0.784 -35.711 540 HA TYR 69 HA TYR 69 14.022 -2.142 -35.627 541 HB2 TYR 69 1HB TYR 69 12.798 -1.403 -37.665 542 HB3 TYR 69 2HB TYR 69 14.258 -0.577 -38.248 543 HD1 TYR 69 HD1 TYR 69 12.657 -3.861 -37.609 544 HD2 TYR 69 HD2 TYR 69 16.161 -1.900 -39.196 545 HE1 TYR 69 HE1 TYR 69 13.394 -5.982 -38.727 546 HE2 TYR 69 HE2 TYR 69 16.958 -4.036 -40.159 547 HH TYR 69 HH TYR 69 14.962 -7.104 -39.930 548 H ASP 70 H ASP 70 15.880 -3.097 -35.050 549 HA ASP 70 HA ASP 70 18.436 -2.156 -36.285 550 HB2 ASP 70 1HB ASP 70 18.146 -1.141 -33.990 551 HB3 ASP 70 2HB ASP 70 18.072 -2.807 -33.388 552 H LYS 71 H LYS 71 17.687 -4.270 -37.618 553 HA LYS 71 HA LYS 71 18.819 -6.605 -36.266 554 HB2 LYS 71 1HB LYS 71 15.979 -6.467 -37.026 555 HB3 LYS 71 2HB LYS 71 16.856 -7.937 -37.462 556 HG2 LYS 71 1HG LYS 71 16.367 -8.678 -35.448 557 HG3 LYS 71 2HG LYS 71 17.699 -7.645 -34.919 558 HD2 LYS 71 1HD LYS 71 16.137 -5.810 -34.413 559 HD3 LYS 71 2HD LYS 71 14.778 -6.842 -34.935 560 HE2 LYS 71 1HE LYS 71 15.317 -8.419 -33.146 561 HE3 LYS 71 2HE LYS 71 16.730 -7.488 -32.676 562 HZ1 LYS 71 1HZ LYS 71 13.961 -6.444 -32.681 563 HZ2 LYS 71 2HZ LYS 71 15.298 -5.633 -32.129 564 HZ3 LYS 71 3HZ LYS 71 14.761 -7.019 -31.324 565 H LYS 72 H LYS 72 19.513 -8.296 -37.567 566 HA LYS 72 HA LYS 72 20.369 -7.383 -40.236 567 HB2 LYS 72 1HB LYS 72 20.586 -10.040 -38.729 568 HB3 LYS 72 2HB LYS 72 21.265 -9.804 -40.333 569 HG2 LYS 72 1HG LYS 72 22.842 -8.203 -39.491 570 HG3 LYS 72 2HG LYS 72 21.959 -8.016 -37.933 571 HD2 LYS 72 1HD LYS 72 23.942 -9.438 -37.617 572 HD3 LYS 72 2HD LYS 72 22.515 -10.424 -37.423 573 HE2 LYS 72 1HE LYS 72 23.900 -10.321 -40.097 574 HE3 LYS 72 2HE LYS 72 24.585 -11.295 -38.810 575 HZ1 LYS 72 1HZ LYS 72 23.303 -12.794 -40.054 576 HZ2 LYS 72 2HZ LYS 72 22.011 -11.743 -40.273 577 HZ3 LYS 72 3HZ LYS 72 22.301 -12.446 -38.782 578 HA PRO 73 HA PRO 73 16.688 -9.024 -42.069 579 HB2 PRO 73 1HB PRO 73 17.394 -9.540 -44.629 580 HB3 PRO 73 2HB PRO 73 17.189 -7.862 -43.989 581 HG2 PRO 73 1HG PRO 73 19.684 -9.500 -44.350 582 HG3 PRO 73 2HG PRO 73 19.386 -7.829 -44.869 583 HD2 PRO 73 1HD PRO 73 20.666 -8.425 -42.532 584 HD3 PRO 73 2HD PRO 73 19.598 -6.979 -42.751 585 H ALA 74 H ALA 74 15.751 -11.072 -42.605 586 HA ALA 74 HA ALA 74 17.294 -13.358 -41.735 587 HB1 ALA 74 1HB ALA 74 14.902 -13.170 -40.976 588 HB2 ALA 74 2HB ALA 74 14.400 -13.121 -42.702 589 HB3 ALA 74 3HB ALA 74 15.123 -14.607 -42.001 590 H GLY 75 H GLY 75 17.804 -15.193 -43.099 591 HA2 GLY 75 1HA GLY 75 17.082 -15.035 -45.975 592 HA3 GLY 75 2HA GLY 75 18.799 -14.854 -45.569 593 H GLU 76 H GLU 76 17.087 -17.048 -46.909 594 HA GLU 76 HA GLU 76 17.600 -19.433 -45.293 595 HB2 GLU 76 1HB GLU 76 17.098 -18.840 -48.296 596 HB3 GLU 76 2HB GLU 76 17.407 -20.501 -47.614 597 HG2 GLU 76 1HG GLU 76 14.979 -20.214 -47.851 598 HG3 GLU 76 2HG GLU 76 15.458 -20.279 -46.161 599 H PHE 77 H PHE 77 19.073 -21.152 -46.140 600 HA PHE 77 HA PHE 77 21.727 -20.136 -47.061 601 HB2 PHE 77 1HB PHE 77 22.756 -21.661 -45.365 602 HB3 PHE 77 2HB PHE 77 21.825 -20.426 -44.587 603 HD1 PHE 77 HD1 PHE 77 21.933 -24.064 -45.242 604 HD2 PHE 77 HD2 PHE 77 19.725 -20.879 -43.361 605 HE1 PHE 77 HE1 PHE 77 20.634 -25.691 -44.042 606 HE2 PHE 77 HE2 PHE 77 18.343 -22.560 -42.105 607 HZ PHE 77 HZ PHE 77 18.860 -24.960 -42.449 608 H ILE 78 H ILE 78 23.148 -21.951 -47.782 609 HA ILE 78 HA ILE 78 21.519 -23.973 -49.219 610 HB ILE 78 HB ILE 78 23.340 -24.120 -50.801 611 HG12 ILE 78 1HG1 ILE 78 24.864 -22.011 -49.227 612 HG13 ILE 78 2HG1 ILE 78 25.250 -23.733 -49.242 613 HG21 ILE 78 1HG2 ILE 78 23.158 -21.918 -51.845 614 HG22 ILE 78 2HG2 ILE 78 21.618 -22.247 -51.070 615 HG23 ILE 78 3HG2 ILE 78 22.798 -21.132 -50.297 616 HD11 ILE 78 1HD1 ILE 78 25.390 -21.835 -51.623 617 HD12 ILE 78 2HD1 ILE 78 26.746 -22.549 -50.719 618 HD13 ILE 78 3HD1 ILE 78 25.688 -23.610 -51.695 619 H VAL 79 H VAL 79 22.579 -26.087 -49.533 620 HA VAL 79 HA VAL 79 24.482 -26.902 -47.369 621 HB VAL 79 HB VAL 79 23.144 -28.980 -47.064 622 HG11 VAL 79 1HG1 VAL 79 21.374 -27.913 -45.616 623 HG12 VAL 79 2HG1 VAL 79 23.028 -27.273 -45.386 624 HG13 VAL 79 3HG1 VAL 79 21.813 -26.316 -46.341 625 HG21 VAL 79 1HG2 VAL 79 20.889 -27.550 -48.567 626 HG22 VAL 79 2HG2 VAL 79 21.913 -28.794 -49.286 627 HG23 VAL 79 3HG2 VAL 79 20.893 -29.202 -47.918 628 H THR 80 H THR 80 25.397 -29.141 -47.987 629 HA THR 80 HA THR 80 25.604 -29.335 -50.996 630 HB THR 80 HB THR 80 28.057 -30.120 -49.532 631 HG1 THR 80 HG1 THR 80 28.612 -28.219 -48.610 632 HG21 THR 80 1HG2 THR 80 29.147 -28.699 -51.193 633 HG22 THR 80 2HG2 THR 80 27.608 -28.013 -51.680 634 HG23 THR 80 3HG2 THR 80 27.937 -29.729 -51.996 635 H ASP 81 H ASP 81 26.387 -31.461 -51.678 636 HA ASP 81 HA ASP 81 26.219 -33.719 -51.806 637 HB2 ASP 81 1HB ASP 81 27.933 -33.496 -49.953 638 HB3 ASP 81 2HB ASP 81 26.702 -34.176 -48.877 639 HXT ASP 81 H02 ASP 81 23.404 -34.813 -49.576 Start of MODEL 37 1 H2 GLY 1 2H0 GLY 1 5.700 14.482 -21.998 2 H GLY 1 1H0 GLY 1 5.848 16.097 -21.693 3 HA2 GLY 1 1HA GLY 1 8.259 15.805 -22.335 4 HA3 GLY 1 2HA GLY 1 7.741 15.269 -20.750 5 H SER 2 H SER 2 9.942 14.365 -21.149 6 HA SER 2 HA SER 2 10.135 11.973 -22.857 7 HB2 SER 2 1HB SER 2 12.109 13.241 -22.232 8 HB3 SER 2 2HB SER 2 11.811 12.931 -20.526 9 HG SER 2 HG SER 2 12.424 11.060 -22.681 10 H MET 3 H MET 3 9.806 9.913 -22.370 11 HA MET 3 HA MET 3 7.897 9.424 -20.307 12 HB2 MET 3 1HB MET 3 7.776 7.158 -21.198 13 HB3 MET 3 2HB MET 3 7.720 8.372 -22.487 14 HG2 MET 3 1HG MET 3 10.150 8.017 -22.939 15 HG3 MET 3 2HG MET 3 10.128 6.646 -21.844 16 HE1 MET 3 1HE MET 3 11.133 6.281 -24.655 17 HE2 MET 3 2HE MET 3 10.873 4.930 -23.515 18 HE3 MET 3 3HE MET 3 10.260 4.806 -25.182 19 H LYS 4 H LYS 4 7.800 7.863 -18.799 20 HA LYS 4 HA LYS 4 10.243 7.579 -17.170 21 HB2 LYS 4 1HB LYS 4 7.271 7.581 -16.731 22 HB3 LYS 4 2HB LYS 4 8.283 6.518 -15.692 23 HG2 LYS 4 1HG LYS 4 7.909 8.610 -14.582 24 HG3 LYS 4 2HG LYS 4 9.632 8.378 -14.921 25 HD2 LYS 4 1HD LYS 4 9.538 10.015 -16.734 26 HD3 LYS 4 2HD LYS 4 7.786 10.100 -16.653 27 HE2 LYS 4 1HE LYS 4 8.801 12.103 -15.641 28 HE3 LYS 4 2HE LYS 4 7.814 11.151 -14.432 29 HZ1 LYS 4 1HZ LYS 4 10.045 11.893 -13.567 30 HZ2 LYS 4 2HZ LYS 4 10.727 10.917 -14.706 31 HZ3 LYS 4 3HZ LYS 4 9.798 10.202 -13.550 32 H TYR 5 H TYR 5 7.887 5.615 -18.859 33 HA TYR 5 HA TYR 5 9.307 3.097 -17.986 34 HB2 TYR 5 1HB TYR 5 6.457 3.858 -18.456 35 HB3 TYR 5 2HB TYR 5 6.953 2.251 -19.037 36 HD1 TYR 5 HD1 TYR 5 7.193 0.462 -17.492 37 HD2 TYR 5 HD2 TYR 5 6.912 4.487 -15.960 38 HE1 TYR 5 HE1 TYR 5 6.923 -0.440 -15.213 39 HE2 TYR 5 HE2 TYR 5 6.700 3.567 -13.716 40 HH TYR 5 HH TYR 5 6.747 1.841 -12.454 41 H LEU 6 H LEU 6 9.322 1.492 -19.769 42 HA LEU 6 HA LEU 6 10.422 2.569 -22.119 43 HB2 LEU 6 1HB LEU 6 9.161 -0.200 -21.625 44 HB3 LEU 6 2HB LEU 6 10.241 0.211 -22.969 45 HG LEU 6 HG LEU 6 11.111 0.279 -20.120 46 HD11 LEU 6 1HD1 LEU 6 12.277 -1.780 -20.562 47 HD12 LEU 6 2HD1 LEU 6 11.463 -1.897 -22.151 48 HD13 LEU 6 3HD1 LEU 6 10.498 -1.951 -20.641 49 HD21 LEU 6 1HD2 LEU 6 12.501 1.691 -21.446 50 HD22 LEU 6 2HD2 LEU 6 12.593 0.437 -22.733 51 HD23 LEU 6 3HD2 LEU 6 13.386 0.207 -21.172 52 H ASN 7 H ASN 7 7.228 1.236 -21.444 53 HA ASN 7 HA ASN 7 5.244 1.316 -22.557 54 HB2 ASN 7 1HB ASN 7 5.859 3.742 -21.816 55 HB3 ASN 7 2HB ASN 7 6.052 4.061 -23.538 56 HD21 ASN 7 1HD2 ASN 7 2.610 4.777 -23.589 57 HD22 ASN 7 2HD2 ASN 7 4.256 5.364 -23.862 58 H VAL 8 H VAL 8 7.244 -0.029 -24.103 59 HA VAL 8 HA VAL 8 6.267 0.658 -26.883 60 HB VAL 8 HB VAL 8 8.832 0.574 -26.545 61 HG11 VAL 8 1HG1 VAL 8 8.337 -2.383 -25.969 62 HG12 VAL 8 2HG1 VAL 8 9.919 -1.626 -26.220 63 HG13 VAL 8 3HG1 VAL 8 8.913 -1.139 -24.860 64 HG21 VAL 8 1HG2 VAL 8 9.306 -0.403 -28.592 65 HG22 VAL 8 2HG2 VAL 8 8.060 -1.666 -28.454 66 HG23 VAL 8 3HG2 VAL 8 7.604 0.066 -28.728 67 H LEU 9 H LEU 9 5.606 -1.456 -28.086 68 HA LEU 9 HA LEU 9 4.615 -3.495 -26.107 69 HB2 LEU 9 1HB LEU 9 2.844 -3.709 -28.232 70 HB3 LEU 9 2HB LEU 9 2.495 -3.103 -26.631 71 HG LEU 9 HG LEU 9 3.465 -1.226 -28.764 72 HD11 LEU 9 1HD1 LEU 9 0.502 -1.905 -28.326 73 HD12 LEU 9 2HD1 LEU 9 1.432 -2.436 -29.739 74 HD13 LEU 9 3HD1 LEU 9 1.142 -0.722 -29.450 75 HD21 LEU 9 1HD2 LEU 9 3.369 -0.335 -26.476 76 HD22 LEU 9 2HD2 LEU 9 1.668 -0.852 -26.346 77 HD23 LEU 9 3HD2 LEU 9 2.131 0.414 -27.495 78 H ALA 10 H ALA 10 4.188 -5.581 -27.067 79 HA ALA 10 HA ALA 10 5.994 -6.182 -29.363 80 HB1 ALA 10 1HB ALA 10 7.371 -6.553 -27.323 81 HB2 ALA 10 2HB ALA 10 6.031 -7.477 -26.542 82 HB3 ALA 10 3HB ALA 10 6.892 -8.149 -27.959 83 H LYS 11 H LYS 11 5.461 -8.201 -30.445 84 HA LYS 11 HA LYS 11 2.755 -9.307 -29.823 85 HB2 LYS 11 1HB LYS 11 3.453 -8.667 -32.194 86 HB3 LYS 11 2HB LYS 11 4.758 -9.868 -32.109 87 HG2 LYS 11 1HG LYS 11 3.069 -11.653 -31.863 88 HG3 LYS 11 2HG LYS 11 1.786 -10.458 -32.051 89 HD2 LYS 11 1HD LYS 11 2.667 -9.826 -34.237 90 HD3 LYS 11 2HD LYS 11 3.965 -11.030 -34.050 91 HE2 LYS 11 1HE LYS 11 2.298 -12.848 -33.805 92 HE3 LYS 11 2HE LYS 11 1.003 -11.651 -34.006 93 HZ1 LYS 11 1HZ LYS 11 2.901 -12.389 -36.164 94 HZ2 LYS 11 2HZ LYS 11 1.596 -11.411 -36.314 95 HZ3 LYS 11 3HZ LYS 11 1.403 -13.016 -35.956 96 H ALA 12 H ALA 12 2.570 -11.392 -28.977 97 HA ALA 12 HA ALA 12 4.990 -12.876 -28.226 98 HB1 ALA 12 1HB ALA 12 3.384 -14.549 -27.345 99 HB2 ALA 12 2HB ALA 12 3.118 -12.930 -26.642 100 HB3 ALA 12 3HB ALA 12 2.052 -13.528 -27.932 101 H LEU 13 H LEU 13 5.972 -14.492 -29.261 102 HA LEU 13 HA LEU 13 4.918 -15.275 -31.941 103 HB2 LEU 13 1HB LEU 13 7.542 -15.879 -30.481 104 HB3 LEU 13 2HB LEU 13 7.079 -16.271 -32.182 105 HG LEU 13 HG LEU 13 7.249 -13.462 -31.030 106 HD11 LEU 13 1HD1 LEU 13 9.457 -14.491 -30.953 107 HD12 LEU 13 2HD1 LEU 13 9.348 -13.180 -32.104 108 HD13 LEU 13 3HD1 LEU 13 9.340 -14.879 -32.702 109 HD21 LEU 13 1HD2 LEU 13 6.965 -14.519 -33.843 110 HD22 LEU 13 2HD2 LEU 13 7.334 -12.873 -33.462 111 HD23 LEU 13 3HD2 LEU 13 5.793 -13.545 -32.929 112 H TYR 14 H TYR 14 5.290 -16.417 -28.666 113 HA TYR 14 HA TYR 14 4.285 -19.116 -29.382 114 HB2 TYR 14 1HB TYR 14 6.302 -18.396 -27.285 115 HB3 TYR 14 2HB TYR 14 5.704 -20.025 -27.573 116 HD1 TYR 14 HD1 TYR 14 8.028 -17.421 -28.656 117 HD2 TYR 14 HD2 TYR 14 6.368 -21.299 -29.591 118 HE1 TYR 14 HE1 TYR 14 9.854 -17.859 -30.265 119 HE2 TYR 14 HE2 TYR 14 8.197 -21.677 -31.284 120 HH TYR 14 HH TYR 14 10.014 -20.807 -32.257 121 H ASP 15 H ASP 15 3.239 -20.199 -27.539 122 HA ASP 15 HA ASP 15 1.739 -18.227 -25.976 123 HB2 ASP 15 1HB ASP 15 -0.062 -19.751 -25.945 124 HB3 ASP 15 2HB ASP 15 0.559 -19.602 -27.575 125 H ASN 16 H ASN 16 1.085 -18.918 -23.752 126 HA ASN 16 HA ASN 16 2.876 -20.878 -22.482 127 HB2 ASN 16 1HB ASN 16 4.118 -18.717 -22.532 128 HB3 ASN 16 2HB ASN 16 2.820 -18.005 -21.579 129 HD21 ASN 16 1HD2 ASN 16 4.348 -18.893 -18.582 130 HD22 ASN 16 2HD2 ASN 16 3.480 -17.657 -19.539 131 H VAL 17 H VAL 17 2.208 -21.462 -20.349 132 HA VAL 17 HA VAL 17 -0.368 -20.305 -19.361 133 HB VAL 17 HB VAL 17 0.675 -23.141 -18.955 134 HG11 VAL 17 1HG1 VAL 17 -1.937 -21.884 -17.996 135 HG12 VAL 17 2HG1 VAL 17 -1.346 -23.540 -17.618 136 HG13 VAL 17 3HG1 VAL 17 -0.495 -22.121 -16.970 137 HG21 VAL 17 1HG2 VAL 17 -1.298 -23.886 -20.222 138 HG22 VAL 17 2HG2 VAL 17 -1.825 -22.189 -20.437 139 HG23 VAL 17 3HG2 VAL 17 -0.339 -22.749 -21.226 140 H ALA 18 H ALA 18 0.082 -19.135 -17.465 141 HA ALA 18 HA ALA 18 2.726 -19.001 -16.443 142 HB1 ALA 18 1HB ALA 18 1.664 -17.616 -14.668 143 HB2 ALA 18 2HB ALA 18 0.958 -17.211 -16.253 144 HB3 ALA 18 3HB ALA 18 0.062 -18.253 -15.131 145 H GLU 19 H GLU 19 3.798 -20.467 -15.367 146 HA GLU 19 HA GLU 19 2.471 -22.507 -13.691 147 HB2 GLU 19 1HB GLU 19 4.684 -23.362 -13.308 148 HB3 GLU 19 2HB GLU 19 4.570 -22.892 -15.019 149 HG2 GLU 19 1HG GLU 19 5.796 -20.720 -14.298 150 HG3 GLU 19 2HG GLU 19 6.075 -21.544 -12.729 151 H SER 20 H SER 20 3.576 -19.328 -13.253 152 HA SER 20 HA SER 20 3.361 -19.589 -10.295 153 HB2 SER 20 1HB SER 20 5.519 -17.979 -11.718 154 HB3 SER 20 2HB SER 20 5.224 -18.122 -9.955 155 HG SER 20 HG SER 20 6.343 -19.930 -11.792 156 HA PRO 21 HA PRO 21 0.562 -16.250 -10.938 157 HB2 PRO 21 1HB PRO 21 0.544 -14.859 -8.641 158 HB3 PRO 21 2HB PRO 21 -0.115 -16.520 -8.734 159 HG2 PRO 21 1HG PRO 21 2.621 -15.520 -7.842 160 HG3 PRO 21 2HG PRO 21 1.552 -16.722 -6.969 161 HD2 PRO 21 1HD PRO 21 3.549 -17.616 -8.495 162 HD3 PRO 21 2HD PRO 21 1.964 -18.455 -8.463 163 H ASP 22 H ASP 22 3.911 -15.633 -10.260 164 HA ASP 22 HA ASP 22 3.852 -12.766 -10.817 165 HB2 ASP 22 1HB ASP 22 5.557 -13.983 -9.264 166 HB3 ASP 22 2HB ASP 22 6.305 -14.648 -10.734 167 H GLU 23 H GLU 23 3.745 -15.643 -12.616 168 HA GLU 23 HA GLU 23 5.111 -14.450 -14.923 169 HB2 GLU 23 1HB GLU 23 5.587 -16.784 -14.044 170 HB3 GLU 23 2HB GLU 23 3.967 -17.262 -14.573 171 HG2 GLU 23 1HG GLU 23 4.616 -16.878 -16.952 172 HG3 GLU 23 2HG GLU 23 6.173 -16.203 -16.411 173 H LEU 24 H LEU 24 4.051 -14.280 -16.952 174 HA LEU 24 HA LEU 24 1.085 -14.003 -16.712 175 HB2 LEU 24 1HB LEU 24 3.242 -12.719 -18.218 176 HB3 LEU 24 2HB LEU 24 1.893 -13.187 -19.246 177 HG LEU 24 HG LEU 24 1.668 -11.481 -16.737 178 HD11 LEU 24 1HD1 LEU 24 1.224 -9.599 -18.335 179 HD12 LEU 24 2HD1 LEU 24 1.740 -10.675 -19.654 180 HD13 LEU 24 3HD1 LEU 24 2.889 -10.224 -18.382 181 HD21 LEU 24 1HD2 LEU 24 -0.593 -10.912 -17.678 182 HD22 LEU 24 2HD2 LEU 24 -0.435 -12.616 -17.255 183 HD23 LEU 24 3HD2 LEU 24 -0.347 -12.135 -18.918 184 H SER 25 H SER 25 -0.387 -15.147 -17.783 185 HA SER 25 HA SER 25 0.512 -17.337 -19.613 186 HB2 SER 25 1HB SER 25 -2.321 -16.440 -18.722 187 HB3 SER 25 2HB SER 25 -1.930 -17.792 -19.837 188 HG SER 25 HG SER 25 -1.920 -17.648 -17.116 189 H PHE 26 H PHE 26 1.505 -15.926 -21.148 190 HA PHE 26 HA PHE 26 -0.282 -14.195 -22.696 191 HB2 PHE 26 1HB PHE 26 1.757 -13.649 -24.024 192 HB3 PHE 26 2HB PHE 26 1.987 -13.309 -22.293 193 HD1 PHE 26 HD1 PHE 26 3.512 -14.720 -20.885 194 HD2 PHE 26 HD2 PHE 26 3.060 -15.403 -25.121 195 HE1 PHE 26 HE1 PHE 26 5.484 -16.149 -20.857 196 HE2 PHE 26 HE2 PHE 26 5.124 -16.826 -25.071 197 HZ PHE 26 HZ PHE 26 6.396 -17.202 -22.908 198 H ARG 27 H ARG 27 -0.452 -14.501 -25.035 199 HA ARG 27 HA ARG 27 -0.472 -17.440 -25.744 200 HB2 ARG 27 1HB ARG 27 -2.549 -16.046 -27.144 201 HB3 ARG 27 2HB ARG 27 -2.719 -17.376 -25.978 202 HG2 ARG 27 1HG ARG 27 -2.527 -14.479 -25.036 203 HG3 ARG 27 2HG ARG 27 -4.043 -15.145 -25.643 204 HD2 ARG 27 1HD ARG 27 -3.839 -16.960 -24.003 205 HD3 ARG 27 2HD ARG 27 -2.428 -16.165 -23.296 206 HE ARG 27 HE ARG 27 -4.333 -14.166 -23.450 207 HH11 ARG 27 1HH1 ARG 27 -4.134 -17.295 -21.872 208 HH12 ARG 27 2HH1 ARG 27 -5.152 -16.852 -20.522 209 HH21 ARG 27 1HH2 ARG 27 -5.653 -13.614 -21.661 210 HH22 ARG 27 2HH2 ARG 27 -6.019 -14.773 -20.437 211 H LYS 28 H LYS 28 -0.012 -17.854 -27.939 212 HA LYS 28 HA LYS 28 1.660 -15.937 -29.321 213 HB2 LYS 28 1HB LYS 28 1.564 -17.445 -31.167 214 HB3 LYS 28 2HB LYS 28 1.704 -18.382 -29.701 215 HG2 LYS 28 1HG LYS 28 -0.748 -18.914 -29.853 216 HG3 LYS 28 2HG LYS 28 -0.786 -18.045 -31.391 217 HD2 LYS 28 1HD LYS 28 1.032 -19.524 -32.258 218 HD3 LYS 28 2HD LYS 28 1.026 -20.428 -30.731 219 HE2 LYS 28 1HE LYS 28 -0.244 -21.745 -32.285 220 HE3 LYS 28 2HE LYS 28 -1.385 -20.983 -31.135 221 HZ1 LYS 28 1HZ LYS 28 -0.812 -20.026 -33.953 222 HZ2 LYS 28 2HZ LYS 28 -1.794 -19.236 -32.835 223 HZ3 LYS 28 3HZ LYS 28 -2.161 -20.797 -33.412 224 H GLY 29 H GLY 29 1.342 -14.369 -30.792 225 HA2 GLY 29 1HA GLY 29 0.065 -13.164 -32.440 226 HA3 GLY 29 2HA GLY 29 -1.339 -14.125 -31.938 227 H ASP 30 H ASP 30 -0.596 -13.453 -28.979 228 HA ASP 30 HA ASP 30 -2.352 -11.121 -28.978 229 HB2 ASP 30 1HB ASP 30 -1.948 -13.121 -27.169 230 HB3 ASP 30 2HB ASP 30 -0.815 -11.963 -26.531 231 H ILE 31 H ILE 31 -1.785 -9.143 -27.718 232 HA ILE 31 HA ILE 31 1.013 -8.262 -28.250 233 HB ILE 31 HB ILE 31 -1.487 -6.548 -28.448 234 HG12 ILE 31 1HG1 ILE 31 -1.589 -8.213 -30.181 235 HG13 ILE 31 2HG1 ILE 31 -1.400 -6.610 -30.875 236 HG21 ILE 31 1HG2 ILE 31 -0.038 -4.888 -29.534 237 HG22 ILE 31 2HG2 ILE 31 0.527 -5.295 -27.876 238 HG23 ILE 31 3HG2 ILE 31 1.372 -5.986 -29.292 239 HD11 ILE 31 1HD1 ILE 31 0.721 -8.770 -30.642 240 HD12 ILE 31 2HD1 ILE 31 0.020 -8.166 -32.121 241 HD13 ILE 31 3HD1 ILE 31 1.113 -7.161 -31.199 242 H MET 32 H MET 32 2.037 -7.506 -26.506 243 HA MET 32 HA MET 32 0.454 -6.408 -24.226 244 HB2 MET 32 1HB MET 32 2.095 -7.467 -22.664 245 HB3 MET 32 2HB MET 32 1.088 -8.623 -23.539 246 HG2 MET 32 1HG MET 32 3.327 -8.395 -25.220 247 HG3 MET 32 2HG MET 32 3.977 -8.388 -23.546 248 HE1 MET 32 1HE MET 32 0.709 -10.230 -25.209 249 HE2 MET 32 2HE MET 32 1.992 -10.595 -26.361 250 HE3 MET 32 3HE MET 32 1.335 -11.885 -25.328 251 H THR 33 H THR 33 1.304 -4.831 -23.037 252 HA THR 33 HA THR 33 3.397 -3.225 -24.313 253 HB THR 33 HB THR 33 2.001 -2.807 -21.621 254 HG1 THR 33 HG1 THR 33 0.505 -1.780 -22.715 255 HG21 THR 33 1HG2 THR 33 3.439 -0.980 -23.637 256 HG22 THR 33 2HG2 THR 33 3.978 -1.347 -21.999 257 HG23 THR 33 3HG2 THR 33 2.518 -0.361 -22.253 258 H VAL 34 H VAL 34 5.547 -3.128 -23.725 259 HA VAL 34 HA VAL 34 6.427 -4.920 -21.473 260 HB VAL 34 HB VAL 34 8.024 -3.384 -23.611 261 HG11 VAL 34 1HG1 VAL 34 8.914 -5.341 -21.450 262 HG12 VAL 34 2HG1 VAL 34 9.923 -4.778 -22.802 263 HG13 VAL 34 3HG1 VAL 34 9.355 -3.610 -21.598 264 HG21 VAL 34 1HG2 VAL 34 8.397 -5.538 -24.635 265 HG22 VAL 34 2HG2 VAL 34 7.715 -6.432 -23.282 266 HG23 VAL 34 3HG2 VAL 34 6.653 -5.469 -24.338 267 H LEU 35 H LEU 35 7.008 -4.034 -19.588 268 HA LEU 35 HA LEU 35 6.941 -1.119 -19.319 269 HB2 LEU 35 1HB LEU 35 6.704 -3.335 -17.220 270 HB3 LEU 35 2HB LEU 35 6.440 -1.616 -16.934 271 HG LEU 35 HG LEU 35 4.813 -3.480 -18.684 272 HD11 LEU 35 1HD1 LEU 35 4.255 -2.310 -15.906 273 HD12 LEU 35 2HD1 LEU 35 4.527 -4.005 -16.338 274 HD13 LEU 35 3HD1 LEU 35 3.059 -3.213 -16.880 275 HD21 LEU 35 1HD2 LEU 35 3.117 -1.673 -18.656 276 HD22 LEU 35 2HD2 LEU 35 4.536 -1.322 -19.619 277 HD23 LEU 35 3HD2 LEU 35 4.388 -0.570 -18.011 278 H GLU 36 H GLU 36 8.911 -3.924 -18.457 279 HA GLU 36 HA GLU 36 11.300 -2.191 -18.023 280 HB2 GLU 36 1HB GLU 36 10.113 -2.278 -15.890 281 HB3 GLU 36 2HB GLU 36 10.117 -4.084 -15.921 282 HG2 GLU 36 1HG GLU 36 12.534 -4.112 -15.776 283 HG3 GLU 36 2HG GLU 36 12.617 -2.350 -15.913 284 H ARG 37 H ARG 37 13.338 -3.387 -18.268 285 HA ARG 37 HA ARG 37 12.911 -6.202 -19.225 286 HB2 ARG 37 1HB ARG 37 15.002 -4.198 -20.090 287 HB3 ARG 37 2HB ARG 37 14.961 -5.864 -20.605 288 HG2 ARG 37 1HG ARG 37 12.917 -5.550 -21.833 289 HG3 ARG 37 2HG ARG 37 12.737 -3.893 -21.220 290 HD2 ARG 37 1HD ARG 37 15.074 -4.825 -22.966 291 HD3 ARG 37 2HD ARG 37 13.580 -4.024 -23.551 292 HE ARG 37 HE ARG 37 14.700 -2.432 -21.434 293 HH11 ARG 37 1HH1 ARG 37 15.466 -3.344 -24.778 294 HH12 ARG 37 2HH1 ARG 37 16.334 -1.800 -25.093 295 HH21 ARG 37 1HH2 ARG 37 15.798 -0.534 -21.934 296 HH22 ARG 37 2HH2 ARG 37 16.484 -0.275 -23.516 297 H ASP 38 H ASP 38 14.572 -7.650 -18.655 298 HA ASP 38 HA ASP 38 15.989 -8.713 -17.165 299 HB2 ASP 38 1HB ASP 38 17.434 -6.682 -18.032 300 HB3 ASP 38 2HB ASP 38 17.156 -6.005 -16.415 301 H THR 39 H THR 39 13.398 -8.040 -16.363 302 HA THR 39 HA THR 39 13.337 -6.370 -14.060 303 HB THR 39 HB THR 39 11.452 -6.886 -15.730 304 HG1 THR 39 HG1 THR 39 11.387 -6.099 -13.307 305 HG21 THR 39 1HG2 THR 39 11.473 -9.297 -15.827 306 HG22 THR 39 2HG2 THR 39 9.941 -8.795 -15.092 307 HG23 THR 39 3HG2 THR 39 11.234 -9.418 -14.083 308 H GLN 40 H GLN 40 14.148 -9.744 -14.333 309 HA GLN 40 HA GLN 40 13.607 -10.147 -11.400 310 HB2 GLN 40 1HB GLN 40 12.477 -11.419 -13.378 311 HB3 GLN 40 2HB GLN 40 13.972 -12.367 -13.430 312 HG2 GLN 40 1HG GLN 40 12.895 -13.715 -11.922 313 HG3 GLN 40 2HG GLN 40 13.417 -12.495 -10.762 314 HE21 GLN 40 1HE2 GLN 40 9.545 -13.125 -11.002 315 HE22 GLN 40 2HE2 GLN 40 10.781 -14.304 -11.458 316 H GLY 41 H GLY 41 16.133 -9.265 -13.252 317 HA2 GLY 41 1HA GLY 41 18.464 -9.389 -12.862 318 HA3 GLY 41 2HA GLY 41 18.216 -10.659 -11.625 319 H LEU 42 H LEU 42 16.361 -11.841 -13.776 320 HA LEU 42 HA LEU 42 18.363 -13.497 -15.095 321 HB2 LEU 42 1HB LEU 42 15.350 -13.426 -15.236 322 HB3 LEU 42 2HB LEU 42 16.373 -14.587 -16.086 323 HG LEU 42 HG LEU 42 16.219 -14.377 -13.014 324 HD11 LEU 42 1HD1 LEU 42 14.857 -16.428 -14.807 325 HD12 LEU 42 2HD1 LEU 42 14.040 -14.977 -14.190 326 HD13 LEU 42 3HD1 LEU 42 14.658 -16.177 -13.045 327 HD21 LEU 42 1HD2 LEU 42 17.440 -16.432 -14.957 328 HD22 LEU 42 2HD2 LEU 42 17.236 -16.707 -13.220 329 HD23 LEU 42 3HD2 LEU 42 18.304 -15.425 -13.765 330 H ASP 43 H ASP 43 19.235 -12.778 -16.965 331 HA ASP 43 HA ASP 43 18.280 -10.414 -18.238 332 HB2 ASP 43 1HB ASP 43 20.043 -10.711 -19.847 333 HB3 ASP 43 2HB ASP 43 20.663 -11.228 -18.260 334 H GLY 44 H GLY 44 17.142 -10.120 -20.196 335 HA2 GLY 44 1HA GLY 44 15.903 -10.798 -22.054 336 HA3 GLY 44 2HA GLY 44 16.248 -12.461 -21.662 337 H TRP 45 H TRP 45 15.101 -11.368 -18.777 338 HA TRP 45 HA TRP 45 12.319 -12.126 -19.470 339 HB2 TRP 45 1HB TRP 45 13.818 -12.061 -16.862 340 HB3 TRP 45 2HB TRP 45 12.047 -12.179 -16.943 341 HD1 TRP 45 HD1 TRP 45 15.230 -14.253 -18.050 342 HE1 TRP 45 HE1 TRP 45 14.542 -16.705 -18.215 343 HE3 TRP 45 HE3 TRP 45 10.128 -13.709 -17.389 344 HZ2 TRP 45 HZ2 TRP 45 12.182 -18.235 -18.338 345 HZ3 TRP 45 HZ3 TRP 45 8.734 -15.789 -17.418 346 HH2 TRP 45 HH2 TRP 45 9.738 -17.979 -17.985 347 H TRP 46 H TRP 46 10.870 -10.644 -19.848 348 HA TRP 46 HA TRP 46 11.449 -7.872 -18.817 349 HB2 TRP 46 1HB TRP 46 9.681 -8.786 -21.085 350 HB3 TRP 46 2HB TRP 46 10.024 -7.098 -20.678 351 HD1 TRP 46 HD1 TRP 46 13.279 -8.329 -20.226 352 HE1 TRP 46 HE1 TRP 46 14.762 -8.529 -22.292 353 HE3 TRP 46 HE3 TRP 46 9.621 -7.849 -23.796 354 HZ2 TRP 46 HZ2 TRP 46 14.429 -8.509 -25.087 355 HZ3 TRP 46 HZ3 TRP 46 10.275 -8.024 -26.210 356 HH2 TRP 46 HH2 TRP 46 12.694 -8.449 -26.810 357 H LEU 47 H LEU 47 9.868 -6.702 -17.929 358 HA LEU 47 HA LEU 47 7.580 -8.216 -16.797 359 HB2 LEU 47 1HB LEU 47 8.865 -6.638 -15.379 360 HB3 LEU 47 2HB LEU 47 8.455 -5.331 -16.482 361 HG LEU 47 HG LEU 47 6.022 -5.700 -15.889 362 HD11 LEU 47 1HD1 LEU 47 7.132 -7.791 -13.965 363 HD12 LEU 47 2HD1 LEU 47 5.853 -7.931 -15.198 364 HD13 LEU 47 3HD1 LEU 47 5.553 -7.044 -13.768 365 HD21 LEU 47 1HD2 LEU 47 7.714 -5.234 -13.480 366 HD22 LEU 47 2HD2 LEU 47 6.079 -4.631 -13.832 367 HD23 LEU 47 3HD2 LEU 47 7.415 -4.040 -14.780 368 H CYS 48 H CYS 48 5.743 -8.325 -17.923 369 HA CYS 48 HA CYS 48 5.077 -6.105 -19.744 370 HB2 CYS 48 1HB CYS 48 4.378 -8.979 -20.078 371 HB3 CYS 48 2HB CYS 48 4.009 -7.688 -21.247 372 HG CYS 48 HG CYS 48 6.980 -8.736 -20.234 373 H SER 49 H SER 49 2.763 -5.817 -20.232 374 HA SER 49 HA SER 49 1.013 -6.737 -18.009 375 HB2 SER 49 1HB SER 49 1.473 -4.411 -17.710 376 HB3 SER 49 2HB SER 49 1.016 -4.087 -19.425 377 HG SER 49 HG SER 49 -0.517 -3.667 -17.590 378 H LEU 50 H LEU 50 -0.805 -7.827 -18.588 379 HA LEU 50 HA LEU 50 -1.986 -7.502 -21.285 380 HB2 LEU 50 1HB LEU 50 -0.045 -9.019 -21.672 381 HB3 LEU 50 2HB LEU 50 -0.551 -10.039 -20.348 382 HG LEU 50 HG LEU 50 -2.690 -10.491 -21.706 383 HD11 LEU 50 1HD1 LEU 50 -2.579 -9.997 -24.132 384 HD12 LEU 50 2HD1 LEU 50 -1.037 -9.134 -23.921 385 HD13 LEU 50 3HD1 LEU 50 -2.548 -8.510 -23.220 386 HD21 LEU 50 1HD2 LEU 50 -1.728 -12.163 -22.994 387 HD22 LEU 50 2HD2 LEU 50 -0.745 -12.011 -21.543 388 HD23 LEU 50 3HD2 LEU 50 -0.193 -11.343 -23.069 389 H HIS 51 H HIS 51 -4.110 -8.265 -21.294 390 HA HIS 51 HA HIS 51 -6.063 -8.912 -20.422 391 HB2 HIS 51 1HB HIS 51 -4.472 -11.048 -20.527 392 HB3 HIS 51 2HB HIS 51 -4.818 -11.105 -18.809 393 HD1 HIS 51 HD1 HIS 51 -6.714 -11.027 -22.147 394 HD2 HIS 51 HD2 HIS 51 -7.164 -12.293 -18.200 395 HE1 HIS 51 HE1 HIS 51 -8.910 -12.286 -22.022 396 H GLY 52 H GLY 52 -4.598 -6.922 -18.765 397 HA2 GLY 52 1HA GLY 52 -5.374 -5.751 -16.950 398 HA3 GLY 52 2HA GLY 52 -6.385 -7.114 -16.540 399 H ARG 53 H ARG 53 -3.260 -8.201 -17.007 400 HA ARG 53 HA ARG 53 -2.520 -7.783 -14.083 401 HB2 ARG 53 1HB ARG 53 -1.804 -10.239 -15.759 402 HB3 ARG 53 2HB ARG 53 -1.565 -9.972 -13.999 403 HG2 ARG 53 1HG ARG 53 -4.053 -10.106 -13.755 404 HG3 ARG 53 2HG ARG 53 -4.150 -10.551 -15.482 405 HD2 ARG 53 1HD ARG 53 -2.565 -12.463 -15.059 406 HD3 ARG 53 2HD ARG 53 -2.626 -12.057 -13.329 407 HE ARG 53 HE ARG 53 -5.188 -12.531 -14.509 408 HH11 ARG 53 1HH1 ARG 53 -2.399 -14.224 -13.086 409 HH12 ARG 53 2HH1 ARG 53 -3.391 -15.597 -12.660 410 HH21 ARG 53 1HH2 ARG 53 -6.327 -14.321 -13.898 411 HH22 ARG 53 2HH2 ARG 53 -5.537 -15.637 -13.130 412 H GLN 54 H GLN 54 -0.171 -7.935 -13.733 413 HA GLN 54 HA GLN 54 1.464 -7.706 -16.252 414 HB2 GLN 54 1HB GLN 54 2.921 -6.077 -15.268 415 HB3 GLN 54 2HB GLN 54 1.244 -5.452 -15.092 416 HG2 GLN 54 1HG GLN 54 1.386 -6.315 -12.665 417 HG3 GLN 54 2HG GLN 54 3.123 -6.576 -12.970 418 HE21 GLN 54 1HE2 GLN 54 3.705 -3.305 -11.847 419 HE22 GLN 54 2HE2 GLN 54 4.077 -5.016 -11.771 420 H GLY 55 H GLY 55 3.440 -8.754 -16.058 421 HA2 GLY 55 1HA GLY 55 4.392 -10.196 -13.759 422 HA3 GLY 55 2HA GLY 55 3.410 -11.249 -14.851 423 H ILE 56 H ILE 56 5.876 -11.927 -14.519 424 HA ILE 56 HA ILE 56 7.631 -10.782 -16.526 425 HB ILE 56 HB ILE 56 9.312 -12.357 -15.842 426 HG12 ILE 56 1HG1 ILE 56 7.114 -13.858 -14.355 427 HG13 ILE 56 2HG1 ILE 56 7.862 -14.398 -15.869 428 HG21 ILE 56 1HG2 ILE 56 7.778 -11.784 -13.250 429 HG22 ILE 56 2HG2 ILE 56 9.533 -11.803 -13.554 430 HG23 ILE 56 3HG2 ILE 56 8.500 -10.477 -14.250 431 HD11 ILE 56 1HD1 ILE 56 8.952 -15.690 -14.299 432 HD12 ILE 56 2HD1 ILE 56 10.088 -14.374 -14.560 433 HD13 ILE 56 3HD1 ILE 56 9.038 -14.377 -13.105 434 H VAL 57 H VAL 57 8.309 -11.454 -18.392 435 HA VAL 57 HA VAL 57 7.040 -13.891 -19.674 436 HB VAL 57 HB VAL 57 7.195 -11.029 -20.845 437 HG11 VAL 57 1HG1 VAL 57 6.448 -13.654 -22.123 438 HG12 VAL 57 2HG1 VAL 57 5.775 -12.124 -22.724 439 HG13 VAL 57 3HG1 VAL 57 7.536 -12.368 -22.703 440 HG21 VAL 57 1HG2 VAL 57 4.736 -12.670 -20.099 441 HG22 VAL 57 2HG2 VAL 57 5.320 -11.220 -19.238 442 HG23 VAL 57 3HG2 VAL 57 4.703 -11.060 -20.883 443 HA PRO 58 HA PRO 58 11.399 -13.965 -20.912 444 HB2 PRO 58 1HB PRO 58 11.337 -15.952 -22.786 445 HB3 PRO 58 2HB PRO 58 11.418 -16.257 -21.000 446 HG2 PRO 58 1HG PRO 58 9.048 -16.397 -22.877 447 HG3 PRO 58 2HG PRO 58 9.541 -17.487 -21.583 448 HD2 PRO 58 1HD PRO 58 7.612 -15.524 -21.430 449 HD3 PRO 58 2HD PRO 58 8.524 -16.079 -20.024 450 H GLY 59 H GLY 59 12.005 -12.308 -22.169 451 HA2 GLY 59 1HA GLY 59 10.598 -11.232 -24.357 452 HA3 GLY 59 2HA GLY 59 12.282 -10.894 -23.879 453 H ASN 60 H ASN 60 12.948 -13.753 -24.250 454 HA ASN 60 HA ASN 60 13.875 -13.822 -26.923 455 HB2 ASN 60 1HB ASN 60 14.659 -15.247 -25.088 456 HB3 ASN 60 2HB ASN 60 13.124 -16.144 -25.062 457 HD21 ASN 60 1HD2 ASN 60 14.129 -18.360 -27.464 458 HD22 ASN 60 2HD2 ASN 60 13.221 -18.028 -26.013 459 H ARG 61 H ARG 61 10.761 -14.771 -25.532 460 HA ARG 61 HA ARG 61 9.752 -15.956 -28.007 461 HB2 ARG 61 1HB ARG 61 8.600 -15.691 -25.252 462 HB3 ARG 61 2HB ARG 61 7.743 -16.450 -26.599 463 HG2 ARG 61 1HG ARG 61 9.832 -17.935 -26.776 464 HG3 ARG 61 2HG ARG 61 10.258 -17.311 -25.204 465 HD2 ARG 61 1HD ARG 61 7.979 -18.119 -24.336 466 HD3 ARG 61 2HD ARG 61 7.767 -18.909 -25.885 467 HE ARG 61 HE ARG 61 9.671 -19.705 -23.763 468 HH11 ARG 61 1HH1 ARG 61 8.862 -20.114 -27.179 469 HH12 ARG 61 2HH1 ARG 61 9.703 -21.627 -27.281 470 HH21 ARG 61 1HH2 ARG 61 10.721 -21.648 -23.965 471 HH22 ARG 61 2HH2 ARG 61 10.750 -22.464 -25.519 472 H LEU 62 H LEU 62 10.115 -12.870 -27.083 473 HA LEU 62 HA LEU 62 7.504 -12.011 -28.193 474 HB2 LEU 62 1HB LEU 62 9.458 -10.476 -26.460 475 HB3 LEU 62 2HB LEU 62 8.023 -9.787 -27.197 476 HG LEU 62 HG LEU 62 8.101 -11.991 -25.128 477 HD11 LEU 62 1HD1 LEU 62 8.761 -9.782 -24.359 478 HD12 LEU 62 2HD1 LEU 62 7.192 -10.205 -23.693 479 HD13 LEU 62 3HD1 LEU 62 7.314 -9.046 -25.059 480 HD21 LEU 62 1HD2 LEU 62 6.125 -12.319 -26.514 481 HD22 LEU 62 2HD2 LEU 62 5.682 -10.585 -26.446 482 HD23 LEU 62 3HD2 LEU 62 5.616 -11.632 -24.990 483 H LYS 63 H LYS 63 7.402 -10.275 -29.609 484 HA LYS 63 HA LYS 63 10.006 -9.608 -31.072 485 HB2 LYS 63 1HB LYS 63 8.562 -11.058 -32.446 486 HB3 LYS 63 2HB LYS 63 7.179 -9.937 -32.255 487 HG2 LYS 63 1HG LYS 63 8.530 -8.165 -33.481 488 HG3 LYS 63 2HG LYS 63 9.859 -9.377 -33.745 489 HD2 LYS 63 1HD LYS 63 8.291 -10.768 -35.066 490 HD3 LYS 63 2HD LYS 63 7.018 -9.537 -34.883 491 HE2 LYS 63 1HE LYS 63 8.631 -7.868 -35.939 492 HE3 LYS 63 2HE LYS 63 9.780 -9.201 -36.269 493 HZ1 LYS 63 1HZ LYS 63 8.077 -10.257 -37.747 494 HZ2 LYS 63 2HZ LYS 63 8.276 -8.650 -38.250 495 HZ3 LYS 63 3HZ LYS 63 6.963 -9.098 -37.366 496 H ILE 64 H ILE 64 10.429 -7.598 -30.613 497 HA ILE 64 HA ILE 64 8.566 -5.604 -29.634 498 HB ILE 64 HB ILE 64 11.253 -5.288 -31.075 499 HG12 ILE 64 1HG1 ILE 64 11.540 -6.561 -29.015 500 HG13 ILE 64 2HG1 ILE 64 12.124 -4.918 -28.757 501 HG21 ILE 64 1HG2 ILE 64 9.999 -3.155 -31.114 502 HG22 ILE 64 2HG2 ILE 64 9.641 -3.287 -29.354 503 HG23 ILE 64 3HG2 ILE 64 11.311 -3.030 -29.918 504 HD11 ILE 64 1HD1 ILE 64 9.433 -5.960 -27.749 505 HD12 ILE 64 2HD1 ILE 64 10.859 -5.675 -26.751 506 HD13 ILE 64 3HD1 ILE 64 10.063 -4.333 -27.507 507 H LEU 65 H LEU 65 7.102 -4.434 -30.589 508 HA LEU 65 HA LEU 65 6.728 -4.608 -33.505 509 HB2 LEU 65 1HB LEU 65 5.248 -3.008 -31.402 510 HB3 LEU 65 2HB LEU 65 4.792 -3.075 -33.120 511 HG LEU 65 HG LEU 65 4.847 -5.423 -31.140 512 HD11 LEU 65 1HD1 LEU 65 2.984 -3.861 -30.585 513 HD12 LEU 65 2HD1 LEU 65 2.356 -5.278 -31.317 514 HD13 LEU 65 3HD1 LEU 65 2.477 -3.838 -32.289 515 HD21 LEU 65 1HD2 LEU 65 3.698 -6.688 -32.863 516 HD22 LEU 65 2HD2 LEU 65 5.243 -6.149 -33.486 517 HD23 LEU 65 3HD2 LEU 65 3.706 -5.308 -33.973 518 H VAL 66 H VAL 66 8.543 -3.610 -34.441 519 HA VAL 66 HA VAL 66 9.268 -0.891 -33.575 520 HB VAL 66 HB VAL 66 10.875 -1.084 -35.517 521 HG11 VAL 66 1HG1 VAL 66 11.431 -1.923 -33.267 522 HG12 VAL 66 2HG1 VAL 66 10.964 -3.560 -33.808 523 HG13 VAL 66 3HG1 VAL 66 12.333 -2.725 -34.586 524 HG21 VAL 66 1HG2 VAL 66 11.051 -3.128 -36.924 525 HG22 VAL 66 2HG2 VAL 66 9.828 -3.989 -35.946 526 HG23 VAL 66 3HG2 VAL 66 9.362 -2.585 -36.963 527 H GLY 67 H GLY 67 9.218 0.898 -35.251 528 HA2 GLY 67 1HA GLY 67 7.779 0.751 -37.610 529 HA3 GLY 67 2HA GLY 67 6.624 1.113 -36.339 530 H MET 68 H MET 68 6.684 3.104 -38.029 531 HA MET 68 HA MET 68 8.781 5.067 -37.383 532 HB2 MET 68 1HB MET 68 6.572 5.072 -39.468 533 HB3 MET 68 2HB MET 68 7.746 6.348 -39.270 534 HG2 MET 68 1HG MET 68 9.595 4.721 -39.767 535 HG3 MET 68 2HG MET 68 8.393 3.453 -39.944 536 HE1 MET 68 1HE MET 68 9.098 6.734 -43.079 537 HE2 MET 68 2HE MET 68 8.895 7.035 -41.361 538 HE3 MET 68 3HE MET 68 10.305 6.182 -41.938 539 H TYR 69 H TYR 69 6.345 4.265 -35.585 540 HA TYR 69 HA TYR 69 4.745 6.629 -35.655 541 HB2 TYR 69 1HB TYR 69 4.879 4.424 -33.677 542 HB3 TYR 69 2HB TYR 69 3.598 5.653 -33.756 543 HD1 TYR 69 HD1 TYR 69 2.229 5.912 -35.902 544 HD2 TYR 69 HD2 TYR 69 4.550 2.373 -34.958 545 HE1 TYR 69 HE1 TYR 69 0.800 4.563 -37.472 546 HE2 TYR 69 HE2 TYR 69 3.126 0.997 -36.515 547 HH TYR 69 HH TYR 69 0.310 2.602 -38.248 548 H ASP 70 H ASP 70 5.201 8.469 -34.744 549 HA ASP 70 HA ASP 70 6.428 8.531 -32.036 550 HB2 ASP 70 1HB ASP 70 8.098 10.148 -32.613 551 HB3 ASP 70 2HB ASP 70 8.303 8.776 -33.753 552 H LYS 71 H LYS 71 6.164 10.791 -31.147 553 HA LYS 71 HA LYS 71 4.469 12.174 -30.362 554 HB2 LYS 71 1HB LYS 71 4.795 13.000 -33.227 555 HB3 LYS 71 2HB LYS 71 3.855 13.915 -32.023 556 HG2 LYS 71 1HG LYS 71 5.932 14.074 -30.572 557 HG3 LYS 71 2HG LYS 71 6.831 13.263 -31.877 558 HD2 LYS 71 1HD LYS 71 7.307 15.595 -32.015 559 HD3 LYS 71 2HD LYS 71 6.251 15.182 -33.377 560 HE2 LYS 71 1HE LYS 71 4.263 16.031 -32.122 561 HE3 LYS 71 2HE LYS 71 5.311 16.530 -30.792 562 HZ1 LYS 71 1HZ LYS 71 5.577 17.592 -33.539 563 HZ2 LYS 71 2HZ LYS 71 6.504 18.038 -32.277 564 HZ3 LYS 71 3HZ LYS 71 4.906 18.386 -32.320 565 H LYS 72 H LYS 72 3.200 10.105 -30.294 566 HA LYS 72 HA LYS 72 0.842 9.761 -31.879 567 HB2 LYS 72 1HB LYS 72 1.550 9.016 -29.019 568 HB3 LYS 72 2HB LYS 72 0.137 8.385 -29.865 569 HG2 LYS 72 1HG LYS 72 1.654 7.354 -31.529 570 HG3 LYS 72 2HG LYS 72 3.043 8.077 -30.683 571 HD2 LYS 72 1HD LYS 72 2.539 6.719 -28.708 572 HD3 LYS 72 2HD LYS 72 1.119 6.012 -29.514 573 HE2 LYS 72 1HE LYS 72 2.512 4.947 -31.177 574 HE3 LYS 72 2HE LYS 72 4.008 5.736 -30.500 575 HZ1 LYS 72 1HZ LYS 72 2.285 3.703 -29.105 576 HZ2 LYS 72 2HZ LYS 72 3.508 4.535 -28.346 577 HZ3 LYS 72 3HZ LYS 72 3.863 3.507 -29.623 578 HA PRO 73 HA PRO 73 -1.572 13.012 -30.817 579 HB2 PRO 73 1HB PRO 73 -4.107 12.247 -30.329 580 HB3 PRO 73 2HB PRO 73 -3.326 12.169 -31.969 581 HG2 PRO 73 1HG PRO 73 -3.640 9.984 -29.892 582 HG3 PRO 73 2HG PRO 73 -4.051 9.972 -31.648 583 HD2 PRO 73 1HD PRO 73 -1.731 8.975 -30.776 584 HD3 PRO 73 2HD PRO 73 -1.714 9.967 -32.285 585 H ALA 74 H ALA 74 -1.811 10.666 -28.224 586 HA ALA 74 HA ALA 74 -1.979 10.973 -25.924 587 HB1 ALA 74 1HB ALA 74 -0.690 12.753 -24.986 588 HB2 ALA 74 2HB ALA 74 0.139 12.335 -26.504 589 HB3 ALA 74 3HB ALA 74 -0.915 13.784 -26.419 590 H GLY 75 H GLY 75 -4.307 11.434 -27.369 591 HA2 GLY 75 1HA GLY 75 -6.155 12.239 -25.583 592 HA3 GLY 75 2HA GLY 75 -5.544 13.805 -26.150 593 H GLU 76 H GLU 76 -7.818 11.323 -26.669 594 HA GLU 76 HA GLU 76 -8.470 12.509 -29.354 595 HB2 GLU 76 1HB GLU 76 -8.468 9.563 -28.673 596 HB3 GLU 76 2HB GLU 76 -9.299 10.240 -30.057 597 HG2 GLU 76 1HG GLU 76 -7.135 11.113 -30.914 598 HG3 GLU 76 2HG GLU 76 -6.332 10.392 -29.509 599 H PHE 77 H PHE 77 -10.903 11.163 -29.600 600 HA PHE 77 HA PHE 77 -13.030 11.038 -28.997 601 HB2 PHE 77 1HB PHE 77 -11.913 9.532 -27.270 602 HB3 PHE 77 2HB PHE 77 -12.066 10.879 -26.082 603 HD1 PHE 77 HD1 PHE 77 -14.528 9.585 -28.696 604 HD2 PHE 77 HD2 PHE 77 -13.636 10.129 -24.545 605 HE1 PHE 77 HE1 PHE 77 -16.819 8.847 -28.154 606 HE2 PHE 77 HE2 PHE 77 -15.879 9.400 -23.953 607 HZ PHE 77 HZ PHE 77 -17.536 8.624 -25.774 608 H ILE 78 H ILE 78 -12.056 13.549 -29.447 609 HA ILE 78 HA ILE 78 -13.909 15.293 -27.854 610 HB ILE 78 HB ILE 78 -12.198 17.127 -28.271 611 HG12 ILE 78 1HG1 ILE 78 -10.329 14.833 -28.945 612 HG13 ILE 78 2HG1 ILE 78 -11.083 15.887 -30.143 613 HG21 ILE 78 1HG2 ILE 78 -11.253 14.756 -26.568 614 HG22 ILE 78 2HG2 ILE 78 -10.651 16.395 -26.423 615 HG23 ILE 78 3HG2 ILE 78 -12.290 16.065 -26.043 616 HD11 ILE 78 1HD1 ILE 78 -9.834 17.803 -29.391 617 HD12 ILE 78 2HD1 ILE 78 -9.149 16.908 -28.027 618 HD13 ILE 78 3HD1 ILE 78 -8.688 16.495 -29.681 619 H VAL 79 H VAL 79 -14.536 17.203 -29.256 620 HA VAL 79 HA VAL 79 -15.319 16.395 -31.913 621 HB VAL 79 HB VAL 79 -15.604 19.053 -30.452 622 HG11 VAL 79 1HG1 VAL 79 -17.055 17.924 -32.926 623 HG12 VAL 79 2HG1 VAL 79 -17.510 19.419 -32.080 624 HG13 VAL 79 3HG1 VAL 79 -15.961 19.293 -32.924 625 HG21 VAL 79 1HG2 VAL 79 -18.009 18.123 -30.063 626 HG22 VAL 79 2HG2 VAL 79 -17.462 16.567 -30.653 627 HG23 VAL 79 3HG2 VAL 79 -16.782 17.224 -29.170 628 H THR 80 H THR 80 -14.274 16.816 -33.765 629 HA THR 80 HA THR 80 -11.840 18.413 -33.870 630 HB THR 80 HB THR 80 -12.051 17.882 -36.393 631 HG1 THR 80 HG1 THR 80 -13.768 16.270 -36.858 632 HG21 THR 80 1HG2 THR 80 -10.732 16.311 -35.051 633 HG22 THR 80 2HG2 THR 80 -11.793 15.393 -36.164 634 HG23 THR 80 3HG2 THR 80 -12.230 15.542 -34.455 635 H ASP 81 H ASP 81 -15.178 18.725 -35.169 636 HA ASP 81 HA ASP 81 -14.831 21.130 -36.660 637 HB2 ASP 81 1HB ASP 81 -17.325 19.943 -35.324 638 HB3 ASP 81 2HB ASP 81 -17.356 21.535 -36.187 639 HXT ASP 81 H02 ASP 81 -15.203 22.462 -33.032 Start of MODEL 38 1 H2 GLY 1 2H0 GLY 1 2.650 11.005 -24.670 2 H GLY 1 1H0 GLY 1 1.940 9.708 -25.292 3 HA2 GLY 1 1HA GLY 1 1.483 10.953 -22.693 4 HA3 GLY 1 2HA GLY 1 0.345 9.758 -23.316 5 H SER 2 H SER 2 1.476 9.251 -20.950 6 HA SER 2 HA SER 2 2.646 7.608 -19.774 7 HB2 SER 2 1HB SER 2 2.517 6.012 -22.360 8 HB3 SER 2 2HB SER 2 2.773 5.425 -20.709 9 HG SER 2 HG SER 2 0.600 5.229 -21.436 10 H MET 3 H MET 3 4.361 9.565 -21.273 11 HA MET 3 HA MET 3 6.727 8.275 -22.182 12 HB2 MET 3 1HB MET 3 5.784 10.675 -22.285 13 HB3 MET 3 2HB MET 3 6.615 10.934 -20.760 14 HG2 MET 3 1HG MET 3 8.749 10.228 -21.890 15 HG3 MET 3 2HG MET 3 7.860 10.231 -23.401 16 HE1 MET 3 1HE MET 3 7.191 12.360 -24.691 17 HE2 MET 3 2HE MET 3 6.067 12.844 -23.409 18 HE3 MET 3 3HE MET 3 7.247 14.007 -23.976 19 H LYS 4 H LYS 4 5.560 8.477 -18.999 20 HA LYS 4 HA LYS 4 8.093 8.501 -17.603 21 HB2 LYS 4 1HB LYS 4 5.239 8.049 -16.741 22 HB3 LYS 4 2HB LYS 4 6.612 7.847 -15.642 23 HG2 LYS 4 1HG LYS 4 7.330 10.096 -15.877 24 HG3 LYS 4 2HG LYS 4 6.109 10.434 -17.149 25 HD2 LYS 4 1HD LYS 4 5.280 11.354 -15.001 26 HD3 LYS 4 2HD LYS 4 4.293 9.975 -15.463 27 HE2 LYS 4 1HE LYS 4 5.604 8.633 -13.812 28 HE3 LYS 4 2HE LYS 4 6.466 10.084 -13.311 29 HZ1 LYS 4 1HZ LYS 4 3.556 9.932 -13.295 30 HZ2 LYS 4 2HZ LYS 4 4.533 11.013 -12.484 31 HZ3 LYS 4 3HZ LYS 4 4.484 9.450 -11.962 32 H TYR 5 H TYR 5 6.444 6.131 -19.379 33 HA TYR 5 HA TYR 5 8.114 4.015 -18.056 34 HB2 TYR 5 1HB TYR 5 5.227 3.949 -18.786 35 HB3 TYR 5 2HB TYR 5 6.178 2.570 -19.312 36 HD1 TYR 5 HD1 TYR 5 7.628 1.302 -17.563 37 HD2 TYR 5 HD2 TYR 5 4.593 4.173 -16.486 38 HE1 TYR 5 HE1 TYR 5 7.543 0.314 -15.218 39 HE2 TYR 5 HE2 TYR 5 4.503 3.237 -14.199 40 HH TYR 5 HH TYR 5 5.116 1.382 -12.877 41 H LEU 6 H LEU 6 8.414 2.223 -19.800 42 HA LEU 6 HA LEU 6 9.762 3.467 -21.971 43 HB2 LEU 6 1HB LEU 6 8.877 0.588 -21.433 44 HB3 LEU 6 2HB LEU 6 9.785 1.003 -22.887 45 HG LEU 6 HG LEU 6 10.784 1.155 -20.037 46 HD11 LEU 6 1HD1 LEU 6 10.521 -1.129 -20.906 47 HD12 LEU 6 2HD1 LEU 6 12.263 -0.725 -20.868 48 HD13 LEU 6 3HD1 LEU 6 11.370 -0.695 -22.405 49 HD21 LEU 6 1HD2 LEU 6 12.017 2.014 -22.651 50 HD22 LEU 6 2HD2 LEU 6 13.014 1.468 -21.314 51 HD23 LEU 6 3HD2 LEU 6 11.992 2.848 -21.103 52 H ASN 7 H ASN 7 6.648 1.859 -21.643 53 HA ASN 7 HA ASN 7 4.758 1.827 -22.981 54 HB2 ASN 7 1HB ASN 7 5.369 4.397 -22.687 55 HB3 ASN 7 2HB ASN 7 5.763 4.282 -24.405 56 HD21 ASN 7 1HD2 ASN 7 2.504 5.074 -25.128 57 HD22 ASN 7 2HD2 ASN 7 4.196 5.510 -25.211 58 H VAL 8 H VAL 8 6.939 0.276 -23.869 59 HA VAL 8 HA VAL 8 6.714 0.338 -26.833 60 HB VAL 8 HB VAL 8 8.702 -1.081 -24.989 61 HG11 VAL 8 1HG1 VAL 8 8.394 -2.481 -26.913 62 HG12 VAL 8 2HG1 VAL 8 8.388 -1.098 -28.008 63 HG13 VAL 8 3HG1 VAL 8 9.888 -1.582 -27.203 64 HG21 VAL 8 1HG2 VAL 8 9.085 1.233 -26.956 65 HG22 VAL 8 2HG2 VAL 8 9.063 1.395 -25.205 66 HG23 VAL 8 3HG2 VAL 8 10.349 0.491 -25.972 67 H LEU 9 H LEU 9 5.916 -1.623 -27.809 68 HA LEU 9 HA LEU 9 4.882 -3.675 -25.909 69 HB2 LEU 9 1HB LEU 9 2.822 -3.798 -27.319 70 HB3 LEU 9 2HB LEU 9 2.963 -2.417 -26.247 71 HG LEU 9 HG LEU 9 3.851 -1.914 -29.063 72 HD11 LEU 9 1HD1 LEU 9 1.476 -1.751 -29.854 73 HD12 LEU 9 2HD1 LEU 9 0.962 -2.466 -28.306 74 HD13 LEU 9 3HD1 LEU 9 1.966 -3.423 -29.431 75 HD21 LEU 9 1HD2 LEU 9 3.725 -0.095 -27.355 76 HD22 LEU 9 2HD2 LEU 9 2.007 -0.386 -27.236 77 HD23 LEU 9 3HD2 LEU 9 2.705 0.219 -28.722 78 H ALA 10 H ALA 10 4.397 -5.750 -26.769 79 HA ALA 10 HA ALA 10 5.897 -6.281 -29.352 80 HB1 ALA 10 1HB ALA 10 7.462 -6.544 -27.442 81 HB2 ALA 10 2HB ALA 10 6.319 -7.610 -26.635 82 HB3 ALA 10 3HB ALA 10 7.065 -8.122 -28.150 83 H LYS 11 H LYS 11 5.556 -8.445 -30.122 84 HA LYS 11 HA LYS 11 2.776 -9.469 -29.500 85 HB2 LYS 11 1HB LYS 11 3.174 -8.554 -31.824 86 HB3 LYS 11 2HB LYS 11 4.475 -9.697 -32.015 87 HG2 LYS 11 1HG LYS 11 2.975 -11.601 -32.017 88 HG3 LYS 11 2HG LYS 11 1.593 -10.600 -31.568 89 HD2 LYS 11 1HD LYS 11 1.314 -10.937 -33.845 90 HD3 LYS 11 2HD LYS 11 2.070 -9.335 -33.806 91 HE2 LYS 11 1HE LYS 11 4.302 -10.279 -34.418 92 HE3 LYS 11 2HE LYS 11 3.623 -11.948 -34.287 93 HZ1 LYS 11 1HZ LYS 11 2.740 -9.960 -36.236 94 HZ2 LYS 11 2HZ LYS 11 2.141 -11.480 -36.073 95 HZ3 LYS 11 3HZ LYS 11 3.692 -11.204 -36.580 96 H ALA 12 H ALA 12 2.641 -11.576 -28.938 97 HA ALA 12 HA ALA 12 5.027 -13.023 -28.158 98 HB1 ALA 12 1HB ALA 12 3.123 -13.210 -26.714 99 HB2 ALA 12 2HB ALA 12 2.023 -13.621 -28.049 100 HB3 ALA 12 3HB ALA 12 3.251 -14.776 -27.497 101 H LEU 13 H LEU 13 6.115 -14.478 -29.295 102 HA LEU 13 HA LEU 13 5.095 -15.178 -31.977 103 HB2 LEU 13 1HB LEU 13 7.764 -15.616 -30.615 104 HB3 LEU 13 2HB LEU 13 7.396 -16.144 -32.254 105 HG LEU 13 HG LEU 13 7.516 -13.258 -31.358 106 HD11 LEU 13 1HD1 LEU 13 9.608 -13.158 -32.689 107 HD12 LEU 13 2HD1 LEU 13 9.511 -14.874 -33.072 108 HD13 LEU 13 3HD1 LEU 13 9.780 -14.368 -31.392 109 HD21 LEU 13 1HD2 LEU 13 5.926 -13.789 -33.302 110 HD22 LEU 13 2HD2 LEU 13 7.388 -14.390 -34.191 111 HD23 LEU 13 3HD2 LEU 13 7.256 -12.682 -33.690 112 H TYR 14 H TYR 14 5.494 -16.525 -28.804 113 HA TYR 14 HA TYR 14 4.608 -19.205 -29.847 114 HB2 TYR 14 1HB TYR 14 6.536 -18.708 -27.553 115 HB3 TYR 14 2HB TYR 14 6.115 -20.302 -28.264 116 HD1 TYR 14 HD1 TYR 14 8.163 -17.321 -28.678 117 HD2 TYR 14 HD2 TYR 14 7.141 -21.147 -30.262 118 HE1 TYR 14 HE1 TYR 14 10.169 -17.260 -30.073 119 HE2 TYR 14 HE2 TYR 14 9.108 -21.006 -31.818 120 HH TYR 14 HH TYR 14 11.440 -18.254 -31.605 121 H ASP 15 H ASP 15 3.454 -20.432 -28.034 122 HA ASP 15 HA ASP 15 1.961 -18.423 -26.452 123 HB2 ASP 15 1HB ASP 15 0.373 -20.178 -26.074 124 HB3 ASP 15 2HB ASP 15 0.742 -20.147 -27.807 125 H ASN 16 H ASN 16 1.358 -19.133 -24.182 126 HA ASN 16 HA ASN 16 3.456 -20.720 -22.805 127 HB2 ASN 16 1HB ASN 16 4.311 -18.386 -22.949 128 HB3 ASN 16 2HB ASN 16 2.864 -17.807 -22.083 129 HD21 ASN 16 1HD2 ASN 16 4.585 -18.329 -19.070 130 HD22 ASN 16 2HD2 ASN 16 3.581 -17.270 -20.058 131 H VAL 17 H VAL 17 2.887 -21.541 -20.831 132 HA VAL 17 HA VAL 17 0.105 -20.850 -19.819 133 HB VAL 17 HB VAL 17 1.703 -23.457 -19.622 134 HG11 VAL 17 1HG1 VAL 17 -0.455 -24.355 -18.595 135 HG12 VAL 17 2HG1 VAL 17 0.407 -23.162 -17.605 136 HG13 VAL 17 3HG1 VAL 17 -1.032 -22.697 -18.519 137 HG21 VAL 17 1HG2 VAL 17 -0.002 -24.509 -21.027 138 HG22 VAL 17 2HG2 VAL 17 -0.897 -22.989 -21.164 139 HG23 VAL 17 3HG2 VAL 17 0.708 -23.146 -21.889 140 H ALA 18 H ALA 18 0.553 -19.410 -18.357 141 HA ALA 18 HA ALA 18 3.076 -19.470 -16.968 142 HB1 ALA 18 1HB ALA 18 1.950 -17.385 -17.361 143 HB2 ALA 18 2HB ALA 18 0.490 -17.932 -16.518 144 HB3 ALA 18 3HB ALA 18 1.978 -17.684 -15.639 145 H GLU 19 H GLU 19 3.632 -20.480 -15.188 146 HA GLU 19 HA GLU 19 1.529 -22.054 -13.786 147 HB2 GLU 19 1HB GLU 19 3.361 -23.419 -12.911 148 HB3 GLU 19 2HB GLU 19 3.375 -23.362 -14.671 149 HG2 GLU 19 1HG GLU 19 5.297 -22.028 -14.741 150 HG3 GLU 19 2HG GLU 19 5.214 -21.600 -13.035 151 H SER 20 H SER 20 3.688 -19.333 -13.402 152 HA SER 20 HA SER 20 3.382 -19.451 -10.468 153 HB2 SER 20 1HB SER 20 5.214 -17.781 -12.241 154 HB3 SER 20 2HB SER 20 5.229 -17.735 -10.498 155 HG SER 20 HG SER 20 5.378 -20.238 -11.026 156 HA PRO 21 HA PRO 21 0.619 -15.961 -10.647 157 HB2 PRO 21 1HB PRO 21 0.976 -14.754 -8.314 158 HB3 PRO 21 2HB PRO 21 0.307 -16.388 -8.372 159 HG2 PRO 21 1HG PRO 21 3.178 -15.595 -7.856 160 HG3 PRO 21 2HG PRO 21 2.131 -16.699 -6.873 161 HD2 PRO 21 1HD PRO 21 3.871 -17.605 -8.704 162 HD3 PRO 21 2HD PRO 21 2.287 -18.395 -8.414 163 H ASP 22 H ASP 22 4.031 -15.537 -10.260 164 HA ASP 22 HA ASP 22 4.009 -12.637 -10.695 165 HB2 ASP 22 1HB ASP 22 6.203 -14.792 -10.645 166 HB3 ASP 22 2HB ASP 22 6.550 -13.041 -10.806 167 H GLU 23 H GLU 23 3.623 -15.442 -12.637 168 HA GLU 23 HA GLU 23 5.036 -14.316 -14.975 169 HB2 GLU 23 1HB GLU 23 5.377 -16.676 -14.059 170 HB3 GLU 23 2HB GLU 23 3.693 -17.008 -14.511 171 HG2 GLU 23 1HG GLU 23 4.224 -16.695 -16.875 172 HG3 GLU 23 2HG GLU 23 5.895 -16.258 -16.486 173 H LEU 24 H LEU 24 3.966 -13.871 -16.904 174 HA LEU 24 HA LEU 24 1.041 -13.504 -16.614 175 HB2 LEU 24 1HB LEU 24 3.152 -12.194 -18.138 176 HB3 LEU 24 2HB LEU 24 1.824 -12.704 -19.165 177 HG LEU 24 HG LEU 24 1.568 -10.942 -16.673 178 HD11 LEU 24 1HD1 LEU 24 1.155 -9.149 -18.327 179 HD12 LEU 24 2HD1 LEU 24 1.645 -10.286 -19.625 180 HD13 LEU 24 3HD1 LEU 24 2.811 -9.808 -18.317 181 HD21 LEU 24 1HD2 LEU 24 -0.706 -10.455 -17.596 182 HD22 LEU 24 2HD2 LEU 24 -0.511 -12.098 -17.007 183 HD23 LEU 24 3HD2 LEU 24 -0.513 -11.802 -18.768 184 H SER 25 H SER 25 -0.434 -14.798 -17.466 185 HA SER 25 HA SER 25 0.308 -16.891 -19.423 186 HB2 SER 25 1HB SER 25 -1.430 -17.272 -17.816 187 HB3 SER 25 2HB SER 25 -2.384 -15.924 -18.487 188 HG SER 25 HG SER 25 -2.467 -17.054 -20.486 189 H PHE 26 H PHE 26 0.276 -16.696 -21.556 190 HA PHE 26 HA PHE 26 -1.483 -14.787 -22.901 191 HB2 PHE 26 1HB PHE 26 0.315 -13.529 -24.058 192 HB3 PHE 26 2HB PHE 26 0.464 -13.313 -22.335 193 HD1 PHE 26 HD1 PHE 26 1.923 -14.977 -25.296 194 HD2 PHE 26 HD2 PHE 26 2.323 -14.190 -21.103 195 HE1 PHE 26 HE1 PHE 26 4.209 -15.804 -25.396 196 HE2 PHE 26 HE2 PHE 26 4.712 -15.150 -21.178 197 HZ PHE 26 HZ PHE 26 5.579 -15.987 -23.337 198 H ARG 27 H ARG 27 -1.135 -15.032 -25.343 199 HA ARG 27 HA ARG 27 -0.061 -17.774 -26.005 200 HB2 ARG 27 1HB ARG 27 -2.814 -16.662 -26.535 201 HB3 ARG 27 2HB ARG 27 -2.120 -18.032 -27.430 202 HG2 ARG 27 1HG ARG 27 -1.739 -19.181 -25.189 203 HG3 ARG 27 2HG ARG 27 -2.776 -17.931 -24.465 204 HD2 ARG 27 1HD ARG 27 -4.526 -18.651 -26.120 205 HD3 ARG 27 2HD ARG 27 -3.411 -19.886 -26.695 206 HE ARG 27 HE ARG 27 -3.690 -20.153 -23.869 207 HH11 ARG 27 1HH1 ARG 27 -5.472 -20.682 -26.847 208 HH12 ARG 27 2HH1 ARG 27 -6.384 -22.035 -26.233 209 HH21 ARG 27 1HH2 ARG 27 -4.853 -21.860 -23.070 210 HH22 ARG 27 2HH2 ARG 27 -6.061 -22.673 -24.075 211 H LYS 28 H LYS 28 0.056 -18.047 -28.329 212 HA LYS 28 HA LYS 28 1.716 -16.038 -29.433 213 HB2 LYS 28 1HB LYS 28 1.701 -17.551 -31.441 214 HB3 LYS 28 2HB LYS 28 2.026 -18.365 -29.933 215 HG2 LYS 28 1HG LYS 28 -0.421 -19.082 -29.862 216 HG3 LYS 28 2HG LYS 28 -0.518 -18.552 -31.547 217 HD2 LYS 28 1HD LYS 28 1.304 -20.082 -32.128 218 HD3 LYS 28 2HD LYS 28 1.436 -20.577 -30.408 219 HE2 LYS 28 1HE LYS 28 -0.956 -21.327 -30.442 220 HE3 LYS 28 2HE LYS 28 -1.059 -20.916 -32.181 221 HZ1 LYS 28 1HZ LYS 28 0.567 -23.054 -30.952 222 HZ2 LYS 28 2HZ LYS 28 0.814 -22.533 -32.502 223 HZ3 LYS 28 3HZ LYS 28 -0.611 -23.224 -32.127 224 H GLY 29 H GLY 29 1.328 -14.402 -30.773 225 HA2 GLY 29 1HA GLY 29 0.110 -13.010 -32.236 226 HA3 GLY 29 2HA GLY 29 -1.326 -14.015 -31.993 227 H ASP 30 H ASP 30 -0.385 -13.510 -28.825 228 HA ASP 30 HA ASP 30 -2.301 -11.263 -28.598 229 HB2 ASP 30 1HB ASP 30 -1.788 -13.290 -26.982 230 HB3 ASP 30 2HB ASP 30 -0.571 -12.186 -26.327 231 H ILE 31 H ILE 31 -1.831 -9.235 -27.470 232 HA ILE 31 HA ILE 31 0.984 -8.312 -28.119 233 HB ILE 31 HB ILE 31 -1.602 -6.690 -28.235 234 HG12 ILE 31 1HG1 ILE 31 -1.761 -8.309 -29.983 235 HG13 ILE 31 2HG1 ILE 31 -1.493 -6.714 -30.661 236 HG21 ILE 31 1HG2 ILE 31 -0.048 -5.134 -29.659 237 HG22 ILE 31 2HG2 ILE 31 0.239 -5.165 -27.932 238 HG23 ILE 31 3HG2 ILE 31 1.310 -6.054 -29.015 239 HD11 ILE 31 1HD1 ILE 31 0.926 -7.193 -31.065 240 HD12 ILE 31 2HD1 ILE 31 0.703 -8.821 -30.397 241 HD13 ILE 31 3HD1 ILE 31 -0.134 -8.353 -31.919 242 H MET 32 H MET 32 2.078 -7.512 -26.384 243 HA MET 32 HA MET 32 0.361 -6.484 -24.081 244 HB2 MET 32 1HB MET 32 1.877 -7.682 -22.541 245 HB3 MET 32 2HB MET 32 1.082 -8.810 -23.622 246 HG2 MET 32 1HG MET 32 3.297 -8.539 -25.051 247 HG3 MET 32 2HG MET 32 4.004 -8.074 -23.492 248 HE1 MET 32 1HE MET 32 1.275 -10.374 -24.989 249 HE2 MET 32 2HE MET 32 2.760 -10.740 -25.901 250 HE3 MET 32 3HE MET 32 2.032 -11.989 -24.837 251 H THR 33 H THR 33 1.484 -5.019 -22.693 252 HA THR 33 HA THR 33 3.471 -3.370 -24.212 253 HB THR 33 HB THR 33 2.061 -2.722 -21.613 254 HG1 THR 33 HG1 THR 33 0.782 -3.127 -23.600 255 HG21 THR 33 1HG2 THR 33 4.122 -1.328 -22.082 256 HG22 THR 33 2HG2 THR 33 2.627 -0.380 -22.244 257 HG23 THR 33 3HG2 THR 33 3.489 -0.935 -23.689 258 H VAL 34 H VAL 34 5.625 -3.358 -23.686 259 HA VAL 34 HA VAL 34 6.586 -4.864 -21.299 260 HB VAL 34 HB VAL 34 8.143 -3.356 -23.464 261 HG11 VAL 34 1HG1 VAL 34 10.053 -4.759 -22.619 262 HG12 VAL 34 2HG1 VAL 34 9.438 -3.606 -21.425 263 HG13 VAL 34 3HG1 VAL 34 9.012 -5.322 -21.292 264 HG21 VAL 34 1HG2 VAL 34 7.666 -6.383 -23.153 265 HG22 VAL 34 2HG2 VAL 34 6.783 -5.369 -24.278 266 HG23 VAL 34 3HG2 VAL 34 8.546 -5.552 -24.482 267 H LEU 35 H LEU 35 6.822 -3.924 -19.422 268 HA LEU 35 HA LEU 35 6.808 -0.965 -19.271 269 HB2 LEU 35 1HB LEU 35 6.691 -3.134 -17.152 270 HB3 LEU 35 2HB LEU 35 6.622 -1.397 -16.830 271 HG LEU 35 HG LEU 35 4.521 -3.033 -18.394 272 HD11 LEU 35 1HD1 LEU 35 3.170 -2.775 -16.405 273 HD12 LEU 35 2HD1 LEU 35 4.433 -1.910 -15.575 274 HD13 LEU 35 3HD1 LEU 35 4.639 -3.605 -16.005 275 HD21 LEU 35 1HD2 LEU 35 4.402 -0.097 -17.341 276 HD22 LEU 35 2HD2 LEU 35 3.082 -0.982 -18.125 277 HD23 LEU 35 3HD2 LEU 35 4.501 -0.581 -19.054 278 H GLU 36 H GLU 36 8.911 -3.734 -18.460 279 HA GLU 36 HA GLU 36 11.250 -2.041 -18.621 280 HB2 GLU 36 1HB GLU 36 12.141 -2.646 -16.388 281 HB3 GLU 36 2HB GLU 36 10.649 -1.682 -16.308 282 HG2 GLU 36 1HG GLU 36 9.287 -3.568 -15.813 283 HG3 GLU 36 2HG GLU 36 10.665 -4.651 -16.036 284 H ARG 37 H ARG 37 13.306 -3.551 -18.284 285 HA ARG 37 HA ARG 37 12.611 -6.276 -19.336 286 HB2 ARG 37 1HB ARG 37 14.955 -4.498 -20.253 287 HB3 ARG 37 2HB ARG 37 14.788 -6.206 -20.580 288 HG2 ARG 37 1HG ARG 37 12.625 -5.622 -21.702 289 HG3 ARG 37 2HG ARG 37 13.108 -3.923 -21.522 290 HD2 ARG 37 1HD ARG 37 14.919 -5.962 -22.794 291 HD3 ARG 37 2HD ARG 37 13.625 -5.166 -23.743 292 HE ARG 37 HE ARG 37 15.098 -3.138 -22.486 293 HH11 ARG 37 1HH1 ARG 37 15.752 -5.699 -24.728 294 HH12 ARG 37 2HH1 ARG 37 16.995 -4.834 -25.611 295 HH21 ARG 37 1HH2 ARG 37 16.738 -2.006 -23.599 296 HH22 ARG 37 2HH2 ARG 37 17.582 -2.772 -24.911 297 H ASP 38 H ASP 38 14.101 -7.892 -18.741 298 HA ASP 38 HA ASP 38 15.348 -9.125 -17.316 299 HB2 ASP 38 1HB ASP 38 17.012 -6.594 -16.967 300 HB3 ASP 38 2HB ASP 38 17.545 -8.269 -16.708 301 H THR 39 H THR 39 13.077 -8.000 -16.197 302 HA THR 39 HA THR 39 13.454 -6.337 -13.979 303 HB THR 39 HB THR 39 11.310 -6.673 -15.300 304 HG1 THR 39 HG1 THR 39 11.365 -5.686 -13.228 305 HG21 THR 39 1HG2 THR 39 10.780 -9.064 -13.458 306 HG22 THR 39 2HG2 THR 39 11.377 -9.322 -15.089 307 HG23 THR 39 3HG2 THR 39 9.811 -8.546 -14.847 308 H GLN 40 H GLN 40 13.959 -9.722 -14.064 309 HA GLN 40 HA GLN 40 13.751 -9.786 -11.101 310 HB2 GLN 40 1HB GLN 40 12.281 -11.231 -12.733 311 HB3 GLN 40 2HB GLN 40 13.722 -12.291 -12.686 312 HG2 GLN 40 1HG GLN 40 13.527 -12.300 -10.205 313 HG3 GLN 40 2HG GLN 40 12.010 -11.346 -10.379 314 HE21 GLN 40 1HE2 GLN 40 10.093 -14.229 -11.026 315 HE22 GLN 40 2HE2 GLN 40 10.136 -12.532 -10.676 316 H GLY 41 H GLY 41 15.905 -9.070 -13.275 317 HA2 GLY 41 1HA GLY 41 18.248 -9.210 -13.196 318 HA3 GLY 41 2HA GLY 41 18.084 -10.301 -11.829 319 H LEU 42 H LEU 42 16.064 -11.502 -14.006 320 HA LEU 42 HA LEU 42 17.947 -13.416 -15.171 321 HB2 LEU 42 1HB LEU 42 14.939 -12.997 -15.490 322 HB3 LEU 42 2HB LEU 42 15.852 -14.204 -16.356 323 HG LEU 42 HG LEU 42 15.629 -14.127 -13.340 324 HD11 LEU 42 1HD1 LEU 42 13.404 -14.316 -14.403 325 HD12 LEU 42 2HD1 LEU 42 13.870 -15.895 -13.767 326 HD13 LEU 42 3HD1 LEU 42 14.000 -15.580 -15.487 327 HD21 LEU 42 1HD2 LEU 42 17.546 -15.518 -14.350 328 HD22 LEU 42 2HD2 LEU 42 16.354 -16.426 -15.252 329 HD23 LEU 42 3HD2 LEU 42 16.357 -16.474 -13.470 330 H ASP 43 H ASP 43 19.079 -12.843 -16.855 331 HA ASP 43 HA ASP 43 18.481 -10.672 -18.582 332 HB2 ASP 43 1HB ASP 43 20.821 -11.720 -18.294 333 HB3 ASP 43 2HB ASP 43 20.198 -13.122 -19.148 334 H GLY 44 H GLY 44 16.919 -10.498 -19.899 335 HA2 GLY 44 1HA GLY 44 15.898 -11.184 -21.978 336 HA3 GLY 44 2HA GLY 44 16.221 -12.856 -21.610 337 H TRP 45 H TRP 45 14.845 -11.566 -18.772 338 HA TRP 45 HA TRP 45 12.124 -12.283 -19.705 339 HB2 TRP 45 1HB TRP 45 13.540 -12.506 -17.080 340 HB3 TRP 45 2HB TRP 45 11.747 -12.415 -17.160 341 HD1 TRP 45 HD1 TRP 45 14.667 -14.640 -18.449 342 HE1 TRP 45 HE1 TRP 45 13.886 -16.981 -18.770 343 HE3 TRP 45 HE3 TRP 45 9.715 -13.880 -17.480 344 HZ2 TRP 45 HZ2 TRP 45 11.426 -18.451 -18.750 345 HZ3 TRP 45 HZ3 TRP 45 8.137 -15.794 -17.670 346 HH2 TRP 45 HH2 TRP 45 8.956 -18.060 -18.300 347 H TRP 46 H TRP 46 10.810 -10.707 -20.009 348 HA TRP 46 HA TRP 46 11.514 -8.035 -18.869 349 HB2 TRP 46 1HB TRP 46 9.696 -8.811 -21.173 350 HB3 TRP 46 2HB TRP 46 10.154 -7.163 -20.734 351 HD1 TRP 46 HD1 TRP 46 13.372 -8.736 -20.534 352 HE1 TRP 46 HE1 TRP 46 14.707 -8.726 -22.687 353 HE3 TRP 46 HE3 TRP 46 9.491 -7.886 -23.793 354 HZ2 TRP 46 HZ2 TRP 46 14.216 -8.302 -25.458 355 HZ3 TRP 46 HZ3 TRP 46 9.984 -7.660 -26.228 356 HH2 TRP 46 HH2 TRP 46 12.294 -7.827 -27.045 357 H LEU 47 H LEU 47 9.751 -6.682 -18.049 358 HA LEU 47 HA LEU 47 7.495 -8.312 -16.910 359 HB2 LEU 47 1HB LEU 47 8.904 -6.695 -15.486 360 HB3 LEU 47 2HB LEU 47 8.231 -5.426 -16.546 361 HG LEU 47 HG LEU 47 5.946 -6.073 -15.691 362 HD11 LEU 47 1HD1 LEU 47 5.702 -7.640 -13.878 363 HD12 LEU 47 2HD1 LEU 47 7.450 -7.679 -13.567 364 HD13 LEU 47 3HD1 LEU 47 6.788 -8.458 -15.028 365 HD21 LEU 47 1HD2 LEU 47 7.968 -5.252 -13.546 366 HD22 LEU 47 2HD2 LEU 47 6.178 -5.038 -13.488 367 HD23 LEU 47 3HD2 LEU 47 7.125 -4.152 -14.679 368 H CYS 48 H CYS 48 5.620 -8.344 -18.057 369 HA CYS 48 HA CYS 48 5.155 -5.957 -19.770 370 HB2 CYS 48 1HB CYS 48 4.190 -8.826 -20.218 371 HB3 CYS 48 2HB CYS 48 3.890 -7.428 -21.287 372 HG CYS 48 HG CYS 48 6.810 -8.777 -20.389 373 H SER 49 H SER 49 2.908 -5.433 -20.098 374 HA SER 49 HA SER 49 1.184 -6.356 -17.892 375 HB2 SER 49 1HB SER 49 1.757 -4.042 -17.535 376 HB3 SER 49 2HB SER 49 1.272 -3.644 -19.183 377 HG SER 49 HG SER 49 -0.262 -4.081 -16.906 378 H LEU 50 H LEU 50 -0.611 -7.266 -18.301 379 HA LEU 50 HA LEU 50 -2.075 -6.939 -20.872 380 HB2 LEU 50 1HB LEU 50 -0.238 -8.551 -21.359 381 HB3 LEU 50 2HB LEU 50 -0.829 -9.558 -20.046 382 HG LEU 50 HG LEU 50 -2.948 -9.963 -21.271 383 HD11 LEU 50 1HD1 LEU 50 -1.552 -8.514 -23.574 384 HD12 LEU 50 2HD1 LEU 50 -2.903 -7.823 -22.668 385 HD13 LEU 50 3HD1 LEU 50 -3.170 -9.268 -23.642 386 HD21 LEU 50 1HD2 LEU 50 -2.090 -11.546 -22.799 387 HD22 LEU 50 2HD2 LEU 50 -0.841 -11.377 -21.528 388 HD23 LEU 50 3HD2 LEU 50 -0.643 -10.576 -23.120 389 H HIS 51 H HIS 51 -4.258 -7.580 -20.608 390 HA HIS 51 HA HIS 51 -6.262 -7.946 -19.460 391 HB2 HIS 51 1HB HIS 51 -5.078 -10.211 -19.565 392 HB3 HIS 51 2HB HIS 51 -4.775 -10.044 -17.834 393 HD1 HIS 51 HD1 HIS 51 -7.421 -10.852 -20.396 394 HD2 HIS 51 HD2 HIS 51 -7.165 -10.125 -16.277 395 HE1 HIS 51 HE1 HIS 51 -9.565 -11.722 -19.350 396 H GLY 52 H GLY 52 -4.348 -5.961 -18.299 397 HA2 GLY 52 1HA GLY 52 -4.558 -4.446 -16.574 398 HA3 GLY 52 2HA GLY 52 -5.780 -5.504 -15.868 399 H ARG 53 H ARG 53 -3.139 -7.502 -16.332 400 HA ARG 53 HA ARG 53 -2.136 -6.916 -13.562 401 HB2 ARG 53 1HB ARG 53 -1.998 -9.471 -15.162 402 HB3 ARG 53 2HB ARG 53 -1.548 -9.281 -13.470 403 HG2 ARG 53 1HG ARG 53 -3.983 -8.717 -12.954 404 HG3 ARG 53 2HG ARG 53 -4.343 -9.249 -14.624 405 HD2 ARG 53 1HD ARG 53 -3.244 -11.398 -14.104 406 HD3 ARG 53 2HD ARG 53 -3.033 -10.838 -12.445 407 HE ARG 53 HE ARG 53 -5.336 -10.917 -11.992 408 HH11 ARG 53 1HH1 ARG 53 -4.581 -12.216 -15.234 409 HH12 ARG 53 2HH1 ARG 53 -6.161 -12.954 -15.406 410 HH21 ARG 53 1HH2 ARG 53 -7.389 -11.896 -12.322 411 HH22 ARG 53 2HH2 ARG 53 -7.688 -12.853 -13.731 412 H GLN 54 H GLN 54 0.204 -7.433 -13.229 413 HA GLN 54 HA GLN 54 1.763 -7.103 -15.790 414 HB2 GLN 54 1HB GLN 54 2.555 -6.409 -12.937 415 HB3 GLN 54 2HB GLN 54 3.544 -6.190 -14.417 416 HG2 GLN 54 1HG GLN 54 2.142 -4.409 -15.196 417 HG3 GLN 54 2HG GLN 54 0.846 -4.823 -14.080 418 HE21 GLN 54 1HE2 GLN 54 1.960 -2.500 -11.776 419 HE22 GLN 54 2HE2 GLN 54 0.624 -3.270 -12.607 420 H GLY 55 H GLY 55 3.556 -8.592 -16.027 421 HA2 GLY 55 1HA GLY 55 4.182 -10.480 -13.952 422 HA3 GLY 55 2HA GLY 55 3.181 -11.209 -15.169 423 H ILE 56 H ILE 56 5.826 -12.092 -14.718 424 HA ILE 56 HA ILE 56 7.605 -10.691 -16.596 425 HB ILE 56 HB ILE 56 9.259 -12.380 -15.932 426 HG12 ILE 56 1HG1 ILE 56 7.102 -13.625 -14.246 427 HG13 ILE 56 2HG1 ILE 56 7.632 -14.279 -15.810 428 HG21 ILE 56 1HG2 ILE 56 7.850 -11.706 -13.353 429 HG22 ILE 56 2HG2 ILE 56 9.557 -11.605 -13.694 430 HG23 ILE 56 3HG2 ILE 56 8.465 -10.392 -14.366 431 HD11 ILE 56 1HD1 ILE 56 8.736 -15.498 -14.046 432 HD12 ILE 56 2HD1 ILE 56 9.900 -14.556 -14.958 433 HD13 ILE 56 3HD1 ILE 56 9.375 -13.980 -13.378 434 H VAL 57 H VAL 57 8.252 -11.411 -18.602 435 HA VAL 57 HA VAL 57 6.819 -13.825 -19.778 436 HB VAL 57 HB VAL 57 6.938 -10.913 -20.779 437 HG11 VAL 57 1HG1 VAL 57 6.208 -13.420 -22.339 438 HG12 VAL 57 2HG1 VAL 57 5.752 -11.782 -22.863 439 HG13 VAL 57 3HG1 VAL 57 7.454 -12.202 -22.728 440 HG21 VAL 57 1HG2 VAL 57 4.446 -11.221 -21.013 441 HG22 VAL 57 2HG2 VAL 57 4.651 -12.798 -20.127 442 HG23 VAL 57 3HG2 VAL 57 5.066 -11.254 -19.327 443 HA PRO 58 HA PRO 58 11.100 -13.880 -21.152 444 HB2 PRO 58 1HB PRO 58 11.097 -15.911 -22.940 445 HB3 PRO 58 2HB PRO 58 11.020 -16.182 -21.195 446 HG2 PRO 58 1HG PRO 58 8.825 -16.373 -23.124 447 HG3 PRO 58 2HG PRO 58 9.204 -17.379 -21.724 448 HD2 PRO 58 1HD PRO 58 7.351 -15.278 -21.851 449 HD3 PRO 58 2HD PRO 58 8.043 -15.894 -20.314 450 H GLY 59 H GLY 59 11.962 -12.411 -22.232 451 HA2 GLY 59 1HA GLY 59 10.651 -11.151 -24.446 452 HA3 GLY 59 2HA GLY 59 12.285 -10.878 -23.791 453 H ASN 60 H ASN 60 12.955 -13.813 -24.215 454 HA ASN 60 HA ASN 60 13.829 -13.583 -26.986 455 HB2 ASN 60 1HB ASN 60 13.614 -15.925 -25.038 456 HB3 ASN 60 2HB ASN 60 14.299 -16.003 -26.697 457 HD21 ASN 60 1HD2 ASN 60 17.384 -15.376 -25.353 458 HD22 ASN 60 2HD2 ASN 60 16.376 -16.404 -26.318 459 H ARG 61 H ARG 61 10.782 -14.236 -25.655 460 HA ARG 61 HA ARG 61 9.998 -15.850 -28.036 461 HB2 ARG 61 1HB ARG 61 8.623 -15.587 -25.331 462 HB3 ARG 61 2HB ARG 61 7.875 -16.412 -26.705 463 HG2 ARG 61 1HG ARG 61 10.036 -17.881 -26.723 464 HG3 ARG 61 2HG ARG 61 10.321 -17.270 -25.116 465 HD2 ARG 61 1HD ARG 61 8.150 -18.070 -24.310 466 HD3 ARG 61 2HD ARG 61 7.723 -18.535 -25.928 467 HE ARG 61 HE ARG 61 10.090 -19.912 -24.906 468 HH11 ARG 61 1HH1 ARG 61 6.580 -20.076 -25.364 469 HH12 ARG 61 2HH1 ARG 61 6.536 -21.802 -25.338 470 HH21 ARG 61 1HH2 ARG 61 9.934 -22.170 -24.798 471 HH22 ARG 61 2HH2 ARG 61 8.386 -22.939 -25.035 472 H LEU 62 H LEU 62 10.189 -12.807 -27.092 473 HA LEU 62 HA LEU 62 7.578 -11.974 -28.262 474 HB2 LEU 62 1HB LEU 62 9.536 -10.552 -26.428 475 HB3 LEU 62 2HB LEU 62 8.198 -9.763 -27.280 476 HG LEU 62 HG LEU 62 7.876 -11.915 -25.173 477 HD11 LEU 62 1HD1 LEU 62 7.524 -8.857 -25.161 478 HD12 LEU 62 2HD1 LEU 62 8.640 -9.867 -24.165 479 HD13 LEU 62 3HD1 LEU 62 6.883 -9.945 -23.905 480 HD21 LEU 62 1HD2 LEU 62 6.054 -12.124 -26.642 481 HD22 LEU 62 2HD2 LEU 62 5.874 -10.357 -26.855 482 HD23 LEU 62 3HD2 LEU 62 5.458 -11.145 -25.326 483 H LYS 63 H LYS 63 7.501 -10.523 -29.851 484 HA LYS 63 HA LYS 63 10.032 -9.560 -31.142 485 HB2 LYS 63 1HB LYS 63 8.622 -11.156 -32.456 486 HB3 LYS 63 2HB LYS 63 7.311 -10.002 -32.472 487 HG2 LYS 63 1HG LYS 63 8.427 -9.867 -34.547 488 HG3 LYS 63 2HG LYS 63 8.899 -8.399 -33.654 489 HD2 LYS 63 1HD LYS 63 11.067 -9.422 -33.040 490 HD3 LYS 63 2HD LYS 63 10.566 -10.873 -34.000 491 HE2 LYS 63 1HE LYS 63 10.369 -9.449 -36.042 492 HE3 LYS 63 2HE LYS 63 10.867 -8.038 -35.103 493 HZ1 LYS 63 1HZ LYS 63 13.087 -8.960 -34.810 494 HZ2 LYS 63 2HZ LYS 63 12.704 -9.182 -36.415 495 HZ3 LYS 63 3HZ LYS 63 12.503 -10.445 -35.314 496 H ILE 64 H ILE 64 10.361 -7.478 -30.733 497 HA ILE 64 HA ILE 64 8.466 -5.640 -29.668 498 HB ILE 64 HB ILE 64 11.098 -5.092 -31.124 499 HG12 ILE 64 1HG1 ILE 64 11.324 -6.451 -29.049 500 HG13 ILE 64 2HG1 ILE 64 12.186 -4.934 -28.971 501 HG21 ILE 64 1HG2 ILE 64 9.168 -3.257 -29.613 502 HG22 ILE 64 2HG2 ILE 64 10.887 -2.871 -29.637 503 HG23 ILE 64 3HG2 ILE 64 9.982 -2.926 -31.144 504 HD11 ILE 64 1HD1 ILE 64 11.095 -5.387 -26.804 505 HD12 ILE 64 2HD1 ILE 64 10.267 -3.988 -27.568 506 HD13 ILE 64 3HD1 ILE 64 9.500 -5.620 -27.585 507 H LEU 65 H LEU 65 6.996 -4.366 -30.637 508 HA LEU 65 HA LEU 65 6.781 -4.526 -33.614 509 HB2 LEU 65 1HB LEU 65 4.978 -5.454 -31.474 510 HB3 LEU 65 2HB LEU 65 4.225 -4.188 -32.426 511 HG LEU 65 HG LEU 65 3.681 -6.497 -33.185 512 HD11 LEU 65 1HD1 LEU 65 4.006 -6.150 -35.619 513 HD12 LEU 65 2HD1 LEU 65 5.271 -4.935 -35.307 514 HD13 LEU 65 3HD1 LEU 65 3.573 -4.599 -34.844 515 HD21 LEU 65 1HD2 LEU 65 6.510 -6.744 -34.172 516 HD22 LEU 65 2HD2 LEU 65 5.213 -7.941 -34.195 517 HD23 LEU 65 3HD2 LEU 65 5.931 -7.450 -32.643 518 H VAL 66 H VAL 66 5.165 -2.792 -34.327 519 HA VAL 66 HA VAL 66 4.603 -0.636 -34.652 520 HB VAL 66 HB VAL 66 5.172 -0.289 -31.677 521 HG11 VAL 66 1HG1 VAL 66 5.143 1.900 -33.003 522 HG12 VAL 66 2HG1 VAL 66 3.439 1.535 -33.397 523 HG13 VAL 66 3HG1 VAL 66 3.955 1.702 -31.717 524 HG21 VAL 66 1HG2 VAL 66 2.646 -0.420 -31.480 525 HG22 VAL 66 2HG2 VAL 66 2.569 -0.913 -33.168 526 HG23 VAL 66 3HG2 VAL 66 3.375 -1.920 -31.965 527 H GLY 67 H GLY 67 5.571 1.122 -35.449 528 HA2 GLY 67 1HA GLY 67 8.475 1.060 -35.560 529 HA3 GLY 67 2HA GLY 67 7.397 2.085 -36.512 530 H MET 68 H MET 68 8.753 3.947 -36.225 531 HA MET 68 HA MET 68 9.617 4.734 -33.544 532 HB2 MET 68 1HB MET 68 9.337 6.249 -36.167 533 HB3 MET 68 2HB MET 68 9.947 6.960 -34.652 534 HG2 MET 68 1HG MET 68 11.215 4.594 -36.118 535 HG3 MET 68 2HG MET 68 11.760 6.255 -36.174 536 HE1 MET 68 1HE MET 68 13.885 4.070 -35.431 537 HE2 MET 68 2HE MET 68 14.294 5.820 -35.292 538 HE3 MET 68 3HE MET 68 14.636 4.686 -33.943 539 H TYR 69 H TYR 69 6.780 5.421 -35.508 540 HA TYR 69 HA TYR 69 5.799 7.493 -33.690 541 HB2 TYR 69 1HB TYR 69 4.533 5.934 -35.968 542 HB3 TYR 69 2HB TYR 69 3.709 7.238 -35.101 543 HD1 TYR 69 HD1 TYR 69 4.731 6.747 -38.163 544 HD2 TYR 69 HD2 TYR 69 6.044 9.207 -34.890 545 HE1 TYR 69 HE1 TYR 69 5.739 8.304 -39.735 546 HE2 TYR 69 HE2 TYR 69 7.056 10.820 -36.536 547 HH TYR 69 HH TYR 69 6.737 10.184 -40.123 548 H ASP 70 H ASP 70 5.010 7.069 -31.857 549 HA ASP 70 HA ASP 70 4.452 4.369 -30.951 550 HB2 ASP 70 1HB ASP 70 4.234 7.136 -29.725 551 HB3 ASP 70 2HB ASP 70 3.619 5.693 -28.902 552 H LYS 71 H LYS 71 2.768 3.473 -31.881 553 HA LYS 71 HA LYS 71 0.626 2.784 -32.170 554 HB2 LYS 71 1HB LYS 71 0.393 3.379 -29.750 555 HB3 LYS 71 2HB LYS 71 -0.248 4.939 -30.187 556 HG2 LYS 71 1HG LYS 71 -2.129 3.764 -31.398 557 HG3 LYS 71 2HG LYS 71 -1.535 2.216 -30.774 558 HD2 LYS 71 1HD LYS 71 -3.340 2.965 -29.384 559 HD3 LYS 71 2HD LYS 71 -1.845 2.971 -28.462 560 HE2 LYS 71 1HE LYS 71 -1.645 5.507 -28.871 561 HE3 LYS 71 2HE LYS 71 -3.206 5.441 -29.729 562 HZ1 LYS 71 1HZ LYS 71 -3.363 6.103 -27.362 563 HZ2 LYS 71 2HZ LYS 71 -2.775 4.647 -26.888 564 HZ3 LYS 71 3HZ LYS 71 -4.232 4.737 -27.646 565 H LYS 72 H LYS 72 -0.289 3.054 -34.067 566 HA LYS 72 HA LYS 72 -0.428 5.540 -35.441 567 HB2 LYS 72 1HB LYS 72 -1.675 4.374 -37.104 568 HB3 LYS 72 2HB LYS 72 -0.518 3.230 -36.441 569 HG2 LYS 72 1HG LYS 72 -2.425 2.411 -34.930 570 HG3 LYS 72 2HG LYS 72 -3.520 3.317 -35.991 571 HD2 LYS 72 1HD LYS 72 -1.546 1.179 -36.974 572 HD3 LYS 72 2HD LYS 72 -3.186 0.796 -36.443 573 HE2 LYS 72 1HE LYS 72 -4.042 2.266 -38.342 574 HE3 LYS 72 2HE LYS 72 -2.267 2.564 -38.742 575 HZ1 LYS 72 1HZ LYS 72 -2.025 0.066 -38.775 576 HZ2 LYS 72 2HZ LYS 72 -2.944 0.637 -40.003 577 HZ3 LYS 72 3HZ LYS 72 -3.672 -0.103 -38.758 578 HA PRO 73 HA PRO 73 -4.109 7.351 -33.585 579 HB2 PRO 73 1HB PRO 73 -4.718 9.267 -35.461 580 HB3 PRO 73 2HB PRO 73 -3.217 9.328 -34.530 581 HG2 PRO 73 1HG PRO 73 -3.608 8.218 -37.303 582 HG3 PRO 73 2HG PRO 73 -2.450 9.442 -36.693 583 HD2 PRO 73 1HD PRO 73 -1.845 6.782 -37.002 584 HD3 PRO 73 2HD PRO 73 -1.108 7.825 -35.692 585 H ALA 74 H ALA 74 -5.362 5.426 -33.684 586 HA ALA 74 HA ALA 74 -7.685 5.762 -35.466 587 HB1 ALA 74 1HB ALA 74 -7.597 3.242 -36.035 588 HB2 ALA 74 2HB ALA 74 -6.343 4.178 -36.843 589 HB3 ALA 74 3HB ALA 74 -5.943 3.209 -35.408 590 H GLY 75 H GLY 75 -9.542 4.580 -34.565 591 HA2 GLY 75 1HA GLY 75 -10.013 2.913 -32.665 592 HA3 GLY 75 2HA GLY 75 -9.126 4.077 -31.678 593 H GLU 76 H GLU 76 -12.098 3.082 -32.013 594 HA GLU 76 HA GLU 76 -13.535 5.443 -32.742 595 HB2 GLU 76 1HB GLU 76 -14.303 3.181 -33.219 596 HB3 GLU 76 2HB GLU 76 -14.456 2.821 -31.492 597 HG2 GLU 76 1HG GLU 76 -16.234 4.490 -31.260 598 HG3 GLU 76 2HG GLU 76 -15.997 5.055 -32.889 599 H PHE 77 H PHE 77 -14.347 6.954 -31.348 600 HA PHE 77 HA PHE 77 -13.464 6.944 -28.562 601 HB2 PHE 77 1HB PHE 77 -15.150 8.965 -30.059 602 HB3 PHE 77 2HB PHE 77 -14.336 9.173 -28.484 603 HD1 PHE 77 HD1 PHE 77 -11.739 8.861 -28.460 604 HD2 PHE 77 HD2 PHE 77 -14.064 9.635 -32.027 605 HE1 PHE 77 HE1 PHE 77 -9.693 9.591 -29.582 606 HE2 PHE 77 HE2 PHE 77 -11.928 10.352 -33.210 607 HZ PHE 77 HZ PHE 77 -9.794 10.314 -32.039 608 H ILE 78 H ILE 78 -14.964 4.850 -28.560 609 HA ILE 78 HA ILE 78 -17.814 5.192 -28.136 610 HB ILE 78 HB ILE 78 -17.658 3.002 -26.952 611 HG12 ILE 78 1HG1 ILE 78 -14.639 3.004 -27.481 612 HG13 ILE 78 2HG1 ILE 78 -15.386 3.494 -25.949 613 HG21 ILE 78 1HG2 ILE 78 -17.774 2.957 -29.456 614 HG22 ILE 78 2HG2 ILE 78 -16.007 3.058 -29.535 615 HG23 ILE 78 3HG2 ILE 78 -16.783 1.642 -28.867 616 HD11 ILE 78 1HD1 ILE 78 -14.809 1.271 -25.584 617 HD12 ILE 78 2HD1 ILE 78 -16.524 1.237 -25.931 618 HD13 ILE 78 3HD1 ILE 78 -15.352 0.750 -27.208 619 H VAL 79 H VAL 79 -18.931 5.349 -26.117 620 HA VAL 79 HA VAL 79 -17.379 5.965 -23.755 621 HB VAL 79 HB VAL 79 -19.006 7.856 -23.261 622 HG11 VAL 79 1HG1 VAL 79 -16.693 8.369 -24.203 623 HG12 VAL 79 2HG1 VAL 79 -17.343 8.273 -25.848 624 HG13 VAL 79 3HG1 VAL 79 -17.915 9.540 -24.736 625 HG21 VAL 79 1HG2 VAL 79 -20.822 7.195 -24.852 626 HG22 VAL 79 2HG2 VAL 79 -20.268 8.854 -25.129 627 HG23 VAL 79 3HG2 VAL 79 -19.710 7.567 -26.231 628 H THR 80 H THR 80 -18.776 5.939 -21.775 629 HA THR 80 HA THR 80 -21.238 4.229 -22.156 630 HB THR 80 HB THR 80 -19.774 4.132 -19.562 631 HG1 THR 80 HG1 THR 80 -18.638 2.284 -21.192 632 HG21 THR 80 1HG2 THR 80 -21.632 2.704 -19.638 633 HG22 THR 80 2HG2 THR 80 -20.190 1.655 -19.846 634 HG23 THR 80 3HG2 THR 80 -21.158 2.086 -21.266 635 H ASP 81 H ASP 81 -20.464 7.196 -21.841 636 HA ASP 81 HA ASP 81 -22.624 7.944 -20.039 637 HB2 ASP 81 1HB ASP 81 -21.306 9.505 -18.727 638 HB3 ASP 81 2HB ASP 81 -20.663 7.935 -18.535 639 HXT ASP 81 H02 ASP 81 -20.097 9.362 -21.690 Start of MODEL 39 1 H2 GLY 1 2H0 GLY 1 6.785 14.668 -13.981 2 H GLY 1 1H0 GLY 1 6.454 14.593 -12.364 3 HA2 GLY 1 1HA GLY 1 9.166 14.355 -13.446 4 HA3 GLY 1 2HA GLY 1 8.652 14.150 -11.787 5 H SER 2 H SER 2 10.095 12.265 -12.962 6 HA SER 2 HA SER 2 10.252 10.005 -13.465 7 HB2 SER 2 1HB SER 2 7.715 9.961 -11.793 8 HB3 SER 2 2HB SER 2 8.868 8.645 -12.021 9 HG SER 2 HG SER 2 9.656 9.528 -10.196 10 H MET 3 H MET 3 9.238 11.153 -15.660 11 HA MET 3 HA MET 3 6.925 9.459 -16.510 12 HB2 MET 3 1HB MET 3 6.917 12.066 -16.387 13 HB3 MET 3 2HB MET 3 7.868 11.982 -17.897 14 HG2 MET 3 1HG MET 3 6.026 10.805 -19.024 15 HG3 MET 3 2HG MET 3 5.169 10.680 -17.509 16 HE1 MET 3 1HE MET 3 5.664 14.675 -19.831 17 HE2 MET 3 2HE MET 3 7.043 13.635 -19.405 18 HE3 MET 3 3HE MET 3 5.875 13.081 -20.578 19 H LYS 4 H LYS 4 9.540 8.285 -16.584 20 HA LYS 4 HA LYS 4 9.755 7.889 -19.548 21 HB2 LYS 4 1HB LYS 4 11.911 8.792 -17.719 22 HB3 LYS 4 2HB LYS 4 12.285 7.438 -18.751 23 HG2 LYS 4 1HG LYS 4 11.262 8.888 -20.636 24 HG3 LYS 4 2HG LYS 4 11.635 10.262 -19.528 25 HD2 LYS 4 1HD LYS 4 13.991 9.430 -19.386 26 HD3 LYS 4 2HD LYS 4 13.597 8.075 -20.463 27 HE2 LYS 4 1HE LYS 4 14.708 9.850 -21.782 28 HE3 LYS 4 2HE LYS 4 12.993 9.672 -22.282 29 HZ1 LYS 4 1HZ LYS 4 13.668 11.978 -21.969 30 HZ2 LYS 4 2HZ LYS 4 13.905 11.681 -20.325 31 HZ3 LYS 4 3HZ LYS 4 12.388 11.558 -20.979 32 H TYR 5 H TYR 5 9.155 5.932 -19.912 33 HA TYR 5 HA TYR 5 10.562 3.744 -18.497 34 HB2 TYR 5 1HB TYR 5 8.637 2.438 -18.070 35 HB3 TYR 5 2HB TYR 5 8.403 4.022 -17.280 36 HD1 TYR 5 HD1 TYR 5 6.929 5.791 -18.790 37 HD2 TYR 5 HD2 TYR 5 6.941 1.515 -19.270 38 HE1 TYR 5 HE1 TYR 5 4.693 5.886 -19.893 39 HE2 TYR 5 HE2 TYR 5 4.701 1.630 -20.339 40 HH TYR 5 HH TYR 5 3.108 3.045 -21.269 41 H LEU 6 H LEU 6 9.828 1.662 -19.986 42 HA LEU 6 HA LEU 6 10.928 2.276 -22.468 43 HB2 LEU 6 1HB LEU 6 9.265 -0.156 -21.587 44 HB3 LEU 6 2HB LEU 6 10.061 -0.057 -23.160 45 HG LEU 6 HG LEU 6 11.494 0.114 -20.494 46 HD11 LEU 6 1HD1 LEU 6 11.288 -2.244 -22.365 47 HD12 LEU 6 2HD1 LEU 6 10.350 -2.035 -20.881 48 HD13 LEU 6 3HD1 LEU 6 12.098 -2.176 -20.826 49 HD21 LEU 6 1HD2 LEU 6 12.491 -0.203 -23.353 50 HD22 LEU 6 2HD2 LEU 6 13.483 -0.541 -21.916 51 HD23 LEU 6 3HD2 LEU 6 12.844 1.107 -22.202 52 H ASN 7 H ASN 7 7.533 1.854 -21.610 53 HA ASN 7 HA ASN 7 5.587 1.986 -22.818 54 HB2 ASN 7 1HB ASN 7 6.436 4.343 -22.473 55 HB3 ASN 7 2HB ASN 7 6.982 4.280 -24.147 56 HD21 ASN 7 1HD2 ASN 7 3.849 5.719 -24.843 57 HD22 ASN 7 2HD2 ASN 7 5.564 6.014 -24.660 58 H VAL 8 H VAL 8 7.025 0.013 -24.011 59 HA VAL 8 HA VAL 8 6.503 0.457 -26.935 60 HB VAL 8 HB VAL 8 9.046 0.361 -26.219 61 HG11 VAL 8 1HG1 VAL 8 10.001 -1.767 -25.804 62 HG12 VAL 8 2HG1 VAL 8 8.755 -1.474 -24.615 63 HG13 VAL 8 3HG1 VAL 8 8.442 -2.571 -25.977 64 HG21 VAL 8 1HG2 VAL 8 8.051 -1.709 -28.233 65 HG22 VAL 8 2HG2 VAL 8 8.194 0.046 -28.526 66 HG23 VAL 8 3HG2 VAL 8 9.645 -0.910 -28.165 67 H LEU 9 H LEU 9 5.836 -1.585 -27.946 68 HA LEU 9 HA LEU 9 4.762 -3.528 -25.938 69 HB2 LEU 9 1HB LEU 9 2.813 -3.778 -27.577 70 HB3 LEU 9 2HB LEU 9 2.792 -2.463 -26.444 71 HG LEU 9 HG LEU 9 3.663 -2.091 -29.344 72 HD11 LEU 9 1HD1 LEU 9 1.277 -1.422 -29.715 73 HD12 LEU 9 2HD1 LEU 9 0.849 -2.217 -28.211 74 HD13 LEU 9 3HD1 LEU 9 1.573 -3.146 -29.510 75 HD21 LEU 9 1HD2 LEU 9 2.753 0.230 -28.988 76 HD22 LEU 9 2HD2 LEU 9 3.989 -0.108 -27.780 77 HD23 LEU 9 3HD2 LEU 9 2.265 -0.172 -27.315 78 H ALA 10 H ALA 10 4.212 -5.614 -26.942 79 HA ALA 10 HA ALA 10 5.839 -6.181 -29.383 80 HB1 ALA 10 1HB ALA 10 6.229 -7.630 -26.704 81 HB2 ALA 10 2HB ALA 10 7.055 -7.981 -28.298 82 HB3 ALA 10 3HB ALA 10 7.356 -6.425 -27.465 83 H LYS 11 H LYS 11 5.368 -8.238 -30.327 84 HA LYS 11 HA LYS 11 2.682 -9.366 -29.560 85 HB2 LYS 11 1HB LYS 11 3.340 -8.614 -31.967 86 HB3 LYS 11 2HB LYS 11 4.439 -9.993 -31.980 87 HG2 LYS 11 1HG LYS 11 2.081 -11.175 -31.191 88 HG3 LYS 11 2HG LYS 11 1.491 -9.858 -32.236 89 HD2 LYS 11 1HD LYS 11 3.497 -12.082 -32.961 90 HD3 LYS 11 2HD LYS 11 1.818 -11.955 -33.530 91 HE2 LYS 11 1HE LYS 11 2.474 -9.739 -34.628 92 HE3 LYS 11 2HE LYS 11 4.164 -10.248 -34.359 93 HZ1 LYS 11 1HZ LYS 11 3.335 -10.988 -36.538 94 HZ2 LYS 11 2HZ LYS 11 2.045 -11.765 -35.860 95 HZ3 LYS 11 3HZ LYS 11 3.584 -12.338 -35.590 96 H ALA 12 H ALA 12 2.524 -11.421 -28.753 97 HA ALA 12 HA ALA 12 4.977 -12.809 -28.063 98 HB1 ALA 12 1HB ALA 12 3.214 -13.114 -26.516 99 HB2 ALA 12 2HB ALA 12 2.026 -13.443 -27.796 100 HB3 ALA 12 3HB ALA 12 3.304 -14.670 -27.361 101 H LEU 13 H LEU 13 5.937 -14.434 -29.188 102 HA LEU 13 HA LEU 13 4.927 -15.080 -31.894 103 HB2 LEU 13 1HB LEU 13 7.513 -15.734 -30.484 104 HB3 LEU 13 2HB LEU 13 7.118 -16.189 -32.142 105 HG LEU 13 HG LEU 13 7.429 -13.355 -31.148 106 HD11 LEU 13 1HD1 LEU 13 9.467 -13.402 -32.460 107 HD12 LEU 13 2HD1 LEU 13 9.185 -15.084 -32.866 108 HD13 LEU 13 3HD1 LEU 13 9.470 -14.628 -31.173 109 HD21 LEU 13 1HD2 LEU 13 6.908 -14.467 -33.949 110 HD22 LEU 13 2HD2 LEU 13 7.454 -12.803 -33.605 111 HD23 LEU 13 3HD2 LEU 13 5.865 -13.354 -33.040 112 H TYR 14 H TYR 14 5.546 -16.562 -28.793 113 HA TYR 14 HA TYR 14 4.544 -19.197 -29.784 114 HB2 TYR 14 1HB TYR 14 6.476 -18.604 -27.554 115 HB3 TYR 14 2HB TYR 14 5.988 -20.216 -28.093 116 HD1 TYR 14 HD1 TYR 14 6.802 -21.132 -30.233 117 HD2 TYR 14 HD2 TYR 14 8.092 -17.301 -28.807 118 HE1 TYR 14 HE1 TYR 14 8.796 -21.132 -31.794 119 HE2 TYR 14 HE2 TYR 14 10.082 -17.339 -30.364 120 HH TYR 14 HH TYR 14 10.728 -20.106 -32.462 121 H ASP 15 H ASP 15 3.366 -20.392 -27.982 122 HA ASP 15 HA ASP 15 1.842 -18.447 -26.334 123 HB2 ASP 15 1HB ASP 15 0.238 -20.279 -26.102 124 HB3 ASP 15 2HB ASP 15 0.502 -19.811 -27.805 125 H ASN 16 H ASN 16 1.488 -18.828 -24.092 126 HA ASN 16 HA ASN 16 3.317 -20.768 -22.717 127 HB2 ASN 16 1HB ASN 16 4.451 -18.603 -23.169 128 HB3 ASN 16 2HB ASN 16 3.231 -17.812 -22.151 129 HD21 ASN 16 1HD2 ASN 16 4.658 -18.756 -19.125 130 HD22 ASN 16 2HD2 ASN 16 3.504 -17.802 -20.010 131 H VAL 17 H VAL 17 2.232 -21.756 -21.284 132 HA VAL 17 HA VAL 17 -0.172 -20.639 -19.953 133 HB VAL 17 HB VAL 17 1.296 -23.311 -19.673 134 HG11 VAL 17 1HG1 VAL 17 0.294 -22.709 -17.470 135 HG12 VAL 17 2HG1 VAL 17 -1.262 -22.345 -18.280 136 HG13 VAL 17 3HG1 VAL 17 -0.604 -24.026 -18.229 137 HG21 VAL 17 1HG2 VAL 17 -0.714 -24.318 -20.720 138 HG22 VAL 17 2HG2 VAL 17 -1.500 -22.681 -20.792 139 HG23 VAL 17 3HG2 VAL 17 -0.051 -23.014 -21.817 140 H ALA 18 H ALA 18 0.031 -19.577 -17.975 141 HA ALA 18 HA ALA 18 2.703 -19.173 -16.944 142 HB1 ALA 18 1HB ALA 18 1.477 -17.922 -15.118 143 HB2 ALA 18 2HB ALA 18 1.299 -17.291 -16.764 144 HB3 ALA 18 3HB ALA 18 -0.031 -18.247 -16.039 145 H GLU 19 H GLU 19 3.675 -20.503 -15.559 146 HA GLU 19 HA GLU 19 2.071 -22.564 -14.088 147 HB2 GLU 19 1HB GLU 19 5.059 -22.248 -14.595 148 HB3 GLU 19 2HB GLU 19 4.311 -23.610 -13.806 149 HG2 GLU 19 1HG GLU 19 3.331 -23.016 -16.573 150 HG3 GLU 19 2HG GLU 19 4.986 -23.594 -16.421 151 H SER 20 H SER 20 3.618 -19.530 -13.651 152 HA SER 20 HA SER 20 3.916 -20.005 -10.687 153 HB2 SER 20 1HB SER 20 5.617 -18.432 -12.657 154 HB3 SER 20 2HB SER 20 5.728 -18.371 -10.846 155 HG SER 20 HG SER 20 5.861 -20.796 -12.228 156 HA PRO 21 HA PRO 21 1.212 -16.571 -10.759 157 HB2 PRO 21 1HB PRO 21 1.561 -15.294 -8.408 158 HB3 PRO 21 2HB PRO 21 0.801 -16.930 -8.520 159 HG2 PRO 21 1HG PRO 21 3.630 -16.104 -7.838 160 HG3 PRO 21 2HG PRO 21 2.547 -17.223 -6.945 161 HD2 PRO 21 1HD PRO 21 4.439 -18.201 -8.755 162 HD3 PRO 21 2HD PRO 21 2.855 -18.996 -8.563 163 H ASP 22 H ASP 22 4.678 -16.021 -10.450 164 HA ASP 22 HA ASP 22 4.523 -13.140 -10.734 165 HB2 ASP 22 1HB ASP 22 6.675 -15.273 -10.984 166 HB3 ASP 22 2HB ASP 22 7.008 -13.561 -11.488 167 H GLU 23 H GLU 23 4.114 -15.870 -12.714 168 HA GLU 23 HA GLU 23 5.286 -14.687 -15.122 169 HB2 GLU 23 1HB GLU 23 5.412 -17.078 -14.293 170 HB3 GLU 23 2HB GLU 23 3.727 -17.267 -14.857 171 HG2 GLU 23 1HG GLU 23 4.440 -16.673 -17.103 172 HG3 GLU 23 2HG GLU 23 6.113 -16.503 -16.550 173 H LEU 24 H LEU 24 4.199 -14.073 -16.962 174 HA LEU 24 HA LEU 24 1.295 -13.560 -16.526 175 HB2 LEU 24 1HB LEU 24 3.407 -12.282 -17.921 176 HB3 LEU 24 2HB LEU 24 2.266 -12.799 -19.144 177 HG LEU 24 HG LEU 24 1.611 -11.070 -16.727 178 HD11 LEU 24 1HD1 LEU 24 1.239 -9.284 -18.379 179 HD12 LEU 24 2HD1 LEU 24 1.677 -10.375 -19.710 180 HD13 LEU 24 3HD1 LEU 24 2.917 -9.901 -18.475 181 HD21 LEU 24 1HD2 LEU 24 -0.324 -12.397 -17.174 182 HD22 LEU 24 2HD2 LEU 24 -0.158 -12.113 -18.918 183 HD23 LEU 24 3HD2 LEU 24 -0.635 -10.830 -17.812 184 H SER 25 H SER 25 -0.220 -14.731 -17.339 185 HA SER 25 HA SER 25 0.329 -16.959 -19.184 186 HB2 SER 25 1HB SER 25 -1.547 -17.012 -17.433 187 HB3 SER 25 2HB SER 25 -2.387 -15.787 -18.419 188 HG SER 25 HG SER 25 -1.595 -18.389 -19.322 189 H PHE 26 H PHE 26 0.329 -16.832 -21.358 190 HA PHE 26 HA PHE 26 -1.239 -14.754 -22.698 191 HB2 PHE 26 1HB PHE 26 0.578 -13.705 -23.939 192 HB3 PHE 26 2HB PHE 26 0.851 -13.502 -22.163 193 HD1 PHE 26 HD1 PHE 26 2.702 -14.355 -21.100 194 HD2 PHE 26 HD2 PHE 26 1.961 -15.340 -25.203 195 HE1 PHE 26 HE1 PHE 26 5.039 -15.201 -21.278 196 HE2 PHE 26 HE2 PHE 26 4.321 -16.208 -25.391 197 HZ PHE 26 HZ PHE 26 5.818 -16.066 -23.472 198 H ARG 27 H ARG 27 -1.017 -15.004 -25.153 199 HA ARG 27 HA ARG 27 -0.247 -17.779 -25.815 200 HB2 ARG 27 1HB ARG 27 -2.818 -16.423 -26.731 201 HB3 ARG 27 2HB ARG 27 -2.272 -18.099 -27.118 202 HG2 ARG 27 1HG ARG 27 -2.229 -18.391 -24.511 203 HG3 ARG 27 2HG ARG 27 -3.326 -16.979 -24.513 204 HD2 ARG 27 1HD ARG 27 -4.710 -18.352 -26.242 205 HD3 ARG 27 2HD ARG 27 -3.721 -19.746 -25.712 206 HE ARG 27 HE ARG 27 -5.889 -18.450 -24.226 207 HH11 ARG 27 1HH1 ARG 27 -3.030 -20.436 -23.816 208 HH12 ARG 27 2HH1 ARG 27 -3.642 -21.184 -22.376 209 HH21 ARG 27 1HH2 ARG 27 -6.630 -19.486 -22.389 210 HH22 ARG 27 2HH2 ARG 27 -5.618 -20.635 -21.590 211 H LYS 28 H LYS 28 0.016 -18.120 -28.201 212 HA LYS 28 HA LYS 28 1.692 -16.026 -29.247 213 HB2 LYS 28 1HB LYS 28 1.614 -17.411 -31.333 214 HB3 LYS 28 2HB LYS 28 1.966 -18.320 -29.861 215 HG2 LYS 28 1HG LYS 28 -0.480 -19.000 -29.776 216 HG3 LYS 28 2HG LYS 28 -0.644 -18.389 -31.429 217 HD2 LYS 28 1HD LYS 28 1.139 -19.940 -32.198 218 HD3 LYS 28 2HD LYS 28 1.314 -20.543 -30.499 219 HE2 LYS 28 1HE LYS 28 -1.092 -21.171 -30.557 220 HE3 LYS 28 2HE LYS 28 -1.187 -20.714 -32.284 221 HZ1 LYS 28 1HZ LYS 28 0.603 -22.430 -32.684 222 HZ2 LYS 28 2HZ LYS 28 -0.724 -23.128 -32.046 223 HZ3 LYS 28 3HZ LYS 28 0.599 -22.828 -31.078 224 H GLY 29 H GLY 29 1.224 -14.460 -30.685 225 HA2 GLY 29 1HA GLY 29 -0.063 -13.299 -32.292 226 HA3 GLY 29 2HA GLY 29 -1.474 -14.263 -31.889 227 H ASP 30 H ASP 30 -0.473 -13.495 -28.930 228 HA ASP 30 HA ASP 30 -2.349 -11.263 -28.746 229 HB2 ASP 30 1HB ASP 30 -2.011 -13.334 -27.158 230 HB3 ASP 30 2HB ASP 30 -0.682 -12.427 -26.448 231 H ILE 31 H ILE 31 -1.724 -9.236 -27.551 232 HA ILE 31 HA ILE 31 1.185 -8.628 -27.969 233 HB ILE 31 HB ILE 31 -1.228 -6.908 -28.783 234 HG12 ILE 31 1HG1 ILE 31 0.602 -6.856 -30.910 235 HG13 ILE 31 2HG1 ILE 31 0.848 -8.484 -30.233 236 HG21 ILE 31 1HG2 ILE 31 0.342 -5.157 -29.480 237 HG22 ILE 31 2HG2 ILE 31 0.385 -5.413 -27.737 238 HG23 ILE 31 3HG2 ILE 31 1.686 -6.076 -28.765 239 HD11 ILE 31 1HD1 ILE 31 -1.848 -7.357 -31.049 240 HD12 ILE 31 2HD1 ILE 31 -0.854 -8.459 -32.031 241 HD13 ILE 31 3HD1 ILE 31 -1.562 -8.966 -30.459 242 H MET 32 H MET 32 2.181 -7.622 -26.289 243 HA MET 32 HA MET 32 0.470 -6.506 -24.207 244 HB2 MET 32 1HB MET 32 1.887 -7.526 -22.453 245 HB3 MET 32 2HB MET 32 0.954 -8.701 -23.402 246 HG2 MET 32 1HG MET 32 3.901 -8.120 -23.809 247 HG3 MET 32 2HG MET 32 3.223 -9.427 -22.847 248 HE1 MET 32 1HE MET 32 1.074 -10.700 -24.287 249 HE2 MET 32 2HE MET 32 1.651 -11.737 -25.587 250 HE3 MET 32 3HE MET 32 2.430 -11.816 -23.995 251 H THR 33 H THR 33 1.342 -4.751 -23.052 252 HA THR 33 HA THR 33 3.509 -3.296 -24.322 253 HB THR 33 HB THR 33 2.198 -2.739 -21.601 254 HG1 THR 33 HG1 THR 33 0.763 -1.397 -22.983 255 HG21 THR 33 1HG2 THR 33 3.229 -0.822 -23.696 256 HG22 THR 33 2HG2 THR 33 4.131 -1.323 -22.261 257 HG23 THR 33 3HG2 THR 33 2.585 -0.433 -22.086 258 H VAL 34 H VAL 34 5.605 -3.227 -23.740 259 HA VAL 34 HA VAL 34 6.473 -4.915 -21.430 260 HB VAL 34 HB VAL 34 8.094 -3.631 -23.666 261 HG11 VAL 34 1HG1 VAL 34 9.371 -3.869 -21.561 262 HG12 VAL 34 2HG1 VAL 34 8.911 -5.574 -21.493 263 HG13 VAL 34 3HG1 VAL 34 9.942 -5.029 -22.806 264 HG21 VAL 34 1HG2 VAL 34 8.449 -5.940 -24.551 265 HG22 VAL 34 2HG2 VAL 34 7.419 -6.567 -23.249 266 HG23 VAL 34 3HG2 VAL 34 6.704 -5.550 -24.520 267 H LEU 35 H LEU 35 6.961 -3.936 -19.552 268 HA LEU 35 HA LEU 35 6.967 -0.983 -19.586 269 HB2 LEU 35 1HB LEU 35 6.782 -2.852 -17.202 270 HB3 LEU 35 2HB LEU 35 6.560 -1.135 -17.221 271 HG LEU 35 HG LEU 35 4.761 -3.190 -18.640 272 HD11 LEU 35 1HD1 LEU 35 4.661 -3.353 -16.191 273 HD12 LEU 35 2HD1 LEU 35 3.148 -2.677 -16.880 274 HD13 LEU 35 3HD1 LEU 35 4.316 -1.620 -16.060 275 HD21 LEU 35 1HD2 LEU 35 3.168 -1.244 -18.842 276 HD22 LEU 35 2HD2 LEU 35 4.654 -0.957 -19.740 277 HD23 LEU 35 3HD2 LEU 35 4.378 -0.175 -18.173 278 H GLU 36 H GLU 36 8.933 -3.653 -18.291 279 HA GLU 36 HA GLU 36 11.349 -1.941 -18.480 280 HB2 GLU 36 1HB GLU 36 12.088 -2.641 -16.207 281 HB3 GLU 36 2HB GLU 36 10.707 -1.554 -16.192 282 HG2 GLU 36 1HG GLU 36 9.173 -3.339 -15.662 283 HG3 GLU 36 2HG GLU 36 10.454 -4.536 -15.825 284 H ARG 37 H ARG 37 13.322 -3.499 -18.011 285 HA ARG 37 HA ARG 37 12.678 -6.257 -19.030 286 HB2 ARG 37 1HB ARG 37 15.098 -4.531 -19.600 287 HB3 ARG 37 2HB ARG 37 14.928 -6.227 -20.061 288 HG2 ARG 37 1HG ARG 37 12.771 -5.393 -21.373 289 HG3 ARG 37 2HG ARG 37 13.426 -3.794 -21.063 290 HD2 ARG 37 1HD ARG 37 15.567 -4.531 -22.123 291 HD3 ARG 37 2HD ARG 37 14.847 -6.065 -22.541 292 HE ARG 37 HE ARG 37 13.337 -3.828 -23.589 293 HH11 ARG 37 1HH1 ARG 37 16.027 -6.007 -24.151 294 HH12 ARG 37 2HH1 ARG 37 15.937 -5.848 -25.894 295 HH21 ARG 37 1HH2 ARG 37 13.279 -3.666 -25.879 296 HH22 ARG 37 2HH2 ARG 37 14.431 -4.601 -26.795 297 H ASP 38 H ASP 38 14.273 -7.824 -18.373 298 HA ASP 38 HA ASP 38 15.257 -9.020 -16.763 299 HB2 ASP 38 1HB ASP 38 16.978 -6.527 -16.507 300 HB3 ASP 38 2HB ASP 38 17.364 -8.158 -15.968 301 H THR 39 H THR 39 12.921 -8.038 -15.941 302 HA THR 39 HA THR 39 12.981 -6.302 -13.756 303 HB THR 39 HB THR 39 11.006 -6.794 -15.290 304 HG1 THR 39 HG1 THR 39 10.828 -5.804 -13.186 305 HG21 THR 39 1HG2 THR 39 10.606 -9.257 -13.526 306 HG22 THR 39 2HG2 THR 39 11.153 -9.321 -15.212 307 HG23 THR 39 3HG2 THR 39 9.573 -8.713 -14.826 308 H GLN 40 H GLN 40 13.462 -9.761 -13.722 309 HA GLN 40 HA GLN 40 13.090 -9.726 -10.736 310 HB2 GLN 40 1HB GLN 40 11.989 -11.401 -12.520 311 HB3 GLN 40 2HB GLN 40 13.511 -12.285 -12.232 312 HG2 GLN 40 1HG GLN 40 12.968 -12.214 -9.755 313 HG3 GLN 40 2HG GLN 40 11.490 -11.348 -10.179 314 HE21 GLN 40 1HE2 GLN 40 10.992 -15.078 -9.830 315 HE22 GLN 40 2HE2 GLN 40 11.825 -13.921 -8.815 316 H GLY 41 H GLY 41 15.480 -9.011 -12.776 317 HA2 GLY 41 1HA GLY 41 17.760 -8.959 -12.323 318 HA3 GLY 41 2HA GLY 41 17.627 -10.094 -11.046 319 H LEU 42 H LEU 42 15.796 -11.315 -13.516 320 HA LEU 42 HA LEU 42 17.966 -13.161 -14.373 321 HB2 LEU 42 1HB LEU 42 14.964 -13.174 -14.816 322 HB3 LEU 42 2HB LEU 42 16.066 -14.427 -15.388 323 HG LEU 42 HG LEU 42 15.589 -13.783 -12.444 324 HD11 LEU 42 1HD1 LEU 42 13.550 -14.589 -13.508 325 HD12 LEU 42 2HD1 LEU 42 14.261 -15.809 -12.420 326 HD13 LEU 42 3HD1 LEU 42 14.429 -15.975 -14.166 327 HD21 LEU 42 1HD2 LEU 42 16.639 -16.068 -12.099 328 HD22 LEU 42 2HD2 LEU 42 17.746 -14.865 -12.740 329 HD23 LEU 42 3HD2 LEU 42 16.990 -16.123 -13.805 330 H ASP 43 H ASP 43 18.984 -12.686 -16.200 331 HA ASP 43 HA ASP 43 18.178 -10.580 -17.899 332 HB2 ASP 43 1HB ASP 43 20.076 -12.928 -18.348 333 HB3 ASP 43 2HB ASP 43 19.860 -11.656 -19.511 334 H GLY 44 H GLY 44 16.749 -10.539 -19.567 335 HA2 GLY 44 1HA GLY 44 15.779 -11.494 -21.570 336 HA3 GLY 44 2HA GLY 44 16.061 -13.117 -20.875 337 H TRP 45 H TRP 45 14.827 -11.727 -18.274 338 HA TRP 45 HA TRP 45 12.021 -12.368 -19.097 339 HB2 TRP 45 1HB TRP 45 13.402 -12.174 -16.426 340 HB3 TRP 45 2HB TRP 45 11.661 -12.296 -16.600 341 HD1 TRP 45 HD1 TRP 45 14.877 -14.302 -17.014 342 HE1 TRP 45 HE1 TRP 45 14.334 -16.794 -17.379 343 HE3 TRP 45 HE3 TRP 45 9.828 -13.907 -17.684 344 HZ2 TRP 45 HZ2 TRP 45 12.104 -18.359 -17.901 345 HZ3 TRP 45 HZ3 TRP 45 8.462 -15.965 -18.138 346 HH2 TRP 45 HH2 TRP 45 9.633 -18.203 -18.244 347 H TRP 46 H TRP 46 10.801 -10.684 -19.789 348 HA TRP 46 HA TRP 46 11.460 -7.990 -18.722 349 HB2 TRP 46 1HB TRP 46 9.788 -8.934 -21.040 350 HB3 TRP 46 2HB TRP 46 10.143 -7.240 -20.641 351 HD1 TRP 46 HD1 TRP 46 13.339 -8.726 -20.122 352 HE1 TRP 46 HE1 TRP 46 14.848 -8.770 -22.184 353 HE3 TRP 46 HE3 TRP 46 9.749 -7.710 -23.633 354 HZ2 TRP 46 HZ2 TRP 46 14.546 -8.417 -24.970 355 HZ3 TRP 46 HZ3 TRP 46 10.435 -7.610 -26.047 356 HH2 TRP 46 HH2 TRP 46 12.846 -7.919 -26.708 357 H LEU 47 H LEU 47 9.800 -6.680 -17.745 358 HA LEU 47 HA LEU 47 7.478 -8.237 -16.813 359 HB2 LEU 47 1HB LEU 47 8.764 -6.538 -15.369 360 HB3 LEU 47 2HB LEU 47 8.013 -5.312 -16.372 361 HG LEU 47 HG LEU 47 5.784 -6.297 -15.636 362 HD11 LEU 47 1HD1 LEU 47 7.588 -7.512 -13.508 363 HD12 LEU 47 2HD1 LEU 47 6.708 -8.408 -14.775 364 HD13 LEU 47 3HD1 LEU 47 5.826 -7.515 -13.506 365 HD21 LEU 47 1HD2 LEU 47 5.803 -5.054 -13.503 366 HD22 LEU 47 2HD2 LEU 47 6.590 -4.155 -14.887 367 HD23 LEU 47 3HD2 LEU 47 7.620 -4.936 -13.600 368 H CYS 48 H CYS 48 5.676 -8.290 -18.023 369 HA CYS 48 HA CYS 48 5.150 -5.914 -19.856 370 HB2 CYS 48 1HB CYS 48 4.423 -8.838 -20.340 371 HB3 CYS 48 2HB CYS 48 4.285 -7.449 -21.449 372 HG CYS 48 HG CYS 48 7.027 -8.876 -20.243 373 H SER 49 H SER 49 2.809 -5.717 -20.340 374 HA SER 49 HA SER 49 1.121 -6.493 -17.984 375 HB2 SER 49 1HB SER 49 1.637 -4.138 -17.800 376 HB3 SER 49 2HB SER 49 1.141 -3.857 -19.517 377 HG SER 49 HG SER 49 -0.483 -4.877 -17.402 378 H LEU 50 H LEU 50 -0.633 -7.559 -18.490 379 HA LEU 50 HA LEU 50 -2.102 -7.217 -21.024 380 HB2 LEU 50 1HB LEU 50 -0.272 -8.838 -21.539 381 HB3 LEU 50 2HB LEU 50 -0.774 -9.796 -20.160 382 HG LEU 50 HG LEU 50 -2.947 -10.214 -21.372 383 HD11 LEU 50 1HD1 LEU 50 -1.474 -9.012 -23.773 384 HD12 LEU 50 2HD1 LEU 50 -2.817 -8.223 -22.924 385 HD13 LEU 50 3HD1 LEU 50 -3.079 -9.765 -23.792 386 HD21 LEU 50 1HD2 LEU 50 -1.078 -11.814 -21.286 387 HD22 LEU 50 2HD2 LEU 50 -0.437 -11.150 -22.768 388 HD23 LEU 50 3HD2 LEU 50 -2.010 -11.932 -22.796 389 H HIS 51 H HIS 51 -4.248 -8.179 -20.889 390 HA HIS 51 HA HIS 51 -6.165 -8.721 -19.782 391 HB2 HIS 51 1HB HIS 51 -4.650 -10.869 -19.615 392 HB3 HIS 51 2HB HIS 51 -4.587 -10.444 -17.900 393 HD1 HIS 51 HD1 HIS 51 -6.932 -10.371 -16.627 394 HD2 HIS 51 HD2 HIS 51 -6.934 -12.153 -20.389 395 HE1 HIS 51 HE1 HIS 51 -9.057 -11.740 -16.765 396 H GLY 52 H GLY 52 -4.685 -6.423 -18.834 397 HA2 GLY 52 1HA GLY 52 -4.817 -4.870 -17.135 398 HA3 GLY 52 2HA GLY 52 -6.067 -5.860 -16.417 399 H ARG 53 H ARG 53 -2.897 -7.334 -16.775 400 HA ARG 53 HA ARG 53 -2.192 -6.722 -13.974 401 HB2 ARG 53 1HB ARG 53 -1.923 -9.090 -13.381 402 HB3 ARG 53 2HB ARG 53 -3.606 -8.793 -13.835 403 HG2 ARG 53 1HG ARG 53 -2.957 -9.680 -16.159 404 HG3 ARG 53 2HG ARG 53 -1.451 -10.228 -15.422 405 HD2 ARG 53 1HD ARG 53 -2.641 -11.681 -13.926 406 HD3 ARG 53 2HD ARG 53 -4.165 -10.856 -14.310 407 HE ARG 53 HE ARG 53 -3.015 -11.897 -16.694 408 HH11 ARG 53 1HH1 ARG 53 -4.530 -13.126 -13.741 409 HH12 ARG 53 2HH1 ARG 53 -5.171 -14.500 -14.574 410 HH21 ARG 53 1HH2 ARG 53 -3.924 -13.651 -17.662 411 HH22 ARG 53 2HH2 ARG 53 -4.912 -14.759 -16.749 412 H GLN 54 H GLN 54 0.085 -7.615 -13.580 413 HA GLN 54 HA GLN 54 1.566 -7.353 -16.137 414 HB2 GLN 54 1HB GLN 54 2.201 -6.457 -13.337 415 HB3 GLN 54 2HB GLN 54 3.370 -6.430 -14.656 416 HG2 GLN 54 1HG GLN 54 2.455 -4.572 -15.528 417 HG3 GLN 54 2HG GLN 54 0.791 -5.057 -15.210 418 HE21 GLN 54 1HE2 GLN 54 2.381 -2.364 -12.805 419 HE22 GLN 54 2HE2 GLN 54 2.969 -2.753 -14.389 420 H GLY 55 H GLY 55 3.620 -8.583 -16.168 421 HA2 GLY 55 1HA GLY 55 4.334 -10.308 -14.028 422 HA3 GLY 55 2HA GLY 55 3.388 -11.249 -15.214 423 H ILE 56 H ILE 56 5.958 -12.002 -14.688 424 HA ILE 56 HA ILE 56 7.814 -10.769 -16.533 425 HB ILE 56 HB ILE 56 9.357 -12.469 -15.864 426 HG12 ILE 56 1HG1 ILE 56 7.160 -14.070 -14.598 427 HG13 ILE 56 2HG1 ILE 56 7.878 -14.426 -16.145 428 HG21 ILE 56 1HG2 ILE 56 8.597 -10.779 -14.137 429 HG22 ILE 56 2HG2 ILE 56 7.764 -12.149 -13.357 430 HG23 ILE 56 3HG2 ILE 56 9.483 -12.181 -13.582 431 HD11 ILE 56 1HD1 ILE 56 10.114 -14.556 -14.903 432 HD12 ILE 56 2HD1 ILE 56 9.137 -14.526 -13.416 433 HD13 ILE 56 3HD1 ILE 56 8.955 -15.817 -14.605 434 H VAL 57 H VAL 57 8.514 -11.500 -18.571 435 HA VAL 57 HA VAL 57 7.146 -13.790 -19.870 436 HB VAL 57 HB VAL 57 7.397 -11.004 -20.965 437 HG11 VAL 57 1HG1 VAL 57 6.399 -13.529 -22.192 438 HG12 VAL 57 2HG1 VAL 57 6.110 -11.895 -22.895 439 HG13 VAL 57 3HG1 VAL 57 7.762 -12.494 -22.769 440 HG21 VAL 57 1HG2 VAL 57 5.521 -11.033 -19.416 441 HG22 VAL 57 2HG2 VAL 57 4.892 -11.002 -21.072 442 HG23 VAL 57 3HG2 VAL 57 4.924 -12.541 -20.112 443 HA PRO 58 HA PRO 58 11.446 -13.878 -21.111 444 HB2 PRO 58 1HB PRO 58 11.480 -15.913 -22.858 445 HB3 PRO 58 2HB PRO 58 11.367 -16.215 -21.086 446 HG2 PRO 58 1HG PRO 58 9.164 -16.090 -23.163 447 HG3 PRO 58 2HG PRO 58 9.447 -17.344 -21.861 448 HD2 PRO 58 1HD PRO 58 7.632 -15.336 -21.617 449 HD3 PRO 58 2HD PRO 58 8.580 -15.982 -20.262 450 H GLY 59 H GLY 59 12.176 -12.229 -22.316 451 HA2 GLY 59 1HA GLY 59 10.655 -11.167 -24.434 452 HA3 GLY 59 2HA GLY 59 12.339 -10.798 -24.137 453 H ASN 60 H ASN 60 12.948 -13.774 -24.520 454 HA ASN 60 HA ASN 60 13.677 -13.624 -27.268 455 HB2 ASN 60 1HB ASN 60 13.564 -15.859 -25.219 456 HB3 ASN 60 2HB ASN 60 14.062 -16.171 -26.883 457 HD21 ASN 60 1HD2 ASN 60 17.310 -15.061 -26.393 458 HD22 ASN 60 2HD2 ASN 60 16.175 -16.042 -27.268 459 H ARG 61 H ARG 61 10.681 -14.203 -25.910 460 HA ARG 61 HA ARG 61 9.809 -15.849 -28.274 461 HB2 ARG 61 1HB ARG 61 8.578 -15.596 -25.498 462 HB3 ARG 61 2HB ARG 61 7.865 -16.510 -26.853 463 HG2 ARG 61 1HG ARG 61 10.156 -17.722 -26.902 464 HG3 ARG 61 2HG ARG 61 10.337 -17.057 -25.238 465 HD2 ARG 61 1HD ARG 61 8.241 -18.145 -24.560 466 HD3 ARG 61 2HD ARG 61 7.992 -18.753 -26.181 467 HE ARG 61 HE ARG 61 9.884 -19.727 -24.135 468 HH11 ARG 61 1HH1 ARG 61 8.797 -20.049 -27.504 469 HH12 ARG 61 2HH1 ARG 61 9.471 -21.646 -27.682 470 HH21 ARG 61 1HH2 ARG 61 10.734 -21.708 -24.476 471 HH22 ARG 61 2HH2 ARG 61 10.584 -22.568 -25.986 472 H LEU 62 H LEU 62 10.164 -12.822 -27.573 473 HA LEU 62 HA LEU 62 7.402 -11.994 -28.498 474 HB2 LEU 62 1HB LEU 62 9.436 -10.436 -26.887 475 HB3 LEU 62 2HB LEU 62 7.858 -9.809 -27.451 476 HG LEU 62 HG LEU 62 8.190 -12.006 -25.377 477 HD11 LEU 62 1HD1 LEU 62 8.959 -9.847 -24.525 478 HD12 LEU 62 2HD1 LEU 62 7.402 -10.221 -23.787 479 HD13 LEU 62 3HD1 LEU 62 7.499 -9.030 -25.095 480 HD21 LEU 62 1HD2 LEU 62 5.798 -10.554 -26.571 481 HD22 LEU 62 2HD2 LEU 62 5.713 -11.390 -24.999 482 HD23 LEU 62 3HD2 LEU 62 6.122 -12.315 -26.442 483 H LYS 63 H LYS 63 7.276 -10.311 -30.047 484 HA LYS 63 HA LYS 63 9.892 -9.509 -31.299 485 HB2 LYS 63 1HB LYS 63 8.504 -10.980 -32.797 486 HB3 LYS 63 2HB LYS 63 7.216 -9.774 -32.711 487 HG2 LYS 63 1HG LYS 63 8.865 -8.065 -33.587 488 HG3 LYS 63 2HG LYS 63 9.986 -9.396 -33.917 489 HD2 LYS 63 1HD LYS 63 8.239 -10.354 -35.421 490 HD3 LYS 63 2HD LYS 63 7.179 -8.972 -35.067 491 HE2 LYS 63 1HE LYS 63 9.216 -7.529 -35.684 492 HE3 LYS 63 2HE LYS 63 9.833 -9.019 -36.478 493 HZ1 LYS 63 1HZ LYS 63 8.631 -7.669 -38.077 494 HZ2 LYS 63 2HZ LYS 63 7.283 -7.549 -37.117 495 HZ3 LYS 63 3HZ LYS 63 7.698 -8.989 -37.786 496 H ILE 64 H ILE 64 10.294 -7.368 -31.165 497 HA ILE 64 HA ILE 64 8.522 -5.571 -29.884 498 HB ILE 64 HB ILE 64 10.949 -5.060 -31.705 499 HG12 ILE 64 1HG1 ILE 64 11.469 -6.404 -29.749 500 HG13 ILE 64 2HG1 ILE 64 12.185 -4.804 -29.612 501 HG21 ILE 64 1HG2 ILE 64 9.648 -2.975 -31.596 502 HG22 ILE 64 2HG2 ILE 64 9.445 -3.129 -29.799 503 HG23 ILE 64 3HG2 ILE 64 11.046 -2.803 -30.585 504 HD11 ILE 64 1HD1 ILE 64 9.717 -5.747 -28.126 505 HD12 ILE 64 2HD1 ILE 64 11.300 -5.510 -27.440 506 HD13 ILE 64 3HD1 ILE 64 10.365 -4.117 -28.035 507 H LEU 65 H LEU 65 7.040 -4.211 -30.482 508 HA LEU 65 HA LEU 65 6.396 -3.939 -33.357 509 HB2 LEU 65 1HB LEU 65 4.875 -5.085 -31.191 510 HB3 LEU 65 2HB LEU 65 4.039 -3.678 -31.832 511 HG LEU 65 HG LEU 65 4.161 -4.786 -34.107 512 HD11 LEU 65 1HD1 LEU 65 4.506 -7.237 -34.138 513 HD12 LEU 65 2HD1 LEU 65 5.162 -7.143 -32.490 514 HD13 LEU 65 3HD1 LEU 65 5.990 -6.327 -33.877 515 HD21 LEU 65 1HD2 LEU 65 2.296 -6.321 -33.613 516 HD22 LEU 65 2HD2 LEU 65 2.100 -4.782 -32.725 517 HD23 LEU 65 3HD2 LEU 65 2.684 -6.230 -31.888 518 H VAL 66 H VAL 66 5.154 -1.905 -33.771 519 HA VAL 66 HA VAL 66 5.089 0.383 -33.704 520 HB VAL 66 HB VAL 66 4.625 0.051 -30.705 521 HG11 VAL 66 1HG1 VAL 66 4.881 2.427 -31.395 522 HG12 VAL 66 2HG1 VAL 66 3.731 2.160 -32.728 523 HG13 VAL 66 3HG1 VAL 66 3.225 2.045 -30.992 524 HG21 VAL 66 1HG2 VAL 66 2.180 -0.038 -31.394 525 HG22 VAL 66 2HG2 VAL 66 2.695 -0.186 -33.079 526 HG23 VAL 66 3HG2 VAL 66 3.092 -1.471 -31.916 527 H GLY 67 H GLY 67 7.316 0.379 -34.352 528 HA2 GLY 67 1HA GLY 67 8.649 2.342 -32.765 529 HA3 GLY 67 2HA GLY 67 9.512 0.806 -32.785 530 H MET 68 H MET 68 8.029 3.266 -34.856 531 HA MET 68 HA MET 68 8.445 3.993 -36.950 532 HB2 MET 68 1HB MET 68 10.701 4.376 -35.586 533 HB3 MET 68 2HB MET 68 11.341 3.267 -36.744 534 HG2 MET 68 1HG MET 68 10.693 4.744 -38.591 535 HG3 MET 68 2HG MET 68 9.813 5.778 -37.451 536 HE1 MET 68 1HE MET 68 10.986 8.070 -38.092 537 HE2 MET 68 2HE MET 68 12.725 8.191 -38.408 538 HE3 MET 68 3HE MET 68 11.722 7.165 -39.441 539 H TYR 69 H TYR 69 7.509 1.344 -36.883 540 HA TYR 69 HA TYR 69 8.955 0.134 -39.159 541 HB2 TYR 69 1HB TYR 69 6.727 -1.038 -37.501 542 HB3 TYR 69 2HB TYR 69 7.636 -1.920 -38.716 543 HD1 TYR 69 HD1 TYR 69 7.172 -2.014 -35.423 544 HD2 TYR 69 HD2 TYR 69 10.484 -1.117 -38.040 545 HE1 TYR 69 HE1 TYR 69 8.785 -2.597 -33.618 546 HE2 TYR 69 HE2 TYR 69 12.081 -1.753 -36.265 547 HH TYR 69 HH TYR 69 12.353 -2.426 -34.122 548 H ASP 70 H ASP 70 7.665 -0.640 -40.972 549 HA ASP 70 HA ASP 70 5.915 1.376 -41.965 550 HB2 ASP 70 1HB ASP 70 7.516 -0.263 -43.209 551 HB3 ASP 70 2HB ASP 70 6.218 -1.443 -43.021 552 H LYS 71 H LYS 71 3.671 1.144 -42.561 553 HA LYS 71 HA LYS 71 2.155 -1.091 -41.264 554 HB2 LYS 71 1HB LYS 71 0.582 0.456 -40.160 555 HB3 LYS 71 2HB LYS 71 2.198 0.638 -39.493 556 HG2 LYS 71 1HG LYS 71 2.512 2.805 -40.567 557 HG3 LYS 71 2HG LYS 71 1.070 2.567 -41.586 558 HD2 LYS 71 1HD LYS 71 -0.312 2.494 -39.520 559 HD3 LYS 71 2HD LYS 71 1.152 2.862 -38.531 560 HE2 LYS 71 1HE LYS 71 1.400 4.994 -39.711 561 HE3 LYS 71 2HE LYS 71 -0.009 4.643 -40.734 562 HZ1 LYS 71 1HZ LYS 71 -1.312 4.477 -38.540 563 HZ2 LYS 71 2HZ LYS 71 -0.859 5.984 -38.973 564 HZ3 LYS 71 3HZ LYS 71 -0.023 5.166 -37.809 565 H LYS 72 H LYS 72 -0.131 -1.040 -41.912 566 HA LYS 72 HA LYS 72 -0.446 -0.424 -44.789 567 HB2 LYS 72 1HB LYS 72 -2.260 -1.633 -42.662 568 HB3 LYS 72 2HB LYS 72 -2.939 -0.958 -44.147 569 HG2 LYS 72 1HG LYS 72 -2.733 -3.312 -44.493 570 HG3 LYS 72 2HG LYS 72 -1.478 -2.501 -45.432 571 HD2 LYS 72 1HD LYS 72 0.232 -3.098 -43.725 572 HD3 LYS 72 2HD LYS 72 -1.066 -3.854 -42.766 573 HE2 LYS 72 1HE LYS 72 -1.528 -5.449 -44.569 574 HE3 LYS 72 2HE LYS 72 -0.322 -4.645 -45.604 575 HZ1 LYS 72 1HZ LYS 72 0.665 -6.567 -44.450 576 HZ2 LYS 72 2HZ LYS 72 0.203 -6.015 -42.980 577 HZ3 LYS 72 3HZ LYS 72 1.335 -5.202 -43.836 578 HA PRO 73 HA PRO 73 -1.516 3.616 -43.752 579 HB2 PRO 73 1HB PRO 73 -3.365 4.474 -45.609 580 HB3 PRO 73 2HB PRO 73 -1.621 4.181 -46.001 581 HG2 PRO 73 1HG PRO 73 -3.952 2.351 -46.441 582 HG3 PRO 73 2HG PRO 73 -2.603 2.812 -47.533 583 HD2 PRO 73 1HD PRO 73 -2.674 0.491 -46.100 584 HD3 PRO 73 2HD PRO 73 -1.136 1.338 -46.526 585 H ALA 74 H ALA 74 -2.559 3.940 -41.881 586 HA ALA 74 HA ALA 74 -5.439 4.176 -41.827 587 HB1 ALA 74 1HB ALA 74 -5.138 1.762 -41.346 588 HB2 ALA 74 2HB ALA 74 -4.041 2.162 -40.009 589 HB3 ALA 74 3HB ALA 74 -5.766 2.667 -39.925 590 H GLY 75 H GLY 75 -6.063 5.182 -39.613 591 HA2 GLY 75 1HA GLY 75 -3.811 6.840 -38.677 592 HA3 GLY 75 2HA GLY 75 -5.536 7.074 -38.327 593 H GLU 76 H GLU 76 -5.804 6.988 -36.229 594 HA GLU 76 HA GLU 76 -5.971 6.268 -34.141 595 HB2 GLU 76 1HB GLU 76 -6.352 3.892 -35.707 596 HB3 GLU 76 2HB GLU 76 -5.320 3.440 -34.366 597 HG2 GLU 76 1HG GLU 76 -7.517 3.109 -33.552 598 HG3 GLU 76 2HG GLU 76 -7.020 4.590 -32.865 599 H PHE 77 H PHE 77 -4.950 4.932 -32.286 600 HA PHE 77 HA PHE 77 -3.177 4.870 -30.818 601 HB2 PHE 77 1HB PHE 77 -2.744 3.114 -32.893 602 HB3 PHE 77 2HB PHE 77 -1.282 4.012 -32.889 603 HD1 PHE 77 HD1 PHE 77 0.393 3.568 -31.286 604 HD2 PHE 77 HD2 PHE 77 -3.563 2.057 -30.643 605 HE1 PHE 77 HE1 PHE 77 1.288 2.241 -29.333 606 HE2 PHE 77 HE2 PHE 77 -2.712 0.741 -28.713 607 HZ PHE 77 HZ PHE 77 -0.312 0.830 -28.107 608 H ILE 78 H ILE 78 -3.643 7.405 -31.877 609 HA ILE 78 HA ILE 78 -0.930 8.604 -32.053 610 HB ILE 78 HB ILE 78 -2.105 8.593 -34.273 611 HG12 ILE 78 1HG1 ILE 78 -2.041 11.393 -33.108 612 HG13 ILE 78 2HG1 ILE 78 -0.623 10.497 -33.546 613 HG21 ILE 78 1HG2 ILE 78 -4.339 10.196 -32.893 614 HG22 ILE 78 2HG2 ILE 78 -4.239 9.791 -34.631 615 HG23 ILE 78 3HG2 ILE 78 -4.478 8.508 -33.485 616 HD11 ILE 78 1HD1 ILE 78 -1.502 10.365 -35.916 617 HD12 ILE 78 2HD1 ILE 78 -2.857 11.423 -35.416 618 HD13 ILE 78 3HD1 ILE 78 -1.175 11.994 -35.365 619 H VAL 79 H VAL 79 -0.558 10.425 -30.980 620 HA VAL 79 HA VAL 79 -1.966 10.629 -28.474 621 HB VAL 79 HB VAL 79 -0.457 12.535 -28.000 622 HG11 VAL 79 1HG1 VAL 79 0.975 10.376 -29.579 623 HG12 VAL 79 2HG1 VAL 79 1.735 11.497 -28.432 624 HG13 VAL 79 3HG1 VAL 79 0.511 10.313 -27.852 625 HG21 VAL 79 1HG2 VAL 79 1.100 13.412 -29.764 626 HG22 VAL 79 2HG2 VAL 79 0.221 12.480 -30.978 627 HG23 VAL 79 3HG2 VAL 79 -0.635 13.775 -30.123 628 H THR 80 H THR 80 -3.239 12.366 -27.678 629 HA THR 80 HA THR 80 -4.497 14.051 -29.786 630 HB THR 80 HB THR 80 -6.562 14.078 -28.401 631 HG1 THR 80 HG1 THR 80 -6.249 13.520 -26.448 632 HG21 THR 80 1HG2 THR 80 -6.092 12.333 -30.180 633 HG22 THR 80 2HG2 THR 80 -7.271 11.841 -28.945 634 HG23 THR 80 3HG2 THR 80 -5.651 11.231 -28.856 635 H ASP 81 H ASP 81 -3.497 13.939 -26.354 636 HA ASP 81 HA ASP 81 -3.450 16.897 -26.280 637 HB2 ASP 81 1HB ASP 81 -3.808 14.748 -24.126 638 HB3 ASP 81 2HB ASP 81 -3.149 16.286 -23.686 639 HXT ASP 81 H02 ASP 81 -0.214 17.014 -25.795 Start of MODEL 40 1 H2 GLY 1 2H0 GLY 1 9.408 12.701 -20.155 2 H GLY 1 1H0 GLY 1 8.635 13.842 -21.056 3 HA2 GLY 1 1HA GLY 1 8.082 15.138 -19.005 4 HA3 GLY 1 2HA GLY 1 7.370 13.510 -18.892 5 H SER 2 H SER 2 7.237 14.039 -16.662 6 HA SER 2 HA SER 2 9.577 14.449 -15.044 7 HB2 SER 2 1HB SER 2 8.108 13.428 -13.183 8 HB3 SER 2 2HB SER 2 7.425 14.816 -14.038 9 HG SER 2 HG SER 2 5.855 13.147 -13.937 10 H MET 3 H MET 3 7.950 11.454 -16.189 11 HA MET 3 HA MET 3 10.589 10.111 -15.959 12 HB2 MET 3 1HB MET 3 9.602 8.108 -14.670 13 HB3 MET 3 2HB MET 3 9.950 9.558 -13.716 14 HG2 MET 3 1HG MET 3 7.484 10.107 -13.872 15 HG3 MET 3 2HG MET 3 7.184 8.647 -14.761 16 HE1 MET 3 1HE MET 3 8.672 6.116 -13.425 17 HE2 MET 3 2HE MET 3 7.254 5.658 -12.520 18 HE3 MET 3 3HE MET 3 7.076 6.331 -14.136 19 H LYS 4 H LYS 4 7.074 9.584 -16.406 20 HA LYS 4 HA LYS 4 5.841 8.383 -17.919 21 HB2 LYS 4 1HB LYS 4 8.185 8.937 -19.750 22 HB3 LYS 4 2HB LYS 4 6.684 8.191 -20.242 23 HG2 LYS 4 1HG LYS 4 5.415 10.110 -19.543 24 HG3 LYS 4 2HG LYS 4 6.923 10.928 -19.038 25 HD2 LYS 4 1HD LYS 4 7.688 10.952 -21.312 26 HD3 LYS 4 2HD LYS 4 6.413 9.848 -21.862 27 HE2 LYS 4 1HE LYS 4 4.720 11.535 -21.281 28 HE3 LYS 4 2HE LYS 4 5.962 12.705 -20.832 29 HZ1 LYS 4 1HZ LYS 4 5.713 11.531 -23.507 30 HZ2 LYS 4 2HZ LYS 4 6.691 12.759 -23.047 31 HZ3 LYS 4 3HZ LYS 4 5.100 13.007 -23.008 32 H TYR 5 H TYR 5 6.645 6.431 -19.923 33 HA TYR 5 HA TYR 5 8.086 4.342 -18.280 34 HB2 TYR 5 1HB TYR 5 5.156 4.442 -19.060 35 HB3 TYR 5 2HB TYR 5 6.001 2.933 -19.452 36 HD1 TYR 5 HD1 TYR 5 5.286 5.271 -16.551 37 HD2 TYR 5 HD2 TYR 5 6.331 1.250 -17.815 38 HE1 TYR 5 HE1 TYR 5 4.955 4.412 -14.246 39 HE2 TYR 5 HE2 TYR 5 6.021 0.447 -15.502 40 HH TYR 5 HH TYR 5 5.374 0.972 -13.417 41 H LEU 6 H LEU 6 8.325 2.355 -19.823 42 HA LEU 6 HA LEU 6 9.688 3.215 -22.158 43 HB2 LEU 6 1HB LEU 6 8.490 0.500 -21.424 44 HB3 LEU 6 2HB LEU 6 9.414 0.763 -22.889 45 HG LEU 6 HG LEU 6 10.473 0.941 -20.041 46 HD11 LEU 6 1HD1 LEU 6 9.800 -1.356 -20.826 47 HD12 LEU 6 2HD1 LEU 6 11.510 -1.163 -20.415 48 HD13 LEU 6 3HD1 LEU 6 11.000 -1.209 -22.097 49 HD21 LEU 6 1HD2 LEU 6 11.793 1.323 -22.747 50 HD22 LEU 6 2HD2 LEU 6 12.712 0.786 -21.354 51 HD23 LEU 6 3HD2 LEU 6 11.891 2.363 -21.284 52 H ASN 7 H ASN 7 6.426 1.876 -21.643 53 HA ASN 7 HA ASN 7 4.570 1.783 -22.986 54 HB2 ASN 7 1HB ASN 7 5.700 4.387 -24.072 55 HB3 ASN 7 2HB ASN 7 4.096 3.732 -24.432 56 HD21 ASN 7 1HD2 ASN 7 3.024 4.336 -20.968 57 HD22 ASN 7 2HD2 ASN 7 2.908 3.106 -22.229 58 H VAL 8 H VAL 8 6.828 0.380 -23.810 59 HA VAL 8 HA VAL 8 6.797 0.336 -26.792 60 HB VAL 8 HB VAL 8 8.670 -0.948 -24.683 61 HG11 VAL 8 1HG1 VAL 8 8.652 -1.332 -27.675 62 HG12 VAL 8 2HG1 VAL 8 10.015 -1.774 -26.646 63 HG13 VAL 8 3HG1 VAL 8 8.421 -2.577 -26.426 64 HG21 VAL 8 1HG2 VAL 8 9.094 1.414 -25.101 65 HG22 VAL 8 2HG2 VAL 8 10.419 0.393 -25.681 66 HG23 VAL 8 3HG2 VAL 8 9.252 1.081 -26.830 67 H LEU 9 H LEU 9 6.042 -1.689 -27.715 68 HA LEU 9 HA LEU 9 4.770 -3.586 -25.831 69 HB2 LEU 9 1HB LEU 9 2.882 -3.703 -27.556 70 HB3 LEU 9 2HB LEU 9 2.914 -2.327 -26.453 71 HG LEU 9 HG LEU 9 4.317 -1.772 -28.973 72 HD11 LEU 9 1HD1 LEU 9 1.348 -2.279 -29.064 73 HD12 LEU 9 2HD1 LEU 9 2.600 -3.275 -29.810 74 HD13 LEU 9 3HD1 LEU 9 2.405 -1.631 -30.363 75 HD21 LEU 9 1HD2 LEU 9 3.688 -0.108 -27.203 76 HD22 LEU 9 2HD2 LEU 9 1.975 -0.332 -27.643 77 HD23 LEU 9 3HD2 LEU 9 3.142 0.325 -28.823 78 H ALA 10 H ALA 10 4.222 -5.684 -26.911 79 HA ALA 10 HA ALA 10 5.933 -6.225 -29.288 80 HB1 ALA 10 1HB ALA 10 7.486 -6.436 -27.333 81 HB2 ALA 10 2HB ALA 10 6.400 -7.656 -26.590 82 HB3 ALA 10 3HB ALA 10 7.209 -7.993 -28.159 83 H LYS 11 H LYS 11 5.530 -8.286 -30.251 84 HA LYS 11 HA LYS 11 2.742 -9.317 -29.589 85 HB2 LYS 11 1HB LYS 11 3.252 -8.443 -31.899 86 HB3 LYS 11 2HB LYS 11 4.533 -9.640 -32.060 87 HG2 LYS 11 1HG LYS 11 1.861 -10.805 -31.267 88 HG3 LYS 11 2HG LYS 11 1.784 -9.957 -32.819 89 HD2 LYS 11 1HD LYS 11 3.877 -12.024 -32.242 90 HD3 LYS 11 2HD LYS 11 2.295 -12.363 -32.997 91 HE2 LYS 11 1HE LYS 11 4.320 -10.358 -34.135 92 HE3 LYS 11 2HE LYS 11 4.275 -12.067 -34.622 93 HZ1 LYS 11 1HZ LYS 11 1.979 -11.691 -35.275 94 HZ2 LYS 11 2HZ LYS 11 3.093 -10.930 -36.179 95 HZ3 LYS 11 3HZ LYS 11 2.203 -10.094 -35.063 96 H ALA 12 H ALA 12 2.505 -11.362 -28.956 97 HA ALA 12 HA ALA 12 4.924 -12.749 -28.213 98 HB1 ALA 12 1HB ALA 12 3.283 -14.472 -27.444 99 HB2 ALA 12 2HB ALA 12 3.101 -12.868 -26.725 100 HB3 ALA 12 3HB ALA 12 1.997 -13.391 -27.996 101 H LEU 13 H LEU 13 5.999 -14.331 -29.173 102 HA LEU 13 HA LEU 13 5.053 -15.313 -31.824 103 HB2 LEU 13 1HB LEU 13 7.686 -15.815 -30.353 104 HB3 LEU 13 2HB LEU 13 7.308 -16.214 -32.007 105 HG LEU 13 HG LEU 13 7.437 -13.377 -30.899 106 HD11 LEU 13 1HD1 LEU 13 9.599 -13.283 -31.991 107 HD12 LEU 13 2HD1 LEU 13 9.388 -14.913 -32.667 108 HD13 LEU 13 3HD1 LEU 13 9.577 -14.686 -30.916 109 HD21 LEU 13 1HD2 LEU 13 7.527 -12.853 -33.435 110 HD22 LEU 13 2HD2 LEU 13 5.976 -13.374 -32.817 111 HD23 LEU 13 3HD2 LEU 13 6.973 -14.505 -33.712 112 H TYR 14 H TYR 14 5.053 -16.392 -28.496 113 HA TYR 14 HA TYR 14 4.324 -19.108 -29.450 114 HB2 TYR 14 1HB TYR 14 6.199 -18.390 -27.117 115 HB3 TYR 14 2HB TYR 14 5.519 -19.989 -27.413 116 HD1 TYR 14 HD1 TYR 14 7.849 -17.366 -28.586 117 HD2 TYR 14 HD2 TYR 14 6.564 -21.392 -29.220 118 HE1 TYR 14 HE1 TYR 14 9.848 -17.779 -30.027 119 HE2 TYR 14 HE2 TYR 14 8.560 -21.758 -30.668 120 HH TYR 14 HH TYR 14 10.974 -19.071 -31.281 121 H ASP 15 H ASP 15 3.255 -20.305 -27.496 122 HA ASP 15 HA ASP 15 1.521 -18.365 -26.026 123 HB2 ASP 15 1HB ASP 15 -0.182 -20.107 -26.054 124 HB3 ASP 15 2HB ASP 15 0.360 -19.772 -27.724 125 H ASN 16 H ASN 16 0.836 -18.952 -23.863 126 HA ASN 16 HA ASN 16 2.451 -21.064 -22.515 127 HB2 ASN 16 1HB ASN 16 3.992 -19.152 -22.693 128 HB3 ASN 16 2HB ASN 16 2.769 -18.075 -21.975 129 HD21 ASN 16 1HD2 ASN 16 3.897 -18.690 -18.744 130 HD22 ASN 16 2HD2 ASN 16 3.148 -17.599 -19.939 131 H VAL 17 H VAL 17 1.916 -21.230 -20.202 132 HA VAL 17 HA VAL 17 -0.659 -19.903 -19.426 133 HB VAL 17 HB VAL 17 0.113 -22.835 -18.807 134 HG11 VAL 17 1HG1 VAL 17 -1.034 -21.971 -16.935 135 HG12 VAL 17 2HG1 VAL 17 -2.200 -21.074 -17.938 136 HG13 VAL 17 3HG1 VAL 17 -2.272 -22.861 -17.900 137 HG21 VAL 17 1HG2 VAL 17 -1.741 -23.541 -20.273 138 HG22 VAL 17 2HG2 VAL 17 -2.310 -21.876 -20.481 139 HG23 VAL 17 3HG2 VAL 17 -0.775 -22.410 -21.236 140 H ALA 18 H ALA 18 -0.354 -18.844 -17.519 141 HA ALA 18 HA ALA 18 2.332 -18.877 -16.391 142 HB1 ALA 18 1HB ALA 18 1.333 -17.163 -14.817 143 HB2 ALA 18 2HB ALA 18 1.219 -16.787 -16.529 144 HB3 ALA 18 3HB ALA 18 -0.209 -17.387 -15.678 145 H GLU 19 H GLU 19 3.016 -20.163 -14.800 146 HA GLU 19 HA GLU 19 0.999 -21.769 -13.298 147 HB2 GLU 19 1HB GLU 19 4.024 -21.722 -13.030 148 HB3 GLU 19 2HB GLU 19 2.901 -22.939 -12.391 149 HG2 GLU 19 1HG GLU 19 2.258 -23.417 -14.860 150 HG3 GLU 19 2HG GLU 19 3.711 -22.508 -15.296 151 H SER 20 H SER 20 2.688 -18.801 -12.997 152 HA SER 20 HA SER 20 2.241 -18.740 -10.023 153 HB2 SER 20 1HB SER 20 4.575 -17.550 -11.554 154 HB3 SER 20 2HB SER 20 4.308 -17.528 -9.802 155 HG SER 20 HG SER 20 4.927 -19.711 -11.492 156 HA PRO 21 HA PRO 21 0.233 -14.891 -11.240 157 HB2 PRO 21 1HB PRO 21 0.411 -13.331 -8.972 158 HB3 PRO 21 2HB PRO 21 -0.659 -14.829 -9.069 159 HG2 PRO 21 1HG PRO 21 2.144 -14.520 -7.989 160 HG3 PRO 21 2HG PRO 21 0.639 -15.231 -7.223 161 HD2 PRO 21 1HD PRO 21 2.570 -16.749 -8.382 162 HD3 PRO 21 2HD PRO 21 0.798 -17.191 -8.543 163 H ASP 22 H ASP 22 3.527 -14.996 -10.305 164 HA ASP 22 HA ASP 22 4.119 -12.165 -10.918 165 HB2 ASP 22 1HB ASP 22 5.742 -14.721 -10.423 166 HB3 ASP 22 2HB ASP 22 6.524 -13.154 -10.751 167 H GLU 23 H GLU 23 3.220 -14.831 -12.681 168 HA GLU 23 HA GLU 23 5.160 -14.257 -14.974 169 HB2 GLU 23 1HB GLU 23 5.226 -16.515 -13.628 170 HB3 GLU 23 2HB GLU 23 3.610 -16.833 -14.308 171 HG2 GLU 23 1HG GLU 23 4.578 -16.679 -16.601 172 HG3 GLU 23 2HG GLU 23 6.162 -16.313 -15.876 173 H LEU 24 H LEU 24 4.114 -14.124 -17.050 174 HA LEU 24 HA LEU 24 1.174 -13.587 -16.768 175 HB2 LEU 24 1HB LEU 24 3.344 -12.325 -18.148 176 HB3 LEU 24 2HB LEU 24 2.121 -12.838 -19.342 177 HG LEU 24 HG LEU 24 1.597 -11.120 -16.891 178 HD11 LEU 24 1HD1 LEU 24 0.999 -9.378 -18.640 179 HD12 LEU 24 2HD1 LEU 24 1.755 -10.500 -19.864 180 HD13 LEU 24 3HD1 LEU 24 2.730 -9.775 -18.522 181 HD21 LEU 24 1HD2 LEU 24 -0.659 -10.700 -17.884 182 HD22 LEU 24 2HD2 LEU 24 -0.428 -12.342 -17.248 183 HD23 LEU 24 3HD2 LEU 24 -0.334 -12.045 -19.018 184 H SER 25 H SER 25 -0.365 -14.755 -17.726 185 HA SER 25 HA SER 25 0.266 -16.994 -19.528 186 HB2 SER 25 1HB SER 25 -2.425 -16.790 -19.623 187 HB3 SER 25 2HB SER 25 -1.534 -17.588 -18.335 188 HG SER 25 HG SER 25 -2.926 -16.256 -17.327 189 H PHE 26 H PHE 26 1.253 -15.721 -21.223 190 HA PHE 26 HA PHE 26 -0.599 -14.165 -22.961 191 HB2 PHE 26 1HB PHE 26 1.376 -13.618 -24.243 192 HB3 PHE 26 2HB PHE 26 1.578 -13.199 -22.505 193 HD1 PHE 26 HD1 PHE 26 3.067 -14.619 -21.084 194 HD2 PHE 26 HD2 PHE 26 2.826 -15.320 -25.301 195 HE1 PHE 26 HE1 PHE 26 5.171 -15.969 -20.937 196 HE2 PHE 26 HE2 PHE 26 4.924 -16.631 -25.153 197 HZ PHE 26 HZ PHE 26 6.065 -16.990 -22.964 198 H ARG 27 H ARG 27 -0.835 -14.624 -25.278 199 HA ARG 27 HA ARG 27 -0.282 -17.546 -25.983 200 HB2 ARG 27 1HB ARG 27 -2.743 -15.830 -26.534 201 HB3 ARG 27 2HB ARG 27 -2.501 -17.400 -27.302 202 HG2 ARG 27 1HG ARG 27 -2.384 -18.503 -25.019 203 HG3 ARG 27 2HG ARG 27 -2.868 -16.942 -24.314 204 HD2 ARG 27 1HD ARG 27 -4.524 -18.370 -26.417 205 HD3 ARG 27 2HD ARG 27 -4.792 -18.496 -24.650 206 HE ARG 27 HE ARG 27 -5.361 -16.222 -26.427 207 HH11 ARG 27 1HH1 ARG 27 -5.330 -17.352 -23.145 208 HH12 ARG 27 2HH1 ARG 27 -6.375 -16.094 -22.592 209 HH21 ARG 27 1HH2 ARG 27 -6.656 -14.622 -25.686 210 HH22 ARG 27 2HH2 ARG 27 -7.092 -14.570 -23.998 211 H LYS 28 H LYS 28 0.115 -17.870 -28.260 212 HA LYS 28 HA LYS 28 1.742 -15.878 -29.371 213 HB2 LYS 28 1HB LYS 28 1.931 -17.308 -31.294 214 HB3 LYS 28 2HB LYS 28 1.997 -18.241 -29.815 215 HG2 LYS 28 1HG LYS 28 -0.471 -18.767 -30.165 216 HG3 LYS 28 2HG LYS 28 -0.292 -18.126 -31.805 217 HD2 LYS 28 1HD LYS 28 1.512 -19.762 -32.274 218 HD3 LYS 28 2HD LYS 28 1.336 -20.388 -30.612 219 HE2 LYS 28 1HE LYS 28 -1.059 -20.992 -31.123 220 HE3 LYS 28 2HE LYS 28 -0.809 -20.441 -32.772 221 HZ1 LYS 28 1HZ LYS 28 0.795 -22.253 -33.112 222 HZ2 LYS 28 2HZ LYS 28 -0.598 -22.888 -32.514 223 HZ3 LYS 28 3HZ LYS 28 0.699 -22.716 -31.509 224 H GLY 29 H GLY 29 1.466 -14.301 -30.765 225 HA2 GLY 29 1HA GLY 29 0.380 -13.031 -32.452 226 HA3 GLY 29 2HA GLY 29 -1.074 -13.985 -32.240 227 H ASP 30 H ASP 30 -0.624 -13.449 -29.183 228 HA ASP 30 HA ASP 30 -2.267 -11.043 -29.095 229 HB2 ASP 30 1HB ASP 30 -2.073 -13.162 -27.510 230 HB3 ASP 30 2HB ASP 30 -0.797 -12.138 -26.747 231 H ILE 31 H ILE 31 -1.725 -9.114 -27.867 232 HA ILE 31 HA ILE 31 1.096 -8.263 -28.213 233 HB ILE 31 HB ILE 31 -1.367 -6.448 -28.305 234 HG12 ILE 31 1HG1 ILE 31 -1.574 -7.928 -30.156 235 HG13 ILE 31 2HG1 ILE 31 -1.127 -6.347 -30.784 236 HG21 ILE 31 1HG2 ILE 31 0.703 -5.255 -27.719 237 HG22 ILE 31 2HG2 ILE 31 1.551 -5.968 -29.132 238 HG23 ILE 31 3HG2 ILE 31 0.202 -4.822 -29.351 239 HD11 ILE 31 1HD1 ILE 31 0.043 -8.095 -32.030 240 HD12 ILE 31 2HD1 ILE 31 1.221 -7.154 -31.060 241 HD13 ILE 31 3HD1 ILE 31 0.690 -8.733 -30.503 242 H MET 32 H MET 32 2.105 -7.449 -26.510 243 HA MET 32 HA MET 32 0.449 -6.466 -24.294 244 HB2 MET 32 1HB MET 32 1.867 -7.636 -22.634 245 HB3 MET 32 2HB MET 32 0.850 -8.713 -23.628 246 HG2 MET 32 1HG MET 32 3.278 -8.507 -25.001 247 HG3 MET 32 2HG MET 32 3.746 -8.588 -23.297 248 HE1 MET 32 1HE MET 32 2.074 -10.260 -26.326 249 HE2 MET 32 2HE MET 32 1.484 -11.822 -25.710 250 HE3 MET 32 3HE MET 32 0.627 -10.312 -25.265 251 H THR 33 H THR 33 1.425 -5.029 -22.994 252 HA THR 33 HA THR 33 3.540 -3.465 -24.223 253 HB THR 33 HB THR 33 1.996 -2.938 -21.696 254 HG1 THR 33 HG1 THR 33 0.645 -1.700 -23.168 255 HG21 THR 33 1HG2 THR 33 4.020 -1.515 -22.279 256 HG22 THR 33 2HG2 THR 33 2.503 -0.615 -22.121 257 HG23 THR 33 3HG2 THR 33 3.165 -1.012 -23.730 258 H VAL 34 H VAL 34 5.519 -3.325 -23.600 259 HA VAL 34 HA VAL 34 6.468 -5.003 -21.319 260 HB VAL 34 HB VAL 34 8.036 -3.483 -23.471 261 HG11 VAL 34 1HG1 VAL 34 9.921 -4.962 -22.734 262 HG12 VAL 34 2HG1 VAL 34 9.408 -3.658 -21.579 263 HG13 VAL 34 3HG1 VAL 34 8.933 -5.357 -21.271 264 HG21 VAL 34 1HG2 VAL 34 7.189 -6.422 -23.271 265 HG22 VAL 34 2HG2 VAL 34 6.847 -5.268 -24.591 266 HG23 VAL 34 3HG2 VAL 34 8.505 -5.890 -24.332 267 H LEU 35 H LEU 35 6.889 -4.151 -19.405 268 HA LEU 35 HA LEU 35 6.836 -1.199 -19.290 269 HB2 LEU 35 1HB LEU 35 6.669 -3.243 -17.061 270 HB3 LEU 35 2HB LEU 35 6.421 -1.516 -16.879 271 HG LEU 35 HG LEU 35 4.595 -3.354 -18.458 272 HD11 LEU 35 1HD1 LEU 35 4.408 -2.215 -15.640 273 HD12 LEU 35 2HD1 LEU 35 4.555 -3.908 -16.123 274 HD13 LEU 35 3HD1 LEU 35 3.080 -2.991 -16.481 275 HD21 LEU 35 1HD2 LEU 35 4.060 -0.496 -17.572 276 HD22 LEU 35 2HD2 LEU 35 2.994 -1.561 -18.480 277 HD23 LEU 35 3HD2 LEU 35 4.491 -0.987 -19.202 278 H GLU 36 H GLU 36 8.788 -3.991 -18.379 279 HA GLU 36 HA GLU 36 11.241 -2.209 -18.130 280 HB2 GLU 36 1HB GLU 36 10.157 -2.647 -15.767 281 HB3 GLU 36 2HB GLU 36 10.550 -4.393 -16.066 282 HG2 GLU 36 1HG GLU 36 12.934 -3.712 -16.343 283 HG3 GLU 36 2HG GLU 36 12.451 -2.049 -16.032 284 H ARG 37 H ARG 37 13.157 -3.457 -18.729 285 HA ARG 37 HA ARG 37 12.569 -6.279 -19.542 286 HB2 ARG 37 1HB ARG 37 14.586 -4.337 -20.807 287 HB3 ARG 37 2HB ARG 37 14.497 -6.057 -21.171 288 HG2 ARG 37 1HG ARG 37 12.062 -5.589 -21.781 289 HG3 ARG 37 2HG ARG 37 12.442 -3.854 -21.625 290 HD2 ARG 37 1HD ARG 37 13.973 -5.715 -23.503 291 HD3 ARG 37 2HD ARG 37 12.425 -4.944 -23.937 292 HE ARG 37 HE ARG 37 14.312 -3.032 -22.934 293 HH11 ARG 37 1HH1 ARG 37 13.521 -4.934 -25.797 294 HH12 ARG 37 2HH1 ARG 37 14.231 -3.765 -26.898 295 HH21 ARG 37 1HH2 ARG 37 15.228 -1.571 -24.385 296 HH22 ARG 37 2HH2 ARG 37 15.189 -1.907 -26.092 297 H ASP 38 H ASP 38 14.308 -7.759 -18.886 298 HA ASP 38 HA ASP 38 15.732 -8.582 -17.311 299 HB2 ASP 38 1HB ASP 38 17.133 -5.899 -17.500 300 HB3 ASP 38 2HB ASP 38 17.799 -7.385 -16.737 301 H THR 39 H THR 39 13.298 -7.782 -16.450 302 HA THR 39 HA THR 39 13.359 -5.895 -14.357 303 HB THR 39 HB THR 39 11.328 -6.529 -15.658 304 HG1 THR 39 HG1 THR 39 11.217 -5.581 -13.485 305 HG21 THR 39 1HG2 THR 39 11.653 -9.031 -15.656 306 HG22 THR 39 2HG2 THR 39 10.046 -8.537 -15.102 307 HG23 THR 39 3HG2 THR 39 11.259 -9.047 -13.890 308 H GLN 40 H GLN 40 14.219 -9.197 -14.156 309 HA GLN 40 HA GLN 40 14.104 -9.056 -11.155 310 HB2 GLN 40 1HB GLN 40 12.819 -10.874 -12.628 311 HB3 GLN 40 2HB GLN 40 14.425 -11.605 -12.577 312 HG2 GLN 40 1HG GLN 40 14.210 -11.146 -10.057 313 HG3 GLN 40 2HG GLN 40 12.487 -11.059 -10.391 314 HE21 GLN 40 1HE2 GLN 40 12.169 -14.561 -10.866 315 HE22 GLN 40 2HE2 GLN 40 11.443 -12.978 -11.041 316 H GLY 41 H GLY 41 16.104 -8.440 -13.549 317 HA2 GLY 41 1HA GLY 41 18.451 -8.401 -13.612 318 HA3 GLY 41 2HA GLY 41 18.442 -9.455 -12.199 319 H LEU 42 H LEU 42 16.444 -11.216 -13.685 320 HA LEU 42 HA LEU 42 18.156 -13.087 -14.909 321 HB2 LEU 42 1HB LEU 42 15.170 -12.646 -15.316 322 HB3 LEU 42 2HB LEU 42 16.073 -13.997 -15.964 323 HG LEU 42 HG LEU 42 15.681 -13.446 -12.969 324 HD11 LEU 42 1HD1 LEU 42 14.184 -15.377 -14.881 325 HD12 LEU 42 2HD1 LEU 42 13.506 -14.019 -13.955 326 HD13 LEU 42 3HD1 LEU 42 14.088 -15.446 -13.147 327 HD21 LEU 42 1HD2 LEU 42 16.695 -15.922 -14.427 328 HD22 LEU 42 2HD2 LEU 42 16.485 -15.713 -12.688 329 HD23 LEU 42 3HD2 LEU 42 17.690 -14.742 -13.507 330 H ASP 43 H ASP 43 19.095 -13.062 -16.874 331 HA ASP 43 HA ASP 43 18.880 -10.874 -18.600 332 HB2 ASP 43 1HB ASP 43 20.102 -13.601 -18.704 333 HB3 ASP 43 2HB ASP 43 19.952 -12.696 -20.208 334 H GLY 44 H GLY 44 17.547 -10.259 -19.968 335 HA2 GLY 44 1HA GLY 44 16.085 -10.396 -21.840 336 HA3 GLY 44 2HA GLY 44 16.335 -12.136 -21.857 337 H TRP 45 H TRP 45 15.100 -11.112 -18.827 338 HA TRP 45 HA TRP 45 12.433 -12.135 -19.722 339 HB2 TRP 45 1HB TRP 45 13.844 -12.190 -17.017 340 HB3 TRP 45 2HB TRP 45 12.082 -12.358 -17.120 341 HD1 TRP 45 HD1 TRP 45 15.266 -14.129 -18.412 342 HE1 TRP 45 HE1 TRP 45 14.770 -16.641 -18.696 343 HE3 TRP 45 HE3 TRP 45 10.208 -14.070 -17.448 344 HZ2 TRP 45 HZ2 TRP 45 12.541 -18.372 -18.535 345 HZ3 TRP 45 HZ3 TRP 45 8.958 -16.294 -17.447 346 HH2 TRP 45 HH2 TRP 45 10.149 -18.401 -18.025 347 H TRP 46 H TRP 46 10.844 -10.800 -19.929 348 HA TRP 46 HA TRP 46 11.442 -8.036 -18.918 349 HB2 TRP 46 1HB TRP 46 9.681 -9.033 -21.143 350 HB3 TRP 46 2HB TRP 46 9.957 -7.309 -20.760 351 HD1 TRP 46 HD1 TRP 46 13.286 -8.739 -20.523 352 HE1 TRP 46 HE1 TRP 46 14.670 -8.674 -22.648 353 HE3 TRP 46 HE3 TRP 46 9.445 -7.882 -23.748 354 HZ2 TRP 46 HZ2 TRP 46 14.198 -8.269 -25.459 355 HZ3 TRP 46 HZ3 TRP 46 9.975 -7.605 -26.161 356 HH2 TRP 46 HH2 TRP 46 12.308 -7.802 -27.030 357 H LEU 47 H LEU 47 9.897 -6.870 -17.781 358 HA LEU 47 HA LEU 47 7.575 -8.313 -16.709 359 HB2 LEU 47 1HB LEU 47 8.869 -6.627 -15.315 360 HB3 LEU 47 2HB LEU 47 8.406 -5.386 -16.474 361 HG LEU 47 HG LEU 47 6.056 -5.635 -15.817 362 HD11 LEU 47 1HD1 LEU 47 5.993 -8.022 -15.115 363 HD12 LEU 47 2HD1 LEU 47 5.569 -7.062 -13.702 364 HD13 LEU 47 3HD1 LEU 47 7.193 -7.773 -13.879 365 HD21 LEU 47 1HD2 LEU 47 7.946 -5.316 -13.516 366 HD22 LEU 47 2HD2 LEU 47 6.259 -4.745 -13.565 367 HD23 LEU 47 3HD2 LEU 47 7.451 -4.064 -14.634 368 H CYS 48 H CYS 48 5.693 -8.387 -17.804 369 HA CYS 48 HA CYS 48 5.051 -6.070 -19.637 370 HB2 CYS 48 1HB CYS 48 4.352 -8.995 -20.053 371 HB3 CYS 48 2HB CYS 48 4.074 -7.654 -21.197 372 HG CYS 48 HG CYS 48 7.042 -8.696 -20.064 373 H SER 49 H SER 49 2.779 -5.733 -20.133 374 HA SER 49 HA SER 49 1.052 -6.792 -17.989 375 HB2 SER 49 1HB SER 49 1.699 -4.356 -17.735 376 HB3 SER 49 2HB SER 49 0.771 -4.104 -19.277 377 HG SER 49 HG SER 49 -0.490 -5.527 -17.186 378 H LEU 50 H LEU 50 -0.794 -7.670 -18.556 379 HA LEU 50 HA LEU 50 -1.997 -7.276 -21.199 380 HB2 LEU 50 1HB LEU 50 -0.351 -9.102 -21.500 381 HB3 LEU 50 2HB LEU 50 -1.163 -10.003 -20.188 382 HG LEU 50 HG LEU 50 -3.201 -10.145 -21.514 383 HD11 LEU 50 1HD1 LEU 50 -2.864 -9.667 -24.081 384 HD12 LEU 50 2HD1 LEU 50 -1.580 -8.567 -23.547 385 HD13 LEU 50 3HD1 LEU 50 -3.220 -8.319 -22.988 386 HD21 LEU 50 1HD2 LEU 50 -2.317 -11.713 -23.272 387 HD22 LEU 50 2HD2 LEU 50 -1.777 -12.058 -21.611 388 HD23 LEU 50 3HD2 LEU 50 -0.652 -11.265 -22.766 389 H HIS 51 H HIS 51 -4.226 -7.446 -20.985 390 HA HIS 51 HA HIS 51 -6.306 -7.540 -20.003 391 HB2 HIS 51 1HB HIS 51 -5.077 -9.989 -18.678 392 HB3 HIS 51 2HB HIS 51 -6.764 -9.516 -18.559 393 HD1 HIS 51 HD1 HIS 51 -7.544 -11.691 -19.745 394 HD2 HIS 51 HD2 HIS 51 -5.184 -9.140 -22.045 395 HE1 HIS 51 HE1 HIS 51 -7.782 -12.390 -22.138 396 H GLY 52 H GLY 52 -4.313 -5.807 -18.611 397 HA2 GLY 52 1HA GLY 52 -4.378 -4.488 -16.737 398 HA3 GLY 52 2HA GLY 52 -5.788 -5.366 -16.189 399 H ARG 53 H ARG 53 -3.197 -7.482 -16.800 400 HA ARG 53 HA ARG 53 -2.426 -7.599 -13.865 401 HB2 ARG 53 1HB ARG 53 -2.179 -9.664 -16.085 402 HB3 ARG 53 2HB ARG 53 -1.837 -9.931 -14.371 403 HG2 ARG 53 1HG ARG 53 -4.269 -9.421 -13.874 404 HG3 ARG 53 2HG ARG 53 -4.559 -9.502 -15.659 405 HD2 ARG 53 1HD ARG 53 -5.064 -11.606 -14.804 406 HD3 ARG 53 2HD ARG 53 -3.512 -11.796 -15.626 407 HE ARG 53 HE ARG 53 -3.124 -11.232 -12.841 408 HH11 ARG 53 1HH1 ARG 53 -4.096 -13.870 -14.921 409 HH12 ARG 53 2HH1 ARG 53 -3.618 -15.085 -13.733 410 HH21 ARG 53 1HH2 ARG 53 -2.559 -12.797 -11.451 411 HH22 ARG 53 2HH2 ARG 53 -2.747 -14.460 -11.812 412 H GLN 54 H GLN 54 -0.070 -7.962 -13.469 413 HA GLN 54 HA GLN 54 1.607 -7.486 -15.879 414 HB2 GLN 54 1HB GLN 54 2.165 -6.548 -12.988 415 HB3 GLN 54 2HB GLN 54 3.222 -6.350 -14.406 416 HG2 GLN 54 1HG GLN 54 2.283 -4.329 -14.553 417 HG3 GLN 54 2HG GLN 54 1.014 -5.205 -15.400 418 HE21 GLN 54 1HE2 GLN 54 0.262 -3.364 -11.865 419 HE22 GLN 54 2HE2 GLN 54 1.869 -3.418 -12.602 420 H GLY 55 H GLY 55 3.381 -8.811 -16.134 421 HA2 GLY 55 1HA GLY 55 4.351 -10.487 -13.942 422 HA3 GLY 55 2HA GLY 55 3.319 -11.370 -15.070 423 H ILE 56 H ILE 56 5.997 -11.963 -14.631 424 HA ILE 56 HA ILE 56 7.620 -10.582 -16.646 425 HB ILE 56 HB ILE 56 9.366 -12.130 -15.989 426 HG12 ILE 56 1HG1 ILE 56 7.393 -13.687 -14.339 427 HG13 ILE 56 2HG1 ILE 56 7.924 -14.205 -15.925 428 HG21 ILE 56 1HG2 ILE 56 9.716 -11.335 -13.806 429 HG22 ILE 56 2HG2 ILE 56 8.517 -10.192 -14.421 430 HG23 ILE 56 3HG2 ILE 56 8.007 -11.506 -13.346 431 HD11 ILE 56 1HD1 ILE 56 9.151 -15.455 -14.257 432 HD12 ILE 56 2HD1 ILE 56 10.313 -14.257 -14.830 433 HD13 ILE 56 3HD1 ILE 56 9.483 -14.028 -13.273 434 H VAL 57 H VAL 57 8.404 -11.500 -18.541 435 HA VAL 57 HA VAL 57 7.075 -13.947 -19.611 436 HB VAL 57 HB VAL 57 7.100 -11.186 -20.935 437 HG11 VAL 57 1HG1 VAL 57 6.300 -13.912 -22.089 438 HG12 VAL 57 2HG1 VAL 57 5.939 -12.345 -22.828 439 HG13 VAL 57 3HG1 VAL 57 7.608 -12.863 -22.653 440 HG21 VAL 57 1HG2 VAL 57 4.819 -12.992 -20.016 441 HG22 VAL 57 2HG2 VAL 57 5.196 -11.345 -19.469 442 HG23 VAL 57 3HG2 VAL 57 4.632 -11.615 -21.139 443 HA PRO 58 HA PRO 58 11.332 -13.982 -20.926 444 HB2 PRO 58 1HB PRO 58 11.348 -16.068 -22.737 445 HB3 PRO 58 2HB PRO 58 11.361 -16.260 -20.947 446 HG2 PRO 58 1HG PRO 58 9.084 -16.464 -22.872 447 HG3 PRO 58 2HG PRO 58 9.452 -17.491 -21.495 448 HD2 PRO 58 1HD PRO 58 7.607 -15.472 -21.482 449 HD3 PRO 58 2HD PRO 58 8.496 -16.089 -20.035 450 H GLY 59 H GLY 59 12.129 -12.443 -22.104 451 HA2 GLY 59 1HA GLY 59 10.808 -11.172 -24.244 452 HA3 GLY 59 2HA GLY 59 12.501 -11.007 -23.771 453 H ASN 60 H ASN 60 13.034 -13.948 -24.417 454 HA ASN 60 HA ASN 60 13.704 -13.519 -27.257 455 HB2 ASN 60 1HB ASN 60 14.774 -15.110 -25.387 456 HB3 ASN 60 2HB ASN 60 13.590 -16.288 -25.997 457 HD21 ASN 60 1HD2 ASN 60 16.750 -16.794 -27.935 458 HD22 ASN 60 2HD2 ASN 60 16.184 -17.036 -26.296 459 H ARG 61 H ARG 61 10.832 -14.616 -25.620 460 HA ARG 61 HA ARG 61 9.799 -16.040 -28.060 461 HB2 ARG 61 1HB ARG 61 8.659 -15.637 -25.220 462 HB3 ARG 61 2HB ARG 61 7.835 -16.479 -26.557 463 HG2 ARG 61 1HG ARG 61 9.940 -17.981 -26.703 464 HG3 ARG 61 2HG ARG 61 10.415 -17.418 -25.092 465 HD2 ARG 61 1HD ARG 61 8.191 -18.245 -24.239 466 HD3 ARG 61 2HD ARG 61 7.819 -18.775 -25.898 467 HE ARG 61 HE ARG 61 10.306 -19.923 -24.955 468 HH11 ARG 61 1HH1 ARG 61 6.775 -20.326 -24.800 469 HH12 ARG 61 2HH1 ARG 61 6.897 -22.027 -24.408 470 HH21 ARG 61 1HH2 ARG 61 10.347 -22.102 -24.441 471 HH22 ARG 61 2HH2 ARG 61 8.883 -23.028 -24.243 472 H LEU 62 H LEU 62 10.238 -12.947 -27.438 473 HA LEU 62 HA LEU 62 7.493 -12.092 -28.399 474 HB2 LEU 62 1HB LEU 62 9.474 -10.613 -26.596 475 HB3 LEU 62 2HB LEU 62 7.982 -9.986 -27.284 476 HG LEU 62 HG LEU 62 8.093 -12.189 -25.222 477 HD11 LEU 62 1HD1 LEU 62 7.333 -10.483 -23.613 478 HD12 LEU 62 2HD1 LEU 62 7.411 -9.235 -24.858 479 HD13 LEU 62 3HD1 LEU 62 8.886 -10.030 -24.289 480 HD21 LEU 62 1HD2 LEU 62 5.813 -10.623 -26.446 481 HD22 LEU 62 2HD2 LEU 62 5.673 -11.658 -24.996 482 HD23 LEU 62 3HD2 LEU 62 6.109 -12.380 -26.500 483 H LYS 63 H LYS 63 7.399 -10.576 -29.895 484 HA LYS 63 HA LYS 63 10.049 -9.691 -31.104 485 HB2 LYS 63 1HB LYS 63 8.737 -11.187 -32.580 486 HB3 LYS 63 2HB LYS 63 7.371 -10.130 -32.395 487 HG2 LYS 63 1HG LYS 63 8.609 -8.299 -33.533 488 HG3 LYS 63 2HG LYS 63 10.042 -9.335 -33.645 489 HD2 LYS 63 1HD LYS 63 8.786 -10.880 -35.106 490 HD3 LYS 63 2HD LYS 63 7.321 -9.894 -34.901 491 HE2 LYS 63 1HE LYS 63 8.576 -7.925 -35.893 492 HE3 LYS 63 2HE LYS 63 9.965 -9.027 -36.262 493 HZ1 LYS 63 1HZ LYS 63 8.573 -8.862 -38.197 494 HZ2 LYS 63 2HZ LYS 63 7.218 -9.189 -37.340 495 HZ3 LYS 63 3HZ LYS 63 8.319 -10.380 -37.573 496 H ILE 64 H ILE 64 10.371 -7.483 -30.901 497 HA ILE 64 HA ILE 64 8.442 -5.768 -29.710 498 HB ILE 64 HB ILE 64 10.936 -5.003 -31.317 499 HG12 ILE 64 1HG1 ILE 64 11.452 -6.399 -29.300 500 HG13 ILE 64 2HG1 ILE 64 12.059 -4.782 -29.208 501 HG21 ILE 64 1HG2 ILE 64 9.670 -2.991 -31.239 502 HG22 ILE 64 2HG2 ILE 64 9.112 -3.314 -29.580 503 HG23 ILE 64 3HG2 ILE 64 10.807 -2.858 -29.893 504 HD11 ILE 64 1HD1 ILE 64 11.327 -5.162 -27.030 505 HD12 ILE 64 2HD1 ILE 64 10.071 -4.115 -27.777 506 HD13 ILE 64 3HD1 ILE 64 9.789 -5.877 -27.567 507 H LEU 65 H LEU 65 6.858 -4.525 -30.456 508 HA LEU 65 HA LEU 65 6.475 -4.405 -33.478 509 HB2 LEU 65 1HB LEU 65 4.743 -5.782 -32.353 510 HB3 LEU 65 2HB LEU 65 4.408 -4.467 -31.225 511 HG LEU 65 HG LEU 65 3.521 -3.093 -33.130 512 HD11 LEU 65 1HD1 LEU 65 4.808 -4.305 -34.962 513 HD12 LEU 65 2HD1 LEU 65 3.048 -4.124 -35.278 514 HD13 LEU 65 3HD1 LEU 65 3.718 -5.687 -34.728 515 HD21 LEU 65 1HD2 LEU 65 1.389 -4.363 -33.273 516 HD22 LEU 65 2HD2 LEU 65 2.053 -4.579 -31.656 517 HD23 LEU 65 3HD2 LEU 65 2.214 -5.863 -32.822 518 H VAL 66 H VAL 66 6.525 -2.420 -34.370 519 HA VAL 66 HA VAL 66 6.445 -0.103 -32.498 520 HB VAL 66 HB VAL 66 8.074 -0.517 -35.026 521 HG11 VAL 66 1HG1 VAL 66 9.179 1.593 -34.351 522 HG12 VAL 66 2HG1 VAL 66 7.441 1.868 -34.614 523 HG13 VAL 66 3HG1 VAL 66 8.089 1.745 -32.969 524 HG21 VAL 66 1HG2 VAL 66 8.914 -1.911 -33.122 525 HG22 VAL 66 2HG2 VAL 66 10.020 -0.560 -33.478 526 HG23 VAL 66 3HG2 VAL 66 8.970 -0.459 -32.071 527 H GLY 67 H GLY 67 4.934 1.320 -32.831 528 HA2 GLY 67 1HA GLY 67 3.886 2.032 -35.444 529 HA3 GLY 67 2HA GLY 67 2.924 0.777 -34.669 530 H MET 68 H MET 68 4.515 3.830 -33.453 531 HA MET 68 HA MET 68 1.829 4.460 -32.345 532 HB2 MET 68 1HB MET 68 3.366 3.288 -30.663 533 HB3 MET 68 2HB MET 68 4.445 4.676 -30.753 534 HG2 MET 68 1HG MET 68 3.007 4.842 -28.835 535 HG3 MET 68 2HG MET 68 2.506 6.061 -29.962 536 HE1 MET 68 1HE MET 68 0.648 5.307 -27.639 537 HE2 MET 68 2HE MET 68 0.442 6.494 -28.963 538 HE3 MET 68 3HE MET 68 -0.863 5.355 -28.617 539 H TYR 69 H TYR 69 1.501 6.645 -31.921 540 HA TYR 69 HA TYR 69 2.822 8.501 -33.745 541 HB2 TYR 69 1HB TYR 69 0.721 8.937 -31.540 542 HB3 TYR 69 2HB TYR 69 1.209 10.148 -32.725 543 HD1 TYR 69 HD1 TYR 69 0.764 9.835 -35.112 544 HD2 TYR 69 HD2 TYR 69 -0.955 7.340 -32.122 545 HE1 TYR 69 HE1 TYR 69 -0.989 8.982 -36.813 546 HE2 TYR 69 HE2 TYR 69 -2.702 6.528 -33.800 547 HH TYR 69 HH TYR 69 -2.682 7.477 -37.194 548 H ASP 70 H ASP 70 4.358 10.137 -33.135 549 HA ASP 70 HA ASP 70 5.882 9.646 -30.826 550 HB2 ASP 70 1HB ASP 70 5.631 12.068 -32.665 551 HB3 ASP 70 2HB ASP 70 6.933 11.867 -31.439 552 H LYS 71 H LYS 71 3.335 12.034 -31.350 553 HA LYS 71 HA LYS 71 2.435 13.757 -29.966 554 HB2 LYS 71 1HB LYS 71 2.452 11.326 -28.106 555 HB3 LYS 71 2HB LYS 71 1.615 12.878 -27.830 556 HG2 LYS 71 1HG LYS 71 1.182 11.134 -30.284 557 HG3 LYS 71 2HG LYS 71 0.294 10.936 -28.758 558 HD2 LYS 71 1HD LYS 71 -0.431 13.374 -29.029 559 HD3 LYS 71 2HD LYS 71 0.415 13.351 -30.592 560 HE2 LYS 71 1HE LYS 71 -1.859 13.104 -30.998 561 HE3 LYS 71 2HE LYS 71 -1.126 11.537 -31.396 562 HZ1 LYS 71 1HZ LYS 71 -3.171 11.245 -30.160 563 HZ2 LYS 71 2HZ LYS 71 -2.581 12.193 -28.885 564 HZ3 LYS 71 3HZ LYS 71 -1.877 10.739 -29.266 565 H LYS 72 H LYS 72 5.024 14.503 -30.031 566 HA LYS 72 HA LYS 72 6.240 14.672 -27.464 567 HB2 LYS 72 1HB LYS 72 6.460 16.357 -30.013 568 HB3 LYS 72 2HB LYS 72 7.503 16.646 -28.621 569 HG2 LYS 72 1HG LYS 72 8.728 14.732 -28.932 570 HG3 LYS 72 2HG LYS 72 7.351 13.808 -29.547 571 HD2 LYS 72 1HD LYS 72 8.884 14.049 -31.395 572 HD3 LYS 72 2HD LYS 72 7.570 15.200 -31.762 573 HE2 LYS 72 1HE LYS 72 8.949 17.108 -30.952 574 HE3 LYS 72 2HE LYS 72 10.168 15.981 -30.379 575 HZ1 LYS 72 1HZ LYS 72 10.711 15.413 -32.610 576 HZ2 LYS 72 2HZ LYS 72 10.691 17.068 -32.517 577 HZ3 LYS 72 3HZ LYS 72 9.382 16.401 -33.185 578 HA PRO 73 HA PRO 73 3.271 17.365 -25.780 579 HB2 PRO 73 1HB PRO 73 4.621 18.763 -23.831 580 HB3 PRO 73 2HB PRO 73 4.157 16.993 -23.711 581 HG2 PRO 73 1HG PRO 73 6.797 18.225 -24.478 582 HG3 PRO 73 2HG PRO 73 6.441 16.826 -23.345 583 HD2 PRO 73 1HD PRO 73 7.260 16.370 -25.863 584 HD3 PRO 73 2HD PRO 73 6.038 15.309 -25.053 585 H ALA 74 H ALA 74 2.378 19.344 -26.093 586 HA ALA 74 HA ALA 74 3.755 21.337 -27.710 587 HB1 ALA 74 1HB ALA 74 1.558 22.466 -27.742 588 HB2 ALA 74 2HB ALA 74 1.215 20.719 -27.894 589 HB3 ALA 74 3HB ALA 74 0.974 21.560 -26.326 590 H GLY 75 H GLY 75 3.719 20.684 -24.386 591 HA2 GLY 75 1HA GLY 75 5.423 22.389 -23.382 592 HA3 GLY 75 2HA GLY 75 4.083 23.532 -23.611 593 H GLU 76 H GLU 76 1.981 21.757 -22.932 594 HA GLU 76 HA GLU 76 0.757 21.157 -21.079 595 HB2 GLU 76 1HB GLU 76 3.421 20.020 -20.152 596 HB3 GLU 76 2HB GLU 76 1.868 19.660 -19.430 597 HG2 GLU 76 1HG GLU 76 1.073 18.715 -21.550 598 HG3 GLU 76 2HG GLU 76 2.667 18.996 -22.252 599 H PHE 77 H PHE 77 1.934 23.856 -21.087 600 HA PHE 77 HA PHE 77 3.007 24.453 -18.465 601 HB2 PHE 77 1HB PHE 77 3.251 25.640 -20.846 602 HB3 PHE 77 2HB PHE 77 1.848 26.494 -20.295 603 HD1 PHE 77 HD1 PHE 77 2.056 28.233 -18.518 604 HD2 PHE 77 HD2 PHE 77 5.433 25.724 -19.633 605 HE1 PHE 77 HE1 PHE 77 3.594 29.736 -17.238 606 HE2 PHE 77 HE2 PHE 77 6.985 27.255 -18.301 607 HZ PHE 77 HZ PHE 77 6.030 29.259 -17.187 608 H ILE 78 H ILE 78 -0.073 23.637 -19.084 609 HA ILE 78 HA ILE 78 -1.616 25.847 -18.035 610 HB ILE 78 HB ILE 78 -2.389 22.946 -18.418 611 HG12 ILE 78 1HG1 ILE 78 -3.790 24.645 -20.191 612 HG13 ILE 78 2HG1 ILE 78 -2.113 25.187 -20.246 613 HG21 ILE 78 1HG2 ILE 78 -3.756 23.857 -16.670 614 HG22 ILE 78 2HG2 ILE 78 -4.065 25.358 -17.623 615 HG23 ILE 78 3HG2 ILE 78 -4.774 23.808 -18.144 616 HD11 ILE 78 1HD1 ILE 78 -1.275 22.944 -20.818 617 HD12 ILE 78 2HD1 ILE 78 -2.935 22.253 -20.682 618 HD13 ILE 78 3HD1 ILE 78 -2.540 23.430 -21.956 619 H VAL 79 H VAL 79 -1.671 26.413 -16.032 620 HA VAL 79 HA VAL 79 -1.451 26.536 -13.791 621 HB VAL 79 HB VAL 79 -2.563 23.669 -13.670 622 HG11 VAL 79 1HG1 VAL 79 -1.642 24.427 -11.488 623 HG12 VAL 79 2HG1 VAL 79 -2.521 25.982 -11.635 624 HG13 VAL 79 3HG1 VAL 79 -3.425 24.471 -11.427 625 HG21 VAL 79 1HG2 VAL 79 -4.020 25.218 -15.002 626 HG22 VAL 79 2HG2 VAL 79 -4.767 24.638 -13.517 627 HG23 VAL 79 3HG2 VAL 79 -4.096 26.304 -13.607 628 H THR 80 H THR 80 0.876 26.607 -14.054 629 HA THR 80 HA THR 80 2.521 24.276 -13.779 630 HB THR 80 HB THR 80 4.320 25.919 -13.191 631 HG1 THR 80 HG1 THR 80 3.720 28.150 -13.307 632 HG21 THR 80 1HG2 THR 80 4.408 27.013 -15.340 633 HG22 THR 80 2HG2 THR 80 2.650 27.007 -15.502 634 HG23 THR 80 3HG2 THR 80 3.551 25.471 -15.598 635 H ASP 81 H ASP 81 3.616 23.444 -12.036 636 HA ASP 81 HA ASP 81 2.761 24.358 -9.360 637 HB2 ASP 81 1HB ASP 81 2.253 22.178 -8.612 638 HB3 ASP 81 2HB ASP 81 1.302 22.384 -10.108 639 HXT ASP 81 H02 ASP 81 5.530 23.332 -7.931
Contact the webmaster for help, if required. Friday, July 5, 2024 12:39:23 AM GMT (wattos1)